#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 0.68 -0.57 0.53 -4.36 -1.21 -4.82 121.20 111.45 1xc1 s ILE 2 Ca 0.00 -0.61 -0.06 0.00 -0.26 0.00 0.00 60.65 59.72 1xc1 s ILE 2 Cb 0.00 -0.62 0.15 0.00 1.25 0.00 0.00 42.46 43.24 1xc1 s ILE 2 CO 0.00 0.02 0.42 -0.89 0.24 0.00 0.00 174.94 174.73 1xc1 s THR 3 N -0.55 4.05 0.01 8.37 2.01 -1.26 -0.71 115.64 127.55 1xc1 s THR 3 Ca -0.00 -2.41 -0.27 0.00 0.31 0.00 0.00 61.69 59.33 1xc1 s THR 3 Cb -0.05 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1xc1 s THR 3 CO 0.00 -0.84 0.84 -0.69 -0.69 0.00 0.00 174.62 173.24 1xc1 s VAL 4 N 0.58 4.82 -0.42 3.82 1.01 0.11 -1.57 120.40 128.74 1xc1 s VAL 4 Ca 0.12 1.76 -0.21 0.00 0.00 0.00 0.00 61.98 63.66 1xc1 s VAL 4 Cb -0.21 -4.18 0.02 0.00 0.00 0.00 0.00 36.38 32.01 1xc1 s VAL 4 CO -0.04 0.27 0.66 -0.31 0.00 0.00 0.00 175.10 175.69 1xc1 s TYR 5 N 0.46 3.08 -0.22 5.22 1.51 0.12 -1.05 117.35 126.47 1xc1 s TYR 5 Ca 0.43 0.08 -0.08 0.00 -1.01 0.00 0.00 57.07 56.49 1xc1 s TYR 5 Cb -0.20 -3.34 -0.04 0.00 -0.11 0.00 0.00 41.96 38.27 1xc1 s TYR 5 CO 0.24 -0.83 0.09 1.21 -1.11 0.00 0.00 175.55 175.15 1xc1 s ASN 6 N 1.97 5.53 0.00 2.29 2.47 -0.14 -1.08 114.94 125.98 1xc1 s ASN 6 Ca 0.24 -0.03 0.07 0.00 0.42 0.00 0.00 52.86 53.56 1xc1 s ASN 6 Cb -0.14 -1.98 0.08 0.00 -1.45 0.00 0.00 41.25 37.77 1xc1 s ASN 6 CO 0.18 0.07 0.82 0.61 -3.72 0.00 0.00 177.10 175.06 1xc1 n GLY 7 N 4.25 0.08 3.90 1.21 0.00 0.06 -1.06 105.19 113.64 1xc1 n GLY 7 Ca -0.16 -0.20 -0.28 0.00 0.00 0.00 0.00 46.02 45.39 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 -0.66 3.44 0.19 1.61 2.00 -1.24 -3.85 119.66 121.15 1xc1 s GLN 8 Ca 0.09 0.22 -0.33 0.00 -2.00 0.00 0.00 55.36 53.34 1xc1 s GLN 8 Cb 0.06 -2.33 -0.13 0.00 0.80 0.00 0.00 33.01 31.41 1xc1 s GLN 8 CO 0.09 -0.33 1.55 1.58 -0.50 0.00 0.00 175.29 177.68 1xc1 n HIS 9 N -2.36 2.32 -0.35 1.67 -0.00 -1.26 -4.79 115.22 110.45 1xc1 n HIS 9 Ca 0.02 0.29 -0.01 0.00 -0.00 0.00 0.00 57.72 58.02 1xc1 n HIS 9 Cb 0.55 -2.54 0.04 0.00 -0.00 0.00 0.00 29.99 28.05 1xc1 n HIS 9 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 1xc1 h LYS 10 N 5.49 -0.03 0.19 1.57 1.79 -1.97 -0.82 116.57 122.80 1xc1 h LYS 10 Ca -0.45 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.03 1xc1 h LYS 10 Cb 1.25 0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 31.88 1xc1 h LYS 10 CO 0.85 -0.02 -0.31 1.49 -1.08 0.00 0.00 179.45 180.39 1xc1 h GLU 11 N -0.03 -0.56 -0.42 3.15 4.81 -2.01 -1.90 114.58 117.64 1xc1 h GLU 11 Ca 0.34 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.64 1xc1 h GLU 11 Cb 0.60 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.08 1xc1 h GLU 11 CO -0.93 -0.37 0.28 0.00 -0.73 0.00 0.00 179.01 177.26 1xc1 h ALA 12 N 0.04 1.87 -0.55 2.92 0.00 -1.72 -2.09 119.26 119.73 1xc1 h ALA 12 Ca 0.01 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 1xc1 h ALA 12 Cb 0.57 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1xc1 h ALA 12 CO -0.13 0.08 -0.08 0.00 0.00 0.00 0.00 179.25 179.11 1xc1 h ALA 13 N 1.76 0.82 -0.53 0.00 0.00 -0.71 -2.78 119.26 117.84 1xc1 h ALA 13 Ca 0.17 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1xc1 h ALA 13 Cb 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1xc1 h ALA 13 CO -0.04 0.66 0.07 1.96 0.00 0.00 0.00 179.25 181.90 1xc1 h GLN 14 N 0.90 0.89 0.33 0.00 1.08 -0.70 -2.60 115.11 115.01 1xc1 h GLN 14 Ca 0.15 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 57.09 1xc1 h GLN 14 Cb 0.63 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.94 1xc1 h GLN 14 CO 0.04 0.88 -0.41 0.00 -0.95 0.00 0.00 178.83 178.39 1xc1 h ALA 15 N 0.98 -1.04 -0.50 3.87 0.00 -1.25 -0.10 119.26 121.22 1xc1 h ALA 15 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1xc1 h ALA 15 Cb 0.43 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 1xc1 h ALA 15 CO 0.01 -1.08 0.26 -0.39 0.00 0.00 0.00 179.25 178.06 1xc1 h VAL 16 N -0.76 1.16 0.10 0.00 -1.51 -1.57 -1.86 116.25 111.81 1xc1 h VAL 16 Ca -0.04 -0.42 -0.00 0.00 -1.23 0.00 0.00 66.70 65.01 1xc1 h VAL 16 Cb 0.67 0.50 -0.00 0.00 -2.13 0.00 0.00 31.29 30.33 1xc1 h VAL 16 CO -0.09 0.18 -0.07 0.00 -1.23 0.00 0.00 177.57 176.36 1xc1 h ALA 17 N 1.60 -0.90 -0.60 5.19 0.00 -1.17 -0.57 119.26 122.81 1xc1 h ALA 17 Ca 0.18 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.18 1xc1 h ALA 17 Cb 0.04 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 17.95 1xc1 h ALA 17 CO -0.03 -0.89 -0.02 -0.44 0.00 0.00 0.00 179.25 177.87 1xc1 h ASP 18 N -0.16 -0.30 -0.63 0.00 5.19 -0.97 0.69 116.42 120.24 1xc1 h ASP 18 Ca -0.01 0.15 0.11 0.00 -0.62 0.00 0.00 57.03 56.66 1xc1 h ASP 18 Cb 0.13 0.28 -0.04 0.00 0.18 0.00 0.00 39.33 39.88 1xc1 h ASP 18 CO 0.01 -0.12 0.43 0.00 -3.12 0.00 0.00 179.24 176.43 1xc1 h ALA 19 N 1.55 2.07 0.15 3.45 0.00 -1.29 -1.89 119.26 123.31 1xc1 h ALA 19 Ca 0.31 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 1xc1 h ALA 19 Cb 0.50 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1xc1 h ALA 19 CO -0.53 -0.22 -0.07 0.35 0.00 0.00 0.00 179.25 178.78 1xc1 h PHE 20 N 0.39 -0.19 0.00 0.00 3.57 0.18 -3.20 116.94 117.70 1xc1 h PHE 20 Ca 0.30 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1xc1 h PHE 20 Cb 0.65 0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.45 1xc1 h PHE 20 CO -0.00 0.26 0.31 1.15 -2.23 0.00 0.00 178.31 177.80 1xc1 h THR 21 N -0.79 0.00 0.00 4.41 2.02 0.45 -2.91 112.91 116.09 1xc1 h THR 21 Ca -0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1xc1 h THR 21 Cb 0.53 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 1xc1 h THR 21 CO 0.03 0.00 0.00 0.54 0.37 0.00 0.00 175.52 176.46 1xc1 n ARG 22 N -2.23 0.00 -0.35 6.66 1.74 -0.93 -2.52 116.66 119.02 1xc1 n ARG 22 Ca -0.01 0.19 0.26 0.00 -0.77 0.00 0.00 57.85 57.52 1xc1 n ARG 22 Cb 0.34 -0.63 0.51 0.00 -1.02 0.00 0.00 32.46 31.67 1xc1 n ARG 22 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1xc1 h ALA 23 N -2.00 2.14 0.01 7.54 0.00 -1.59 -2.94 119.26 122.42 1xc1 h ALA 23 Ca 0.00 0.16 -0.40 0.00 0.00 0.00 0.00 54.91 54.67 1xc1 h ALA 23 Cb 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 1xc1 h ALA 23 CO 0.00 -0.73 -2.27 0.25 0.00 0.00 0.00 179.25 176.50 1xc1 n THR 24 N -4.94 1.55 0.00 0.00 -2.24 -1.11 -5.03 114.28 102.51 1xc1 n THR 24 Ca 0.32 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 1xc1 n THR 24 Cb 1.06 -1.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.52 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 1.63 1.81 3.77 3.38 0.00 -1.05 -5.08 105.19 109.65 1xc1 n GLY 25 Ca -0.46 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.26 3.84 0.81 -0.61 -1.09 -1.26 -4.92 121.20 115.72 1xc1 s ILE 26 Ca 0.00 1.62 -0.10 0.00 -2.23 0.00 0.00 60.65 59.94 1xc1 s ILE 26 Cb 0.00 -3.93 0.12 0.00 -1.58 0.00 0.00 42.46 37.06 1xc1 s ILE 26 CO 0.00 0.21 1.14 -0.54 -1.23 0.00 0.00 174.94 174.52 1xc1 s LYS 27 N -1.92 1.57 -0.14 2.79 -0.14 -1.26 -3.97 119.74 116.67 1xc1 s LYS 27 Ca 0.50 -0.36 -0.10 0.00 -1.36 0.00 0.00 55.97 54.65 1xc1 s LYS 27 Cb -0.24 -2.05 0.04 0.00 -1.68 0.00 0.00 37.83 33.91 1xc1 s LYS 27 CO 0.31 -1.72 0.36 0.08 -0.76 0.00 0.00 175.35 173.61 1xc1 s VAL 28 N -3.50 -0.02 -0.07 3.17 1.01 -1.26 -3.31 120.40 116.42 1xc1 s VAL 28 Ca 0.66 0.06 -0.02 0.00 0.00 0.00 0.00 61.98 62.68 1xc1 s VAL 28 Cb -0.08 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.75 1xc1 s VAL 28 CO 0.48 0.02 0.02 -0.75 0.00 0.00 0.00 175.10 174.87 1xc1 s LYS 29 N 0.79 2.99 -0.23 2.72 2.20 0.11 -4.98 119.74 123.35 1xc1 s LYS 29 Ca -0.05 -0.42 -0.02 0.00 -0.36 0.00 0.00 55.97 55.12 1xc1 s LYS 29 Cb -0.06 -2.81 0.01 0.00 -1.51 0.00 0.00 37.83 33.46 1xc1 s LYS 29 CO -0.06 0.69 -0.08 -0.51 -0.36 0.00 0.00 175.35 175.04 1xc1 s LEU 30 N -1.06 2.90 -0.80 5.43 1.43 -1.26 0.06 118.68 125.37 1xc1 s LEU 30 Ca 0.15 -0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 52.49 1xc1 s LEU 30 Cb -0.11 -1.66 0.21 0.00 0.03 0.00 0.00 46.19 44.66 1xc1 s LEU 30 CO 0.04 -0.07 0.71 0.21 0.23 0.00 0.00 176.35 177.48 1xc1 s ASN 31 N 1.38 6.41 0.07 2.29 3.84 -0.22 -4.98 114.94 123.73 1xc1 s ASN 31 Ca 0.03 -2.81 -0.18 0.00 0.21 0.00 0.00 52.86 50.10 1xc1 s ASN 31 Cb -0.15 -2.12 -0.07 0.00 -0.55 0.00 0.00 41.25 38.37 1xc1 s ASN 31 CO -0.06 -0.50 0.55 -0.44 -2.79 0.00 0.00 177.10 173.87 1xc1 s SER 32 N 1.69 7.02 0.00 -4.21 0.01 -1.26 -0.97 113.70 115.98 1xc1 s SER 32 Ca 0.19 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.67 1xc1 s SER 32 Cb -0.12 -2.34 0.00 0.00 0.21 0.00 0.00 66.02 63.76 1xc1 s SER 32 CO -0.08 0.26 0.00 0.00 0.41 0.00 0.00 173.24 173.84 1xc1 n ALA 33 N 1.63 0.00 -1.99 1.44 0.00 -0.22 -4.96 120.51 116.41 1xc1 n ALA 33 Ca -0.10 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 52.93 1xc1 n ALA 33 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 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 -1.56 4.54 0.47 0.00 1.02 -1.26 -3.56 119.74 119.39 1xc1 s LYS 34 Ca 0.00 1.84 0.28 0.00 0.02 0.00 0.00 55.97 58.11 1xc1 s LYS 34 Cb 0.00 -3.23 1.34 0.00 -0.52 0.00 0.00 37.83 35.42 1xc1 s LYS 34 CO 0.00 0.00 1.76 0.78 -0.92 0.00 0.00 175.35 176.97 1xc1 h GLY 35 N 4.88 0.69 0.76 -3.33 0.00 -1.84 -0.85 103.07 103.38 1xc1 h GLY 35 Ca -0.45 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 1xc1 h GLY 35 CO 0.72 -0.11 -0.03 -1.80 0.00 0.00 0.00 176.54 175.33 1xc1 h ASP 36 N 0.18 0.27 0.05 0.19 1.82 -1.94 -2.93 116.42 114.07 1xc1 h ASP 36 Ca 0.62 -0.36 -0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1xc1 h ASP 36 Cb 2.00 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.94 1xc1 h ASP 36 CO -0.18 0.57 -0.02 1.56 -1.61 0.00 0.00 179.24 179.55 1xc1 h GLN 37 N -0.03 -0.07 -0.39 0.28 1.08 -1.56 -3.11 115.11 111.32 1xc1 h GLN 37 Ca 0.04 0.00 0.11 0.00 -1.45 0.00 0.00 58.65 57.35 1xc1 h GLN 37 Cb 0.45 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.88 1xc1 h GLN 37 CO 0.01 0.18 0.30 -0.07 -0.95 0.00 0.00 178.83 178.31 1xc1 h LEU 38 N -0.31 0.00 -0.67 1.46 3.38 -1.46 0.06 115.31 117.78 1xc1 h LEU 38 Ca -0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1xc1 h LEU 38 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 1xc1 h LEU 38 CO 0.01 0.00 -0.28 0.00 0.09 0.00 0.00 178.44 178.26 1xc1 h ALA 39 N 1.76 0.85 -0.27 1.53 0.00 -1.44 -1.87 119.26 119.82 1xc1 h ALA 39 Ca 0.18 -0.39 -0.09 0.00 0.00 0.00 0.00 54.91 54.61 1xc1 h ALA 39 Cb 0.79 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1xc1 h ALA 39 CO -0.00 0.64 -0.20 0.78 0.00 0.00 0.00 179.25 180.47 1xc1 h GLY 40 N 0.97 0.67 0.31 0.00 0.00 -1.03 -2.79 103.07 101.20 1xc1 h GLY 40 Ca 0.08 -0.65 0.13 0.00 0.00 0.00 0.00 47.33 46.89 1xc1 h GLY 40 CO 0.07 0.58 0.40 -1.61 0.00 0.00 0.00 176.54 175.98 1xc1 h GLN 41 N 0.35 0.59 -0.60 4.80 5.75 -1.18 -0.54 115.11 124.28 1xc1 h GLN 41 Ca 0.05 -0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.48 1xc1 h GLN 41 Cb 0.74 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 29.13 1xc1 h GLN 41 CO 0.05 0.39 0.24 0.82 -2.65 0.00 0.00 178.83 177.68 1xc1 h ILE 42 N 0.61 1.23 0.00 2.39 2.04 -1.20 -2.55 117.51 120.02 1xc1 h ILE 42 Ca 0.42 -0.72 -0.09 0.00 1.00 0.00 0.00 64.86 65.47 1xc1 h ILE 42 Cb 0.55 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1xc1 h ILE 42 CO -0.33 0.28 -0.44 0.11 0.00 0.00 0.00 178.15 177.76 1xc1 h LYS 43 N 0.83 0.00 0.11 2.37 1.57 -1.04 -2.42 116.57 117.98 1xc1 h LYS 43 Ca 0.20 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 1xc1 h LYS 43 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1xc1 h LYS 43 CO -0.02 0.44 -0.05 0.93 -0.57 0.00 0.00 179.45 180.19 1xc1 h GLU 44 N 0.00 -0.14 0.00 3.15 5.08 -0.85 -2.86 114.58 118.96 1xc1 h GLU 44 Ca -0.00 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1xc1 h GLU 44 Cb 0.91 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1xc1 h GLU 44 CO 0.06 0.21 0.00 0.93 -1.00 0.00 0.00 179.01 179.21 1xc1 h GLU 45 N -0.51 0.00 0.00 2.33 5.08 -1.48 -3.45 114.58 116.55 1xc1 h GLU 45 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1xc1 h GLU 45 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1xc1 h GLU 45 CO 0.02 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 1xc1 n GLY 46 N -0.07 0.26 0.02 -3.84 0.00 -0.91 -2.22 105.19 98.43 1xc1 n GLY 46 Ca 0.02 0.30 -0.00 0.00 0.00 0.00 0.00 46.02 46.33 1xc1 n GLY 46 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xc1 n SER 47 N 1.11 -0.04 -3.69 1.61 7.64 -1.26 -4.09 113.62 114.90 1xc1 n SER 47 Ca 0.00 0.14 -0.17 0.00 1.01 0.00 0.00 58.87 59.86 1xc1 n SER 47 Cb 0.00 -0.05 -0.16 0.00 -1.01 0.00 0.00 64.21 62.99 1xc1 n SER 47 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1xc1 s ARG 48 N -3.67 0.02 -0.09 1.43 3.52 -0.94 -4.88 118.95 114.35 1xc1 s ARG 48 Ca -0.00 0.46 0.00 0.00 -0.13 0.00 0.00 55.73 56.06 1xc1 s ARG 48 Cb 0.00 -0.30 -0.03 0.00 -1.56 0.00 0.00 34.95 33.06 1xc1 s ARG 48 CO 0.02 -0.28 -0.08 0.45 -0.81 0.00 0.00 175.30 174.61 1xc1 s SER 49 N 1.97 4.56 0.51 -2.12 0.15 -1.26 -4.84 113.70 112.67 1xc1 s SER 49 Ca 0.00 -0.08 0.24 0.00 0.70 0.00 0.00 55.95 56.81 1xc1 s SER 49 Cb -0.12 -1.28 1.33 0.00 -1.71 0.00 0.00 66.02 64.25 1xc1 s SER 49 CO -0.05 0.31 1.98 -0.65 1.20 0.00 0.00 173.24 176.03 1xc1 h PRO 50 N 5.62 0.08 -6.75 5.44 0.11 -1.94 -3.44 132.00 131.12 1xc1 h PRO 50 Ca -0.44 -0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.12 1xc1 h PRO 50 Cb 1.18 -0.02 0.09 0.00 0.11 0.00 0.00 31.00 32.36 1xc1 h PRO 50 CO 0.54 0.05 0.78 0.00 -0.21 0.00 0.00 178.00 179.16 1xc1 n ALA 51 N -2.62 2.09 -0.09 -0.75 0.00 -1.26 -4.55 120.51 113.33 1xc1 n ALA 51 Ca 0.11 0.38 -0.11 0.00 0.00 0.00 0.00 53.44 53.82 1xc1 n ALA 51 Cb 0.60 -2.40 -0.10 0.00 0.00 0.00 0.00 19.45 17.55 1xc1 n ALA 51 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1xc1 n ASP 52 N 1.95 1.98 -4.03 0.00 9.92 -0.61 -4.34 116.55 121.41 1xc1 n ASP 52 Ca 0.09 -0.06 -0.16 0.00 -0.53 0.00 0.00 54.79 54.12 1xc1 n ASP 52 Cb 0.35 0.18 -0.13 0.00 -0.64 0.00 0.00 41.12 40.88 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 -2.38 0.63 -0.23 2.53 1.01 -1.26 -2.30 120.40 118.40 1xc1 s VAL 53 Ca -0.19 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.16 1xc1 s VAL 53 Cb 0.06 -0.59 0.05 0.00 0.00 0.00 0.00 36.38 35.90 1xc1 s VAL 53 CO 0.52 -0.04 -0.13 0.12 0.00 0.00 0.00 175.10 175.57 1xc1 s PHE 54 N -0.66 3.01 -0.37 5.22 5.36 -0.13 0.15 117.98 130.56 1xc1 s PHE 54 Ca -0.02 -2.04 -0.06 0.00 -0.96 0.00 0.00 56.93 53.85 1xc1 s PHE 54 Cb -0.06 -1.88 0.07 0.00 -0.34 0.00 0.00 43.02 40.81 1xc1 s PHE 54 CO 0.00 -0.84 0.16 -0.47 -1.46 0.00 0.00 175.22 172.61 1xc1 s TYR 55 N 1.20 3.36 0.34 10.12 5.04 -0.24 -0.83 117.35 136.33 1xc1 s TYR 55 Ca -0.04 -1.75 0.09 0.00 -2.44 0.00 0.00 57.07 52.93 1xc1 s TYR 55 Cb -0.18 -2.69 -0.06 0.00 0.35 0.00 0.00 41.96 39.38 1xc1 s TYR 55 CO -0.08 -0.84 -0.06 -1.54 -1.34 0.00 0.00 175.55 171.70 1xc1 s SER 56 N 1.72 3.91 0.07 4.32 1.04 -0.43 -0.76 113.70 123.57 1xc1 s SER 56 Ca 0.02 -1.10 0.23 0.00 0.48 0.00 0.00 55.95 55.57 1xc1 s SER 56 Cb -0.21 -0.42 0.03 0.00 0.10 0.00 0.00 66.02 65.52 1xc1 s SER 56 CO 0.00 -0.20 1.01 -1.84 0.98 0.00 0.00 173.24 173.19 1xc1 n GLU 57 N -0.85 0.37 -4.11 4.02 0.00 -1.25 -1.88 120.64 116.94 1xc1 n GLU 57 Ca -0.05 0.01 -0.33 0.00 0.00 0.00 0.00 57.16 56.79 1xc1 n GLU 57 Cb 0.63 -1.63 -0.16 0.00 0.00 0.00 0.00 31.44 30.28 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 -3.25 2.79 0.24 3.44 -1.52 -1.26 -4.22 119.66 115.89 1xc1 s GLN 58 Ca 0.02 -0.95 -0.05 0.00 -1.95 0.00 0.00 55.36 52.43 1xc1 s GLN 58 Cb 0.14 -2.64 0.25 0.00 -0.22 0.00 0.00 33.01 30.53 1xc1 s GLN 58 CO 0.80 -0.30 1.80 0.82 -0.25 0.00 0.00 175.29 178.16 1xc1 h ILE 59 N 6.14 1.25 -0.63 1.08 2.04 -1.88 -2.60 117.51 122.91 1xc1 h ILE 59 Ca -0.39 -0.83 0.10 0.00 1.00 0.00 0.00 64.86 64.75 1xc1 h ILE 59 Cb 1.12 0.44 -0.04 0.00 -0.74 0.00 0.00 36.82 37.60 1xc1 h ILE 59 CO 0.59 0.33 0.42 1.55 0.00 0.00 0.00 178.15 181.04 1xc1 h PRO 60 N 1.03 0.42 -0.59 2.37 0.13 -1.93 0.30 132.00 133.74 1xc1 h PRO 60 Ca 0.23 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.34 1xc1 h PRO 60 Cb 0.25 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 31.25 1xc1 h PRO 60 CO -0.01 0.28 0.37 0.00 -0.23 0.00 0.00 178.00 178.40 1xc1 h ALA 61 N 1.68 1.53 -0.17 -0.56 0.00 -1.80 0.13 119.26 120.07 1xc1 h ALA 61 Ca 0.29 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 1xc1 h ALA 61 Cb 0.57 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1xc1 h ALA 61 CO -0.09 0.42 -0.44 -0.07 0.00 0.00 0.00 179.25 179.08 1xc1 h LEU 62 N 0.81 0.68 -1.54 0.00 3.38 -0.53 -3.07 115.31 115.04 1xc1 h LEU 62 Ca 0.21 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 1xc1 h LEU 62 Cb -0.05 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1xc1 h LEU 62 CO -0.04 1.14 0.18 0.00 0.09 0.00 0.00 178.44 179.80 1xc1 h ALA 63 N 0.57 1.65 0.01 1.53 0.00 -0.18 -0.56 119.26 122.27 1xc1 h ALA 63 Ca -0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1xc1 h ALA 63 Cb 1.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1xc1 h ALA 63 CO 0.09 0.29 -0.07 1.15 0.00 0.00 0.00 179.25 180.71 1xc1 h THR 64 N 0.49 0.82 -0.22 0.00 2.02 -0.90 0.25 112.91 115.37 1xc1 h THR 64 Ca 0.13 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.22 1xc1 h THR 64 Cb 0.04 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 67.25 1xc1 h THR 64 CO -0.02 0.00 -0.23 -0.07 0.37 0.00 0.00 175.52 175.57 1xc1 h LEU 65 N -0.13 0.39 -0.57 2.58 3.38 -1.35 -2.71 115.31 116.90 1xc1 h LEU 65 Ca 0.03 -0.12 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 1xc1 h LEU 65 Cb 0.16 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1xc1 h LEU 65 CO -0.07 0.63 -0.39 -1.28 0.09 0.00 0.00 178.44 177.43 1xc1 h SER 66 N 0.35 0.76 0.20 -0.43 0.87 -0.67 -1.41 113.55 113.23 1xc1 h SER 66 Ca 0.06 -0.34 -0.04 0.00 -1.23 0.00 0.00 61.79 60.24 1xc1 h SER 66 Cb 0.61 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.35 1xc1 h SER 66 CO 0.04 1.06 -0.19 0.00 -0.53 0.00 0.00 176.83 177.21 1xc1 h ALA 67 N 0.98 1.66 -0.00 6.23 0.00 -0.21 -0.78 119.26 127.14 1xc1 h ALA 67 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1xc1 h ALA 67 Cb 0.92 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1xc1 h ALA 67 CO 0.08 0.24 -0.34 0.00 0.00 0.00 0.00 179.25 179.24 1xc1 n ALA 68 N -2.49 3.19 -3.20 0.00 0.00 -1.01 -4.95 120.51 112.04 1xc1 n ALA 68 Ca -0.02 -0.31 -0.15 0.00 0.00 0.00 0.00 53.44 52.95 1xc1 n ALA 68 Cb 0.26 -1.20 0.06 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.28 -4.33 -1.09 0.00 3.02 -0.30 -4.92 115.26 106.36 1xc1 n ASN 69 Ca 0.08 -0.39 0.11 0.00 -0.03 0.00 0.00 54.58 54.35 1xc1 n ASN 69 Cb 0.33 -3.66 0.22 0.00 -0.61 0.00 0.00 39.78 36.06 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 -3.52 3.41 -4.61 3.41 4.77 -0.61 -4.92 117.00 114.93 1xc1 n LEU 70 Ca -0.04 -1.63 -0.34 0.00 -0.03 0.00 0.00 56.01 53.96 1xc1 n LEU 70 Cb 0.56 -0.28 -0.11 0.00 -2.33 0.00 0.00 43.42 41.26 1xc1 n LEU 70 CO 0.44 0.77 -0.34 -0.76 -1.33 0.00 0.00 177.39 176.17 1xc1 s LEU 71 N -1.29 3.37 -0.29 2.23 1.43 -1.26 -0.62 118.68 122.26 1xc1 s LEU 71 Ca 0.37 0.03 -0.25 0.00 -1.03 0.00 0.00 54.13 53.26 1xc1 s LEU 71 Cb 0.21 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.67 1xc1 s LEU 71 CO 0.29 0.33 0.84 -0.70 0.23 0.00 0.00 176.35 177.34 1xc1 s GLU 72 N -0.62 4.05 0.19 1.70 2.56 0.19 -4.68 118.70 122.09 1xc1 s GLU 72 Ca 0.10 0.77 -0.32 0.00 0.00 0.00 0.00 54.97 55.52 1xc1 s GLU 72 Cb -0.12 -3.70 -0.15 0.00 2.00 0.00 0.00 34.13 32.16 1xc1 s GLU 72 CO 0.02 -0.66 1.11 -0.35 -0.56 0.00 0.00 175.26 174.83 1xc1 n PRO 73 N 6.23 1.15 -3.75 4.30 -0.04 -1.26 -4.50 135.00 137.13 1xc1 n PRO 73 Ca 0.05 0.41 -0.35 0.00 -0.04 0.00 0.00 63.50 63.58 1xc1 n PRO 73 Cb 0.48 -1.87 -0.05 0.00 -0.04 0.00 0.00 33.50 32.02 1xc1 n PRO 73 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1xc1 s LEU 74 N 0.70 4.37 1.25 1.53 1.43 0.12 -4.96 118.68 123.12 1xc1 s LEU 74 Ca 0.70 0.58 -0.18 0.00 -1.03 0.00 0.00 54.13 54.20 1xc1 s LEU 74 Cb -0.83 -2.69 0.27 0.00 0.03 0.00 0.00 46.19 42.97 1xc1 s LEU 74 CO 0.54 0.25 0.67 -0.81 0.23 0.00 0.00 176.35 177.22 1xc1 n PRO 75 N 1.11 -3.14 0.05 1.29 -0.04 -1.26 -4.88 135.00 128.13 1xc1 n PRO 75 Ca -0.11 -0.91 -0.08 0.00 -0.04 0.00 0.00 63.50 62.35 1xc1 n PRO 75 Cb 0.53 -1.89 -0.12 0.00 -0.04 0.00 0.00 33.50 31.97 1xc1 n PRO 75 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xc1 h ALA 76 N -2.92 0.39 0.00 0.55 0.00 -1.99 -3.24 119.26 112.06 1xc1 h ALA 76 Ca -0.49 -1.00 -0.04 0.00 0.00 0.00 0.00 54.91 53.39 1xc1 h ALA 76 Cb 1.26 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1xc1 h ALA 76 CO 0.34 1.28 -0.21 0.66 0.00 0.00 0.00 179.25 181.32 1xc1 h SER 77 N 0.01 0.00 0.01 0.00 4.64 -2.00 -1.96 113.55 114.26 1xc1 h SER 77 Ca -0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.25 1xc1 h SER 77 Cb 1.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.92 1xc1 h SER 77 CO 0.13 0.21 -0.00 0.74 -0.87 0.00 0.00 176.83 177.03 1xc1 h THR 78 N 0.00 1.15 -0.31 2.95 2.02 -1.93 -3.33 112.91 113.46 1xc1 h THR 78 Ca -0.00 -1.82 -0.07 0.00 0.77 0.00 0.00 66.41 65.29 1xc1 h THR 78 Cb 0.42 2.15 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 1xc1 h THR 78 CO 0.03 0.38 -0.11 0.40 0.37 0.00 0.00 175.52 176.59 1xc1 h ILE 79 N -0.99 1.23 0.00 3.11 2.04 -1.58 -3.10 117.51 118.22 1xc1 h ILE 79 Ca -0.00 -1.00 -0.06 0.00 1.00 0.00 0.00 64.86 64.80 1xc1 h ILE 79 Cb 0.64 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1xc1 h ILE 79 CO 0.00 0.33 -0.31 0.78 0.00 0.00 0.00 178.15 178.95 1xc1 h ASN 80 N 0.48 0.00 -0.71 1.72 2.35 -1.52 -3.15 115.58 114.75 1xc1 h ASN 80 Ca 0.09 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.97 1xc1 h ASN 80 Cb 0.48 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.80 1xc1 h ASN 80 CO 0.03 0.31 0.48 -0.33 -1.65 0.00 0.00 177.43 176.26 1xc1 h GLU 81 N 0.00 0.43 -0.23 0.81 4.39 -1.65 -2.24 114.58 116.09 1xc1 h GLU 81 Ca -0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1xc1 h GLU 81 Cb 0.67 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1xc1 h GLU 81 CO 0.04 0.28 0.00 0.25 -1.16 0.00 0.00 179.01 178.42 1xc1 n THR 82 N -4.48 1.28 -1.97 1.13 -2.24 -1.20 -4.37 114.28 102.43 1xc1 n THR 82 Ca 0.13 -1.24 -0.42 0.00 -2.27 0.00 0.00 64.05 60.25 1xc1 n THR 82 Cb 0.46 0.32 -0.03 0.00 -2.10 0.00 0.00 70.33 68.99 1xc1 n THR 82 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1xc1 s ARG 83 N -1.44 4.21 0.09 -0.78 3.52 -0.85 -4.72 118.95 118.98 1xc1 s ARG 83 Ca 0.22 2.29 -0.04 0.00 -0.13 0.00 0.00 55.73 58.07 1xc1 s ARG 83 Cb 0.14 -3.53 -0.03 0.00 -1.56 0.00 0.00 34.95 29.97 1xc1 s ARG 83 CO 0.10 -0.69 0.07 0.20 -0.81 0.00 0.00 175.30 174.17 1xc1 s GLY 84 N 2.16 0.51 0.41 8.12 0.00 -1.26 -4.98 107.32 112.28 1xc1 s GLY 84 Ca 0.72 -1.11 0.19 0.00 0.00 0.00 0.00 44.72 44.52 1xc1 s GLY 84 CO 0.31 -1.16 1.81 0.07 0.00 0.00 0.00 173.10 174.13 1xc1 h LYS 85 N 2.93 0.38 -0.01 2.90 2.10 -2.01 -2.33 116.57 120.52 1xc1 h LYS 85 Ca -0.34 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 1xc1 h LYS 85 Cb 1.18 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 1xc1 h LYS 85 CO 0.60 0.25 -0.03 0.41 -2.00 0.00 0.00 179.45 178.68 1xc1 n GLY 86 N -1.51 -0.63 3.73 0.07 0.00 -1.26 -5.03 105.19 100.57 1xc1 n GLY 86 Ca 0.23 -0.21 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.71 2.82 0.22 1.61 1.01 -0.88 -4.95 120.40 119.52 1xc1 s VAL 87 Ca 0.08 0.62 -0.32 0.00 0.00 0.00 0.00 61.98 62.36 1xc1 s VAL 87 Cb 0.06 -3.40 -0.13 0.00 0.00 0.00 0.00 36.38 32.91 1xc1 s VAL 87 CO 0.11 0.07 1.53 -2.65 0.00 0.00 0.00 175.10 174.16 1xc1 n PRO 88 N 3.42 2.28 -4.36 2.72 -0.02 -1.26 -4.72 135.00 133.05 1xc1 n PRO 88 Ca 0.11 0.82 -0.29 0.00 -2.02 0.00 0.00 63.50 62.12 1xc1 n PRO 88 Cb 0.40 -2.55 -0.17 0.00 -0.02 0.00 0.00 33.50 31.16 1xc1 n PRO 88 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xc1 s VAL 89 N 0.40 1.49 -0.23 -1.45 1.01 -1.26 -4.41 120.40 115.95 1xc1 s VAL 89 Ca 0.72 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 1xc1 s VAL 89 Cb -0.61 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.37 1xc1 s VAL 89 CO 0.44 0.44 1.49 0.00 0.00 0.00 0.00 175.10 177.46 1xc1 s ALA 90 N 1.10 3.37 0.39 5.51 0.00 -1.26 -4.90 121.76 125.95 1xc1 s ALA 90 Ca -0.04 0.39 0.13 0.00 0.00 0.00 0.00 51.96 52.44 1xc1 s ALA 90 Cb -0.14 -3.80 0.95 0.00 0.00 0.00 0.00 23.12 20.13 1xc1 s ALA 90 CO -0.03 -1.77 1.87 0.00 0.00 0.00 0.00 175.76 175.82 1xc1 h ALA 91 N 9.94 2.00 0.00 0.00 0.00 -1.99 0.41 119.26 129.62 1xc1 h ALA 91 Ca -0.31 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1xc1 h ALA 91 Cb 1.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1xc1 h ALA 91 CO 1.00 -0.26 -0.60 0.87 0.00 0.00 0.00 179.25 180.27 1xc1 h LYS 92 N 0.55 0.00 -2.56 0.00 1.57 -1.99 -3.48 116.57 110.67 1xc1 h LYS 92 Ca 0.45 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 59.12 1xc1 h LYS 92 Cb 0.90 0.00 0.04 0.00 0.08 0.00 0.00 32.23 33.25 1xc1 h LYS 92 CO -0.19 0.00 -0.20 1.17 -0.57 0.00 0.00 179.45 179.66 1xc1 n LYS 93 N -2.33 -2.17 -0.11 3.15 4.81 0.13 -4.86 118.16 116.78 1xc1 n LYS 93 Ca 0.03 0.24 0.04 0.00 -0.87 0.00 0.00 58.31 57.75 1xc1 n LYS 93 Cb 0.47 -3.46 0.09 0.00 0.02 0.00 0.00 35.03 32.15 1xc1 n LYS 93 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1xc1 n ASP 94 N -0.28 2.52 -3.53 3.14 5.75 -1.26 0.15 116.55 123.03 1xc1 n ASP 94 Ca -0.02 -2.27 -0.11 0.00 -0.01 0.00 0.00 54.79 52.38 1xc1 n ASP 94 Cb 0.53 -0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 40.41 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 -1.47 -0.43 -0.03 2.11 1.48 -1.26 -4.47 118.94 114.87 1xc1 s TRP 95 Ca 0.16 0.16 0.01 0.00 -1.06 0.00 0.00 56.10 55.37 1xc1 s TRP 95 Cb 0.11 0.56 0.02 0.00 -1.16 0.00 0.00 33.47 33.00 1xc1 s TRP 95 CO 0.06 -0.92 -0.03 0.54 -4.06 0.00 0.00 176.95 172.54 1xc1 s VAL 96 N -3.79 0.34 0.32 -0.66 0.11 -0.35 -4.48 120.40 111.89 1xc1 s VAL 96 Ca 0.03 -0.06 -0.28 0.00 -2.93 0.00 0.00 61.98 58.74 1xc1 s VAL 96 Cb -0.02 -0.37 -0.09 0.00 -1.53 0.00 0.00 36.38 34.37 1xc1 s VAL 96 CO -0.09 0.16 1.11 0.00 -3.33 0.00 0.00 175.10 172.95 1xc1 s ALA 97 N 0.65 3.33 -0.02 1.54 0.00 -1.26 -1.05 121.76 124.95 1xc1 s ALA 97 Ca -0.07 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.78 1xc1 s ALA 97 Cb -0.11 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.67 1xc1 s ALA 97 CO -0.01 -0.23 -0.01 1.28 0.00 0.00 0.00 175.76 176.79 1xc1 n LEU 98 N 0.84 2.12 0.00 0.00 4.77 0.61 -4.84 117.00 120.50 1xc1 n LEU 98 Ca 0.01 -0.01 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 1xc1 n LEU 98 Cb 0.46 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.51 1xc1 n LEU 98 CO 0.52 0.39 0.40 -1.54 -1.33 0.00 0.00 177.39 175.83 1xc1 n SER 99 N -2.42 -1.95 -3.88 -1.43 3.41 -1.23 -3.02 113.62 103.10 1xc1 n SER 99 Ca -0.04 -2.71 -0.10 0.00 -0.26 0.00 0.00 58.87 55.76 1xc1 n SER 99 Cb 0.55 3.36 -0.09 0.00 -0.26 0.00 0.00 64.21 67.76 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 -3.11 0.09 0.02 5.00 0.00 -0.70 -1.71 107.32 106.91 1xc1 s GLY 100 Ca 0.21 -0.35 0.07 0.00 0.00 0.00 0.00 44.72 44.65 1xc1 s GLY 100 CO 0.15 -0.50 -0.21 0.50 0.00 0.00 0.00 173.10 173.04 1xc1 s ARG 101 N -2.30 2.06 0.01 2.90 0.52 0.14 -0.64 118.95 121.65 1xc1 s ARG 101 Ca -0.07 -0.97 0.09 0.00 -0.52 0.00 0.00 55.73 54.25 1xc1 s ARG 101 Cb -0.03 -2.14 -0.02 0.00 0.52 0.00 0.00 34.95 33.28 1xc1 s ARG 101 CO -0.03 0.55 -0.26 0.45 0.02 0.00 0.00 175.30 176.03 1xc1 s SER 102 N -1.16 3.11 0.28 0.23 0.15 -1.26 -0.18 113.70 114.87 1xc1 s SER 102 Ca 0.13 -0.53 -0.29 0.00 0.70 0.00 0.00 55.95 55.96 1xc1 s SER 102 Cb -0.10 -0.31 -0.09 0.00 -1.71 0.00 0.00 66.02 63.80 1xc1 s SER 102 CO 0.03 0.29 1.00 -0.13 1.20 0.00 0.00 173.24 175.62 1xc1 s ARG 103 N -0.94 4.68 0.24 5.44 1.81 -0.43 -0.60 118.95 129.16 1xc1 s ARG 103 Ca 0.11 1.56 -0.12 0.00 -1.72 0.00 0.00 55.73 55.56 1xc1 s ARG 103 Cb -0.10 -3.11 -0.01 0.00 -0.45 0.00 0.00 34.95 31.29 1xc1 s ARG 103 CO 0.01 0.33 0.46 0.14 -0.68 0.00 0.00 175.30 175.55 1xc1 s VAL 104 N -1.29 0.00 -0.22 3.52 -7.23 -0.43 -4.69 120.40 110.06 1xc1 s VAL 104 Ca 0.45 -1.45 -0.01 0.00 -1.81 0.00 0.00 61.98 59.16 1xc1 s VAL 104 Cb -0.26 -2.22 0.02 0.00 0.56 0.00 0.00 36.38 34.47 1xc1 s VAL 104 CO 0.33 -0.00 -0.10 -0.69 -0.31 0.00 0.00 175.10 174.33 1xc1 s VAL 105 N -4.03 2.68 -0.17 1.32 1.01 -0.79 -1.97 120.40 118.45 1xc1 s VAL 105 Ca 0.24 -0.94 -0.15 0.00 0.00 0.00 0.00 61.98 61.13 1xc1 s VAL 105 Cb -0.00 -2.29 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1xc1 s VAL 105 CO 0.09 0.33 0.35 0.54 0.00 0.00 0.00 175.10 176.41 1xc1 s VAL 106 N 1.33 5.26 0.26 2.92 0.11 -0.36 -0.37 120.40 129.56 1xc1 s VAL 106 Ca 0.02 0.64 0.05 0.00 -2.93 0.00 0.00 61.98 59.76 1xc1 s VAL 106 Cb -0.15 -3.68 -0.06 0.00 -1.53 0.00 0.00 36.38 30.96 1xc1 s VAL 106 CO -0.07 0.34 -0.02 -0.72 -3.33 0.00 0.00 175.10 171.30 1xc1 s TYR 107 N 0.77 1.79 -0.66 1.54 1.13 -0.13 -1.56 117.35 120.22 1xc1 s TYR 107 Ca 0.18 -0.82 -0.24 0.00 -1.41 0.00 0.00 57.07 54.78 1xc1 s TYR 107 Cb -0.14 -1.05 0.05 0.00 -1.10 0.00 0.00 41.96 39.73 1xc1 s TYR 107 CO 0.06 0.11 1.07 0.34 -2.51 0.00 0.00 175.55 174.62 1xc1 s ASP 108 N -3.39 6.21 0.00 -0.18 3.68 0.09 -1.70 116.67 121.37 1xc1 s ASP 108 Ca 0.30 -0.68 0.18 0.00 2.13 0.00 0.00 52.55 54.47 1xc1 s ASP 108 Cb 0.05 -2.47 0.96 0.00 -1.45 0.00 0.00 42.92 40.01 1xc1 s ASP 108 CO 0.11 -1.53 1.49 0.35 0.13 0.00 0.00 175.17 175.72 1xc1 n THR 109 N 6.13 0.27 0.55 1.71 -2.24 -0.62 -0.53 114.28 119.55 1xc1 n THR 109 Ca -0.00 0.07 0.13 0.00 -2.27 0.00 0.00 64.05 61.97 1xc1 n THR 109 Cb 0.47 -0.79 0.44 0.00 -2.10 0.00 0.00 70.33 68.35 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 -1.15 0.24 0.00 -0.78 1.74 -1.26 -4.19 116.66 111.25 1xc1 n ARG 110 Ca 0.11 0.29 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 1xc1 n ARG 110 Cb 0.10 -1.83 0.00 0.00 -1.02 0.00 0.00 32.46 29.71 1xc1 n ARG 110 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1xc1 n LYS 111 N -2.25 2.33 -4.44 5.56 2.85 -0.77 -5.12 118.16 116.33 1xc1 n LYS 111 Ca 0.04 0.00 -0.24 0.00 -1.05 0.00 0.00 58.31 57.06 1xc1 n LYS 111 Cb 0.36 -0.61 -0.10 0.00 -0.65 0.00 0.00 35.03 34.03 1xc1 n LYS 111 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1xc1 s LEU 112 N -1.28 2.67 0.26 -5.58 1.43 0.31 -5.10 118.68 111.39 1xc1 s LEU 112 Ca 0.00 -0.96 0.10 0.00 -1.03 0.00 0.00 54.13 52.24 1xc1 s LEU 112 Cb 0.00 -1.20 -0.05 0.00 0.03 0.00 0.00 46.19 44.97 1xc1 s LEU 112 CO 0.00 0.04 -0.18 -0.44 0.23 0.00 0.00 176.35 176.00 1xc1 s SER 113 N -3.48 3.25 0.00 2.29 0.01 -1.26 -4.22 113.70 110.29 1xc1 s SER 113 Ca 0.30 -1.03 0.00 0.00 1.31 0.00 0.00 55.95 56.52 1xc1 s SER 113 Cb -0.05 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.93 1xc1 s SER 113 CO 0.15 -0.04 0.82 1.21 0.41 0.00 0.00 173.24 175.79 1xc1 n GLU 114 N -0.55 0.45 0.00 12.44 4.07 -1.26 -1.26 120.64 134.53 1xc1 n GLU 114 Ca -0.06 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.04 1xc1 n GLU 114 Cb 0.60 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.71 1xc1 n GLU 114 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1xc1 n LYS 115 N 1.60 0.96 0.07 5.31 5.02 -1.26 -4.76 118.16 125.10 1xc1 n LYS 115 Ca 0.00 0.00 -0.08 0.00 -2.02 0.00 0.00 58.31 56.21 1xc1 n LYS 115 Cb 0.22 -0.77 0.05 0.00 -0.02 0.00 0.00 35.03 34.51 1xc1 n LYS 115 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1xc1 h ASP 116 N 0.00 0.37 -3.98 4.39 5.19 -1.58 -3.46 116.42 117.35 1xc1 h ASP 116 Ca 0.00 -0.24 -0.55 0.00 -0.62 0.00 0.00 57.03 55.61 1xc1 h ASP 116 Cb 0.54 -0.11 0.17 0.00 0.18 0.00 0.00 39.33 40.11 1xc1 h ASP 116 CO 0.00 0.97 0.32 0.18 -3.12 0.00 0.00 179.24 177.60 1xc1 n LEU 117 N -3.81 4.80 -4.79 1.55 4.77 -1.24 -4.97 117.00 113.31 1xc1 n LEU 117 Ca -0.04 0.73 -0.34 0.00 -0.03 0.00 0.00 56.01 56.34 1xc1 n LEU 117 Cb 0.70 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.31 1xc1 n LEU 117 CO 0.47 -1.51 0.73 -1.61 -1.33 0.00 0.00 177.39 174.14 1xc1 s GLU 118 N -3.45 3.35 0.15 3.23 0.41 -1.26 -4.95 118.70 116.17 1xc1 s GLU 118 Ca 0.78 1.36 0.26 0.00 -0.41 0.00 0.00 54.97 56.96 1xc1 s GLU 118 Cb -0.36 -2.03 0.71 0.00 -1.78 0.00 0.00 34.13 30.68 1xc1 s GLU 118 CO 0.46 -0.81 1.65 1.63 -0.49 0.00 0.00 175.26 177.69 1xc1 n LYS 119 N -1.69 0.22 -4.02 1.61 4.76 -1.26 -4.78 118.16 113.00 1xc1 n LYS 119 Ca 0.10 0.14 -0.12 0.00 -2.87 0.00 0.00 58.31 55.56 1xc1 n LYS 119 Cb 0.52 -1.71 -0.12 0.00 -1.84 0.00 0.00 35.03 31.88 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 -4.16 0.50 0.19 4.39 0.15 -1.26 -4.85 113.70 108.66 1xc1 s SER 120 Ca 0.10 -0.43 0.26 0.00 0.70 0.00 0.00 55.95 56.58 1xc1 s SER 120 Cb 0.14 0.05 0.80 0.00 -1.71 0.00 0.00 66.02 65.30 1xc1 s SER 120 CO 0.63 -0.19 1.75 0.52 1.20 0.00 0.00 173.24 177.15 1xc1 n VAL 121 N 1.84 0.54 0.24 4.45 0.31 -1.26 -3.35 118.33 121.10 1xc1 n VAL 121 Ca -0.21 -0.27 0.12 0.00 -0.01 0.00 0.00 64.34 63.97 1xc1 n VAL 121 Cb 0.56 -0.55 0.50 0.00 -0.91 0.00 0.00 33.84 33.44 1xc1 n VAL 121 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1xc1 h LEU 122 N 0.00 0.00 -0.12 7.52 3.38 -1.99 -3.02 115.31 121.08 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 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1xc1 h LEU 122 CO 0.00 0.14 0.00 0.59 0.09 0.00 0.00 178.44 179.26 1xc1 n ASN 123 N -3.27 0.18 0.14 -0.43 3.02 -1.21 -3.23 115.26 110.46 1xc1 n ASN 123 Ca 0.01 -1.54 0.12 0.00 -0.03 0.00 0.00 54.58 53.13 1xc1 n ASN 123 Cb 0.40 -0.01 0.10 0.00 -0.61 0.00 0.00 39.78 39.66 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 0.23 0.00 -0.96 3.10 0.05 -1.75 -3.35 116.97 114.29 1xc1 h TYR 124 Ca 0.00 0.00 -0.49 0.00 0.05 0.00 0.00 58.73 58.29 1xc1 h TYR 124 Cb 0.05 0.00 -0.16 0.00 1.01 0.00 0.00 36.73 37.63 1xc1 h TYR 124 CO 0.01 0.00 0.53 0.00 -1.05 0.00 0.00 178.16 177.65 1xc1 n ALA 125 N -2.10 6.49 -2.37 3.88 0.00 -1.20 -4.61 120.51 120.61 1xc1 n ALA 125 Ca 0.02 -3.03 -0.20 0.00 0.00 0.00 0.00 53.44 50.23 1xc1 n ALA 125 Cb 0.53 -2.24 -0.09 0.00 0.00 0.00 0.00 19.45 17.65 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 -1.77 0.45 0.55 0.00 -4.23 -1.26 -4.53 115.64 104.85 1xc1 s THR 126 Ca 0.59 -2.00 0.22 0.00 -1.18 0.00 0.00 61.69 59.32 1xc1 s THR 126 Cb 0.36 -2.51 0.30 0.00 1.34 0.00 0.00 72.50 71.99 1xc1 s THR 126 CO -0.19 0.00 2.19 -0.65 -0.54 0.00 0.00 174.62 175.44 1xc1 h PRO 127 N 2.14 0.00 0.00 3.99 0.11 -1.92 -2.80 132.00 133.51 1xc1 h PRO 127 Ca -0.34 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 1xc1 h PRO 127 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1xc1 h PRO 127 CO 0.54 0.00 -0.16 -0.22 -0.21 0.00 0.00 178.00 177.96 1xc1 h LYS 128 N 0.00 0.00 -0.43 1.05 3.64 -1.93 -2.91 116.57 115.99 1xc1 h LYS 128 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1xc1 h LYS 128 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1xc1 h LYS 128 CO -0.00 0.16 0.00 0.91 -2.27 0.00 0.00 179.45 178.25 1xc1 n TRP 129 N -3.75 1.19 -1.67 1.91 7.02 -1.06 -4.92 117.44 116.16 1xc1 n TRP 129 Ca -0.02 -0.72 -0.47 0.00 -1.02 0.00 0.00 57.50 55.27 1xc1 n TRP 129 Cb 0.27 -0.28 -0.04 0.00 -2.42 0.00 0.00 31.31 28.83 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 0.29 2.16 -1.14 -0.99 3.00 -1.10 -0.39 118.16 119.98 1xc1 n LYS 130 Ca 0.22 0.79 -0.05 0.00 -0.00 0.00 0.00 58.31 59.27 1xc1 n LYS 130 Cb 0.86 -2.60 -0.02 0.00 0.00 0.00 0.00 35.03 33.27 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 5.17 -5.58 -0.09 3.14 3.02 0.29 -4.82 115.26 116.40 1xc1 n ASN 131 Ca 0.20 0.12 0.02 0.00 -0.03 0.00 0.00 54.58 54.89 1xc1 n ASN 131 Cb 0.29 -3.51 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 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 -0.19 2.31 -4.30 3.52 1.74 0.48 -4.71 116.66 115.49 1xc1 n ARG 132 Ca -0.05 -0.41 -0.21 0.00 -0.77 0.00 0.00 57.85 56.41 1xc1 n ARG 132 Cb 0.49 -0.89 -0.16 0.00 -1.02 0.00 0.00 32.46 30.88 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 -0.75 0.72 0.21 0.55 1.10 -1.17 -1.94 121.20 119.92 1xc1 s ILE 133 Ca 0.03 -0.24 0.06 0.00 -0.51 0.00 0.00 60.65 60.00 1xc1 s ILE 133 Cb 0.03 -0.70 -0.04 0.00 0.15 0.00 0.00 42.46 41.90 1xc1 s ILE 133 CO 0.09 0.26 0.14 -0.83 -2.11 0.00 0.00 174.94 172.49 1xc1 s GLY 134 N 0.80 1.58 0.08 1.50 0.00 -0.16 -1.61 107.32 109.50 1xc1 s GLY 134 Ca -0.12 -1.34 -0.14 0.00 0.00 0.00 0.00 44.72 43.11 1xc1 s GLY 134 CO 0.01 -1.37 0.33 -2.52 0.00 0.00 0.00 173.10 169.56 1xc1 s TYR 135 N -1.95 -0.11 -0.65 1.90 1.13 -0.89 -1.48 117.35 115.30 1xc1 s TYR 135 Ca 0.32 -0.12 -0.01 0.00 -1.41 0.00 0.00 57.07 55.85 1xc1 s TYR 135 Cb -0.09 0.14 0.16 0.00 -1.10 0.00 0.00 41.96 41.07 1xc1 s TYR 135 CO 0.23 -0.58 0.45 0.08 -2.51 0.00 0.00 175.55 173.23 1xc1 s VAL 136 N -3.18 3.53 0.53 -3.49 1.01 -1.26 -0.66 120.40 116.89 1xc1 s VAL 136 Ca -0.01 -3.25 0.24 0.00 0.00 0.00 0.00 61.98 58.97 1xc1 s VAL 136 Cb 0.01 -3.31 0.38 0.00 0.00 0.00 0.00 36.38 33.46 1xc1 s VAL 136 CO -0.07 -0.90 2.02 1.55 0.00 0.00 0.00 175.10 177.70 1xc1 h PRO 137 N 6.68 0.00 0.00 2.72 0.13 -1.92 -1.53 132.00 138.08 1xc1 h PRO 137 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1xc1 h PRO 137 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1xc1 h PRO 137 CO 0.72 0.00 -0.45 1.79 -0.23 0.00 0.00 178.00 179.83 1xc1 h THR 138 N 0.00 0.00 -3.19 1.56 1.35 -1.85 -3.44 112.91 107.34 1xc1 h THR 138 Ca 0.21 -0.84 -0.57 0.00 -0.55 0.00 0.00 66.41 64.66 1xc1 h THR 138 Cb 0.85 1.59 0.11 0.00 -1.73 0.00 0.00 68.15 68.97 1xc1 h THR 138 CO -0.00 0.00 0.49 -0.24 -0.25 0.00 0.00 175.52 175.52 1xc1 n SER 139 N -2.67 2.66 -0.17 5.36 2.88 -0.58 -4.92 113.62 116.19 1xc1 n SER 139 Ca 0.03 1.20 -0.10 0.00 -1.33 0.00 0.00 58.87 58.66 1xc1 n SER 139 Cb 0.51 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 1xc1 n SER 139 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1xc1 h GLY 140 N 2.69 0.99 2.00 0.46 0.00 -1.91 -2.66 103.07 104.63 1xc1 h GLY 140 Ca -0.45 -0.79 -0.06 0.00 0.00 0.00 0.00 47.33 46.03 1xc1 h GLY 140 CO 0.64 0.72 -0.28 0.00 0.00 0.00 0.00 176.54 177.61 1xc1 h ALA 141 N 0.90 1.49 -0.19 3.60 0.00 -1.94 -1.51 119.26 121.62 1xc1 h ALA 141 Ca 0.13 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1xc1 h ALA 141 Cb 0.62 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1xc1 h ALA 141 CO 0.04 0.35 0.06 0.35 0.00 0.00 0.00 179.25 180.06 1xc1 h PHE 142 N 0.00 0.30 -0.46 0.00 3.57 -1.75 -1.35 116.94 117.25 1xc1 h PHE 142 Ca -0.00 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.48 1xc1 h PHE 142 Cb 0.51 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 1xc1 h PHE 142 CO 0.00 0.37 0.31 1.25 -2.23 0.00 0.00 178.31 178.01 1xc1 h LEU 143 N 0.13 0.52 -0.99 0.59 5.85 -1.11 -0.66 115.31 119.63 1xc1 h LEU 143 Ca 0.06 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.66 1xc1 h LEU 143 Cb 0.21 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1xc1 h LEU 143 CO -0.00 0.37 -0.44 -0.33 -0.34 0.00 0.00 178.44 177.70 1xc1 h GLU 144 N 0.61 0.13 -0.34 1.25 4.39 -0.78 -1.97 114.58 117.87 1xc1 h GLU 144 Ca 0.17 -0.06 -0.14 0.00 0.34 0.00 0.00 59.36 59.67 1xc1 h GLU 144 Cb -0.05 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 1xc1 h GLU 144 CO -0.04 0.55 -0.35 0.37 -1.16 0.00 0.00 179.01 178.38 1xc1 h GLN 145 N 0.11 0.78 0.47 2.33 5.75 -0.02 -2.41 115.11 122.12 1xc1 h GLN 145 Ca 0.01 -0.38 -0.02 0.00 -0.15 0.00 0.00 58.65 58.10 1xc1 h GLN 145 Cb 0.83 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.38 1xc1 h GLN 145 CO 0.06 1.01 -0.22 0.82 -2.65 0.00 0.00 178.83 177.85 1xc1 h ILE 146 N 0.65 0.54 -1.09 2.39 2.04 -1.11 -2.21 117.51 118.71 1xc1 h ILE 146 Ca 0.06 -0.11 0.29 0.00 1.00 0.00 0.00 64.86 66.11 1xc1 h ILE 146 Cb 0.90 0.59 -0.08 0.00 -0.74 0.00 0.00 36.82 37.48 1xc1 h ILE 146 CO 0.08 0.02 0.72 0.58 0.00 0.00 0.00 178.15 179.55 1xc1 h VAL 147 N -0.69 0.47 -0.02 1.67 2.07 -1.30 -1.20 116.25 117.25 1xc1 h VAL 147 Ca -0.06 -0.09 -0.17 0.00 0.82 0.00 0.00 66.70 67.20 1xc1 h VAL 147 Cb 0.51 0.17 0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1xc1 h VAL 147 CO 0.11 0.05 -0.63 0.00 0.02 0.00 0.00 177.57 177.11 1xc1 h ALA 148 N 1.57 0.11 -0.18 1.67 0.00 -1.09 -2.92 119.26 118.42 1xc1 h ALA 148 Ca 0.60 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1xc1 h ALA 148 Cb 1.75 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.55 1xc1 h ALA 148 CO -0.23 0.40 -0.15 0.82 0.00 0.00 0.00 179.25 180.09 1xc1 h ILE 149 N 0.00 1.20 -0.58 0.00 2.04 -0.65 0.11 117.51 119.63 1xc1 h ILE 149 Ca -0.07 -0.89 -0.10 0.00 1.00 0.00 0.00 64.86 64.80 1xc1 h ILE 149 Cb 1.32 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 38.61 1xc1 h ILE 149 CO 0.13 0.28 -0.04 0.58 0.00 0.00 0.00 178.15 179.09 1xc1 h VAL 150 N 0.27 1.27 0.00 1.67 2.07 -1.31 1.68 116.25 121.90 1xc1 h VAL 150 Ca 0.05 -1.19 -0.15 0.00 0.82 0.00 0.00 66.70 66.23 1xc1 h VAL 150 Cb 0.43 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1xc1 h VAL 150 CO 0.03 0.43 -0.73 0.11 0.02 0.00 0.00 177.57 177.42 1xc1 h LYS 151 N 0.94 0.00 0.00 1.57 1.57 -1.20 -2.12 116.57 117.33 1xc1 h LYS 151 Ca 0.16 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.73 1xc1 h LYS 151 Cb 0.60 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.87 1xc1 h LYS 151 CO 0.04 0.73 -2.05 1.28 -0.57 0.00 0.00 179.45 178.88 1xc1 n LEU 152 N -3.47 0.20 0.00 2.94 4.77 0.31 -4.76 117.00 116.99 1xc1 n LEU 152 Ca -0.00 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1xc1 n LEU 152 Cb 0.76 0.25 0.00 0.00 -2.33 0.00 0.00 43.42 42.10 1xc1 n LEU 152 CO 0.43 0.27 -0.38 0.29 -1.33 0.00 0.00 177.39 176.67 1xc1 n LYS 153 N -2.63 1.80 0.00 3.23 4.76 0.57 -5.04 118.16 120.85 1xc1 n LYS 153 Ca -0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1xc1 n LYS 153 Cb 0.91 -0.88 0.00 0.00 -1.84 0.00 0.00 35.03 33.22 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 1.98 2.89 0.33 0.72 0.00 -0.80 -4.55 105.19 105.76 1xc1 n GLY 154 Ca 0.00 -1.89 -0.01 0.00 0.00 0.00 0.00 46.02 44.13 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 1.01 -0.17 1.61 4.81 -1.87 -2.50 114.58 117.47 1xc1 h GLU 155 Ca 0.00 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1xc1 h GLU 155 Cb 0.00 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 1xc1 h GLU 155 CO 0.00 0.67 0.09 0.00 -0.73 0.00 0.00 179.01 179.04 1xc1 h ALA 156 N 1.38 0.20 -0.53 2.92 0.00 -1.97 -0.31 119.26 120.95 1xc1 h ALA 156 Ca 0.36 0.00 0.07 0.00 0.00 0.00 0.00 54.91 55.34 1xc1 h ALA 156 Cb 0.07 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 1xc1 h ALA 156 CO -0.14 -0.33 0.22 0.00 0.00 0.00 0.00 179.25 178.99 1xc1 h ALA 157 N 1.08 0.67 0.00 0.00 0.00 -1.73 0.38 119.26 119.66 1xc1 h ALA 157 Ca 0.07 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1xc1 h ALA 157 Cb 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1xc1 h ALA 157 CO -0.04 -0.17 -0.27 0.00 0.00 0.00 0.00 179.25 178.77 1xc1 h ALA 158 N 1.34 1.17 0.18 0.00 0.00 -1.15 -2.18 119.26 118.62 1xc1 h ALA 158 Ca 0.25 -0.25 -0.25 0.00 0.00 0.00 0.00 54.91 54.67 1xc1 h ALA 158 Cb 0.25 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.03 1xc1 h ALA 158 CO -0.24 0.34 -1.10 1.25 0.00 0.00 0.00 179.25 179.50 1xc1 h LEU 159 N 0.00 0.60 -0.31 0.00 5.85 0.53 -2.90 115.31 119.08 1xc1 h LEU 159 Ca -0.00 -0.94 0.02 0.00 0.84 0.00 0.00 57.88 57.80 1xc1 h LEU 159 Cb 0.64 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1xc1 h LEU 159 CO 0.04 1.53 0.15 0.50 -0.34 0.00 0.00 178.44 180.31 1xc1 h LYS 160 N -0.18 0.30 -0.48 1.25 3.64 -0.25 -0.84 116.57 120.01 1xc1 h LYS 160 Ca -0.20 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.22 1xc1 h LYS 160 Cb 1.84 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 33.54 1xc1 h LYS 160 CO 0.19 0.20 0.21 2.35 -2.27 0.00 0.00 179.45 180.13 1xc1 h TRP 161 N 0.31 0.38 -0.31 1.91 7.01 -1.49 0.35 115.95 124.11 1xc1 h TRP 161 Ca 0.13 0.02 -0.04 0.00 2.11 0.00 0.00 58.89 61.11 1xc1 h TRP 161 Cb 0.05 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.00 1xc1 h TRP 161 CO -0.10 0.17 0.05 -0.07 -2.79 0.00 0.00 178.44 175.70 1xc1 h LEU 162 N 0.41 0.49 -1.59 0.65 3.38 -1.25 -1.10 115.31 116.31 1xc1 h LEU 162 Ca 0.22 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1xc1 h LEU 162 Cb 0.17 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1xc1 h LEU 162 CO -0.18 0.63 -0.19 0.11 0.09 0.00 0.00 178.44 178.89 1xc1 h LYS 163 N 0.34 0.00 -0.04 1.13 1.57 -0.89 -0.50 116.57 118.18 1xc1 h LYS 163 Ca 0.09 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.75 1xc1 h LYS 163 Cb 0.34 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.66 1xc1 h LYS 163 CO 0.01 0.19 -0.45 0.78 -0.57 0.00 0.00 179.45 179.41 1xc1 h GLY 164 N 1.23 0.42 0.99 3.86 0.00 -0.59 -2.86 103.07 106.12 1xc1 h GLY 164 Ca -0.00 -0.65 -0.06 0.00 0.00 0.00 0.00 47.33 46.62 1xc1 h GLY 164 CO 0.02 0.58 0.08 1.41 0.00 0.00 0.00 176.54 178.63 1xc1 h LEU 165 N -0.13 0.82 -2.03 3.11 3.38 -0.97 0.56 115.31 120.05 1xc1 h LEU 165 Ca -0.04 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.68 1xc1 h LEU 165 Cb 1.13 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.66 1xc1 h LEU 165 CO 0.09 0.88 0.06 0.50 0.09 0.00 0.00 178.44 180.05 1xc1 h LYS 166 N 0.73 0.00 0.09 1.13 3.11 -1.16 0.99 116.57 121.45 1xc1 h LYS 166 Ca 0.15 0.00 -0.34 0.00 -2.81 0.00 0.00 60.65 57.66 1xc1 h LYS 166 Cb 0.41 0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.61 1xc1 h LYS 166 CO 0.01 0.00 -1.85 1.49 -2.81 0.00 0.00 179.45 176.29 1xc1 h GLU 167 N 0.00 0.18 0.00 1.90 4.81 -1.20 -3.42 114.58 116.86 1xc1 h GLU 167 Ca 0.04 -0.31 -0.25 0.00 -0.13 0.00 0.00 59.36 58.71 1xc1 h GLU 167 Cb 0.15 0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.60 1xc1 h GLU 167 CO -0.00 0.98 -1.94 0.66 -0.73 0.00 0.00 179.01 177.97 1xc1 n TYR 168 N -3.34 0.00 -1.10 0.92 0.53 0.15 -4.93 117.16 109.38 1xc1 n TYR 168 Ca -0.25 0.00 -0.06 0.00 -1.02 0.00 0.00 57.90 56.56 1xc1 n TYR 168 Cb 1.05 -0.67 0.05 0.00 -1.03 0.00 0.00 39.34 38.74 1xc1 n TYR 168 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1xc1 n GLY 169 N 2.26 -1.44 2.74 2.72 0.00 0.34 -0.54 105.19 111.27 1xc1 n GLY 169 Ca -0.24 -1.64 -0.21 0.00 0.00 0.00 0.00 46.02 43.93 1xc1 n GLY 169 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xc1 s LYS 170 N -3.62 0.33 0.34 1.61 2.20 -0.63 -4.71 119.74 115.25 1xc1 s LYS 170 Ca 0.16 0.20 -0.28 0.00 -0.36 0.00 0.00 55.97 55.69 1xc1 s LYS 170 Cb -0.01 -0.74 -0.09 0.00 -1.51 0.00 0.00 37.83 35.48 1xc1 s LYS 170 CO 0.12 -0.29 1.19 -1.25 -0.36 0.00 0.00 175.35 174.76 1xc1 s PRO 171 N 1.89 4.34 -0.03 4.03 0.04 -1.26 -2.10 135.00 141.92 1xc1 s PRO 171 Ca 0.03 1.94 0.03 0.00 0.04 0.00 0.00 61.00 63.04 1xc1 s PRO 171 Cb -0.12 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.46 1xc1 s PRO 171 CO -0.04 -0.10 -0.12 0.71 0.04 0.00 0.00 177.00 177.49 1xc1 s TYR 172 N -1.25 1.23 0.27 0.56 2.02 0.17 -4.90 117.35 115.45 1xc1 s TYR 172 Ca 0.50 -0.32 -0.00 0.00 -0.37 0.00 0.00 57.07 56.88 1xc1 s TYR 172 Cb -0.34 -0.85 0.60 0.00 -0.40 0.00 0.00 41.96 40.98 1xc1 s TYR 172 CO 0.44 -0.12 1.68 0.00 -1.57 0.00 0.00 175.55 175.98 1xc1 h ALA 173 N 6.32 1.19 -2.77 3.71 0.00 -1.97 -3.39 119.26 122.35 1xc1 h ALA 173 Ca -0.33 0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1xc1 h ALA 173 Cb 1.17 0.21 -0.11 0.00 0.00 0.00 0.00 17.79 19.06 1xc1 h ALA 173 CO 0.48 -0.35 -0.12 -1.59 0.00 0.00 0.00 179.25 177.67 1xc1 s LYS 174 N -5.97 1.30 0.28 0.00 -2.85 -1.26 -4.81 119.74 106.43 1xc1 s LYS 174 Ca -0.12 -1.01 -0.00 0.00 -1.00 0.00 0.00 55.97 53.83 1xc1 s LYS 174 Cb 0.24 0.46 0.49 0.00 -2.06 0.00 0.00 37.83 36.95 1xc1 s LYS 174 CO 0.77 -0.52 1.88 -0.91 0.10 0.00 0.00 175.35 176.67 1xc1 h ASN 175 N 2.34 0.97 -0.72 0.03 -0.26 -1.95 -1.44 115.58 114.55 1xc1 h ASN 175 Ca -0.30 0.02 0.01 0.00 -0.56 0.00 0.00 56.30 55.47 1xc1 h ASN 175 Cb 1.25 -0.19 -0.04 0.00 -1.06 0.00 0.00 38.32 38.29 1xc1 h ASN 175 CO 0.42 0.59 0.47 0.77 -1.06 0.00 0.00 177.43 178.62 1xc1 h SER 176 N 1.08 0.82 -0.19 5.81 4.64 -1.99 -1.77 113.55 121.96 1xc1 h SER 176 Ca 0.44 -0.02 -0.21 0.00 -0.47 0.00 0.00 61.79 61.52 1xc1 h SER 176 Cb 0.27 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1xc1 h SER 176 CO -0.19 0.60 -0.72 0.58 -0.87 0.00 0.00 176.83 176.23 1xc1 h VAL 177 N 0.97 1.27 -0.55 0.95 2.07 -1.69 -2.92 116.25 116.35 1xc1 h VAL 177 Ca 0.26 -1.91 -0.06 0.00 0.82 0.00 0.00 66.70 65.82 1xc1 h VAL 177 Cb -0.11 1.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1xc1 h VAL 177 CO -0.06 0.61 0.13 0.00 0.02 0.00 0.00 177.57 178.27 1xc1 h ALA 178 N 0.59 0.73 -0.53 1.67 0.00 -1.08 -1.64 119.26 118.99 1xc1 h ALA 178 Ca -0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1xc1 h ALA 178 Cb 1.34 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1xc1 h ALA 178 CO 0.15 0.44 0.30 1.25 0.00 0.00 0.00 179.25 181.39 1xc1 h LEU 179 N 0.79 0.65 -1.36 0.00 5.85 -1.38 -2.47 115.31 117.39 1xc1 h LEU 179 Ca 0.17 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 1xc1 h LEU 179 Cb 0.36 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1xc1 h LEU 179 CO 0.00 0.54 -0.19 1.56 -0.34 0.00 0.00 178.44 180.01 1xc1 h GLN 180 N 0.71 0.00 -0.07 1.25 1.08 -1.36 0.12 115.11 116.84 1xc1 h GLN 180 Ca 0.19 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.37 1xc1 h GLN 180 Cb 0.02 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.45 1xc1 h GLN 180 CO -0.03 0.19 -0.04 0.00 -0.95 0.00 0.00 178.83 178.00 1xc1 h ALA 181 N 1.81 0.11 -0.13 3.87 0.00 -0.86 -1.09 119.26 122.96 1xc1 h ALA 181 Ca -0.00 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 1xc1 h ALA 181 Cb 0.62 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1xc1 h ALA 181 CO 0.03 -0.14 0.03 0.28 0.00 0.00 0.00 179.25 179.45 1xc1 h VAL 182 N -0.22 1.20 -0.07 0.00 2.07 -1.23 0.12 116.25 118.12 1xc1 h VAL 182 Ca 0.02 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 66.92 1xc1 h VAL 182 Cb 0.48 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1xc1 h VAL 182 CO 0.01 0.19 0.12 -0.08 0.02 0.00 0.00 177.57 177.83 1xc1 h GLU 183 N 0.01 0.00 -0.36 1.57 4.22 -0.75 -1.04 114.58 118.23 1xc1 h GLU 183 Ca 0.04 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.48 1xc1 h GLU 183 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1xc1 h GLU 183 CO 0.00 0.00 0.00 0.09 -2.18 0.00 0.00 179.01 176.92 1xc1 n ASN 184 N -3.50 3.13 -0.01 1.04 3.02 -0.42 -4.79 115.26 113.73 1xc1 n ASN 184 Ca -0.01 -1.91 -0.00 0.00 -0.03 0.00 0.00 54.58 52.63 1xc1 n ASN 184 Cb 0.21 -0.24 -0.00 0.00 -0.61 0.00 0.00 39.78 39.14 1xc1 n ASN 184 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xc1 n GLY 185 N 1.10 0.40 0.18 7.41 0.00 -0.40 -4.95 105.19 108.94 1xc1 n GLY 185 Ca 0.16 -1.04 0.08 0.00 0.00 0.00 0.00 46.02 45.21 1xc1 n GLY 185 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1xc1 h GLU 186 N 0.05 0.00 -1.90 1.61 5.08 -0.98 -3.47 114.58 114.96 1xc1 h GLU 186 Ca -0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1xc1 h GLU 186 Cb 0.01 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.05 1xc1 h GLU 186 CO 0.01 0.24 0.24 -1.50 -1.00 0.00 0.00 179.01 177.00 1xc1 s ILE 187 N -3.12 0.00 0.14 3.13 2.07 -1.24 -4.97 121.20 117.21 1xc1 s ILE 187 Ca 0.05 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.06 1xc1 s ILE 187 Cb 0.06 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.66 1xc1 s ILE 187 CO 0.70 0.00 1.64 0.44 -1.91 0.00 0.00 174.94 175.81 1xc1 h ASP 188 N 3.72 -0.71 -5.33 4.50 5.19 -1.84 -3.37 116.42 118.58 1xc1 h ASP 188 Ca -0.27 0.12 -0.11 0.00 -0.62 0.00 0.00 57.03 56.15 1xc1 h ASP 188 Cb 1.15 0.33 -0.10 0.00 0.18 0.00 0.00 39.33 40.89 1xc1 h ASP 188 CO 0.24 -0.27 -0.22 0.00 -3.12 0.00 0.00 179.24 175.87 1xc1 s ALA 189 N -6.09 0.12 -0.02 3.45 0.00 -0.82 -0.74 121.76 117.67 1xc1 s ALA 189 Ca -0.15 -1.10 -0.19 0.00 0.00 0.00 0.00 51.96 50.53 1xc1 s ALA 189 Cb 0.11 1.14 0.04 0.00 0.00 0.00 0.00 23.12 24.41 1xc1 s ALA 189 CO 0.68 -0.80 0.41 0.00 0.00 0.00 0.00 175.76 176.05 1xc1 s ALA 190 N -3.94 -1.05 -0.26 0.00 0.00 -0.60 -0.99 121.76 114.91 1xc1 s ALA 190 Ca 0.26 0.57 -0.12 0.00 0.00 0.00 0.00 51.96 52.68 1xc1 s ALA 190 Cb 0.01 0.08 -0.05 0.00 0.00 0.00 0.00 23.12 23.16 1xc1 s ALA 190 CO 0.11 -0.30 0.22 -0.51 0.00 0.00 0.00 175.76 175.28 1xc1 s LEU 191 N -1.35 4.05 0.00 0.00 1.43 -0.55 -1.22 118.68 121.04 1xc1 s LEU 191 Ca -0.12 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1xc1 s LEU 191 Cb -0.04 -2.18 0.00 0.00 0.03 0.00 0.00 46.19 44.00 1xc1 s LEU 191 CO 0.05 -0.04 0.00 2.30 0.23 0.00 0.00 176.35 178.89 1xc1 n ILE 192 N 4.84 0.00 -3.93 -0.59 -5.35 -0.83 -4.47 119.36 109.03 1xc1 n ILE 192 Ca -0.13 0.00 -0.35 0.00 -0.27 0.00 0.00 62.75 62.00 1xc1 n ILE 192 Cb 0.52 0.00 -0.06 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 -0.22 6.26 0.04 7.28 0.01 -1.26 -1.31 114.94 125.73 1xc1 s ASN 193 Ca 0.00 0.36 -0.09 0.00 -0.71 0.00 0.00 52.86 52.42 1xc1 s ASN 193 Cb 0.00 -1.97 -0.03 0.00 0.41 0.00 0.00 41.25 39.66 1xc1 s ASN 193 CO 0.00 0.32 1.16 -0.55 -1.51 0.00 0.00 177.10 176.51 1xc1 h ASN 194 N 4.29 -0.52 -0.83 -1.22 -1.07 -1.17 -3.04 115.58 112.01 1xc1 h ASN 194 Ca -0.51 0.07 0.24 0.00 0.07 0.00 0.00 56.30 56.17 1xc1 h ASN 194 Cb 1.20 0.21 -0.03 0.00 -2.07 0.00 0.00 38.32 37.63 1xc1 h ASN 194 CO 0.64 -0.12 0.66 0.00 0.07 0.00 0.00 177.43 178.68 1xc1 n TYR 195 N -3.44 0.00 0.27 4.14 4.11 -1.26 -0.20 117.16 120.78 1xc1 n TYR 195 Ca -0.01 0.00 0.15 0.00 -0.00 0.00 0.00 57.90 58.04 1xc1 n TYR 195 Cb 0.10 -0.21 0.74 0.00 -0.00 0.00 0.00 39.34 39.98 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 0.00 0.06 -3.48 -1.99 -1.93 -0.23 116.97 109.39 1xc1 h TYR 196 Ca 0.40 0.00 -0.37 0.00 2.00 0.00 0.00 58.73 60.76 1xc1 h TYR 196 Cb 1.72 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 40.41 1xc1 h TYR 196 CO 0.00 0.08 -2.19 1.87 -0.00 0.00 0.00 178.16 177.92 1xc1 n TRP 197 N -3.34 0.66 -0.23 4.88 -0.00 0.72 -2.61 117.44 117.53 1xc1 n TRP 197 Ca -0.01 0.15 -0.08 0.00 -0.00 0.00 0.00 57.50 57.56 1xc1 n TRP 197 Cb 0.27 -1.09 0.03 0.00 -0.00 0.00 0.00 31.31 30.52 1xc1 n TRP 197 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 1xc1 h HIS 198 N 0.03 1.08 -0.35 5.87 3.86 -1.57 -0.73 115.15 123.34 1xc1 h HIS 198 Ca -0.48 -0.13 -0.08 0.00 -1.16 0.00 0.00 60.37 58.51 1xc1 h HIS 198 Cb 2.00 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 30.15 1xc1 h HIS 198 CO 0.05 0.90 -0.10 0.00 0.86 0.00 0.00 177.93 179.64 1xc1 h ALA 199 N 1.05 0.49 -0.20 2.45 0.00 -1.16 -1.68 119.26 120.22 1xc1 h ALA 199 Ca 0.20 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1xc1 h ALA 199 Cb 0.37 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1xc1 h ALA 199 CO 0.00 0.35 0.05 0.35 0.00 0.00 0.00 179.25 180.00 1xc1 h PHE 200 N 0.48 0.33 -0.75 0.00 3.57 -1.43 -2.39 116.94 116.76 1xc1 h PHE 200 Ca 0.09 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.49 1xc1 h PHE 200 Cb 0.62 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 1xc1 h PHE 200 CO 0.05 0.44 0.24 0.00 -2.23 0.00 0.00 178.31 176.81 1xc1 h ALA 201 N 0.86 1.00 -0.14 2.41 0.00 -1.14 -1.75 119.26 120.49 1xc1 h ALA 201 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1xc1 h ALA 201 Cb 0.27 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1xc1 h ALA 201 CO 0.00 0.67 0.07 -0.09 0.00 0.00 0.00 179.25 179.90 1xc1 h ARG 202 N 1.12 0.21 -0.46 0.00 2.43 -1.24 0.97 114.38 117.41 1xc1 h ARG 202 Ca 0.24 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.42 1xc1 h ARG 202 Cb 0.30 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.77 1xc1 h ARG 202 CO -0.01 0.26 0.23 1.49 -1.51 0.00 0.00 179.97 180.43 1xc1 h GLU 203 N 0.11 0.45 0.00 0.20 4.81 -1.26 -3.26 114.58 115.63 1xc1 h GLU 203 Ca 0.05 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 59.11 1xc1 h GLU 203 Cb 0.12 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1xc1 h GLU 203 CO -0.01 0.30 -1.36 1.63 -0.73 0.00 0.00 179.01 178.84 1xc1 n LYS 204 N -4.90 0.62 0.00 1.92 4.76 -0.67 -5.07 118.16 114.82 1xc1 n LYS 204 Ca 0.03 0.21 0.00 0.00 -2.87 0.00 0.00 58.31 55.68 1xc1 n LYS 204 Cb 0.12 -1.81 0.00 0.00 -1.84 0.00 0.00 35.03 31.50 1xc1 n LYS 204 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xc1 n GLY 205 N 1.37 0.98 0.45 0.72 0.00 0.33 -4.62 105.19 104.42 1xc1 n GLY 205 Ca -0.08 -1.07 0.28 0.00 0.00 0.00 0.00 46.02 45.15 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 0.45 0.00 1.61 3.04 -1.85 0.48 116.25 119.98 1xc1 h VAL 206 Ca 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 1xc1 h VAL 206 Cb 0.00 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 29.47 1xc1 h VAL 206 CO 0.00 0.04 0.00 1.67 -1.01 0.00 0.00 177.57 178.27 1xc1 n GLN 207 N -4.49 0.06 0.00 4.17 -0.06 -1.26 -2.19 117.38 113.61 1xc1 n GLN 207 Ca 0.26 0.35 0.11 0.00 -2.00 0.00 0.00 57.00 55.72 1xc1 n GLN 207 Cb 1.04 -1.62 -0.06 0.00 -4.06 0.00 0.00 30.24 25.53 1xc1 n GLN 207 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1xc1 n ASN 208 N -1.73 1.50 -4.72 1.69 4.13 0.17 -4.95 115.26 111.35 1xc1 n ASN 208 Ca 0.02 -1.25 -0.33 0.00 1.68 0.00 0.00 54.58 54.70 1xc1 n ASN 208 Cb 0.15 0.75 -0.08 0.00 -1.54 0.00 0.00 39.78 39.06 1xc1 n ASN 208 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1xc1 s VAL 209 N -2.75 4.38 -2.70 2.41 -7.23 -0.93 -5.02 120.40 108.56 1xc1 s VAL 209 Ca 0.13 -0.47 0.22 0.00 -1.81 0.00 0.00 61.98 60.05 1xc1 s VAL 209 Cb 0.17 -2.95 0.16 0.00 0.56 0.00 0.00 36.38 34.32 1xc1 s VAL 209 CO 0.73 0.41 1.19 1.41 -0.31 0.00 0.00 175.10 178.53 1xc1 n HIS 210 N 1.46 0.00 -3.23 2.82 8.25 -1.26 -4.97 115.22 118.29 1xc1 n HIS 210 Ca -0.15 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.04 1xc1 n HIS 210 Cb 0.53 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.62 1xc1 n HIS 210 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1xc1 s THR 211 N -1.92 5.02 0.05 1.59 -1.32 -1.26 -1.59 115.64 116.21 1xc1 s THR 211 Ca 0.25 -0.02 -0.09 0.00 -1.21 0.00 0.00 61.69 60.63 1xc1 s THR 211 Cb 0.18 -3.78 0.00 0.00 -1.51 0.00 0.00 72.50 67.40 1xc1 s THR 211 CO 0.31 -0.45 0.18 -0.13 -2.21 0.00 0.00 174.62 172.32 1xc1 s ARG 212 N -3.89 0.73 0.05 7.08 0.52 -0.69 -4.89 118.95 117.86 1xc1 s ARG 212 Ca 0.44 -0.74 -0.10 0.00 -0.52 0.00 0.00 55.73 54.80 1xc1 s ARG 212 Cb -0.10 0.30 -0.06 0.00 0.52 0.00 0.00 34.95 35.61 1xc1 s ARG 212 CO 0.33 -0.21 0.38 -0.51 0.02 0.00 0.00 175.30 175.31 1xc1 s LEU 213 N -2.33 4.37 -0.05 2.53 1.43 -1.26 -0.96 118.68 122.40 1xc1 s LEU 213 Ca -0.02 0.78 0.04 0.00 -1.03 0.00 0.00 54.13 53.90 1xc1 s LEU 213 Cb 0.01 -2.87 -0.00 0.00 0.03 0.00 0.00 46.19 43.36 1xc1 s LEU 213 CO -0.06 0.21 -0.19 0.21 0.23 0.00 0.00 176.35 176.75 1xc1 s ASN 214 N -1.64 2.39 -0.19 2.29 3.84 0.51 -4.96 114.94 117.17 1xc1 s ASN 214 Ca 0.31 -0.40 -0.01 0.00 0.21 0.00 0.00 52.86 52.97 1xc1 s ASN 214 Cb -0.14 -0.76 0.01 0.00 -0.55 0.00 0.00 41.25 39.80 1xc1 s ASN 214 CO 0.17 0.16 -0.13 -0.36 -2.79 0.00 0.00 177.10 174.14 1xc1 s PHE 215 N 0.11 2.84 0.20 0.43 0.40 -1.26 -1.89 117.98 118.80 1xc1 s PHE 215 Ca -0.07 -1.26 -0.08 0.00 -0.60 0.00 0.00 56.93 54.92 1xc1 s PHE 215 Cb -0.13 -1.98 0.12 0.00 0.51 0.00 0.00 43.02 41.53 1xc1 s PHE 215 CO 0.03 -0.64 1.68 0.28 0.70 0.00 0.00 175.22 177.28 1xc1 h VAL 216 N 5.80 1.26 -0.75 -0.44 2.07 -1.89 -3.49 116.25 118.81 1xc1 h VAL 216 Ca -0.41 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.03 1xc1 h VAL 216 Cb 1.16 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1xc1 h VAL 216 CO 0.61 0.40 0.00 0.54 0.02 0.00 0.00 177.57 179.14 1xc1 n ARG 217 N -4.20 0.00 -4.13 1.57 1.74 -1.26 -4.87 116.66 105.52 1xc1 n ARG 217 Ca 0.04 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.69 1xc1 n ARG 217 Cb 0.31 0.00 -0.01 0.00 -1.02 0.00 0.00 32.46 31.74 1xc1 n ARG 217 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1xc1 n HIS 218 N 0.00 -1.37 -1.07 -1.55 1.44 -1.23 -1.20 115.22 110.24 1xc1 n HIS 218 Ca 0.00 0.22 -0.07 0.00 -2.01 0.00 0.00 57.72 55.86 1xc1 n HIS 218 Cb 0.00 -2.82 -0.03 0.00 0.12 0.00 0.00 29.99 27.26 1xc1 n HIS 218 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 1xc1 n ARG 219 N -4.92 -1.34 -2.09 -1.40 5.12 0.18 -4.91 116.66 107.29 1xc1 n ARG 219 Ca -0.17 0.43 -0.37 0.00 -1.93 0.00 0.00 57.85 55.81 1xc1 n ARG 219 Cb 0.60 -4.42 0.01 0.00 -1.16 0.00 0.00 32.46 27.49 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 -1.52 5.84 0.55 0.55 2.15 -0.34 -4.27 116.67 119.63 1xc1 s ASP 220 Ca 0.00 2.47 0.27 0.00 0.43 0.00 0.00 52.55 55.71 1xc1 s ASP 220 Cb 0.00 -2.61 1.47 0.00 -0.30 0.00 0.00 42.92 41.47 1xc1 s ASP 220 CO 0.00 -1.16 2.00 -0.65 -0.17 0.00 0.00 175.17 175.19 1xc1 h PRO 221 N 1.82 0.00 0.00 4.34 0.11 -1.90 0.22 132.00 136.59 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 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1xc1 h PRO 221 CO 0.59 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.79 1xc1 n GLY 222 N -1.57 -0.94 1.30 -0.55 0.00 -1.26 -2.35 105.19 99.82 1xc1 n GLY 222 Ca 0.08 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.97 2.39 -1.60 4.61 0.00 0.79 -4.46 120.51 121.27 1xc1 n ALA 223 Ca 0.21 -1.23 -0.51 0.00 0.00 0.00 0.00 53.44 51.92 1xc1 n ALA 223 Cb 0.10 -0.94 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 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 1.56 1.77 -4.26 0.00 7.94 -0.99 -4.34 117.00 118.68 1xc1 n LEU 224 Ca 0.23 1.12 -0.32 0.00 -1.11 0.00 0.00 56.01 55.93 1xc1 n LEU 224 Cb 0.59 -1.22 -0.16 0.00 0.53 0.00 0.00 43.42 43.17 1xc1 n LEU 224 CO 0.16 -1.00 -0.52 -0.69 -1.11 0.00 0.00 177.39 174.23 1xc1 s VAL 225 N 0.44 2.40 -0.16 1.96 1.01 -1.26 -1.32 120.40 123.47 1xc1 s VAL 225 Ca 0.82 -0.89 -0.06 0.00 0.00 0.00 0.00 61.98 61.85 1xc1 s VAL 225 Cb -0.92 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.47 1xc1 s VAL 225 CO 0.47 0.54 0.05 -0.89 0.00 0.00 0.00 175.10 175.27 1xc1 s THR 226 N 0.42 4.70 0.18 3.92 2.01 0.75 -4.88 115.64 122.74 1xc1 s THR 226 Ca -0.15 -0.07 0.05 0.00 0.31 0.00 0.00 61.69 61.83 1xc1 s THR 226 Cb -0.17 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 1xc1 s THR 226 CO 0.06 0.50 0.17 -0.31 -0.69 0.00 0.00 174.62 174.35 1xc1 s TYR 227 N 0.03 3.19 0.27 4.92 1.51 -1.26 0.24 117.35 126.24 1xc1 s TYR 227 Ca 0.05 -0.01 0.11 0.00 -1.01 0.00 0.00 57.07 56.20 1xc1 s TYR 227 Cb -0.12 -1.52 -0.05 0.00 -0.11 0.00 0.00 41.96 40.17 1xc1 s TYR 227 CO 0.01 0.52 -0.09 -1.54 -1.11 0.00 0.00 175.55 173.34 1xc1 s SER 228 N -3.23 4.15 0.06 2.29 1.04 -0.69 -3.74 113.70 113.57 1xc1 s SER 228 Ca 0.32 -0.80 -0.01 0.00 0.48 0.00 0.00 55.95 55.94 1xc1 s SER 228 Cb -0.10 -0.62 0.00 0.00 0.10 0.00 0.00 66.02 65.40 1xc1 s SER 228 CO 0.24 0.02 0.09 0.61 0.98 0.00 0.00 173.24 175.19 1xc1 n GLY 229 N -0.75 2.54 3.32 7.32 0.00 -0.79 -0.28 105.19 116.55 1xc1 n GLY 229 Ca -0.06 -1.27 -0.11 0.00 0.00 0.00 0.00 46.02 44.58 1xc1 n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xc1 s ALA 230 N -1.53 -0.96 0.20 4.61 0.00 -0.21 -1.32 121.76 122.56 1xc1 s ALA 230 Ca 0.04 -0.02 -0.20 0.00 0.00 0.00 0.00 51.96 51.79 1xc1 s ALA 230 Cb -0.00 0.69 0.04 0.00 0.00 0.00 0.00 23.12 23.84 1xc1 s ALA 230 CO 0.03 -0.64 0.58 0.00 0.00 0.00 0.00 175.76 175.73 1xc1 s ALA 231 N -3.75 -1.16 -0.20 0.00 0.00 -0.01 -1.21 121.76 115.43 1xc1 s ALA 231 Ca 0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 51.96 51.89 1xc1 s ALA 231 Cb 0.02 0.86 -0.02 0.00 0.00 0.00 0.00 23.12 23.97 1xc1 s ALA 231 CO -0.12 -0.84 -0.01 0.08 0.00 0.00 0.00 175.76 174.88 1xc1 s VAL 232 N -3.85 3.88 0.65 0.00 1.01 -1.26 -0.95 120.40 119.88 1xc1 s VAL 232 Ca 0.07 -0.34 -0.17 0.00 0.00 0.00 0.00 61.98 61.55 1xc1 s VAL 232 Cb -0.02 -2.76 -0.00 0.00 0.00 0.00 0.00 36.38 33.60 1xc1 s VAL 232 CO -0.04 0.43 1.18 -0.76 0.00 0.00 0.00 175.10 175.91 1xc1 s LEU 233 N 1.05 3.48 0.24 3.92 1.02 -0.97 0.56 118.68 127.99 1xc1 s LEU 233 Ca 0.02 2.27 -0.04 0.00 0.02 0.00 0.00 54.13 56.39 1xc1 s LEU 233 Cb -0.14 -4.58 0.27 0.00 0.02 0.00 0.00 46.19 41.75 1xc1 s LEU 233 CO 0.01 -1.82 1.78 0.50 0.02 0.00 0.00 176.35 176.85 1xc1 h LYS 234 N 0.28 0.99 -2.88 1.70 3.64 -1.14 -3.30 116.57 115.86 1xc1 h LYS 234 Ca -0.49 -0.21 -0.76 0.00 -1.27 0.00 0.00 60.65 57.92 1xc1 h LYS 234 Cb 1.28 -0.14 -0.31 0.00 -0.41 0.00 0.00 32.23 32.65 1xc1 h LYS 234 CO 0.53 0.87 0.41 -1.13 -2.27 0.00 0.00 179.45 177.85 1xc1 n SER 235 N -4.26 5.63 -0.05 4.20 3.41 -1.26 -4.71 113.62 116.58 1xc1 n SER 235 Ca 0.05 -3.36 -0.01 0.00 -0.26 0.00 0.00 58.87 55.29 1xc1 n SER 235 Cb 0.23 -1.15 -0.12 0.00 -0.26 0.00 0.00 64.21 62.92 1xc1 n SER 235 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xc1 n SER 236 N 1.45 1.41 0.00 4.04 3.41 -1.24 -4.20 113.62 118.49 1xc1 n SER 236 Ca 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 1xc1 n SER 236 Cb 0.36 1.20 0.00 0.00 -0.26 0.00 0.00 64.21 65.51 1xc1 n SER 236 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xc1 n GLN 237 N -2.34 0.00 -1.44 4.33 3.00 -1.26 -4.57 117.38 115.10 1xc1 n GLN 237 Ca -0.15 0.00 -0.31 0.00 -0.01 0.00 0.00 57.00 56.53 1xc1 n GLN 237 Cb 0.75 0.00 0.03 0.00 0.00 0.00 0.00 30.24 31.02 1xc1 n GLN 237 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1xc1 n ASN 238 N 3.23 7.13 0.23 1.08 3.02 -1.26 -4.73 115.26 123.97 1xc1 n ASN 238 Ca 0.00 -3.52 0.14 0.00 -0.03 0.00 0.00 54.58 51.17 1xc1 n ASN 238 Cb 0.00 -1.08 0.80 0.00 -0.61 0.00 0.00 39.78 38.89 1xc1 n ASN 238 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 1xc1 h LYS 239 N 2.39 0.00 0.01 3.52 1.57 -1.93 0.90 116.57 123.03 1xc1 h LYS 239 Ca 0.48 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 59.05 1xc1 h LYS 239 Cb 0.60 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 1xc1 h LYS 239 CO 1.22 0.00 -0.94 0.22 -0.57 0.00 0.00 179.45 179.38 1xc1 h ASP 240 N 0.00 0.40 0.01 0.86 1.82 -1.99 -2.13 116.42 115.39 1xc1 h ASP 240 Ca 0.05 -0.33 -0.00 0.00 -0.39 0.00 0.00 57.03 56.36 1xc1 h ASP 240 Cb 0.25 -0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.14 1xc1 h ASP 240 CO -0.00 1.14 -0.00 -0.33 -1.61 0.00 0.00 179.24 178.44 1xc1 h GLU 241 N 0.16 -0.01 -0.97 0.28 5.08 -1.83 -2.73 114.58 114.56 1xc1 h GLU 241 Ca -0.07 0.00 0.26 0.00 -1.00 0.00 0.00 59.36 58.55 1xc1 h GLU 241 Cb 1.58 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.77 1xc1 h GLU 241 CO 0.15 0.81 0.66 0.00 -1.00 0.00 0.00 179.01 179.64 1xc1 h ALA 242 N -0.07 2.55 -0.17 3.43 0.00 -0.93 0.25 119.26 124.31 1xc1 h ALA 242 Ca -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.70 1xc1 h ALA 242 Cb 0.83 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.66 1xc1 h ALA 242 CO 0.00 -0.86 -0.73 0.87 0.00 0.00 0.00 179.25 178.54 1xc1 h LYS 243 N 0.22 0.80 -0.46 0.00 1.57 -1.41 -2.78 116.57 114.50 1xc1 h LYS 243 Ca 0.50 -0.63 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1xc1 h LYS 243 Cb 1.57 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.99 1xc1 h LYS 243 CO -0.13 1.24 0.12 0.87 -0.57 0.00 0.00 179.45 180.99 1xc1 h LYS 244 N 0.54 0.73 -0.31 3.15 1.57 -0.31 -0.67 116.57 121.27 1xc1 h LYS 244 Ca -0.04 -0.17 0.07 0.00 -1.87 0.00 0.00 60.65 58.64 1xc1 h LYS 244 Cb 1.36 -0.10 -0.07 0.00 0.08 0.00 0.00 32.23 33.50 1xc1 h LYS 244 CO 0.15 0.71 -0.14 0.35 -0.57 0.00 0.00 179.45 179.96 1xc1 h PHE 245 N 0.61 -0.33 -0.22 -1.35 3.57 -0.87 0.36 116.94 118.71 1xc1 h PHE 245 Ca 0.15 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.58 1xc1 h PHE 245 Cb 0.31 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1xc1 h PHE 245 CO 0.02 -0.21 -0.27 0.28 -2.23 0.00 0.00 178.31 175.90 1xc1 h VAL 246 N -0.09 1.27 0.00 1.41 2.07 -1.36 0.03 116.25 119.59 1xc1 h VAL 246 Ca 0.16 -1.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 1xc1 h VAL 246 Cb 0.32 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1xc1 h VAL 246 CO -0.36 0.40 -0.07 0.00 0.02 0.00 0.00 177.57 177.56 1xc1 h ALA 247 N 1.34 1.27 0.00 1.67 0.00 0.52 -2.05 119.26 122.01 1xc1 h ALA 247 Ca 0.05 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1xc1 h ALA 247 Cb 0.68 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xc1 h ALA 247 CO 0.05 0.08 -0.12 0.35 0.00 0.00 0.00 179.25 179.62 1xc1 h PHE 248 N 0.00 0.00 -0.75 0.00 3.57 0.11 -2.52 116.94 117.36 1xc1 h PHE 248 Ca -0.00 0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.70 1xc1 h PHE 248 Cb 0.23 0.00 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 1xc1 h PHE 248 CO 0.00 0.94 0.53 -0.07 -2.23 0.00 0.00 178.31 177.47 1xc1 h LEU 249 N -1.00 0.10 0.00 0.59 3.38 -0.64 0.66 115.31 118.40 1xc1 h LEU 249 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1xc1 h LEU 249 Cb 0.92 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1xc1 h LEU 249 CO -0.02 0.05 -0.85 0.00 0.09 0.00 0.00 178.44 177.70 1xc1 n ALA 250 N -2.64 3.77 -1.88 1.53 0.00 -0.81 -3.97 120.51 116.52 1xc1 n ALA 250 Ca 0.15 -0.43 -0.31 0.00 0.00 0.00 0.00 53.44 52.84 1xc1 n ALA 250 Cb 0.75 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 19.22 1xc1 n ALA 250 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1xc1 s GLY 251 N -3.29 1.82 0.30 0.00 0.00 0.23 -4.56 107.32 101.82 1xc1 s GLY 251 Ca 0.07 0.01 0.03 0.00 0.00 0.00 0.00 44.72 44.83 1xc1 s GLY 251 CO 0.79 0.27 1.82 0.50 0.00 0.00 0.00 173.10 176.48 1xc1 h LYS 252 N 0.22 0.87 -0.24 2.90 1.57 -1.90 0.15 116.57 120.15 1xc1 h LYS 252 Ca -0.45 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.25 1xc1 h LYS 252 Cb 1.19 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 1xc1 h LYS 252 CO 0.62 0.58 0.04 0.93 -0.57 0.00 0.00 179.45 181.05 1xc1 h GLU 253 N 0.90 0.40 -0.31 3.15 3.07 -1.94 -2.56 114.58 117.29 1xc1 h GLU 253 Ca 0.52 -0.10 -0.08 0.00 -0.50 0.00 0.00 59.36 59.19 1xc1 h GLU 253 Cb 0.63 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.48 1xc1 h GLU 253 CO -0.29 0.52 -0.12 0.78 -1.40 0.00 0.00 179.01 178.50 1xc1 h GLY 254 N 0.20 0.68 0.39 -3.84 0.00 -1.29 -2.51 103.07 96.71 1xc1 h GLY 254 Ca 0.07 -0.60 0.11 0.00 0.00 0.00 0.00 47.33 46.91 1xc1 h GLY 254 CO 0.00 0.54 0.35 1.46 0.00 0.00 0.00 176.54 178.90 1xc1 h GLN 255 N 0.39 0.56 0.00 4.80 1.08 -0.76 -2.29 115.11 118.90 1xc1 h GLN 255 Ca 0.07 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1xc1 h GLN 255 Cb 0.63 -0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1xc1 h GLN 255 CO 0.04 0.37 -0.00 0.00 -0.95 0.00 0.00 178.83 178.29 1xc1 h ARG 256 N 0.58 -0.00 -0.86 1.46 2.47 -1.33 0.68 114.38 117.38 1xc1 h ARG 256 Ca 0.37 0.00 0.13 0.00 -1.26 0.00 0.00 59.98 59.23 1xc1 h ARG 256 Cb 0.44 0.00 -0.06 0.00 -1.65 0.00 0.00 29.97 28.70 1xc1 h ARG 256 CO -0.30 0.04 0.56 0.00 0.56 0.00 0.00 179.97 180.82 1xc1 h ALA 257 N 0.96 1.83 0.14 0.04 0.00 -0.98 0.25 119.26 121.50 1xc1 h ALA 257 Ca -0.00 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1xc1 h ALA 257 Cb 0.04 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 17.72 1xc1 h ALA 257 CO 0.00 -0.05 -0.83 1.25 0.00 0.00 0.00 179.25 179.62 1xc1 h LEU 258 N 0.69 0.49 -0.02 0.00 5.85 -1.18 -3.25 115.31 117.89 1xc1 h LEU 258 Ca 0.42 -0.94 0.00 0.00 0.84 0.00 0.00 57.88 58.20 1xc1 h LEU 258 Cb 0.66 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1xc1 h LEU 258 CO -0.18 1.39 0.00 0.41 -0.34 0.00 0.00 178.44 179.72 1xc1 n THR 259 N -4.11 1.90 0.01 1.05 -1.04 0.24 -1.41 114.28 110.91 1xc1 n THR 259 Ca -0.14 0.48 0.05 0.00 -2.04 0.00 0.00 64.05 62.41 1xc1 n THR 259 Cb 0.82 -1.46 -0.11 0.00 -1.82 0.00 0.00 70.33 67.76 1xc1 n THR 259 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xc1 n ALA 260 N -1.50 2.35 0.00 2.41 0.00 0.73 -1.76 120.51 122.73 1xc1 n ALA 260 Ca 0.00 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1xc1 n ALA 260 Cb 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1xc1 n ALA 260 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1xc1 n VAL 261 N -2.56 0.00 -4.63 0.00 3.14 -0.86 -4.93 118.33 108.49 1xc1 n VAL 261 Ca -0.09 -0.05 -0.24 0.00 -2.96 0.00 0.00 64.34 61.00 1xc1 n VAL 261 Cb 0.72 0.55 -0.16 0.00 -1.06 0.00 0.00 33.84 33.89 1xc1 n VAL 261 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 1xc1 s ARG 262 N -1.87 1.46 -0.64 1.45 3.52 -0.50 -4.92 118.95 117.45 1xc1 s ARG 262 Ca 0.00 -0.46 -0.07 0.00 -0.13 0.00 0.00 55.73 55.07 1xc1 s ARG 262 Cb 0.00 -1.28 -0.18 0.00 -1.56 0.00 0.00 34.95 31.93 1xc1 s ARG 262 CO 0.00 0.16 3.12 0.00 -0.81 0.00 0.00 175.30 177.77 1xc1 n ALA 263 N 3.31 6.39 -2.69 6.12 0.00 -1.26 -4.45 120.51 127.94 1xc1 n ALA 263 Ca -0.19 -2.34 -0.33 0.00 0.00 0.00 0.00 53.44 50.58 1xc1 n ALA 263 Cb 0.53 -2.74 -0.09 0.00 0.00 0.00 0.00 19.45 17.15 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 1.71 2.83 -0.12 0.00 2.02 -1.26 -4.33 118.70 119.55 1xc1 s GLU 264 Ca 0.62 -0.57 -0.29 0.00 0.02 0.00 0.00 54.97 54.75 1xc1 s GLU 264 Cb 0.24 -2.70 -0.04 0.00 0.10 0.00 0.00 34.13 31.73 1xc1 s GLU 264 CO -0.02 0.64 1.64 0.71 0.02 0.00 0.00 175.26 178.25 1xc1 s TYR 265 N -1.06 2.03 0.26 1.61 1.51 0.19 -4.78 117.35 117.11 1xc1 s TYR 265 Ca 0.19 0.37 -0.30 0.00 -1.01 0.00 0.00 57.07 56.31 1xc1 s TYR 265 Cb -0.11 -3.92 -0.11 0.00 -0.11 0.00 0.00 41.96 37.71 1xc1 s TYR 265 CO 0.09 -3.44 1.52 -2.14 -1.11 0.00 0.00 175.55 170.47 1xc1 s PRO 266 N 4.31 4.20 0.23 -1.71 0.02 -1.26 -1.72 135.00 139.07 1xc1 s PRO 266 Ca 0.73 2.43 0.23 0.00 0.02 0.00 0.00 61.00 64.41 1xc1 s PRO 266 Cb -0.30 -3.08 0.22 0.00 0.02 0.00 0.00 34.50 31.37 1xc1 s PRO 266 CO 0.29 -0.53 1.29 -0.07 -0.33 0.00 0.00 177.00 177.65 1xc1 h LEU 267 N 5.10 0.00 -8.89 -5.54 3.38 -1.88 -3.43 115.31 104.04 1xc1 h LEU 267 Ca -0.46 -0.06 -0.58 0.00 0.09 0.00 0.00 57.88 56.86 1xc1 h LEU 267 Cb 1.22 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.89 1xc1 h LEU 267 CO 0.80 0.03 0.72 0.21 0.09 0.00 0.00 178.44 180.29 1xc1 s ASN 268 N -5.15 6.80 0.00 -0.43 3.04 -1.26 -4.54 114.94 113.40 1xc1 s ASN 268 Ca 0.04 0.81 0.06 0.00 0.04 0.00 0.00 52.86 53.81 1xc1 s ASN 268 Cb 0.10 -2.50 0.35 0.00 -1.54 0.00 0.00 41.25 37.66 1xc1 s ASN 268 CO 0.73 -0.87 0.78 -0.81 -3.04 0.00 0.00 177.10 173.90 1xc1 n PRO 269 N 6.83 0.21 0.00 0.43 -0.04 -1.26 -2.03 135.00 139.14 1xc1 n PRO 269 Ca 0.09 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.63 1xc1 n PRO 269 Cb 0.48 -1.44 -0.00 0.00 -0.04 0.00 0.00 33.50 32.50 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 -0.94 0.00 -3.40 0.54 8.25 -1.26 -4.97 115.22 113.44 1xc1 n HIS 270 Ca 0.04 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.12 1xc1 n HIS 270 Cb 0.02 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.07 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 -1.82 4.93 -0.17 1.59 1.01 -0.86 -5.07 120.40 120.00 1xc1 s VAL 271 Ca 0.13 1.00 -0.01 0.00 0.00 0.00 0.00 61.98 63.10 1xc1 s VAL 271 Cb 0.12 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.71 1xc1 s VAL 271 CO 0.38 0.55 -0.13 -0.69 0.00 0.00 0.00 175.10 175.21 1xc1 s VAL 272 N -0.94 2.83 0.66 2.92 1.01 -1.26 -4.97 120.40 120.64 1xc1 s VAL 272 Ca 0.26 -0.70 -0.15 0.00 0.00 0.00 0.00 61.98 61.39 1xc1 s VAL 272 Cb -0.18 -2.22 -0.00 0.00 0.00 0.00 0.00 36.38 33.98 1xc1 s VAL 272 CO 0.15 0.49 1.10 -0.55 0.00 0.00 0.00 175.10 176.30 1xc1 s SER 273 N 1.00 5.17 0.10 3.32 0.15 -1.26 -4.92 113.70 117.26 1xc1 s SER 273 Ca -0.01 1.95 0.28 0.00 0.70 0.00 0.00 55.95 58.87 1xc1 s SER 273 Cb -0.15 -2.55 1.03 0.00 -1.71 0.00 0.00 66.02 62.65 1xc1 s SER 273 CO -0.02 -1.59 1.85 1.07 1.20 0.00 0.00 173.24 175.75 1xc1 n THR 274 N -2.45 0.28 -3.61 6.45 5.66 -0.72 -4.78 114.28 115.11 1xc1 n THR 274 Ca 0.10 -0.14 -0.20 0.00 -3.05 0.00 0.00 64.05 60.77 1xc1 n THR 274 Cb 0.52 -0.54 -0.01 0.00 -1.55 0.00 0.00 70.33 68.75 1xc1 n THR 274 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 1xc1 s PHE 275 N -3.05 3.09 -1.49 1.09 0.40 -1.26 -5.00 117.98 111.75 1xc1 s PHE 275 Ca 0.12 -0.22 -0.12 0.00 -0.60 0.00 0.00 56.93 56.11 1xc1 s PHE 275 Cb 0.16 -1.90 0.01 0.00 0.51 0.00 0.00 43.02 41.80 1xc1 s PHE 275 CO 0.56 0.09 2.45 0.09 0.70 0.00 0.00 175.22 179.11 1xc1 n ASN 276 N -1.54 5.78 -4.46 1.36 3.02 -1.26 -4.87 115.26 113.28 1xc1 n ASN 276 Ca -0.01 -2.79 -0.35 0.00 -0.03 0.00 0.00 54.58 51.40 1xc1 n ASN 276 Cb 0.58 -1.60 -0.12 0.00 -0.61 0.00 0.00 39.78 38.03 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 1.12 3.31 1.00 3.41 1.43 -1.26 -5.12 118.68 122.57 1xc1 s LEU 277 Ca 0.54 -0.18 -0.16 0.00 -1.03 0.00 0.00 54.13 53.30 1xc1 s LEU 277 Cb 0.15 -1.84 0.20 0.00 0.03 0.00 0.00 46.19 44.73 1xc1 s LEU 277 CO -0.07 0.07 1.24 -1.83 0.23 0.00 0.00 176.35 175.99 1xc1 s GLU 278 N 0.97 0.40 0.18 1.70 -1.05 -1.26 -4.70 118.70 114.94 1xc1 s GLU 278 Ca 0.02 -0.21 -0.33 0.00 -0.15 0.00 0.00 54.97 54.30 1xc1 s GLU 278 Cb -0.14 -1.80 -0.13 0.00 -0.44 0.00 0.00 34.13 31.62 1xc1 s GLU 278 CO 0.02 -2.60 1.68 -2.30 0.95 0.00 0.00 175.26 173.01 1xc1 n PRO 279 N -3.95 2.54 -0.23 -4.83 -0.02 -1.26 -4.85 135.00 122.41 1xc1 n PRO 279 Ca 0.13 0.92 0.03 0.00 -2.02 0.00 0.00 63.50 62.56 1xc1 n PRO 279 Cb 0.60 -2.74 0.14 0.00 -0.02 0.00 0.00 33.50 31.47 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 3.83 0.45 -1.02 4.25 2.10 -1.92 0.28 117.51 125.48 1xc1 h ILE 280 Ca -0.44 -0.05 0.26 0.00 1.08 0.00 0.00 64.86 65.71 1xc1 h ILE 280 Cb 1.22 0.29 -0.12 0.00 -1.09 0.00 0.00 36.82 37.12 1xc1 h ILE 280 CO 0.93 0.03 0.62 0.00 -1.08 0.00 0.00 178.15 178.65 1xc1 h ALA 281 N 1.62 1.94 0.00 0.18 0.00 -1.94 0.27 119.26 121.33 1xc1 h ALA 281 Ca 0.37 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1xc1 h ALA 281 Cb 0.63 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xc1 h ALA 281 CO -0.57 -0.41 0.00 -0.22 0.00 0.00 0.00 179.25 178.05 1xc1 h LYS 282 N 0.50 0.00 0.00 0.00 3.64 -0.79 -2.50 116.57 117.43 1xc1 h LYS 282 Ca 0.65 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.98 1xc1 h LYS 282 Cb 1.37 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.18 1xc1 h LYS 282 CO -0.44 0.00 -0.22 -0.07 -2.27 0.00 0.00 179.45 176.45 1xc1 h LEU 283 N 0.00 0.00 -1.33 5.20 3.38 -0.46 -3.47 115.31 118.64 1xc1 h LEU 283 Ca 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.69 1xc1 h LEU 283 Cb 0.24 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.10 1xc1 h LEU 283 CO 0.00 0.22 -0.55 -0.62 0.09 0.00 0.00 178.44 177.58 1xc1 n GLU 284 N -4.14 -5.55 -2.30 1.13 1.02 -0.94 -3.99 120.64 105.88 1xc1 n GLU 284 Ca -0.02 0.64 -0.37 0.00 -0.02 0.00 0.00 57.16 57.39 1xc1 n GLU 284 Cb 0.29 -5.07 -0.01 0.00 -0.02 0.00 0.00 31.44 26.62 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 -3.26 2.97 0.68 0.62 0.00 -1.26 0.47 121.76 121.98 1xc1 s ALA 285 Ca 0.22 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 52.95 1xc1 s ALA 285 Cb -0.10 -3.36 -0.00 0.00 0.00 0.00 0.00 23.12 19.66 1xc1 s ALA 285 CO 0.56 -0.60 1.06 -1.25 0.00 0.00 0.00 175.76 175.52 1xc1 s PRO 286 N -2.73 3.08 -0.19 0.00 0.04 -1.26 -4.65 135.00 129.29 1xc1 s PRO 286 Ca 0.64 0.77 -0.18 0.00 0.04 0.00 0.00 61.00 62.26 1xc1 s PRO 286 Cb -0.27 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 1xc1 s PRO 286 CO 0.33 -0.95 0.50 -1.14 0.04 0.00 0.00 177.00 175.78 1xc1 s GLN 287 N -5.15 4.20 -0.02 4.56 0.74 -1.26 -4.78 119.66 117.95 1xc1 s GLN 287 Ca 0.57 0.40 0.00 0.00 0.05 0.00 0.00 55.36 56.38 1xc1 s GLN 287 Cb -0.12 -3.55 0.02 0.00 1.10 0.00 0.00 33.01 30.46 1xc1 s GLN 287 CO 0.54 -0.11 0.01 0.54 -0.55 0.00 0.00 175.29 175.73 1xc1 s VAL 288 N 1.50 0.02 1.13 1.34 0.11 -1.26 -5.02 120.40 118.21 1xc1 s VAL 288 Ca 0.24 0.11 -0.13 0.00 -2.93 0.00 0.00 61.98 59.27 1xc1 s VAL 288 Cb -0.15 -0.11 0.26 0.00 -1.53 0.00 0.00 36.38 34.85 1xc1 s VAL 288 CO 0.10 0.08 1.04 -0.94 -3.33 0.00 0.00 175.10 172.05 1xc1 s SER 289 N 0.72 1.32 0.69 3.54 1.04 -1.26 -4.96 113.70 114.79 1xc1 s SER 289 Ca -0.06 1.45 -0.16 0.00 0.48 0.00 0.00 55.95 57.66 1xc1 s SER 289 Cb -0.09 -2.21 0.02 0.00 0.10 0.00 0.00 66.02 63.84 1xc1 s SER 289 CO -0.02 -3.98 1.22 0.00 0.98 0.00 0.00 173.24 171.45 1xc1 s ALA 290 N -2.57 2.25 0.31 5.32 0.00 -1.26 -4.98 121.76 120.83 1xc1 s ALA 290 Ca 0.68 0.96 -0.22 0.00 0.00 0.00 0.00 51.96 53.38 1xc1 s ALA 290 Cb -0.24 -3.48 -0.10 0.00 0.00 0.00 0.00 23.12 19.31 1xc1 s ALA 290 CO 0.63 -1.68 0.86 0.99 0.00 0.00 0.00 175.76 176.56 1xc1 s THR 291 N -1.81 4.40 0.46 0.00 2.01 -1.26 -5.06 115.64 114.38 1xc1 s THR 291 Ca 0.76 1.51 0.04 0.00 0.31 0.00 0.00 61.69 64.31 1xc1 s THR 291 Cb -0.31 -3.84 -0.05 0.00 0.01 0.00 0.00 72.50 68.31 1xc1 s THR 291 CO 0.42 0.03 0.03 0.42 -0.69 0.00 0.00 174.62 174.83 1xc1 s THR 292 N -1.74 1.63 0.10 -0.82 -4.23 -1.26 -4.71 115.64 104.61 1xc1 s THR 292 Ca 0.51 -1.97 -0.22 0.00 -1.18 0.00 0.00 61.69 58.83 1xc1 s THR 292 Cb -0.15 -2.60 -0.13 0.00 1.34 0.00 0.00 72.50 70.95 1xc1 s THR 292 CO 0.20 0.00 1.75 0.58 -0.54 0.00 0.00 174.62 176.61 1xc1 h VAL 293 N 1.53 1.01 0.00 2.29 2.07 -1.99 -1.31 116.25 119.85 1xc1 h VAL 293 Ca -0.44 -0.02 -0.05 0.00 0.82 0.00 0.00 66.70 67.02 1xc1 h VAL 293 Cb 1.28 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.99 1xc1 h VAL 293 CO 0.77 0.01 -0.22 0.28 0.02 0.00 0.00 177.57 178.42 1xc1 h SER 294 N 0.05 0.00 0.04 0.57 0.02 -1.97 0.17 113.55 112.43 1xc1 h SER 294 Ca 0.01 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.78 1xc1 h SER 294 Cb -0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.53 1xc1 h SER 294 CO -0.00 0.22 -0.66 -0.33 -1.14 0.00 0.00 176.83 174.92 1xc1 h GLU 295 N 0.00 0.58 0.05 3.45 5.08 -1.82 0.22 114.58 122.14 1xc1 h GLU 295 Ca -0.00 -0.43 -0.23 0.00 -1.00 0.00 0.00 59.36 57.70 1xc1 h GLU 295 Cb 0.54 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1xc1 h GLU 295 CO 0.03 1.05 -1.06 0.87 -1.00 0.00 0.00 179.01 178.89 1xc1 h LYS 296 N 0.42 0.18 -0.28 2.33 1.57 -0.67 -2.14 116.57 117.99 1xc1 h LYS 296 Ca -0.02 -0.27 -0.05 0.00 -1.87 0.00 0.00 60.65 58.44 1xc1 h LYS 296 Cb 1.24 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 1xc1 h LYS 296 CO 0.12 1.08 -0.03 1.49 -0.57 0.00 0.00 179.45 181.55 1xc1 h GLU 297 N 0.07 0.51 -0.25 3.15 4.57 -0.63 -1.34 114.58 120.67 1xc1 h GLU 297 Ca -0.07 -0.18 0.02 0.00 -1.18 0.00 0.00 59.36 57.95 1xc1 h GLU 297 Cb 1.77 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 30.30 1xc1 h GLU 297 CO 0.16 0.69 0.11 1.25 -1.18 0.00 0.00 179.01 180.04 1xc1 h HIS 298 N 0.28 0.20 0.00 0.92 2.76 -0.57 -0.09 115.15 118.65 1xc1 h HIS 298 Ca 0.08 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.20 1xc1 h HIS 298 Cb 0.48 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.38 1xc1 h HIS 298 CO 0.04 0.11 -0.28 0.00 -1.30 0.00 0.00 177.93 176.50 1xc1 h ALA 299 N 1.14 1.32 -0.05 5.26 0.00 -1.36 -1.87 119.26 123.69 1xc1 h ALA 299 Ca 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1xc1 h ALA 299 Cb 0.05 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1xc1 h ALA 299 CO -0.08 0.35 -0.06 1.15 0.00 0.00 0.00 179.25 180.61 1xc1 h THR 300 N 0.00 1.38 -0.45 0.00 2.02 -0.47 -1.27 112.91 114.12 1xc1 h THR 300 Ca -0.00 -1.23 -0.00 0.00 0.77 0.00 0.00 66.41 65.95 1xc1 h THR 300 Cb 0.57 2.09 -0.02 0.00 -1.74 0.00 0.00 68.15 69.05 1xc1 h THR 300 CO 0.04 0.33 0.28 -0.09 0.37 0.00 0.00 175.52 176.45 1xc1 h ARG 301 N -0.33 0.60 -0.07 6.66 2.43 -0.76 0.77 114.38 123.69 1xc1 h ARG 301 Ca 0.01 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.04 1xc1 h ARG 301 Cb 0.57 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 1xc1 h ARG 301 CO 0.01 0.42 -0.39 -0.07 -1.51 0.00 0.00 179.97 178.43 1xc1 h LEU 302 N 0.62 0.16 -1.67 3.80 3.38 -1.23 -0.86 115.31 119.52 1xc1 h LEU 302 Ca 0.16 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 1xc1 h LEU 302 Cb -0.04 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 1xc1 h LEU 302 CO -0.03 0.54 -0.14 0.25 0.09 0.00 0.00 178.44 179.15 1xc1 h LEU 303 N 0.13 0.00 0.09 1.67 5.85 0.37 -2.33 115.31 121.10 1xc1 h LEU 303 Ca 0.01 0.00 -0.33 0.00 0.84 0.00 0.00 57.88 58.40 1xc1 h LEU 303 Cb 0.75 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1xc1 h LEU 303 CO 0.06 0.14 -1.81 -0.33 -0.34 0.00 0.00 178.44 176.15 1xc1 h GLU 304 N 0.00 0.20 0.00 1.25 5.08 -0.71 -0.74 114.58 119.65 1xc1 h GLU 304 Ca -0.00 -0.33 -0.03 0.00 -1.00 0.00 0.00 59.36 57.99 1xc1 h GLU 304 Cb 0.47 0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 1xc1 h GLU 304 CO 0.02 1.00 -0.15 1.96 -1.00 0.00 0.00 179.01 180.83 1xc1 h GLN 305 N 0.05 0.00 0.00 2.33 4.20 -0.86 -2.57 115.11 118.27 1xc1 h GLN 305 Ca -0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.36 1xc1 h GLN 305 Cb 2.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.81 1xc1 h GLN 305 CO 0.11 0.15 -0.83 0.00 -0.67 0.00 0.00 178.83 177.59 1xc1 n ALA 306 N -2.27 3.03 -0.12 3.87 0.00 -0.90 -4.97 120.51 119.14 1xc1 n ALA 306 Ca -0.01 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1xc1 n ALA 306 Cb 0.29 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.65 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 1.33 0.55 0.00 0.00 0.00 -0.97 -4.76 105.19 101.35 1xc1 n GLY 307 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.00 0.00 -0.68 1.61 2.81 -0.69 -5.01 117.12 113.16 1xc1 n MET 308 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1xc1 n MET 308 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.51 1xc1 n MET 308 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65