#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bi8 s SER 3 N 0.00 5.88 0.25 0.00 0.15 -1.26 -4.97 113.70 113.75 2bi8 s SER 3 Ca 0.00 1.05 -0.17 0.00 0.70 0.00 0.00 55.95 57.53 2bi8 s SER 3 Cb 0.00 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 2bi8 s SER 3 CO 0.00 -1.76 0.70 -0.54 1.20 0.00 0.00 173.24 172.84 2bi8 s LYS 4 N 5.73 4.11 -0.45 5.44 -0.14 -1.26 -4.78 119.74 128.39 2bi8 s LYS 4 Ca 0.74 0.72 -0.20 0.00 -1.36 0.00 0.00 55.97 55.87 2bi8 s LYS 4 Cb -0.19 -2.71 0.03 0.00 -1.68 0.00 0.00 37.83 33.27 2bi8 s LYS 4 CO 0.31 0.32 0.60 0.15 -0.76 0.00 0.00 175.35 175.97 2bi8 s LYS 5 N -2.37 3.22 -0.16 1.68 3.01 -1.26 -1.34 119.74 122.51 2bi8 s LYS 5 Ca 0.47 -0.52 -0.04 0.00 -1.01 0.00 0.00 55.97 54.87 2bi8 s LYS 5 Cb -0.14 -3.97 -0.03 0.00 -1.01 0.00 0.00 37.83 32.68 2bi8 s LYS 5 CO 0.19 -1.01 -0.04 0.42 0.51 0.00 0.00 175.35 175.43 2bi8 s ILE 6 N 2.67 3.83 -0.20 2.17 -1.09 -0.69 0.10 121.20 127.99 2bi8 s ILE 6 Ca 0.19 -0.37 -0.10 0.00 -2.23 0.00 0.00 60.65 58.14 2bi8 s ILE 6 Cb -0.15 -2.69 -0.05 0.00 -1.58 0.00 0.00 42.46 37.99 2bi8 s ILE 6 CO 0.17 0.48 0.13 -0.22 -1.23 0.00 0.00 174.94 174.27 2bi8 s LEU 7 N 0.50 4.18 -0.16 2.97 2.96 -0.95 -0.28 118.68 127.90 2bi8 s LEU 7 Ca -0.03 0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2bi8 s LEU 7 Cb -0.14 -2.09 -0.01 0.00 0.50 0.00 0.00 46.19 44.45 2bi8 s LEU 7 CO 0.03 0.17 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.47 2bi8 s ILE 8 N 0.43 2.93 -0.64 6.68 1.01 0.72 -1.20 121.20 131.14 2bi8 s ILE 8 Ca 0.08 -0.68 -0.17 0.00 0.00 0.00 0.00 60.65 59.88 2bi8 s ILE 8 Cb -0.11 -2.26 0.14 0.00 0.01 0.00 0.00 42.46 40.24 2bi8 s ILE 8 CO -0.01 0.50 0.65 -0.69 0.00 0.00 0.00 174.94 175.39 2bi8 s VAL 9 N 0.82 5.15 0.00 2.92 1.01 0.36 -1.65 120.40 129.00 2bi8 s VAL 9 Ca -0.04 -1.56 0.00 0.00 0.00 0.00 0.00 61.98 60.38 2bi8 s VAL 9 Cb -0.15 -4.44 0.00 0.00 0.00 0.00 0.00 36.38 31.79 2bi8 s VAL 9 CO 0.00 -1.02 0.00 0.61 0.00 0.00 0.00 175.10 174.70 2bi8 n GLY 10 N 5.00 3.99 1.30 4.51 0.00 0.01 -1.48 105.19 118.53 2bi8 n GLY 10 Ca -0.05 -1.23 -0.01 0.00 0.00 0.00 0.00 46.02 44.73 2bi8 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bi8 n ALA 11 N -0.06 3.95 -1.20 4.61 0.00 -1.26 -3.98 120.51 122.58 2bi8 n ALA 11 Ca 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 53.44 50.76 2bi8 n ALA 11 Cb 0.00 -0.88 0.03 0.00 0.00 0.00 0.00 19.45 18.60 2bi8 n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bi8 n GLY 12 N -0.69 -1.12 0.20 0.00 0.00 -1.26 -1.20 105.19 101.11 2bi8 n GLY 12 Ca 0.32 -1.69 -0.03 0.00 0.00 0.00 0.00 46.02 44.62 2bi8 n GLY 12 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2bi8 h PHE 13 N -1.10 -0.25 -0.09 1.61 -1.00 -1.95 -0.09 116.94 114.08 2bi8 h PHE 13 Ca -0.07 0.04 0.04 0.00 2.81 0.00 0.00 57.97 60.79 2bi8 h PHE 13 Cb 0.19 0.19 -0.06 0.00 3.61 0.00 0.00 35.95 39.88 2bi8 h PHE 13 CO 0.00 -0.21 -0.46 0.77 -1.61 0.00 0.00 178.31 176.81 2bi8 h SER 14 N 0.01 -1.42 -0.16 2.17 0.02 -1.93 0.29 113.55 112.53 2bi8 h SER 14 Ca 0.24 0.18 -0.01 0.00 -0.84 0.00 0.00 61.79 61.35 2bi8 h SER 14 Cb 0.37 0.56 -0.01 0.00 0.14 0.00 0.00 62.40 63.46 2bi8 h SER 14 CO -0.50 -0.46 0.05 1.23 -1.14 0.00 0.00 176.83 176.00 2bi8 h GLY 15 N -0.55 0.26 0.95 -3.77 0.00 -1.63 -1.96 103.07 96.38 2bi8 h GLY 15 Ca 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.22 2bi8 h GLY 15 CO -0.38 0.15 0.17 0.00 0.00 0.00 0.00 176.54 176.47 2bi8 h ALA 16 N 0.86 0.42 -0.18 3.60 0.00 -0.89 0.65 119.26 123.72 2bi8 h ALA 16 Ca 0.05 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 2bi8 h ALA 16 Cb 0.23 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2bi8 h ALA 16 CO -0.00 -0.04 -0.25 0.28 0.00 0.00 0.00 179.25 179.23 2bi8 h VAL 17 N 0.39 1.34 0.05 0.00 2.07 -0.94 -0.48 116.25 118.69 2bi8 h VAL 17 Ca 0.11 -1.46 0.00 0.00 0.82 0.00 0.00 66.70 66.17 2bi8 h VAL 17 Cb 0.09 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 2bi8 h VAL 17 CO -0.02 0.44 -0.05 0.40 0.02 0.00 0.00 177.57 178.37 2bi8 h ILE 18 N 0.14 0.89 -0.54 4.57 2.04 -1.36 -2.36 117.51 120.88 2bi8 h ILE 18 Ca 0.02 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.99 2bi8 h ILE 18 Cb 0.82 0.89 -0.11 0.00 -0.74 0.00 0.00 36.82 37.69 2bi8 h ILE 18 CO 0.06 0.00 -0.17 1.23 0.00 0.00 0.00 178.15 179.26 2bi8 h GLY 19 N -0.11 0.30 1.04 5.37 0.00 -0.76 -1.66 103.07 107.25 2bi8 h GLY 19 Ca 0.00 0.23 -0.10 0.00 0.00 0.00 0.00 47.33 47.46 2bi8 h GLY 19 CO -0.01 -0.22 -0.11 -0.09 0.00 0.00 0.00 176.54 176.11 2bi8 h ARG 20 N -0.04 0.91 -0.63 4.80 9.65 -1.05 0.17 114.38 128.18 2bi8 h ARG 20 Ca 0.26 -0.35 0.02 0.00 -1.10 0.00 0.00 59.98 58.81 2bi8 h ARG 20 Cb 0.44 -0.05 -0.04 0.00 -1.39 0.00 0.00 29.97 28.93 2bi8 h ARG 20 CO -0.58 1.00 0.40 1.96 2.80 0.00 0.00 179.97 185.55 2bi8 h GLN 21 N 0.75 0.77 -0.24 0.20 1.08 -1.08 -1.74 115.11 114.86 2bi8 h GLN 21 Ca 0.12 -0.05 -0.19 0.00 -1.45 0.00 0.00 58.65 57.08 2bi8 h GLN 21 Cb 0.66 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.92 2bi8 h GLN 21 CO 0.05 0.51 -0.60 -0.07 -0.95 0.00 0.00 178.83 177.77 2bi8 h LEU 22 N 0.79 0.94 -0.89 1.46 3.38 -1.13 -3.21 115.31 116.66 2bi8 h LEU 22 Ca 0.25 -0.56 0.02 0.00 0.09 0.00 0.00 57.88 57.67 2bi8 h LEU 22 Cb -0.02 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.41 2bi8 h LEU 22 CO -0.09 1.34 0.59 0.00 0.09 0.00 0.00 178.44 180.37 2bi8 h ALA 23 N 0.63 1.14 0.00 1.53 0.00 -0.49 -2.04 119.26 120.03 2bi8 h ALA 23 Ca -0.01 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2bi8 h ALA 23 Cb 1.21 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 2bi8 h ALA 23 CO 0.13 0.50 -0.02 0.93 0.00 0.00 0.00 179.25 180.79 2bi8 h GLU 24 N 1.18 0.00 -0.63 0.00 5.08 -1.32 -0.65 114.58 118.23 2bi8 h GLU 24 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2bi8 h GLU 24 Cb -0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.15 2bi8 h GLU 24 CO -0.09 0.02 0.00 1.63 -1.00 0.00 0.00 179.01 179.57 2bi8 n LYS 25 N -3.15 3.30 -0.39 2.33 4.76 -0.79 -4.92 118.16 119.29 2bi8 n LYS 25 Ca -0.01 -2.36 0.00 0.00 -2.87 0.00 0.00 58.31 53.07 2bi8 n LYS 25 Cb 0.21 -1.80 0.00 0.00 -1.84 0.00 0.00 35.03 31.60 2bi8 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2bi8 n GLY 26 N 0.97 0.76 3.83 0.72 0.00 -0.25 -4.99 105.19 106.23 2bi8 n GLY 26 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2bi8 n GLY 26 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bi8 s HIS 27 N -2.34 3.30 -0.59 1.61 3.76 -1.05 -4.70 115.29 115.28 2bi8 s HIS 27 Ca 0.00 1.52 -0.17 0.00 -0.15 0.00 0.00 55.06 56.26 2bi8 s HIS 27 Cb 0.00 -2.87 0.12 0.00 1.11 0.00 0.00 32.58 30.94 2bi8 s HIS 27 CO 0.00 -0.47 0.63 -0.65 -0.85 0.00 0.00 174.74 173.39 2bi8 s GLN 28 N -3.77 3.06 -0.20 1.40 -0.21 -0.45 -4.34 119.66 115.15 2bi8 s GLN 28 Ca 0.61 -1.57 -0.16 0.00 0.02 0.00 0.00 55.36 54.27 2bi8 s GLN 28 Cb -0.11 -4.30 -0.04 0.00 1.00 0.00 0.00 33.01 29.55 2bi8 s GLN 28 CO 0.27 -1.44 0.39 0.08 -2.12 0.00 0.00 175.29 172.47 2bi8 s VAL 29 N 2.07 5.20 -0.27 1.09 1.01 -0.09 -1.70 120.40 127.71 2bi8 s VAL 29 Ca 0.08 0.70 -0.02 0.00 0.00 0.00 0.00 61.98 62.75 2bi8 s VAL 29 Cb -0.26 -3.72 0.03 0.00 0.00 0.00 0.00 36.38 32.43 2bi8 s VAL 29 CO 0.04 0.26 -0.04 -2.28 0.00 0.00 0.00 175.10 173.07 2bi8 s HIS 30 N 1.29 3.14 -0.18 5.22 2.46 0.62 -1.35 115.29 126.47 2bi8 s HIS 30 Ca 0.19 -1.67 -0.05 0.00 0.47 0.00 0.00 55.06 54.00 2bi8 s HIS 30 Cb -0.15 -2.07 -0.03 0.00 -0.13 0.00 0.00 32.58 30.20 2bi8 s HIS 30 CO 0.08 -0.75 0.01 0.42 -2.47 0.00 0.00 174.74 172.02 2bi8 s ILE 31 N 1.30 4.16 0.07 0.89 1.01 0.44 -0.20 121.20 128.87 2bi8 s ILE 31 Ca -0.02 -0.25 0.10 0.00 0.00 0.00 0.00 60.65 60.48 2bi8 s ILE 31 Cb -0.18 -2.86 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 2bi8 s ILE 31 CO -0.03 0.45 -0.26 0.27 0.00 0.00 0.00 174.94 175.37 2bi8 s ILE 32 N 0.67 2.14 -0.07 2.92 -4.36 -0.66 -0.42 121.20 121.43 2bi8 s ILE 32 Ca 0.00 -1.48 -0.03 0.00 -0.26 0.00 0.00 60.65 58.88 2bi8 s ILE 32 Cb -0.14 -1.85 0.04 0.00 1.25 0.00 0.00 42.46 41.76 2bi8 s ILE 32 CO 0.02 0.28 0.16 -0.62 0.24 0.00 0.00 174.94 175.02 2bi8 s ASP 33 N -1.45 -0.13 0.54 4.36 -1.08 -0.59 -0.81 116.67 117.50 2bi8 s ASP 33 Ca 0.12 0.32 0.24 0.00 -0.52 0.00 0.00 52.55 52.71 2bi8 s ASP 33 Cb -0.10 0.22 1.50 0.00 -1.46 0.00 0.00 42.92 43.08 2bi8 s ASP 33 CO 0.03 -0.14 2.16 0.06 0.52 0.00 0.00 175.17 177.80 2bi8 h GLN 34 N 7.09 0.00 -7.31 4.34 3.07 -1.73 0.91 115.11 121.48 2bi8 h GLN 34 Ca -0.41 0.00 -0.51 0.00 0.09 0.00 0.00 58.65 57.82 2bi8 h GLN 34 Cb 1.15 0.00 0.08 0.00 0.08 0.00 0.00 27.48 28.79 2bi8 h GLN 34 CO 0.42 0.05 0.38 1.03 0.09 0.00 0.00 178.83 180.80 2bi8 s ARG 35 N -4.65 3.09 -0.02 0.06 0.52 -1.26 -3.88 118.95 112.80 2bi8 s ARG 35 Ca -0.04 0.98 0.02 0.00 -0.52 0.00 0.00 55.73 56.17 2bi8 s ARG 35 Cb 0.15 -2.01 0.10 0.00 0.52 0.00 0.00 34.95 33.71 2bi8 s ARG 35 CO 0.61 -0.98 0.78 -0.40 0.02 0.00 0.00 175.30 175.33 2bi8 n ASP 36 N -2.86 1.29 -3.56 0.23 5.75 -1.26 -0.71 116.55 115.44 2bi8 n ASP 36 Ca 0.08 -2.09 -0.17 0.00 -0.01 0.00 0.00 54.79 52.61 2bi8 n ASP 36 Cb 0.53 -0.39 -0.06 0.00 -1.03 0.00 0.00 41.12 40.17 2bi8 n ASP 36 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2bi8 s HIS 37 N -1.41 -0.56 1.05 2.11 -3.43 -1.26 -4.87 115.29 106.92 2bi8 s HIS 37 Ca 0.07 0.89 -0.16 0.00 -0.80 0.00 0.00 55.06 55.05 2bi8 s HIS 37 Cb 0.05 0.37 0.22 0.00 -1.43 0.00 0.00 32.58 31.78 2bi8 s HIS 37 CO 0.03 -0.60 1.18 0.96 -2.00 0.00 0.00 174.74 174.31 2bi8 s ILE 38 N -1.50 1.83 0.00 -5.38 -4.36 -1.26 -4.58 121.20 105.96 2bi8 s ILE 38 Ca -0.10 0.00 0.00 0.00 -0.26 0.00 0.00 60.65 60.29 2bi8 s ILE 38 Cb -0.01 -2.70 0.00 0.00 1.25 0.00 0.00 42.46 41.00 2bi8 s ILE 38 CO 0.07 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.86 2bi8 n GLY 39 N -2.06 2.48 7.00 6.27 0.00 -0.34 -4.72 105.19 113.82 2bi8 n GLY 39 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2bi8 n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bi8 n GLY 40 N -0.42 2.09 0.00 -0.02 0.00 -1.26 -2.63 105.19 102.96 2bi8 n GLY 40 Ca 0.00 -0.49 0.09 0.00 0.00 0.00 0.00 46.02 45.62 2bi8 n GLY 40 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2bi8 n ASN 41 N -0.37 0.00 -0.33 1.61 4.13 -1.26 -2.35 115.26 116.69 2bi8 n ASN 41 Ca 0.00 -0.01 0.13 0.00 1.68 0.00 0.00 54.58 56.38 2bi8 n ASN 41 Cb 0.00 -0.27 0.39 0.00 -1.54 0.00 0.00 39.78 38.36 2bi8 n ASN 41 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 2bi8 n SER 42 N -1.27 1.23 -4.70 6.41 7.64 -1.08 -4.39 113.62 117.46 2bi8 n SER 42 Ca 0.09 -1.09 -0.44 0.00 1.01 0.00 0.00 58.87 58.45 2bi8 n SER 42 Cb 0.14 0.12 -0.02 0.00 -1.01 0.00 0.00 64.21 63.43 2bi8 n SER 42 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bi8 n TYR 43 N -0.38 2.46 -4.24 1.43 9.36 -0.99 -4.52 117.16 120.27 2bi8 n TYR 43 Ca 0.14 0.33 -0.15 0.00 3.32 0.00 0.00 57.90 61.54 2bi8 n TYR 43 Cb 0.36 -2.53 -0.10 0.00 -0.63 0.00 0.00 39.34 36.44 2bi8 n TYR 43 CO 0.00 0.00 0.00 0.16 0.22 0.00 0.00 176.86 177.24 2bi8 s ASP 44 N 0.46 1.81 0.00 2.98 1.47 -1.26 -2.09 116.67 120.04 2bi8 s ASP 44 Ca 0.68 -0.94 -0.16 0.00 1.18 0.00 0.00 52.55 53.31 2bi8 s ASP 44 Cb -0.59 -0.02 0.03 0.00 -0.34 0.00 0.00 42.92 42.00 2bi8 s ASP 44 CO 0.47 -0.27 0.35 0.00 0.68 0.00 0.00 175.17 176.40 2bi8 s ALA 45 N -2.92 -0.87 -0.35 2.11 0.00 -0.76 -4.58 121.76 114.39 2bi8 s ALA 45 Ca 0.13 0.34 -0.25 0.00 0.00 0.00 0.00 51.96 52.19 2bi8 s ALA 45 Cb -0.00 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.28 2bi8 s ALA 45 CO 0.01 -0.33 0.86 1.03 0.00 0.00 0.00 175.76 177.34 2bi8 s ARG 46 N -1.72 3.87 0.09 0.00 0.52 -1.26 -0.45 118.95 120.00 2bi8 s ARG 46 Ca -0.11 0.55 -0.36 0.00 -0.52 0.00 0.00 55.73 55.30 2bi8 s ARG 46 Cb -0.03 -3.78 -0.15 0.00 0.52 0.00 0.00 34.95 31.51 2bi8 s ARG 46 CO 0.02 -0.84 1.48 -3.47 0.02 0.00 0.00 175.30 172.51 2bi8 n ASP 47 N 6.53 2.37 -0.10 0.23 2.03 -0.29 -4.86 116.55 122.46 2bi8 n ASP 47 Ca 0.05 1.10 -0.13 0.00 0.52 0.00 0.00 54.79 56.33 2bi8 n ASP 47 Cb 0.48 -1.30 -0.01 0.00 -0.72 0.00 0.00 41.12 39.58 2bi8 n ASP 47 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2bi8 h SER 48 N 5.45 0.96 0.13 1.67 4.64 -1.95 0.46 113.55 124.91 2bi8 h SER 48 Ca -0.46 -0.44 -0.19 0.00 -0.47 0.00 0.00 61.79 60.23 2bi8 h SER 48 Cb 1.30 -0.27 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 2bi8 h SER 48 CO 0.84 1.23 -0.71 -0.08 -0.87 0.00 0.00 176.83 177.24 2bi8 h GLU 49 N 0.73 0.52 0.00 4.77 4.81 -1.99 -3.37 114.58 120.05 2bi8 h GLU 49 Ca 0.06 -0.40 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 2bi8 h GLU 49 Cb 0.98 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.44 2bi8 h GLU 49 CO 0.09 1.03 -1.62 -2.37 -0.73 0.00 0.00 179.01 175.42 2bi8 n THR 50 N -3.88 0.01 -1.56 0.32 5.66 -1.22 -5.00 114.28 108.62 2bi8 n THR 50 Ca -0.05 -0.31 -0.19 0.00 -3.05 0.00 0.00 64.05 60.45 2bi8 n THR 50 Cb 0.70 0.18 -0.08 0.00 -1.55 0.00 0.00 70.33 69.57 2bi8 n THR 50 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 2bi8 n ASN 51 N -1.98 -5.39 -4.71 1.09 5.15 0.16 -4.78 115.26 104.81 2bi8 n ASN 51 Ca -0.03 0.48 -0.42 0.00 -0.60 0.00 0.00 54.58 54.01 2bi8 n ASN 51 Cb 0.36 -4.58 -0.03 0.00 -0.53 0.00 0.00 39.78 35.00 2bi8 n ASN 51 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2bi8 s VAL 52 N -2.69 4.74 -0.27 3.44 1.01 -1.25 -4.75 120.40 120.62 2bi8 s VAL 52 Ca 0.00 1.99 -0.28 0.00 0.00 0.00 0.00 61.98 63.70 2bi8 s VAL 52 Cb 0.00 -4.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.05 2bi8 s VAL 52 CO 0.00 0.17 2.24 -0.32 0.00 0.00 0.00 175.10 177.20 2bi8 s MET 53 N 0.90 2.95 -0.21 2.72 1.75 -1.26 -1.14 119.30 125.02 2bi8 s MET 53 Ca 0.52 1.90 -0.10 0.00 -1.25 0.00 0.00 55.69 56.77 2bi8 s MET 53 Cb -0.22 -4.41 -0.05 0.00 2.84 0.00 0.00 34.83 32.99 2bi8 s MET 53 CO 0.28 -2.31 0.13 0.08 -0.65 0.00 0.00 175.02 172.55 2bi8 s VAL 54 N 8.98 5.33 -0.66 10.11 1.01 0.40 -4.64 120.40 140.93 2bi8 s VAL 54 Ca 1.00 0.16 -0.25 0.00 0.00 0.00 0.00 61.98 62.89 2bi8 s VAL 54 Cb -0.30 -3.44 0.04 0.00 0.00 0.00 0.00 36.38 32.68 2bi8 s VAL 54 CO 0.33 0.42 1.11 -1.00 0.00 0.00 0.00 175.10 175.97 2bi8 s HIS 55 N 0.50 2.54 0.25 5.22 3.76 -1.26 -1.83 115.29 124.47 2bi8 s HIS 55 Ca 0.07 -0.14 -0.04 0.00 -0.15 0.00 0.00 55.06 54.81 2bi8 s HIS 55 Cb -0.12 -4.41 0.30 0.00 1.11 0.00 0.00 32.58 29.47 2bi8 s HIS 55 CO -0.01 -1.75 1.82 0.28 -0.85 0.00 0.00 174.74 174.23 2bi8 h VAL 56 N 6.03 1.24 -0.87 -0.90 2.07 -1.76 -2.26 116.25 119.80 2bi8 h VAL 56 Ca -0.27 -0.79 -0.45 0.00 0.82 0.00 0.00 66.70 66.00 2bi8 h VAL 56 Cb 1.06 0.48 -0.27 0.00 -1.52 0.00 0.00 31.29 31.04 2bi8 h VAL 56 CO 1.20 0.31 0.51 -1.22 0.02 0.00 0.00 177.57 178.39 2bi8 n TYR 57 N -4.28 2.68 0.00 1.57 4.02 -1.26 -5.04 117.16 114.85 2bi8 n TYR 57 Ca 0.06 -1.82 0.00 0.00 -0.01 0.00 0.00 57.90 56.13 2bi8 n TYR 57 Cb 0.20 -0.86 0.00 0.00 -0.02 0.00 0.00 39.34 38.65 2bi8 n TYR 57 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bi8 n GLY 58 N -1.14 1.83 3.64 2.72 0.00 -0.85 -4.98 105.19 106.40 2bi8 n GLY 58 Ca 0.55 -1.97 -0.50 0.00 0.00 0.00 0.00 46.02 44.10 2bi8 n GLY 58 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bi8 n PRO 59 N 1.73 1.60 -4.03 1.61 -0.02 -1.26 -4.75 135.00 129.88 2bi8 n PRO 59 Ca 0.00 0.58 -0.31 0.00 -2.02 0.00 0.00 63.50 61.75 2bi8 n PRO 59 Cb 0.00 -2.29 -0.15 0.00 -0.02 0.00 0.00 33.50 31.04 2bi8 n PRO 59 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 2bi8 s HIS 60 N 1.22 2.89 -0.19 6.00 3.76 -1.26 -5.10 115.29 122.61 2bi8 s HIS 60 Ca 0.84 -2.03 -0.03 0.00 -0.15 0.00 0.00 55.06 53.68 2bi8 s HIS 60 Cb -0.84 -1.80 -0.02 0.00 1.11 0.00 0.00 32.58 31.04 2bi8 s HIS 60 CO 0.46 -0.83 -0.05 0.42 -0.85 0.00 0.00 174.74 173.89 2bi8 s ILE 61 N 1.23 3.50 -0.14 0.60 -1.09 -1.26 -5.04 121.20 119.00 2bi8 s ILE 61 Ca -0.06 -0.47 -0.20 0.00 -2.23 0.00 0.00 60.65 57.69 2bi8 s ILE 61 Cb -0.19 -2.56 -0.03 0.00 -1.58 0.00 0.00 42.46 38.09 2bi8 s ILE 61 CO -0.06 0.45 0.58 0.12 -1.23 0.00 0.00 174.94 174.80 2bi8 s PHE 62 N 1.05 3.48 -0.18 3.97 5.36 -1.17 -4.95 117.98 125.54 2bi8 s PHE 62 Ca 0.01 0.98 -0.12 0.00 -0.96 0.00 0.00 56.93 56.84 2bi8 s PHE 62 Cb -0.15 -2.70 0.06 0.00 -0.34 0.00 0.00 43.02 39.89 2bi8 s PHE 62 CO 0.00 0.02 0.46 -3.38 -1.46 0.00 0.00 175.22 170.86 2bi8 s HIS 63 N 1.13 -0.62 -0.02 10.12 -3.43 -1.26 -1.50 115.29 119.71 2bi8 s HIS 63 Ca 0.29 1.36 -0.21 0.00 -0.80 0.00 0.00 55.06 55.70 2bi8 s HIS 63 Cb -0.16 0.27 0.04 0.00 -1.43 0.00 0.00 32.58 31.31 2bi8 s HIS 63 CO 0.12 -0.33 0.46 -0.08 -2.00 0.00 0.00 174.74 172.91 2bi8 s THR 64 N 1.03 0.03 -2.48 -5.38 -1.32 0.15 -4.64 115.64 103.04 2bi8 s THR 64 Ca -0.06 -0.29 0.22 0.00 -1.21 0.00 0.00 61.69 60.35 2bi8 s THR 64 Cb -0.06 -0.79 0.11 0.00 -1.51 0.00 0.00 72.50 70.25 2bi8 s THR 64 CO -0.09 -0.16 1.15 0.47 -2.21 0.00 0.00 174.62 173.78 2bi8 n ASP 65 N 1.07 2.53 -4.52 8.08 8.00 -1.26 -0.76 116.55 129.69 2bi8 n ASP 65 Ca -0.20 -1.76 -0.43 0.00 0.71 0.00 0.00 54.79 53.10 2bi8 n ASP 65 Cb 0.57 0.18 -0.06 0.00 -0.02 0.00 0.00 41.12 41.79 2bi8 n ASP 65 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2bi8 s ASN 66 N -2.07 6.36 0.23 -2.24 3.84 -1.26 -4.92 114.94 114.89 2bi8 s ASN 66 Ca 0.23 -0.27 -0.05 0.00 0.21 0.00 0.00 52.86 52.98 2bi8 s ASN 66 Cb 0.18 -2.37 0.24 0.00 -0.55 0.00 0.00 41.25 38.75 2bi8 s ASN 66 CO 0.38 -0.93 1.72 -0.08 -2.79 0.00 0.00 177.10 175.40 2bi8 h GLU 67 N 9.01 0.92 -0.62 0.43 4.81 -1.99 -1.54 114.58 125.59 2bi8 h GLU 67 Ca -0.25 -0.25 0.05 0.00 -0.13 0.00 0.00 59.36 58.78 2bi8 h GLU 67 Cb 1.09 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.31 2bi8 h GLU 67 CO 0.97 0.89 0.34 1.15 -0.73 0.00 0.00 179.01 181.63 2bi8 h THR 68 N 0.85 0.97 -0.41 0.32 2.02 -1.99 0.11 112.91 114.78 2bi8 h THR 68 Ca 0.16 -0.22 -0.11 0.00 0.77 0.00 0.00 66.41 67.01 2bi8 h THR 68 Cb 0.47 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 2bi8 h THR 68 CO 0.02 0.12 -0.17 0.58 0.37 0.00 0.00 175.52 176.43 2bi8 h VAL 69 N 0.64 1.28 -0.36 3.16 2.07 -1.86 -1.47 116.25 119.72 2bi8 h VAL 69 Ca 0.28 -1.31 0.03 0.00 0.82 0.00 0.00 66.70 66.52 2bi8 h VAL 69 Cb 0.16 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2bi8 h VAL 69 CO -0.17 0.44 0.17 -0.25 0.02 0.00 0.00 177.57 177.78 2bi8 h TRP 70 N 0.66 0.31 -0.97 1.57 2.91 -0.98 -1.48 115.95 117.98 2bi8 h TRP 70 Ca 0.10 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.14 2bi8 h TRP 70 Cb 0.73 -0.09 -0.05 0.00 -0.51 0.00 0.00 29.16 29.24 2bi8 h TRP 70 CO 0.05 0.16 0.62 -0.91 -1.03 0.00 0.00 178.44 177.34 2bi8 h ASN 71 N 0.35 1.13 -0.12 2.65 2.35 -0.61 -2.33 115.58 119.00 2bi8 h ASN 71 Ca 0.15 -0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.88 2bi8 h ASN 71 Cb 0.08 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.15 2bi8 h ASN 71 CO -0.12 0.83 0.01 0.22 -1.65 0.00 0.00 177.43 176.72 2bi8 h TYR 72 N 1.32 0.01 -0.28 1.19 3.20 -0.76 -2.31 116.97 119.34 2bi8 h TYR 72 Ca 0.35 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.16 2bi8 h TYR 72 Cb -0.12 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 2bi8 h TYR 72 CO -0.00 -0.00 -0.14 -0.39 -1.64 0.00 0.00 178.16 175.98 2bi8 h VAL 73 N 0.05 1.23 0.00 1.81 -1.51 -1.12 -2.62 116.25 114.10 2bi8 h VAL 73 Ca 0.05 -1.05 -0.02 0.00 -1.23 0.00 0.00 66.70 64.46 2bi8 h VAL 73 Cb 0.06 1.18 -0.00 0.00 -2.13 0.00 0.00 31.29 30.39 2bi8 h VAL 73 CO -0.08 0.34 -0.08 0.78 -1.23 0.00 0.00 177.57 177.30 2bi8 h ASN 74 N 0.45 0.00 0.42 4.19 2.35 -1.12 -1.17 115.58 120.70 2bi8 h ASN 74 Ca 0.08 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 2bi8 h ASN 74 Cb 0.52 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.88 2bi8 h ASN 74 CO 0.03 0.08 -0.38 0.11 -1.65 0.00 0.00 177.43 175.62 2bi8 h LYS 75 N 0.00 0.00 -0.05 0.81 1.57 -1.03 -3.31 116.57 114.57 2bi8 h LYS 75 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2bi8 h LYS 75 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 2bi8 h LYS 75 CO 0.01 0.38 0.00 0.72 -0.57 0.00 0.00 179.45 179.99 2bi8 n HIS 76 N -4.01 0.04 -3.52 -1.35 8.25 -0.54 -5.02 115.22 109.06 2bi8 n HIS 76 Ca -0.02 -0.04 -0.10 0.00 -0.26 0.00 0.00 57.72 57.31 2bi8 n HIS 76 Cb 0.42 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.51 2bi8 n HIS 76 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2bi8 s ALA 77 N -1.07 -1.64 -0.40 -1.41 0.00 -0.63 -4.26 121.76 112.35 2bi8 s ALA 77 Ca 0.16 0.55 -0.22 0.00 0.00 0.00 0.00 51.96 52.45 2bi8 s ALA 77 Cb 0.11 0.71 0.01 0.00 0.00 0.00 0.00 23.12 23.95 2bi8 s ALA 77 CO 0.16 -0.79 0.72 -2.00 0.00 0.00 0.00 175.76 173.85 2bi8 s GLU 78 N -3.52 3.57 -0.20 0.00 2.12 -1.26 -4.42 118.70 114.99 2bi8 s GLU 78 Ca 0.04 0.03 -0.22 0.00 0.36 0.00 0.00 54.97 55.18 2bi8 s GLU 78 Cb -0.02 -3.87 -0.02 0.00 0.26 0.00 0.00 34.13 30.49 2bi8 s GLU 78 CO -0.08 -0.92 0.69 -1.64 -0.54 0.00 0.00 175.26 172.77 2bi8 s MET 79 N 3.01 4.22 -0.12 4.30 -1.94 -1.26 -0.01 119.30 127.50 2bi8 s MET 79 Ca 0.28 0.73 -0.11 0.00 -1.71 0.00 0.00 55.69 54.88 2bi8 s MET 79 Cb -0.13 -3.59 -0.05 0.00 2.01 0.00 0.00 34.83 33.07 2bi8 s MET 79 CO 0.18 -0.29 0.24 -1.64 -0.01 0.00 0.00 175.02 173.50 2bi8 s MET 80 N 2.08 3.89 0.09 2.03 1.00 0.15 -4.85 119.30 123.68 2bi8 s MET 80 Ca 0.31 0.03 -0.33 0.00 0.00 0.00 0.00 55.69 55.71 2bi8 s MET 80 Cb -0.16 -3.30 -0.12 0.00 0.00 0.00 0.00 34.83 31.25 2bi8 s MET 80 CO 0.10 0.53 1.78 -2.30 0.00 0.00 0.00 175.02 175.13 2bi8 n PRO 81 N 2.65 2.48 -3.66 2.03 -0.02 -1.26 -1.28 135.00 135.93 2bi8 n PRO 81 Ca -0.16 0.90 -0.06 0.00 -2.02 0.00 0.00 63.50 62.16 2bi8 n PRO 81 Cb 0.53 -2.75 -0.08 0.00 -0.02 0.00 0.00 33.50 31.18 2bi8 n PRO 81 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2bi8 s TYR 82 N 2.52 -0.96 -0.22 6.00 5.04 -1.24 -4.87 117.35 123.62 2bi8 s TYR 82 Ca 0.83 1.79 -0.01 0.00 -2.44 0.00 0.00 57.07 57.25 2bi8 s TYR 82 Cb -0.58 0.48 0.02 0.00 0.35 0.00 0.00 41.96 42.23 2bi8 s TYR 82 CO 0.41 -0.53 -0.11 0.08 -1.34 0.00 0.00 175.55 174.07 2bi8 s VAL 83 N 2.47 2.66 0.10 3.14 1.01 -1.26 -3.93 120.40 124.59 2bi8 s VAL 83 Ca -0.05 -0.94 -0.31 0.00 0.00 0.00 0.00 61.98 60.69 2bi8 s VAL 83 Cb -0.11 -2.27 -0.07 0.00 0.00 0.00 0.00 36.38 33.93 2bi8 s VAL 83 CO -0.15 0.34 1.23 0.21 0.00 0.00 0.00 175.10 176.72 2bi8 s ASN 84 N 1.33 7.04 -0.06 3.32 3.04 -1.26 -4.97 114.94 123.38 2bi8 s ASN 84 Ca 0.02 2.12 0.02 0.00 0.04 0.00 0.00 52.86 55.06 2bi8 s ASN 84 Cb -0.15 -2.59 0.01 0.00 -1.54 0.00 0.00 41.25 36.99 2bi8 s ASN 84 CO -0.07 -0.47 -0.11 -0.13 -3.04 0.00 0.00 177.10 173.27 2bi8 s ARG 85 N 0.76 1.59 -0.10 0.43 0.52 -1.26 -1.83 118.95 119.06 2bi8 s ARG 85 Ca 0.58 -0.38 0.02 0.00 -0.52 0.00 0.00 55.73 55.43 2bi8 s ARG 85 Cb -0.31 -1.33 -0.02 0.00 0.52 0.00 0.00 34.95 33.81 2bi8 s ARG 85 CO 0.31 0.02 -0.15 0.08 0.02 0.00 0.00 175.30 175.58 2bi8 s VAL 86 N 0.68 2.94 0.19 3.52 1.01 -1.26 -4.63 120.40 122.85 2bi8 s VAL 86 Ca -0.14 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.16 2bi8 s VAL 86 Cb -0.16 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 2bi8 s VAL 86 CO 0.03 0.55 0.24 -0.54 0.00 0.00 0.00 175.10 175.39 2bi8 s LYS 87 N -0.02 3.20 -0.02 2.72 -0.14 -1.15 -1.18 119.74 123.15 2bi8 s LYS 87 Ca -0.04 -0.79 0.02 0.00 -1.36 0.00 0.00 55.97 53.81 2bi8 s LYS 87 Cb -0.14 -2.79 0.00 0.00 -1.68 0.00 0.00 37.83 33.22 2bi8 s LYS 87 CO 0.04 0.47 -0.09 0.00 -0.76 0.00 0.00 175.35 175.01 2bi8 s ALA 88 N -1.86 0.82 -0.17 5.17 0.00 0.04 -0.88 121.76 124.87 2bi8 s ALA 88 Ca 0.33 -0.33 -0.06 0.00 0.00 0.00 0.00 51.96 51.90 2bi8 s ALA 88 Cb -0.10 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.70 2bi8 s ALA 88 CO 0.27 0.14 0.02 0.99 0.00 0.00 0.00 175.76 177.18 2bi8 s THR 89 N 0.11 4.41 -0.26 0.00 2.01 0.97 -0.38 115.64 122.50 2bi8 s THR 89 Ca -0.02 -0.17 -0.27 0.00 0.31 0.00 0.00 61.69 61.54 2bi8 s THR 89 Cb -0.07 -2.97 0.17 0.00 0.01 0.00 0.00 72.50 69.63 2bi8 s THR 89 CO 0.00 0.47 1.25 0.54 -0.69 0.00 0.00 174.62 176.19 2bi8 s VAL 90 N 0.42 0.00 -1.49 3.82 0.11 -0.55 -2.56 120.40 120.16 2bi8 s VAL 90 Ca 0.00 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 58.99 2bi8 s VAL 90 Cb -0.13 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.74 2bi8 s VAL 90 CO 0.01 0.00 0.72 0.59 -3.33 0.00 0.00 175.10 173.10 2bi8 n ASN 91 N 1.17 -5.79 -3.24 3.54 3.02 -1.26 -1.79 115.26 110.90 2bi8 n ASN 91 Ca -0.07 -0.38 -0.23 0.00 -0.03 0.00 0.00 54.58 53.87 2bi8 n ASN 91 Cb 0.58 -4.66 0.02 0.00 -0.61 0.00 0.00 39.78 35.10 2bi8 n ASN 91 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bi8 n GLY 92 N -1.58 -0.51 3.14 7.41 0.00 -1.26 -4.98 105.19 107.41 2bi8 n GLY 92 Ca -0.07 0.12 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 2bi8 n GLY 92 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bi8 s GLN 93 N -5.91 0.73 -0.14 1.61 -0.21 -0.74 -5.16 119.66 109.84 2bi8 s GLN 93 Ca 0.37 -1.16 0.02 0.00 0.02 0.00 0.00 55.36 54.62 2bi8 s GLN 93 Cb -0.18 0.26 0.00 0.00 1.00 0.00 0.00 33.01 34.09 2bi8 s GLN 93 CO 0.46 -0.18 -0.20 0.08 -2.12 0.00 0.00 175.29 173.33 2bi8 s VAL 94 N -3.92 2.29 0.21 1.09 1.01 -1.26 -1.48 120.40 118.35 2bi8 s VAL 94 Ca 0.08 -0.91 0.09 0.00 0.00 0.00 0.00 61.98 61.24 2bi8 s VAL 94 Cb 0.07 -1.92 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 2bi8 s VAL 94 CO -0.09 0.54 -0.16 -0.36 0.00 0.00 0.00 175.10 175.03 2bi8 s PHE 95 N 0.69 1.82 0.26 5.22 0.40 0.49 -4.95 117.98 121.91 2bi8 s PHE 95 Ca -0.09 -0.52 -0.29 0.00 -0.60 0.00 0.00 56.93 55.42 2bi8 s PHE 95 Cb -0.16 -0.84 -0.09 0.00 0.51 0.00 0.00 43.02 42.44 2bi8 s PHE 95 CO 0.01 0.42 0.97 -1.12 0.70 0.00 0.00 175.22 176.20 2bi8 s SER 96 N -3.28 7.52 0.12 1.36 0.01 -1.26 -0.78 113.70 117.39 2bi8 s SER 96 Ca 0.23 1.99 0.09 0.00 1.31 0.00 0.00 55.95 59.58 2bi8 s SER 96 Cb -0.02 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 2bi8 s SER 96 CO 0.08 0.06 -0.20 -0.76 0.41 0.00 0.00 173.24 172.83 2bi8 s LEU 97 N -1.37 2.61 1.11 2.44 1.43 -0.32 -4.31 118.68 120.26 2bi8 s LEU 97 Ca 0.43 -0.61 -0.14 0.00 -1.03 0.00 0.00 54.13 52.78 2bi8 s LEU 97 Cb -0.26 -1.47 0.24 0.00 0.03 0.00 0.00 46.19 44.74 2bi8 s LEU 97 CO 0.32 0.18 1.07 -2.16 0.23 0.00 0.00 176.35 175.99 2bi8 s PRO 98 N -2.14 -0.44 -0.08 1.29 0.04 -1.26 -4.11 135.00 128.29 2bi8 s PRO 98 Ca 0.17 0.47 -0.31 0.00 0.04 0.00 0.00 61.00 61.37 2bi8 s PRO 98 Cb -0.10 -1.64 -0.09 0.00 0.04 0.00 0.00 34.50 32.71 2bi8 s PRO 98 CO 0.09 -3.31 2.04 -0.89 0.04 0.00 0.00 177.00 174.97 2bi8 n ILE 99 N -4.57 0.58 -4.18 0.56 5.41 -1.26 -4.90 119.36 111.01 2bi8 n ILE 99 Ca 0.06 -0.22 -0.09 0.00 1.00 0.00 0.00 62.75 63.49 2bi8 n ILE 99 Cb 0.57 -2.24 -0.03 0.00 -0.71 0.00 0.00 39.64 37.23 2bi8 n ILE 99 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2bi8 n ASN 100 N 8.59 0.81 -0.29 4.38 0.23 -1.26 -1.26 115.26 126.47 2bi8 n ASN 100 Ca 0.25 -1.84 0.04 0.00 -0.53 0.00 0.00 54.58 52.50 2bi8 n ASN 100 Cb 0.38 0.44 0.19 0.00 -2.08 0.00 0.00 39.78 38.71 2bi8 n ASN 100 CO 0.00 0.00 0.00 0.25 -0.93 0.00 0.00 177.26 176.58 2bi8 h LEU 101 N 0.00 0.58 -0.27 -4.53 5.85 -1.19 -0.75 115.31 115.01 2bi8 h LEU 101 Ca -0.12 0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.65 2bi8 h LEU 101 Cb 0.47 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2bi8 h LEU 101 CO 0.18 0.30 0.09 -0.74 -0.34 0.00 0.00 178.44 177.94 2bi8 h HIS 102 N 0.70 0.42 -0.65 1.25 2.76 -1.92 0.92 115.15 118.63 2bi8 h HIS 102 Ca 0.42 -0.04 0.11 0.00 -2.20 0.00 0.00 60.37 58.66 2bi8 h HIS 102 Cb 0.48 -0.12 -0.08 0.00 1.55 0.00 0.00 27.41 29.24 2bi8 h HIS 102 CO -0.08 0.45 0.21 1.15 -1.30 0.00 0.00 177.93 178.36 2bi8 h THR 103 N 0.27 0.69 0.53 6.26 2.02 -1.53 0.89 112.91 122.05 2bi8 h THR 103 Ca 0.09 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 2bi8 h THR 103 Cb 0.22 0.30 0.01 0.00 -1.74 0.00 0.00 68.15 66.93 2bi8 h THR 103 CO -0.00 0.07 -0.26 0.40 0.37 0.00 0.00 175.52 176.10 2bi8 h ILE 104 N 0.36 0.24 -0.86 3.11 2.04 -1.04 0.26 117.51 121.63 2bi8 h ILE 104 Ca 0.34 -0.45 0.15 0.00 1.00 0.00 0.00 64.86 65.91 2bi8 h ILE 104 Cb 0.48 0.35 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 2bi8 h ILE 104 CO -0.37 0.04 0.56 0.78 0.00 0.00 0.00 178.15 179.16 2bi8 h ASN 105 N -1.07 0.55 -0.02 1.72 2.35 -0.63 -1.20 115.58 117.27 2bi8 h ASN 105 Ca -0.07 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.64 2bi8 h ASN 105 Cb 0.62 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.92 2bi8 h ASN 105 CO 0.12 0.27 -0.28 -0.61 -1.65 0.00 0.00 177.43 175.28 2bi8 h GLN 106 N 0.57 0.23 -0.36 0.81 4.15 -0.77 0.41 115.11 120.16 2bi8 h GLN 106 Ca 0.43 -0.22 0.07 0.00 0.77 0.00 0.00 58.65 59.70 2bi8 h GLN 106 Cb 0.82 0.06 -0.06 0.00 0.21 0.00 0.00 27.48 28.50 2bi8 h GLN 106 CO -0.18 0.91 -0.06 0.35 -1.93 0.00 0.00 178.83 177.92 2bi8 h PHE 107 N -0.37 -0.13 -0.58 3.99 3.57 0.35 -2.80 116.94 120.97 2bi8 h PHE 107 Ca -0.03 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2bi8 h PHE 107 Cb 0.99 0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.84 2bi8 h PHE 107 CO 0.16 -0.12 0.00 1.19 -2.23 0.00 0.00 178.31 177.31 2bi8 n PHE 108 N -5.25 1.68 -4.10 0.41 3.01 -0.53 -4.94 117.46 107.74 2bi8 n PHE 108 Ca 0.01 -0.62 -0.47 0.00 1.01 0.00 0.00 57.45 57.39 2bi8 n PHE 108 Cb 0.20 -0.36 0.01 0.00 -0.01 0.00 0.00 39.48 39.32 2bi8 n PHE 108 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2bi8 n SER 109 N 0.84 -3.80 -3.10 4.37 7.64 -1.02 -4.95 113.62 113.60 2bi8 n SER 109 Ca 0.25 -1.30 -0.16 0.00 1.01 0.00 0.00 58.87 58.67 2bi8 n SER 109 Cb 0.99 -1.56 -0.04 0.00 -1.01 0.00 0.00 64.21 62.59 2bi8 n SER 109 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2bi8 n LYS 110 N -5.04 0.94 -1.21 1.43 4.76 0.14 -5.03 118.16 114.15 2bi8 n LYS 110 Ca -0.12 -2.03 0.01 0.00 -2.87 0.00 0.00 58.31 53.30 2bi8 n LYS 110 Cb 0.56 0.89 -0.00 0.00 -1.84 0.00 0.00 35.03 34.63 2bi8 n LYS 110 CO 0.00 0.00 0.00 -2.37 -1.37 0.00 0.00 177.40 173.66 2bi8 n THR 111 N -0.60 0.00 -1.70 -0.18 5.66 -1.26 -4.60 114.28 111.60 2bi8 n THR 111 Ca -0.07 -0.59 -0.43 0.00 -3.05 0.00 0.00 64.05 59.91 2bi8 n THR 111 Cb 0.36 0.77 -0.02 0.00 -1.55 0.00 0.00 70.33 69.89 2bi8 n THR 111 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bi8 s SER 113 N 0.20 1.55 0.14 0.00 1.04 -1.26 -4.80 113.70 110.57 2bi8 s SER 113 Ca 0.63 0.84 -0.17 0.00 0.48 0.00 0.00 55.95 57.73 2bi8 s SER 113 Cb -0.58 -1.25 0.00 0.00 0.10 0.00 0.00 66.02 64.30 2bi8 s SER 113 CO 0.53 -3.76 1.78 -0.65 0.98 0.00 0.00 173.24 172.11 2bi8 h PRO 114 N -2.33 0.33 -0.27 4.02 0.11 -1.96 -1.59 132.00 130.32 2bi8 h PRO 114 Ca -0.49 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.53 2bi8 h PRO 114 Cb 1.31 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 2bi8 h PRO 114 CO 0.44 0.22 -0.12 -0.44 -0.21 0.00 0.00 178.00 177.88 2bi8 h ASP 115 N 0.34 0.43 -0.09 -2.05 3.32 -1.94 -1.66 116.42 114.78 2bi8 h ASP 115 Ca 0.13 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 56.96 2bi8 h ASP 115 Cb 0.03 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2bi8 h ASP 115 CO -0.08 0.59 -0.30 -0.33 -1.72 0.00 0.00 179.24 177.40 2bi8 h GLU 116 N 0.42 0.56 -0.20 3.56 5.08 -1.89 -3.02 114.58 119.08 2bi8 h GLU 116 Ca 0.08 -0.24 -0.13 0.00 -1.00 0.00 0.00 59.36 58.07 2bi8 h GLU 116 Cb 0.47 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 2bi8 h GLU 116 CO 0.03 0.79 -0.42 0.00 -1.00 0.00 0.00 179.01 178.41 2bi8 h ALA 117 N 1.20 0.91 -0.43 3.43 0.00 -0.42 -2.09 119.26 121.86 2bi8 h ALA 117 Ca 0.06 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 2bi8 h ALA 117 Cb 0.76 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2bi8 h ALA 117 CO 0.06 0.64 0.16 0.00 0.00 0.00 0.00 179.25 180.10 2bi8 h ARG 118 N 0.38 0.61 -0.15 0.00 3.08 -1.30 -0.53 114.38 116.48 2bi8 h ARG 118 Ca 0.03 -0.09 -0.21 0.00 0.07 0.00 0.00 59.98 59.78 2bi8 h ARG 118 Cb 0.90 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.85 2bi8 h ARG 118 CO 0.08 0.52 -0.75 0.00 -1.07 0.00 0.00 179.97 178.75 2bi8 h ALA 119 N 1.57 0.39 -0.29 0.04 0.00 -1.37 -2.19 119.26 117.40 2bi8 h ALA 119 Ca 0.15 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 2bi8 h ALA 119 Cb 0.15 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2bi8 h ALA 119 CO -0.01 0.70 0.01 1.25 0.00 0.00 0.00 179.25 181.20 2bi8 h LEU 120 N 0.49 0.49 -1.15 0.00 6.46 -0.99 0.29 115.31 120.91 2bi8 h LEU 120 Ca -0.04 -0.30 -0.06 0.00 -0.12 0.00 0.00 57.88 57.36 2bi8 h LEU 120 Cb 1.37 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 41.15 2bi8 h LEU 120 CO 0.15 0.67 -0.03 0.40 -0.62 0.00 0.00 178.44 179.00 2bi8 h ILE 121 N 0.30 1.21 -0.28 4.05 1.08 -1.15 -0.75 117.51 121.97 2bi8 h ILE 121 Ca 0.08 -0.88 -0.09 0.00 -0.39 0.00 0.00 64.86 63.59 2bi8 h ILE 121 Cb 0.41 0.99 -0.01 0.00 -3.07 0.00 0.00 36.82 35.14 2bi8 h ILE 121 CO 0.01 0.30 -0.17 0.00 -0.69 0.00 0.00 178.15 177.60 2bi8 h ALA 122 N 1.45 0.40 -0.18 1.87 0.00 -1.13 -0.13 119.26 121.54 2bi8 h ALA 122 Ca 0.11 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bi8 h ALA 122 Cb 0.39 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2bi8 h ALA 122 CO 0.02 0.31 0.00 -0.85 0.00 0.00 0.00 179.25 178.73 2bi8 n GLU 123 N -4.39 1.43 -0.02 0.00 0.28 0.07 -3.00 120.64 115.01 2bi8 n GLU 123 Ca -0.04 -0.65 -0.01 0.00 -0.16 0.00 0.00 57.16 56.31 2bi8 n GLU 123 Cb 0.39 -1.16 -0.04 0.00 1.43 0.00 0.00 31.44 32.06 2bi8 n GLU 123 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 2bi8 n LYS 124 N 0.03 2.30 -1.83 3.44 3.00 -0.31 -5.02 118.16 119.77 2bi8 n LYS 124 Ca 0.06 -0.02 -0.40 0.00 -0.00 0.00 0.00 58.31 57.95 2bi8 n LYS 124 Cb 0.16 -1.13 0.01 0.00 0.00 0.00 0.00 35.03 34.07 2bi8 n LYS 124 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2bi8 s GLY 125 N -3.32 2.93 -0.35 3.14 0.00 -0.08 -3.53 107.32 106.11 2bi8 s GLY 125 Ca -0.02 1.47 -0.29 0.00 0.00 0.00 0.00 44.72 45.88 2bi8 s GLY 125 CO 0.21 2.10 1.24 -0.35 0.00 0.00 0.00 173.10 176.31 2bi8 s ASP 126 N -0.43 6.67 -1.31 1.64 2.15 0.12 -4.85 116.67 120.66 2bi8 s ASP 126 Ca 0.58 0.98 -0.10 0.00 0.43 0.00 0.00 52.55 54.44 2bi8 s ASP 126 Cb -0.44 -2.54 0.15 0.00 -0.30 0.00 0.00 42.92 39.78 2bi8 s ASP 126 CO 0.57 -1.13 1.92 -1.54 -0.17 0.00 0.00 175.17 174.83 2bi8 n SER 127 N 7.70 4.89 0.00 -0.34 3.41 -1.26 -4.34 113.62 123.68 2bi8 n SER 127 Ca 0.14 -3.06 0.00 0.00 -0.26 0.00 0.00 58.87 55.69 2bi8 n SER 127 Cb 0.47 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 62.91 2bi8 n SER 127 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2bi8 n THR 128 N 3.67 0.00 -1.38 6.66 -1.04 -1.26 -5.07 114.28 115.86 2bi8 n THR 128 Ca 0.42 0.00 -0.51 0.00 -2.04 0.00 0.00 64.05 61.92 2bi8 n THR 128 Cb 0.37 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.77 2bi8 n THR 128 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2bi8 n ILE 129 N 0.00 0.04 -0.04 12.58 2.08 -1.26 -4.81 119.36 127.95 2bi8 n ILE 129 Ca 0.00 -0.11 -0.12 0.00 0.56 0.00 0.00 62.75 63.08 2bi8 n ILE 129 Cb 0.00 -0.91 -0.08 0.00 -0.75 0.00 0.00 39.64 37.90 2bi8 n ILE 129 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2bi8 h ALA 130 N 11.29 -0.78 -3.48 -1.39 0.00 -1.97 -3.33 119.26 119.59 2bi8 h ALA 130 Ca -0.13 -0.04 -0.65 0.00 0.00 0.00 0.00 54.91 54.10 2bi8 h ALA 130 Cb 1.36 0.97 -0.41 0.00 0.00 0.00 0.00 17.79 19.71 2bi8 h ALA 130 CO 1.16 -0.96 -0.66 0.34 0.00 0.00 0.00 179.25 179.14 2bi8 s ASP 131 N -4.49 4.46 0.02 0.00 3.68 -1.26 -5.09 116.67 114.00 2bi8 s ASP 131 Ca -0.12 -2.74 -0.34 0.00 2.13 0.00 0.00 52.55 51.47 2bi8 s ASP 131 Cb 0.06 -1.64 -0.13 0.00 -1.45 0.00 0.00 42.92 39.76 2bi8 s ASP 131 CO 0.50 -0.28 1.72 -2.65 0.13 0.00 0.00 175.17 174.59 2bi8 n PRO 132 N 3.47 2.08 -0.00 4.34 -0.02 -1.25 -4.86 135.00 138.76 2bi8 n PRO 132 Ca 0.05 0.76 0.08 0.00 -2.02 0.00 0.00 63.50 62.36 2bi8 n PRO 132 Cb 0.35 -2.55 -0.11 0.00 -0.02 0.00 0.00 33.50 31.17 2bi8 n PRO 132 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2bi8 n GLN 133 N 4.98 0.96 -4.35 -0.52 1.13 -1.26 -4.70 117.38 113.62 2bi8 n GLN 133 Ca 0.20 -0.10 -0.29 0.00 -1.94 0.00 0.00 57.00 54.88 2bi8 n GLN 133 Cb 0.28 -1.34 -0.12 0.00 0.11 0.00 0.00 30.24 29.18 2bi8 n GLN 133 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2bi8 s THR 134 N -2.90 2.58 0.28 5.09 2.01 -1.26 -1.99 115.64 119.45 2bi8 s THR 134 Ca -0.02 -1.70 -0.02 0.00 0.31 0.00 0.00 61.69 60.27 2bi8 s THR 134 Cb 0.11 -2.19 0.19 0.00 0.01 0.00 0.00 72.50 70.62 2bi8 s THR 134 CO 0.67 0.04 1.87 0.15 -0.69 0.00 0.00 174.62 176.66 2bi8 h PHE 135 N 3.63 0.94 -0.13 4.92 3.57 -1.21 0.37 116.94 129.04 2bi8 h PHE 135 Ca -0.49 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 60.99 2bi8 h PHE 135 Cb 1.18 -0.29 -0.04 0.00 2.79 0.00 0.00 35.95 39.59 2bi8 h PHE 135 CO 0.62 0.71 -0.12 1.49 -2.23 0.00 0.00 178.31 178.78 2bi8 h GLU 136 N 0.92 -0.13 0.00 1.11 4.81 -1.70 -1.45 114.58 118.14 2bi8 h GLU 136 Ca 0.22 0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.35 2bi8 h GLU 136 Cb 0.16 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 2bi8 h GLU 136 CO -0.02 -0.09 -0.50 1.05 -0.73 0.00 0.00 179.01 178.72 2bi8 h GLU 137 N -0.13 0.00 -0.15 1.92 4.11 -1.84 -1.61 114.58 116.88 2bi8 h GLU 137 Ca 0.09 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.49 2bi8 h GLU 137 Cb 0.26 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2bi8 h GLU 137 CO -0.21 0.50 -0.01 1.49 0.07 0.00 0.00 179.01 180.86 2bi8 h GLU 138 N 0.00 0.27 -0.04 1.06 4.57 -0.86 -1.04 114.58 118.55 2bi8 h GLU 138 Ca -0.01 -0.09 0.02 0.00 -1.18 0.00 0.00 59.36 58.11 2bi8 h GLU 138 Cb 1.28 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.82 2bi8 h GLU 138 CO 0.07 0.51 -0.10 0.00 -1.18 0.00 0.00 179.01 178.31 2bi8 h ALA 139 N 0.76 -0.07 -0.88 2.92 0.00 -1.22 -1.57 119.26 119.18 2bi8 h ALA 139 Ca 0.04 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2bi8 h ALA 139 Cb 0.39 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2bi8 h ALA 139 CO 0.01 -0.58 0.56 -0.07 0.00 0.00 0.00 179.25 179.17 2bi8 h LEU 140 N -0.15 0.91 0.41 0.00 3.38 -1.26 0.10 115.31 118.71 2bi8 h LEU 140 Ca 0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 2bi8 h LEU 140 Cb 0.21 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2bi8 h LEU 140 CO -0.12 0.60 -0.20 -0.09 0.09 0.00 0.00 178.44 178.72 2bi8 h ARG 141 N 1.06 -0.54 0.41 1.13 2.43 -1.02 0.36 114.38 118.21 2bi8 h ARG 141 Ca 0.37 0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.56 2bi8 h ARG 141 Cb 0.09 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.76 2bi8 h ARG 141 CO -0.15 -0.36 -0.27 0.74 -1.51 0.00 0.00 179.97 178.43 2bi8 h PHE 142 N -0.56 -0.72 0.00 2.20 0.05 -0.67 -2.84 116.94 114.40 2bi8 h PHE 142 Ca -0.06 -0.01 0.00 0.00 3.82 0.00 0.00 57.97 61.73 2bi8 h PHE 142 Cb 0.43 0.26 0.00 0.00 2.00 0.00 0.00 35.95 38.64 2bi8 h PHE 142 CO -0.05 -0.39 -0.33 0.44 -0.18 0.00 0.00 178.31 177.80 2bi8 n ILE 143 N -3.99 0.00 -2.59 -0.55 -5.35 0.30 -4.22 119.36 102.96 2bi8 n ILE 143 Ca -0.08 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.06 2bi8 n ILE 143 Cb 0.27 0.99 0.00 0.00 -1.74 0.00 0.00 39.64 39.16 2bi8 n ILE 143 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2bi8 n GLY 144 N 1.17 -2.07 0.07 3.28 0.00 -0.52 -4.44 105.19 102.69 2bi8 n GLY 144 Ca 0.01 -1.62 -0.14 0.00 0.00 0.00 0.00 46.02 44.28 2bi8 n GLY 144 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2bi8 h LYS 145 N 0.00 0.00 -0.62 1.61 3.64 -1.82 -2.67 116.57 116.71 2bi8 h LYS 145 Ca 0.00 0.00 0.10 0.00 -1.27 0.00 0.00 60.65 59.48 2bi8 h LYS 145 Cb 0.00 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 31.75 2bi8 h LYS 145 CO 0.00 0.88 0.24 0.93 -2.27 0.00 0.00 179.45 179.23 2bi8 h GLU 146 N -1.00 0.41 0.00 1.90 3.07 -1.95 -0.48 114.58 116.53 2bi8 h GLU 146 Ca -0.06 -0.02 -0.23 0.00 -0.50 0.00 0.00 59.36 58.55 2bi8 h GLU 146 Cb 0.94 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 2bi8 h GLU 146 CO -0.04 0.27 -0.94 -0.07 -1.40 0.00 0.00 179.01 176.83 2bi8 h LEU 147 N 0.42 0.53 -0.25 1.33 3.38 -1.79 0.16 115.31 119.09 2bi8 h LEU 147 Ca 0.32 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2bi8 h LEU 147 Cb 0.39 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2bi8 h LEU 147 CO -0.31 1.22 0.16 0.22 0.09 0.00 0.00 178.44 179.83 2bi8 h TYR 148 N 0.23 0.31 -0.15 1.13 3.20 -1.08 -0.76 116.97 119.84 2bi8 h TYR 148 Ca -0.08 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.73 2bi8 h TYR 148 Cb 1.58 -0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.74 2bi8 h TYR 148 CO 0.06 0.20 -0.17 0.93 -1.64 0.00 0.00 178.16 177.55 2bi8 h GLU 149 N 0.33 0.39 -0.12 1.82 5.08 -1.09 0.16 114.58 121.15 2bi8 h GLU 149 Ca 0.09 -0.21 0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2bi8 h GLU 149 Cb -0.03 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 2bi8 h GLU 149 CO -0.02 0.77 -0.05 0.00 -1.00 0.00 0.00 179.01 178.72 2bi8 h ALA 150 N 0.61 0.06 0.00 3.43 0.00 -0.94 -3.37 119.26 119.05 2bi8 h ALA 150 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2bi8 h ALA 150 Cb 0.71 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.62 2bi8 h ALA 150 CO 0.04 -0.50 -1.10 1.19 0.00 0.00 0.00 179.25 178.88 2bi8 n PHE 151 N -5.18 0.00 -0.01 0.00 3.01 -0.30 -4.71 117.46 110.28 2bi8 n PHE 151 Ca -0.04 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.41 2bi8 n PHE 151 Cb 0.11 -0.15 -0.00 0.00 -0.01 0.00 0.00 39.48 39.43 2bi8 n PHE 151 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2bi8 n PHE 152 N -1.63 0.00 0.41 1.38 3.01 0.35 -4.68 117.46 116.30 2bi8 n PHE 152 Ca -0.01 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.30 2bi8 n PHE 152 Cb 0.22 -0.04 -0.08 0.00 -0.01 0.00 0.00 39.48 39.57 2bi8 n PHE 152 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2bi8 h LYS 153 N -0.02 -0.99 -0.06 -1.08 3.64 -1.12 -1.98 116.57 114.95 2bi8 h LYS 153 Ca -0.03 0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.38 2bi8 h LYS 153 Cb 1.03 0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 33.07 2bi8 h LYS 153 CO -0.01 -0.66 -0.16 0.78 -2.27 0.00 0.00 179.45 177.13 2bi8 h GLY 154 N -1.03 0.10 1.21 5.01 0.00 -1.74 -2.19 103.07 104.44 2bi8 h GLY 154 Ca -0.10 -0.06 -0.17 0.00 0.00 0.00 0.00 47.33 46.99 2bi8 h GLY 154 CO 0.17 0.06 -0.48 -1.82 0.00 0.00 0.00 176.54 174.47 2bi8 h TYR 155 N 0.09 1.04 -0.00 5.60 3.20 -1.50 -2.12 116.97 123.28 2bi8 h TYR 155 Ca 0.02 -0.34 -0.00 0.00 3.14 0.00 0.00 58.73 61.55 2bi8 h TYR 155 Cb 0.34 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 38.41 2bi8 h TYR 155 CO 0.00 1.15 0.00 1.15 -1.64 0.00 0.00 178.16 178.82 2bi8 h THR 156 N 0.67 1.16 -0.79 1.81 2.02 -0.99 -0.17 112.91 116.62 2bi8 h THR 156 Ca 0.03 -0.47 0.09 0.00 0.77 0.00 0.00 66.41 66.84 2bi8 h THR 156 Cb 1.07 1.48 -0.07 0.00 -1.74 0.00 0.00 68.15 68.88 2bi8 h THR 156 CO 0.11 0.12 0.44 0.40 0.37 0.00 0.00 175.52 176.96 2bi8 h ILE 157 N -0.20 0.90 -0.08 3.11 2.04 -1.34 0.41 117.51 122.35 2bi8 h ILE 157 Ca 0.00 -0.26 -0.14 0.00 1.00 0.00 0.00 64.86 65.47 2bi8 h ILE 157 Cb 0.20 0.09 0.01 0.00 -0.74 0.00 0.00 36.82 36.38 2bi8 h ILE 157 CO -0.00 0.14 -0.48 0.11 0.00 0.00 0.00 178.15 177.92 2bi8 h LYS 158 N 0.74 0.46 0.03 2.37 1.57 -1.36 -1.63 116.57 118.76 2bi8 h LYS 158 Ca 0.38 -0.39 -0.27 0.00 -1.87 0.00 0.00 60.65 58.50 2bi8 h LYS 158 Cb 0.36 0.09 0.02 0.00 0.08 0.00 0.00 32.23 32.77 2bi8 h LYS 158 CO -0.25 1.03 -1.08 0.37 -0.57 0.00 0.00 179.45 178.95 2bi8 h GLN 159 N 0.02 0.62 0.00 3.15 5.75 -0.70 -3.37 115.11 120.57 2bi8 h GLN 159 Ca -0.04 -0.71 0.00 0.00 -0.15 0.00 0.00 58.65 57.75 2bi8 h GLN 159 Cb 1.14 0.21 0.00 0.00 1.07 0.00 0.00 27.48 29.90 2bi8 h GLN 159 CO 0.10 1.30 -0.52 0.91 -2.65 0.00 0.00 178.83 177.97 2bi8 n TRP 160 N -3.81 0.00 -3.44 3.99 7.02 0.14 -4.80 117.44 116.54 2bi8 n TRP 160 Ca -0.11 0.00 -0.20 0.00 -1.02 0.00 0.00 57.50 56.18 2bi8 n TRP 160 Cb 0.90 -0.02 0.08 0.00 -2.42 0.00 0.00 31.31 29.85 2bi8 n TRP 160 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2bi8 n GLY 161 N 1.28 -0.39 3.32 6.99 0.00 -0.61 -5.01 105.19 110.78 2bi8 n GLY 161 Ca 0.01 0.14 -0.14 0.00 0.00 0.00 0.00 46.02 46.03 2bi8 n GLY 161 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bi8 s MET 162 N -5.81 0.72 0.20 1.61 1.00 -1.25 -5.04 119.30 110.72 2bi8 s MET 162 Ca 0.31 0.09 -0.30 0.00 0.00 0.00 0.00 55.69 55.79 2bi8 s MET 162 Cb -0.14 0.33 -0.08 0.00 0.00 0.00 0.00 34.83 34.94 2bi8 s MET 162 CO 0.68 -0.19 1.01 -0.65 0.00 0.00 0.00 175.02 175.88 2bi8 s GLN 163 N -0.94 4.72 0.66 2.03 -1.52 -1.26 -3.11 119.66 120.23 2bi8 s GLN 163 Ca -0.10 1.59 0.34 0.00 -1.95 0.00 0.00 55.36 55.24 2bi8 s GLN 163 Cb -0.04 -3.29 1.86 0.00 -0.22 0.00 0.00 33.01 31.33 2bi8 s GLN 163 CO 0.05 0.28 2.07 -1.35 -0.25 0.00 0.00 175.29 176.08 2bi8 h PRO 164 N 4.70 0.00 0.00 2.91 0.11 -1.94 0.89 132.00 138.67 2bi8 h PRO 164 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2bi8 h PRO 164 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2bi8 h PRO 164 CO 0.70 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.15 2bi8 h SER 165 N 0.00 0.00 0.25 -2.05 4.64 -1.93 -2.41 113.55 112.05 2bi8 h SER 165 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2bi8 h SER 165 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2bi8 h SER 165 CO -0.00 0.00 -0.28 -0.62 -0.87 0.00 0.00 176.83 175.06 2bi8 n GLU 166 N -2.31 0.78 -4.12 4.77 1.02 0.30 -4.84 120.64 116.24 2bi8 n GLU 166 Ca 0.03 -0.46 -0.28 0.00 -0.02 0.00 0.00 57.16 56.42 2bi8 n GLU 166 Cb 0.31 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.17 2bi8 n GLU 166 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2bi8 s LEU 167 N -2.54 3.56 0.67 -4.62 1.43 -1.13 -5.01 118.68 111.04 2bi8 s LEU 167 Ca 0.23 -0.19 -0.11 0.00 -1.03 0.00 0.00 54.13 53.03 2bi8 s LEU 167 Cb 0.19 -2.24 -0.00 0.00 0.03 0.00 0.00 46.19 44.17 2bi8 s LEU 167 CO 0.54 0.13 1.06 -2.16 0.23 0.00 0.00 176.35 176.14 2bi8 s PRO 168 N -2.66 3.06 0.64 1.29 0.04 -1.26 -1.47 135.00 134.64 2bi8 s PRO 168 Ca 0.28 0.49 0.40 0.00 0.04 0.00 0.00 61.00 62.21 2bi8 s PRO 168 Cb -0.11 -2.06 2.21 0.00 0.04 0.00 0.00 34.50 34.58 2bi8 s PRO 168 CO 0.20 -0.87 2.32 0.00 0.04 0.00 0.00 177.00 178.69 2bi8 h ALA 169 N -0.51 1.17 -0.50 8.56 0.00 -1.55 -3.03 119.26 123.39 2bi8 h ALA 169 Ca -0.45 -0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.60 2bi8 h ALA 169 Cb 1.24 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 2bi8 h ALA 169 CO 0.63 0.00 0.49 0.77 0.00 0.00 0.00 179.25 181.15 2bi8 h SER 170 N 0.00 0.00 0.33 0.00 0.02 -1.92 -2.64 113.55 109.35 2bi8 h SER 170 Ca -0.00 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 2bi8 h SER 170 Cb 0.02 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.55 2bi8 h SER 170 CO 0.00 0.00 -0.30 0.40 -1.14 0.00 0.00 176.83 175.79 2bi8 h ILE 171 N 0.00 1.19 -3.23 3.27 2.04 -1.93 -3.36 117.51 115.49 2bi8 h ILE 171 Ca 0.24 -1.06 -0.64 0.00 1.00 0.00 0.00 64.86 64.41 2bi8 h ILE 171 Cb 1.22 1.57 -0.41 0.00 -0.74 0.00 0.00 36.82 38.47 2bi8 h ILE 171 CO -0.00 0.30 -0.56 -0.22 0.00 0.00 0.00 178.15 177.67 2bi8 s LEU 172 N -8.25 4.70 0.20 1.44 2.96 -0.99 -4.94 118.68 113.80 2bi8 s LEU 172 Ca -0.03 -3.50 -0.01 0.00 -0.22 0.00 0.00 54.13 50.36 2bi8 s LEU 172 Cb 0.15 -1.66 0.15 0.00 0.50 0.00 0.00 46.19 45.32 2bi8 s LEU 172 CO 0.71 -0.15 1.52 0.11 -1.32 0.00 0.00 176.35 177.22 2bi8 h LYS 173 N 5.90 0.48 -5.60 1.98 1.79 -1.78 -3.46 116.57 115.88 2bi8 h LYS 173 Ca 0.06 -0.31 -0.45 0.00 -2.18 0.00 0.00 60.65 57.77 2bi8 h LYS 173 Cb 0.82 0.04 -0.19 0.00 -1.58 0.00 0.00 32.23 31.31 2bi8 h LYS 173 CO 0.72 0.91 -0.77 1.03 -1.08 0.00 0.00 179.45 180.25 2bi8 s ARG 174 N -3.95 1.07 -0.26 3.15 0.52 -1.26 -5.10 118.95 113.13 2bi8 s ARG 174 Ca -0.07 -1.24 -0.38 0.00 -0.52 0.00 0.00 55.73 53.52 2bi8 s ARG 174 Cb 0.11 -1.04 -0.14 0.00 0.52 0.00 0.00 34.95 34.41 2bi8 s ARG 174 CO 0.83 0.21 1.86 -0.11 0.02 0.00 0.00 175.30 178.11 2bi8 n LEU 175 N 0.60 2.55 -3.55 2.53 7.94 -1.26 -4.87 117.00 120.94 2bi8 n LEU 175 Ca -0.16 0.94 -0.41 0.00 -1.11 0.00 0.00 56.01 55.28 2bi8 n LEU 175 Cb 0.56 -1.20 -0.01 0.00 0.53 0.00 0.00 43.42 43.30 2bi8 n LEU 175 CO 0.27 -0.40 2.59 -0.81 -1.11 0.00 0.00 177.39 177.93 2bi8 n PRO 176 N 6.17 3.95 -3.82 1.96 -0.04 -1.26 -4.88 135.00 137.08 2bi8 n PRO 176 Ca 0.29 -3.06 -0.12 0.00 -0.04 0.00 0.00 63.50 60.56 2bi8 n PRO 176 Cb 0.18 -2.82 -0.11 0.00 -0.04 0.00 0.00 33.50 30.71 2bi8 n PRO 176 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2bi8 s VAL 177 N 0.53 0.03 -0.15 0.52 1.01 -1.26 -4.43 120.40 116.64 2bi8 s VAL 177 Ca 0.54 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 62.32 2bi8 s VAL 177 Cb 0.16 -0.35 0.01 0.00 0.00 0.00 0.00 36.38 36.20 2bi8 s VAL 177 CO -0.06 -0.12 -0.21 -0.60 0.00 0.00 0.00 175.10 174.11 2bi8 s ARG 178 N -0.39 3.04 -0.46 2.72 3.52 -0.39 -5.01 118.95 121.98 2bi8 s ARG 178 Ca -0.05 -0.84 -0.03 0.00 -0.13 0.00 0.00 55.73 54.69 2bi8 s ARG 178 Cb -0.03 -2.48 0.14 0.00 -1.56 0.00 0.00 34.95 31.02 2bi8 s ARG 178 CO 0.01 -0.04 2.49 1.19 -0.81 0.00 0.00 175.30 178.13 2bi8 n PHE 179 N 4.16 1.77 -3.63 5.12 3.01 -1.26 -2.83 117.46 123.80 2bi8 n PHE 179 Ca -0.20 -2.04 -0.06 0.00 1.01 0.00 0.00 57.45 56.15 2bi8 n PHE 179 Cb 0.51 -1.26 -0.00 0.00 -0.01 0.00 0.00 39.48 38.72 2bi8 n PHE 179 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 2bi8 n ASN 180 N 0.54 -1.01 -0.85 4.37 0.23 -1.26 -4.59 115.26 112.68 2bi8 n ASN 180 Ca 0.45 -1.96 0.11 0.00 -0.53 0.00 0.00 54.58 52.66 2bi8 n ASN 180 Cb 0.54 1.76 0.29 0.00 -2.08 0.00 0.00 39.78 40.29 2bi8 n ASN 180 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 2bi8 n TYR 181 N -0.31 0.36 -1.74 -2.53 4.02 -1.26 -1.79 117.16 113.92 2bi8 n TYR 181 Ca -0.02 -0.18 -0.42 0.00 -0.01 0.00 0.00 57.90 57.26 2bi8 n TYR 181 Cb 0.32 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.61 2bi8 n TYR 181 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2bi8 s ASP 182 N -1.50 6.46 -0.08 7.72 1.01 -1.26 -4.89 116.67 124.13 2bi8 s ASP 182 Ca 0.35 2.69 0.11 0.00 0.71 0.00 0.00 52.55 56.41 2bi8 s ASP 182 Cb 0.20 -2.56 0.17 0.00 1.01 0.00 0.00 42.92 41.74 2bi8 s ASP 182 CO 0.28 -1.00 1.07 -0.90 0.21 0.00 0.00 175.17 174.83 2bi8 n ASP 183 N 6.19 2.01 -4.67 0.27 5.75 -1.26 -4.94 116.55 119.91 2bi8 n ASP 183 Ca 0.18 -2.60 -0.46 0.00 -0.01 0.00 0.00 54.79 51.89 2bi8 n ASP 183 Cb 0.39 -0.26 -0.04 0.00 -1.03 0.00 0.00 41.12 40.18 2bi8 n ASP 183 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2bi8 n ASN 184 N -1.00 3.09 -0.04 -1.12 6.94 -1.26 -4.56 115.26 117.31 2bi8 n ASN 184 Ca 0.09 1.08 -0.13 0.00 -0.02 0.00 0.00 54.58 55.60 2bi8 n ASN 184 Cb 0.51 -1.42 -0.01 0.00 -2.36 0.00 0.00 39.78 36.50 2bi8 n ASN 184 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 2bi8 h TYR 185 N 6.13 0.95 -3.72 -2.53 3.20 -1.64 -3.44 116.97 115.91 2bi8 h TYR 185 Ca -0.45 -0.36 -0.68 0.00 3.14 0.00 0.00 58.73 60.38 2bi8 h TYR 185 Cb 1.26 -0.17 -0.21 0.00 1.54 0.00 0.00 36.73 39.14 2bi8 h TYR 185 CO 0.64 1.16 -0.72 -0.06 -1.64 0.00 0.00 178.16 177.53 2bi8 s PHE 186 N -3.99 2.85 -2.21 -3.82 0.40 -1.26 -4.85 117.98 105.10 2bi8 s PHE 186 Ca -0.09 -0.13 0.26 0.00 -0.60 0.00 0.00 56.93 56.37 2bi8 s PHE 186 Cb 0.10 -1.72 0.70 0.00 0.51 0.00 0.00 43.02 42.62 2bi8 s PHE 186 CO 0.88 0.20 1.54 0.09 0.70 0.00 0.00 175.22 178.62 2bi8 n ASN 187 N 2.49 1.56 -4.68 1.36 3.02 -1.26 -4.97 115.26 112.78 2bi8 n ASN 187 Ca -0.18 -1.33 -0.38 0.00 -0.03 0.00 0.00 54.58 52.67 2bi8 n ASN 187 Cb 0.53 0.11 0.05 0.00 -0.61 0.00 0.00 39.78 39.86 2bi8 n ASN 187 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2bi8 n HIS 188 N -0.03 1.55 -0.14 3.10 8.25 -1.26 -4.94 115.22 121.74 2bi8 n HIS 188 Ca 0.15 0.44 -0.11 0.00 -0.26 0.00 0.00 57.72 57.94 2bi8 n HIS 188 Cb 0.40 -2.25 -0.01 0.00 1.12 0.00 0.00 29.99 29.25 2bi8 n HIS 188 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2bi8 h LYS 189 N 0.91 0.80 -5.05 -0.41 3.64 -1.91 -3.43 116.57 111.12 2bi8 h LYS 189 Ca -0.49 -0.29 -0.65 0.00 -1.27 0.00 0.00 60.65 57.94 2bi8 h LYS 189 Cb 1.34 -0.05 -0.26 0.00 -0.41 0.00 0.00 32.23 32.84 2bi8 h LYS 189 CO 0.54 0.91 -0.71 -0.06 -2.27 0.00 0.00 179.45 177.86 2bi8 s PHE 190 N -4.84 2.97 -0.05 1.91 0.40 0.06 -5.01 117.98 113.42 2bi8 s PHE 190 Ca -0.12 -0.79 -0.02 0.00 -0.60 0.00 0.00 56.93 55.39 2bi8 s PHE 190 Cb 0.11 -2.08 0.03 0.00 0.51 0.00 0.00 43.02 41.59 2bi8 s PHE 190 CO 0.82 -0.44 0.06 -0.65 0.70 0.00 0.00 175.22 175.71 2bi8 s GLN 191 N 1.27 -0.07 0.20 0.44 -0.21 -1.26 -0.68 119.66 119.36 2bi8 s GLN 191 Ca 0.03 0.36 -0.06 0.00 0.02 0.00 0.00 55.36 55.72 2bi8 s GLN 191 Cb -0.14 -0.57 0.02 0.00 1.00 0.00 0.00 33.01 33.32 2bi8 s GLN 191 CO -0.01 -0.35 0.37 0.41 -2.12 0.00 0.00 175.29 173.59 2bi8 n GLY 192 N 5.30 1.84 3.01 3.09 0.00 -0.56 -3.69 105.19 114.18 2bi8 n GLY 192 Ca -0.03 -1.26 -0.13 0.00 0.00 0.00 0.00 46.02 44.60 2bi8 n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2bi8 s MET 193 N -2.18 0.17 0.13 1.61 1.75 -0.41 -3.02 119.30 117.35 2bi8 s MET 193 Ca 0.11 0.49 -0.31 0.00 -1.25 0.00 0.00 55.69 54.73 2bi8 s MET 193 Cb -0.02 -0.14 -0.09 0.00 2.84 0.00 0.00 34.83 37.42 2bi8 s MET 193 CO 0.08 -0.17 1.56 -1.25 -0.65 0.00 0.00 175.02 174.59 2bi8 s PRO 194 N 1.28 4.23 0.29 4.11 0.04 -1.26 0.33 135.00 144.02 2bi8 s PRO 194 Ca -0.09 2.31 0.02 0.00 0.04 0.00 0.00 61.00 63.28 2bi8 s PRO 194 Cb -0.11 -3.29 0.58 0.00 0.04 0.00 0.00 34.50 31.72 2bi8 s PRO 194 CO -0.08 -0.62 1.85 -0.22 0.04 0.00 0.00 177.00 177.97 2bi8 h LYS 195 N 7.21 0.94 -0.24 4.56 3.64 -0.80 -2.15 116.57 129.73 2bi8 h LYS 195 Ca -0.42 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2bi8 h LYS 195 Cb 1.20 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 32.81 2bi8 h LYS 195 CO 0.91 0.62 0.00 0.00 -2.27 0.00 0.00 179.45 178.72 2bi8 n GLY 197 N 0.04 0.82 0.28 0.00 0.00 -0.81 -4.26 105.19 101.26 2bi8 n GLY 197 Ca 0.11 -1.81 -0.01 0.00 0.00 0.00 0.00 46.02 44.30 2bi8 n GLY 197 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2bi8 h TYR 198 N 0.00 0.64 -0.32 1.61 -1.99 -1.85 -2.46 116.97 112.60 2bi8 h TYR 198 Ca 0.00 -0.06 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 2bi8 h TYR 198 Cb 0.00 -0.19 -0.01 0.00 2.00 0.00 0.00 36.73 38.53 2bi8 h TYR 198 CO 0.00 0.60 0.17 1.15 -0.00 0.00 0.00 178.16 180.08 2bi8 h THR 199 N 0.59 1.14 -0.75 -2.88 2.02 -1.81 0.29 112.91 111.53 2bi8 h THR 199 Ca 0.13 -0.38 -0.04 0.00 0.77 0.00 0.00 66.41 66.88 2bi8 h THR 199 Cb 0.33 0.81 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 2bi8 h THR 199 CO 0.01 0.14 0.30 1.56 0.37 0.00 0.00 175.52 177.90 2bi8 h GLN 200 N 0.39 1.12 -0.29 6.66 1.08 -1.72 0.35 115.11 122.70 2bi8 h GLN 200 Ca 0.11 -0.20 0.06 0.00 -1.45 0.00 0.00 58.65 57.16 2bi8 h GLN 200 Cb 0.08 -0.18 -0.05 0.00 -0.05 0.00 0.00 27.48 27.28 2bi8 h GLN 200 CO -0.02 0.91 -0.04 1.98 -0.95 0.00 0.00 178.83 180.72 2bi8 h MET 201 N 1.08 0.04 0.00 1.46 4.05 -1.03 -1.35 114.93 119.18 2bi8 h MET 201 Ca 0.25 -0.00 -0.10 0.00 -0.28 0.00 0.00 59.70 59.56 2bi8 h MET 201 Cb 0.21 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 30.99 2bi8 h MET 201 CO -0.02 0.03 -0.49 0.82 0.23 0.00 0.00 176.91 177.48 2bi8 h ILE 202 N 0.04 1.12 -0.68 1.77 2.04 -0.75 -1.95 117.51 119.09 2bi8 h ILE 202 Ca 0.14 -1.82 -0.07 0.00 1.00 0.00 0.00 64.86 64.11 2bi8 h ILE 202 Cb 0.20 2.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 2bi8 h ILE 202 CO -0.27 0.48 0.14 0.50 0.00 0.00 0.00 178.15 179.00 2bi8 h LYS 203 N 0.00 1.10 -0.27 2.37 3.64 -0.51 -0.87 116.57 122.03 2bi8 h LYS 203 Ca -0.00 -0.27 -0.04 0.00 -1.27 0.00 0.00 60.65 59.06 2bi8 h LYS 203 Cb 1.01 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.68 2bi8 h LYS 203 CO 0.06 0.98 0.00 1.03 -2.27 0.00 0.00 179.45 179.26 2bi8 h SER 204 N 1.04 0.47 -0.82 4.20 0.87 -0.98 -1.78 113.55 116.54 2bi8 h SER 204 Ca 0.21 -0.31 0.10 0.00 -1.23 0.00 0.00 61.79 60.57 2bi8 h SER 204 Cb 0.39 -0.13 -0.06 0.00 -0.44 0.00 0.00 62.40 62.17 2bi8 h SER 204 CO 0.01 0.66 0.54 0.40 -0.53 0.00 0.00 176.83 177.91 2bi8 h ILE 205 N 0.27 0.93 -0.00 2.23 2.04 -1.16 -0.32 117.51 121.49 2bi8 h ILE 205 Ca 0.08 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.68 2bi8 h ILE 205 Cb 0.42 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 2bi8 h ILE 205 CO 0.01 0.14 -0.11 0.18 0.00 0.00 0.00 178.15 178.37 2bi8 n LEU 206 N -4.52 0.33 -4.55 1.44 4.77 -0.35 -4.63 117.00 109.49 2bi8 n LEU 206 Ca 0.14 0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.83 2bi8 n LEU 206 Cb 0.35 -0.24 -0.01 0.00 -2.33 0.00 0.00 43.42 41.19 2bi8 n LEU 206 CO 0.32 0.06 1.94 -3.20 -1.33 0.00 0.00 177.39 175.18 2bi8 n ASN 207 N -1.12 4.65 -3.76 -1.43 5.15 -0.13 -4.79 115.26 113.82 2bi8 n ASN 207 Ca 0.13 -2.89 -0.13 0.00 -0.60 0.00 0.00 54.58 51.09 2bi8 n ASN 207 Cb 0.28 -1.74 -0.11 0.00 -0.53 0.00 0.00 39.78 37.68 2bi8 n ASN 207 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2bi8 s HIS 208 N 5.08 -0.35 0.46 1.20 2.46 -1.26 -5.03 115.29 117.84 2bi8 s HIS 208 Ca 0.56 0.87 0.22 0.00 0.47 0.00 0.00 55.06 57.17 2bi8 s HIS 208 Cb 0.04 0.12 1.21 0.00 -0.13 0.00 0.00 32.58 33.82 2bi8 s HIS 208 CO 0.08 -0.17 1.88 0.93 -2.47 0.00 0.00 174.74 174.99 2bi8 h GLU 209 N 5.62 0.26 -0.01 2.88 3.07 -1.97 -0.69 114.58 123.75 2bi8 h GLU 209 Ca -0.26 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 2bi8 h GLU 209 Cb 1.19 -0.06 0.00 0.00 -0.84 0.00 0.00 28.75 29.04 2bi8 h GLU 209 CO 0.30 0.17 -0.05 0.09 -1.40 0.00 0.00 179.01 178.12 2bi8 n ASN 210 N -4.44 0.59 -4.46 1.42 3.02 -1.26 -4.76 115.26 105.36 2bi8 n ASN 210 Ca 0.18 -0.93 -0.35 0.00 -0.03 0.00 0.00 54.58 53.45 2bi8 n ASN 210 Cb 0.75 -0.03 -0.12 0.00 -0.61 0.00 0.00 39.78 39.76 2bi8 n ASN 210 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2bi8 s ILE 211 N -2.22 4.07 -0.19 2.41 1.01 -0.27 -0.92 121.20 125.09 2bi8 s ILE 211 Ca 0.37 -0.27 -0.04 0.00 0.00 0.00 0.00 60.65 60.71 2bi8 s ILE 211 Cb 0.21 -2.85 -0.02 0.00 0.01 0.00 0.00 42.46 39.81 2bi8 s ILE 211 CO 0.41 0.42 -0.04 -0.75 0.00 0.00 0.00 174.94 174.98 2bi8 s LYS 212 N 1.01 3.51 -0.21 2.79 2.47 -0.46 -4.79 119.74 124.06 2bi8 s LYS 212 Ca 0.02 -0.58 -0.10 0.00 -1.56 0.00 0.00 55.97 53.76 2bi8 s LYS 212 Cb -0.14 -2.98 -0.05 0.00 -1.46 0.00 0.00 37.83 33.20 2bi8 s LYS 212 CO 0.02 -0.02 0.12 0.08 0.16 0.00 0.00 175.35 175.72 2bi8 s VAL 213 N 1.03 5.22 -0.20 4.02 1.01 -1.26 -0.42 120.40 129.81 2bi8 s VAL 213 Ca 0.01 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.13 2bi8 s VAL 213 Cb -0.15 -3.40 0.04 0.00 0.00 0.00 0.00 36.38 32.87 2bi8 s VAL 213 CO 0.01 0.41 -0.14 -1.81 0.00 0.00 0.00 175.10 173.56 2bi8 s ASP 214 N 0.66 3.46 0.59 3.32 1.01 0.44 -4.99 116.67 121.16 2bi8 s ASP 214 Ca 0.07 -0.88 0.03 0.00 0.71 0.00 0.00 52.55 52.48 2bi8 s ASP 214 Cb -0.12 -1.37 0.06 0.00 1.01 0.00 0.00 42.92 42.50 2bi8 s ASP 214 CO 0.01 -0.10 0.81 -0.76 0.21 0.00 0.00 175.17 175.34 2bi8 s LEU 215 N 1.31 3.22 -1.04 1.23 1.43 -1.26 -1.54 118.68 122.02 2bi8 s LEU 215 Ca -0.00 -0.29 -0.00 0.00 -1.03 0.00 0.00 54.13 52.81 2bi8 s LEU 215 Cb -0.16 -2.41 0.00 0.00 0.03 0.00 0.00 46.19 43.65 2bi8 s LEU 215 CO -0.09 -1.33 0.01 0.00 0.23 0.00 0.00 176.35 175.17 2bi8 n GLN 216 N -2.40 -2.26 -4.03 1.70 6.02 0.11 -4.84 117.38 111.68 2bi8 n GLN 216 Ca 0.11 0.59 -0.31 0.00 -0.01 0.00 0.00 57.00 57.38 2bi8 n GLN 216 Cb 0.60 -5.19 -0.16 0.00 1.02 0.00 0.00 30.24 26.52 2bi8 n GLN 216 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 2bi8 s ARG 217 N -5.04 2.16 0.31 -1.09 3.52 0.09 -4.86 118.95 114.04 2bi8 s ARG 217 Ca 0.01 -1.00 -0.28 0.00 -0.13 0.00 0.00 55.73 54.33 2bi8 s ARG 217 Cb -0.00 -2.59 -0.09 0.00 -1.56 0.00 0.00 34.95 30.71 2bi8 s ARG 217 CO 0.01 -0.46 1.02 -1.21 -0.81 0.00 0.00 175.30 173.85 2bi8 s GLU 218 N 1.30 4.56 0.36 5.12 2.02 -1.26 -2.09 118.70 128.71 2bi8 s GLU 218 Ca -0.03 1.57 -0.28 0.00 0.02 0.00 0.00 54.97 56.25 2bi8 s GLU 218 Cb -0.17 -2.98 -0.11 0.00 0.10 0.00 0.00 34.13 30.97 2bi8 s GLU 218 CO -0.08 0.21 1.44 0.34 0.02 0.00 0.00 175.26 177.19 2bi8 n PHE 219 N 0.83 2.79 -4.51 1.61 7.35 -1.26 -5.00 117.46 119.28 2bi8 n PHE 219 Ca 0.01 0.47 -0.29 0.00 -0.76 0.00 0.00 57.45 56.88 2bi8 n PHE 219 Cb 0.47 -2.50 -0.17 0.00 0.35 0.00 0.00 39.48 37.63 2bi8 n PHE 219 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 2bi8 s ILE 220 N -1.06 1.55 0.45 -2.13 1.01 -1.26 -5.04 121.20 114.72 2bi8 s ILE 220 Ca 0.54 -0.68 0.23 0.00 0.00 0.00 0.00 60.65 60.74 2bi8 s ILE 220 Cb -0.50 -1.41 0.42 0.00 0.01 0.00 0.00 42.46 40.98 2bi8 s ILE 220 CO 0.63 0.45 1.83 0.58 0.00 0.00 0.00 174.94 178.43 2bi8 h VAL 221 N 5.94 0.57 -0.73 2.92 2.07 -1.99 -2.06 116.25 122.98 2bi8 h VAL 221 Ca -0.31 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 2bi8 h VAL 221 Cb 1.18 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2bi8 h VAL 221 CO 0.49 0.05 0.43 -0.33 0.02 0.00 0.00 177.57 178.24 2bi8 h GLU 222 N 0.27 0.99 -0.96 1.57 4.39 -2.03 -2.59 114.58 116.22 2bi8 h GLU 222 Ca 0.51 -0.09 0.27 0.00 0.34 0.00 0.00 59.36 60.40 2bi8 h GLU 222 Cb 1.51 -0.21 -0.04 0.00 -0.10 0.00 0.00 28.75 29.91 2bi8 h GLU 222 CO -0.16 0.70 0.69 0.93 -1.16 0.00 0.00 179.01 180.00 2bi8 h GLU 223 N 1.00 0.04 -1.16 2.33 5.08 -1.81 -3.12 114.58 116.93 2bi8 h GLU 223 Ca 0.26 -0.00 0.44 0.00 -1.00 0.00 0.00 59.36 59.06 2bi8 h GLU 223 Cb -0.03 -0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.05 2bi8 h GLU 223 CO -0.05 0.03 0.69 0.00 -1.00 0.00 0.00 179.01 178.68 2bi8 h ARG 224 N 0.04 0.03 0.00 2.33 3.08 -1.64 0.17 114.38 118.39 2bi8 h ARG 224 Ca 0.46 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.51 2bi8 h ARG 224 Cb 1.79 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.83 2bi8 h ARG 224 CO -0.03 0.02 0.00 0.25 -1.07 0.00 0.00 179.97 179.14 2bi8 n THR 225 N -5.02 0.70 1.74 2.04 -2.24 -1.18 -2.81 114.28 107.52 2bi8 n THR 225 Ca 0.38 0.02 0.11 0.00 -2.27 0.00 0.00 64.05 62.30 2bi8 n THR 225 Cb 1.38 -0.89 0.57 0.00 -2.10 0.00 0.00 70.33 69.29 2bi8 n THR 225 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2bi8 n HIS 226 N -2.16 0.06 -4.19 4.78 8.25 0.60 -4.92 115.22 117.64 2bi8 n HIS 226 Ca 0.04 -0.03 -0.15 0.00 -0.26 0.00 0.00 57.72 57.32 2bi8 n HIS 226 Cb 0.31 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.31 2bi8 n HIS 226 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2bi8 s TYR 227 N -1.94 1.14 0.26 4.41 1.51 -1.12 -4.97 117.35 116.63 2bi8 s TYR 227 Ca 0.34 -0.61 0.13 0.00 -1.01 0.00 0.00 57.07 55.92 2bi8 s TYR 227 Cb 0.16 -0.62 0.50 0.00 -0.11 0.00 0.00 41.96 41.90 2bi8 s TYR 227 CO 0.27 0.04 1.68 -0.44 -1.11 0.00 0.00 175.55 175.98 2bi8 h ASP 228 N 3.65 0.00 -4.56 2.29 3.32 0.39 -3.47 116.42 118.05 2bi8 h ASP 228 Ca -0.38 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.66 2bi8 h ASP 228 Cb 1.19 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 40.53 2bi8 h ASP 228 CO 0.51 0.52 0.31 -2.28 -1.72 0.00 0.00 179.24 176.58 2bi8 s HIS 229 N -3.70 -0.57 -0.10 4.55 2.46 -1.22 -4.95 115.29 111.76 2bi8 s HIS 229 Ca -0.01 1.03 0.01 0.00 0.47 0.00 0.00 55.06 56.56 2bi8 s HIS 229 Cb 0.13 0.41 -0.02 0.00 -0.13 0.00 0.00 32.58 32.97 2bi8 s HIS 229 CO 0.74 -0.49 -0.15 0.08 -2.47 0.00 0.00 174.74 172.45 2bi8 s VAL 230 N -0.99 2.94 -0.27 0.89 1.01 -0.30 -2.24 120.40 121.45 2bi8 s VAL 230 Ca -0.07 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.11 2bi8 s VAL 230 Cb -0.01 -2.20 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 2bi8 s VAL 230 CO 0.06 0.55 0.10 -0.36 0.00 0.00 0.00 175.10 175.44 2bi8 s PHE 231 N 0.06 3.12 -0.25 5.22 0.40 -0.34 -0.52 117.98 125.67 2bi8 s PHE 231 Ca -0.06 -0.41 -0.00 0.00 -0.60 0.00 0.00 56.93 55.86 2bi8 s PHE 231 Cb -0.15 -2.28 0.04 0.00 0.51 0.00 0.00 43.02 41.14 2bi8 s PHE 231 CO 0.05 -0.36 -0.09 -0.47 0.70 0.00 0.00 175.22 175.05 2bi8 s TYR 232 N 1.63 3.09 -0.69 0.36 5.04 0.20 -0.49 117.35 126.48 2bi8 s TYR 232 Ca 0.06 -1.77 0.15 0.00 -2.44 0.00 0.00 57.07 53.06 2bi8 s TYR 232 Cb -0.16 -2.02 0.50 0.00 0.35 0.00 0.00 41.96 40.64 2bi8 s TYR 232 CO 0.05 -0.78 1.42 -1.13 -1.34 0.00 0.00 175.55 173.76 2bi8 n SER 233 N 4.60 3.78 -4.91 4.32 3.41 -0.55 -1.00 113.62 123.27 2bi8 n SER 233 Ca -0.16 -2.50 -0.27 0.00 -0.26 0.00 0.00 58.87 55.68 2bi8 n SER 233 Cb 0.46 -0.44 0.04 0.00 -0.26 0.00 0.00 64.21 64.01 2bi8 n SER 233 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2bi8 s GLY 234 N -1.32 1.63 0.03 5.00 0.00 -1.24 -4.03 107.32 107.39 2bi8 s GLY 234 Ca 0.38 -0.68 -0.34 0.00 0.00 0.00 0.00 44.72 44.07 2bi8 s GLY 234 CO 0.15 -0.35 1.70 -1.05 0.00 0.00 0.00 173.10 173.55 2bi8 n PRO 235 N -2.74 2.07 -0.32 2.90 -0.02 -1.26 -2.59 135.00 133.04 2bi8 n PRO 235 Ca 0.06 0.75 -0.05 0.00 -2.02 0.00 0.00 63.50 62.25 2bi8 n PRO 235 Cb 0.58 -2.55 0.08 0.00 -0.02 0.00 0.00 33.50 31.59 2bi8 n PRO 235 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2bi8 h LEU 236 N 7.32 1.10 -1.26 2.45 5.85 -1.70 -1.80 115.31 127.27 2bi8 h LEU 236 Ca -0.47 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.06 2bi8 h LEU 236 Cb 1.27 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 2bi8 h LEU 236 CO 0.91 0.90 -0.35 -2.24 -0.34 0.00 0.00 178.44 177.32 2bi8 h ASP 237 N 1.21 0.03 -0.18 1.25 2.03 -1.90 -3.14 116.42 115.71 2bi8 h ASP 237 Ca 0.30 -0.01 -0.14 0.00 -0.73 0.00 0.00 57.03 56.45 2bi8 h ASP 237 Cb 0.07 -0.01 0.00 0.00 -0.83 0.00 0.00 39.33 38.57 2bi8 h ASP 237 CO -0.04 0.38 -0.42 0.00 -1.03 0.00 0.00 179.24 178.13 2bi8 h ALA 238 N 1.62 0.30 -1.11 4.15 0.00 -1.74 0.45 119.26 122.93 2bi8 h ALA 238 Ca 0.00 -0.46 0.31 0.00 0.00 0.00 0.00 54.91 54.76 2bi8 h ALA 238 Cb 0.64 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 18.27 2bi8 h ALA 238 CO 0.05 0.42 0.70 0.35 0.00 0.00 0.00 179.25 180.77 2bi8 h PHE 239 N 0.28 0.66 -0.59 0.00 3.57 -1.31 0.58 116.94 120.14 2bi8 h PHE 239 Ca -0.00 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 2bi8 h PHE 239 Cb 1.03 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2bi8 h PHE 239 CO 0.09 -0.03 0.03 0.66 -2.23 0.00 0.00 178.31 176.83 2bi8 n TYR 240 N -4.70 2.10 -2.14 0.41 4.02 -0.97 -4.93 117.16 110.96 2bi8 n TYR 240 Ca 0.29 -0.77 -0.19 0.00 -0.01 0.00 0.00 57.90 57.23 2bi8 n TYR 240 Cb 1.03 -0.53 -0.03 0.00 -0.02 0.00 0.00 39.34 39.79 2bi8 n TYR 240 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2bi8 n GLY 241 N 0.53 0.19 4.14 2.72 0.00 0.20 -2.18 105.19 110.79 2bi8 n GLY 241 Ca 0.29 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2bi8 n GLY 241 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bi8 n TYR 242 N -3.60 -1.41 0.52 1.61 4.01 0.15 -4.87 117.16 113.56 2bi8 n TYR 242 Ca -0.21 0.47 0.13 0.00 -0.16 0.00 0.00 57.90 58.13 2bi8 n TYR 242 Cb 0.65 -3.02 0.40 0.00 -0.31 0.00 0.00 39.34 37.06 2bi8 n TYR 242 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 2bi8 h GLN 243 N -2.04 0.00 0.00 -0.72 3.07 -1.66 -3.05 115.11 110.71 2bi8 h GLN 243 Ca -0.67 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.07 2bi8 h GLN 243 Cb 1.39 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.95 2bi8 h GLN 243 CO 0.62 0.00 -0.88 0.66 0.09 0.00 0.00 178.83 179.32 2bi8 n TYR 244 N -2.41 0.00 0.00 0.06 0.53 -1.26 -5.11 117.16 108.97 2bi8 n TYR 244 Ca 0.05 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.93 2bi8 n TYR 244 Cb 0.40 -0.07 0.00 0.00 -1.03 0.00 0.00 39.34 38.64 2bi8 n TYR 244 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2bi8 n GLY 245 N 1.40 3.09 3.73 2.72 0.00 -1.15 -5.08 105.19 109.89 2bi8 n GLY 245 Ca 0.02 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 2bi8 n GLY 245 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bi8 s ARG 246 N -2.67 4.67 0.26 1.61 0.52 -1.26 -4.80 118.95 117.28 2bi8 s ARG 246 Ca 0.00 1.44 -0.30 0.00 -0.52 0.00 0.00 55.73 56.35 2bi8 s ARG 246 Cb 0.00 -3.39 -0.10 0.00 0.52 0.00 0.00 34.95 31.98 2bi8 s ARG 246 CO 0.00 0.16 1.39 -0.51 0.02 0.00 0.00 175.30 176.36 2bi8 s LEU 247 N 0.20 4.40 0.04 2.53 1.43 -1.26 -4.96 118.68 121.06 2bi8 s LEU 247 Ca 0.48 2.64 -0.30 0.00 -1.03 0.00 0.00 54.13 55.91 2bi8 s LEU 247 Cb -0.23 -3.63 -0.08 0.00 0.03 0.00 0.00 46.19 42.28 2bi8 s LEU 247 CO 0.29 -0.64 1.83 -0.83 0.23 0.00 0.00 176.35 177.24 2bi8 s GLY 248 N 0.14 1.46 0.03 -3.19 0.00 -1.26 -5.00 107.32 99.50 2bi8 s GLY 248 Ca 0.56 1.25 0.00 0.00 0.00 0.00 0.00 44.72 46.54 2bi8 s GLY 248 CO 0.45 3.24 -0.04 -0.19 0.00 0.00 0.00 173.10 176.56 2bi8 s TYR 249 N 3.78 0.36 -0.08 1.90 1.51 -1.26 -1.07 117.35 122.49 2bi8 s TYR 249 Ca 0.82 -0.62 -0.14 0.00 -1.01 0.00 0.00 57.07 56.12 2bi8 s TYR 249 Cb -0.41 -0.25 -0.05 0.00 -0.11 0.00 0.00 41.96 41.14 2bi8 s TYR 249 CO 0.37 -0.21 0.35 1.03 -1.11 0.00 0.00 175.55 175.98 2bi8 s ARG 250 N -1.90 4.02 0.32 -0.62 1.81 0.12 -2.03 118.95 120.66 2bi8 s ARG 250 Ca -0.11 0.25 0.05 0.00 -1.72 0.00 0.00 55.73 54.20 2bi8 s ARG 250 Cb -0.07 -3.31 -0.02 0.00 -0.45 0.00 0.00 34.95 31.10 2bi8 s ARG 250 CO -0.02 0.49 0.46 -0.08 -0.68 0.00 0.00 175.30 175.46 2bi8 s THR 251 N -0.35 4.52 -0.09 0.02 -1.32 0.19 -2.22 115.64 116.40 2bi8 s THR 251 Ca 0.21 -0.91 0.04 0.00 -1.21 0.00 0.00 61.69 59.81 2bi8 s THR 251 Cb -0.15 -3.59 0.00 0.00 -1.51 0.00 0.00 72.50 67.25 2bi8 s THR 251 CO 0.09 -0.26 -0.21 -0.76 -2.21 0.00 0.00 174.62 171.27 2bi8 s LEU 252 N -4.16 1.96 -0.18 9.08 1.43 -1.26 -1.89 118.68 123.67 2bi8 s LEU 252 Ca 0.41 -0.48 -0.10 0.00 -1.03 0.00 0.00 54.13 52.93 2bi8 s LEU 252 Cb -0.09 -1.23 -0.05 0.00 0.03 0.00 0.00 46.19 44.84 2bi8 s LEU 252 CO 0.31 0.13 0.17 -1.81 0.23 0.00 0.00 176.35 175.38 2bi8 s ASP 253 N 0.39 6.29 -0.27 2.29 1.01 -0.07 -4.94 116.67 121.37 2bi8 s ASP 253 Ca -0.16 0.33 -0.05 0.00 0.71 0.00 0.00 52.55 53.38 2bi8 s ASP 253 Cb -0.17 -2.11 0.01 0.00 1.01 0.00 0.00 42.92 41.66 2bi8 s ASP 253 CO 0.07 0.21 0.02 -0.36 0.21 0.00 0.00 175.17 175.32 2bi8 s PHE 254 N 0.11 3.09 -0.44 4.23 0.40 -1.26 -0.68 117.98 123.43 2bi8 s PHE 254 Ca 0.11 -1.08 -0.21 0.00 -0.60 0.00 0.00 56.93 55.15 2bi8 s PHE 254 Cb -0.12 -2.18 0.02 0.00 0.51 0.00 0.00 43.02 41.26 2bi8 s PHE 254 CO 0.00 -0.59 0.68 0.21 0.70 0.00 0.00 175.22 176.22 2bi8 s LYS 255 N 1.46 3.33 0.08 0.44 2.36 0.01 -4.93 119.74 122.50 2bi8 s LYS 255 Ca 0.03 -0.27 -0.28 0.00 -2.55 0.00 0.00 55.97 52.89 2bi8 s LYS 255 Cb -0.16 -3.94 -0.06 0.00 -1.05 0.00 0.00 37.83 32.62 2bi8 s LYS 255 CO -0.00 -1.03 0.89 0.21 1.55 0.00 0.00 175.35 176.97 2bi8 s LYS 256 N 2.95 4.62 0.05 4.03 2.20 -1.26 -1.60 119.74 130.72 2bi8 s LYS 256 Ca 0.25 1.30 -0.12 0.00 -0.36 0.00 0.00 55.97 57.05 2bi8 s LYS 256 Cb -0.14 -3.37 0.01 0.00 -1.51 0.00 0.00 37.83 32.82 2bi8 s LYS 256 CO 0.20 0.23 0.25 -0.59 -0.36 0.00 0.00 175.35 175.08 2bi8 s PHE 257 N 0.00 -0.02 -0.11 4.03 -0.12 -0.71 -5.02 117.98 116.04 2bi8 s PHE 257 Ca 0.44 -0.18 0.01 0.00 -0.05 0.00 0.00 56.93 57.16 2bi8 s PHE 257 Cb -0.22 0.03 -0.02 0.00 -0.63 0.00 0.00 43.02 42.19 2bi8 s PHE 257 CO 0.27 -0.48 -0.15 0.99 -0.05 0.00 0.00 175.22 175.81 2bi8 s THR 258 N -2.66 2.93 -0.01 -4.49 2.01 -1.26 -1.14 115.64 111.01 2bi8 s THR 258 Ca -0.04 -0.72 0.05 0.00 0.31 0.00 0.00 61.69 61.29 2bi8 s THR 258 Cb -0.01 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.28 2bi8 s THR 258 CO -0.04 0.54 -0.16 -0.47 -0.69 0.00 0.00 174.62 173.80 2bi8 s TYR 259 N 0.11 2.62 -0.51 4.92 5.04 0.37 -4.93 117.35 124.97 2bi8 s TYR 259 Ca -0.07 -0.22 -0.22 0.00 -2.44 0.00 0.00 57.07 54.12 2bi8 s TYR 259 Cb -0.15 -1.55 0.04 0.00 0.35 0.00 0.00 41.96 40.65 2bi8 s TYR 259 CO 0.05 0.20 0.81 -1.14 -1.34 0.00 0.00 175.55 174.13 2bi8 s GLN 260 N -1.02 3.29 0.00 4.97 2.00 -1.26 0.13 119.66 127.77 2bi8 s GLN 260 Ca 0.13 -0.39 0.00 0.00 -2.00 0.00 0.00 55.36 53.10 2bi8 s GLN 260 Cb -0.11 -4.03 0.00 0.00 0.80 0.00 0.00 33.01 29.67 2bi8 s GLN 260 CO 0.03 -1.32 0.00 0.41 -0.50 0.00 0.00 175.29 173.91 2bi8 n GLY 261 N 5.10 0.51 2.91 2.59 0.00 -0.15 -4.93 105.19 111.21 2bi8 n GLY 261 Ca -0.00 -1.58 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 2bi8 n GLY 261 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2bi8 s ASP 262 N -4.00 3.75 0.06 1.61 3.68 -1.26 -4.29 116.67 116.21 2bi8 s ASP 262 Ca 0.00 -1.16 -0.17 0.00 2.13 0.00 0.00 52.55 53.35 2bi8 s ASP 262 Cb 0.00 -1.10 -0.15 0.00 -1.45 0.00 0.00 42.92 40.22 2bi8 s ASP 262 CO 0.00 -0.25 1.30 0.22 0.13 0.00 0.00 175.17 176.56 2bi8 h TYR 263 N 7.99 0.72 0.00 -5.34 3.20 -1.91 -3.41 116.97 118.22 2bi8 h TYR 263 Ca -0.17 -0.27 0.00 0.00 3.14 0.00 0.00 58.73 61.42 2bi8 h TYR 263 Cb 1.08 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.22 2bi8 h TYR 263 CO 0.47 1.03 -0.04 0.00 -1.64 0.00 0.00 178.16 177.97 2bi8 n GLN 264 N -4.27 2.26 -1.06 1.82 10.64 -1.26 -5.05 117.38 120.45 2bi8 n GLN 264 Ca -0.07 0.00 -0.02 0.00 -1.83 0.00 0.00 57.00 55.08 2bi8 n GLN 264 Cb 0.54 -0.21 -0.01 0.00 -0.86 0.00 0.00 30.24 29.70 2bi8 n GLN 264 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2bi8 n GLY 265 N 0.33 0.53 3.38 2.61 0.00 -1.26 -4.99 105.19 105.78 2bi8 n GLY 265 Ca 0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 2bi8 n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bi8 h ALA 267 N 2.22 0.83 -3.34 0.00 0.00 -1.85 -3.37 119.26 113.76 2bi8 h ALA 267 Ca -0.33 -0.18 -0.32 0.00 0.00 0.00 0.00 54.91 54.08 2bi8 h ALA 267 Cb 1.28 -0.25 -0.36 0.00 0.00 0.00 0.00 17.79 18.46 2bi8 h ALA 267 CO 0.43 0.45 -0.70 0.08 0.00 0.00 0.00 179.25 179.51 2bi8 s VAL 268 N -5.54 -0.11 -0.17 0.00 1.01 -1.26 -0.02 120.40 114.31 2bi8 s VAL 268 Ca -0.13 0.32 0.01 0.00 0.00 0.00 0.00 61.98 62.18 2bi8 s VAL 268 Cb 0.13 -0.16 0.03 0.00 0.00 0.00 0.00 36.38 36.38 2bi8 s VAL 268 CO 0.81 0.13 -0.14 -0.32 0.00 0.00 0.00 175.10 175.57 2bi8 s MET 269 N 1.69 2.39 0.26 2.72 0.00 -0.50 -2.95 119.30 122.92 2bi8 s MET 269 Ca -0.02 -0.73 -0.25 0.00 0.00 0.00 0.00 55.69 54.70 2bi8 s MET 269 Cb -0.12 -2.33 -0.09 0.00 0.00 0.00 0.00 34.83 32.29 2bi8 s MET 269 CO -0.04 -0.29 0.86 -0.80 0.00 0.00 0.00 175.02 174.75 2bi8 s ASN 270 N 1.40 7.32 -0.34 1.11 -0.87 -0.06 -0.91 114.94 122.59 2bi8 s ASN 270 Ca 0.03 1.72 0.03 0.00 -1.57 0.00 0.00 52.86 53.06 2bi8 s ASN 270 Cb -0.14 -2.53 0.09 0.00 -0.02 0.00 0.00 41.25 38.65 2bi8 s ASN 270 CO -0.10 0.03 0.04 -0.31 -2.57 0.00 0.00 177.10 174.19 2bi8 s TYR 271 N -1.46 3.66 -0.21 2.20 1.51 -0.48 -0.02 117.35 122.54 2bi8 s TYR 271 Ca 0.45 -2.81 0.25 0.00 -1.01 0.00 0.00 57.07 53.95 2bi8 s TYR 271 Cb -0.20 -2.80 0.64 0.00 -0.11 0.00 0.00 41.96 39.50 2bi8 s TYR 271 CO 0.24 -0.94 1.71 0.00 -1.11 0.00 0.00 175.55 175.46 2bi8 s SER 273 N -6.09 6.76 0.40 0.00 0.15 -1.26 -2.55 113.70 111.10 2bi8 s SER 273 Ca 0.05 2.15 0.15 0.00 0.70 0.00 0.00 55.95 58.99 2bi8 s SER 273 Cb 0.07 -2.60 0.84 0.00 -1.71 0.00 0.00 66.02 62.62 2bi8 s SER 273 CO 0.64 -0.50 1.88 0.58 1.20 0.00 0.00 173.24 177.04 2bi8 h VAL 274 N 2.35 1.16 0.00 4.45 2.07 -1.89 -2.77 116.25 121.63 2bi8 h VAL 274 Ca -0.48 -1.09 0.00 0.00 0.82 0.00 0.00 66.70 65.95 2bi8 h VAL 274 Cb 1.22 1.60 0.00 0.00 -1.52 0.00 0.00 31.29 32.59 2bi8 h VAL 274 CO 0.63 0.30 0.00 0.47 0.02 0.00 0.00 177.57 178.99 2bi8 n ASP 275 N -4.08 0.00 -4.28 0.57 9.92 -1.26 -4.28 116.55 113.13 2bi8 n ASP 275 Ca -0.02 0.28 -0.35 0.00 -0.53 0.00 0.00 54.79 54.17 2bi8 n ASP 275 Cb 0.36 -0.36 -0.14 0.00 -0.64 0.00 0.00 41.12 40.34 2bi8 n ASP 275 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2bi8 s VAL 276 N -2.72 3.22 0.18 2.53 1.01 -1.05 -5.03 120.40 118.54 2bi8 s VAL 276 Ca 0.07 -0.57 0.10 0.00 0.00 0.00 0.00 61.98 61.58 2bi8 s VAL 276 Cb 0.06 -2.47 -0.07 0.00 0.00 0.00 0.00 36.38 33.90 2bi8 s VAL 276 CO 0.14 0.42 1.49 1.55 0.00 0.00 0.00 175.10 178.70 2bi8 h PRO 277 N 8.09 0.00 -7.00 2.72 0.13 -1.84 -3.43 132.00 130.67 2bi8 h PRO 277 Ca -0.41 0.00 -0.49 0.00 -0.87 0.00 0.00 66.00 64.22 2bi8 h PRO 277 Cb 1.15 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.31 2bi8 h PRO 277 CO 0.61 0.73 0.20 1.52 -0.23 0.00 0.00 178.00 180.82 2bi8 s TYR 278 N -3.25 3.52 -0.16 1.56 -0.85 -1.26 -4.72 117.35 112.19 2bi8 s TYR 278 Ca -0.00 1.08 0.18 0.00 -0.52 0.00 0.00 57.07 57.81 2bi8 s TYR 278 Cb 0.11 -2.50 -0.25 0.00 0.38 0.00 0.00 41.96 39.70 2bi8 s TYR 278 CO 0.78 -0.29 0.22 -2.37 -1.52 0.00 0.00 175.55 172.37 2bi8 n THR 279 N -1.83 1.27 -3.58 -3.49 5.66 0.66 -4.69 114.28 108.27 2bi8 n THR 279 Ca 0.03 -0.81 -0.05 0.00 -3.05 0.00 0.00 64.05 60.17 2bi8 n THR 279 Cb 0.54 -0.49 -0.02 0.00 -1.55 0.00 0.00 70.33 68.81 2bi8 n THR 279 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bi8 s ARG 280 N -2.63 0.47 -0.11 1.09 1.70 -1.25 -1.39 118.95 116.83 2bi8 s ARG 280 Ca -0.09 -0.18 0.04 0.00 -0.47 0.00 0.00 55.73 55.02 2bi8 s ARG 280 Cb 0.07 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.66 2bi8 s ARG 280 CO 0.84 -0.21 -0.23 0.42 -1.08 0.00 0.00 175.30 175.04 2bi8 s ILE 281 N -2.61 2.00 -0.12 4.99 1.01 -0.09 -1.46 121.20 124.91 2bi8 s ILE 281 Ca 0.09 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 59.76 2bi8 s ILE 281 Cb -0.01 -1.74 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 2bi8 s ILE 281 CO -0.05 0.55 -0.12 0.42 0.00 0.00 0.00 174.94 175.73 2bi8 s THR 282 N 0.46 3.16 -0.46 2.92 -4.23 -0.69 -1.41 115.64 115.40 2bi8 s THR 282 Ca -0.16 -0.63 -0.05 0.00 -1.18 0.00 0.00 61.69 59.66 2bi8 s THR 282 Cb -0.17 -2.32 0.12 0.00 1.34 0.00 0.00 72.50 71.47 2bi8 s THR 282 CO 0.06 0.53 0.29 -0.70 -0.54 0.00 0.00 174.62 174.27 2bi8 s GLU 283 N 0.14 2.25 0.39 3.99 2.12 0.97 -1.24 118.70 127.32 2bi8 s GLU 283 Ca -0.06 -1.87 0.08 0.00 0.36 0.00 0.00 54.97 53.47 2bi8 s GLU 283 Cb -0.15 -3.74 0.83 0.00 0.26 0.00 0.00 34.13 31.33 2bi8 s GLU 283 CO 0.05 -1.13 1.99 0.45 -0.54 0.00 0.00 175.26 176.08 2bi8 h HIS 284 N 8.11 0.63 -0.14 5.30 3.86 -1.68 -1.67 115.15 129.55 2bi8 h HIS 284 Ca -0.15 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.12 2bi8 h HIS 284 Cb 1.05 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 29.30 2bi8 h HIS 284 CO 0.61 0.35 0.18 1.57 0.86 0.00 0.00 177.93 181.49 2bi8 h LYS 285 N 0.64 0.00 0.00 2.45 2.10 -1.82 0.45 116.57 120.38 2bi8 h LYS 285 Ca 0.26 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.91 2bi8 h LYS 285 Cb 0.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 2bi8 h LYS 285 CO -0.08 0.00 0.00 0.66 -2.00 0.00 0.00 179.45 178.03 2bi8 n TYR 286 N -3.69 0.56 0.95 0.07 4.02 -0.63 -1.87 117.16 116.57 2bi8 n TYR 286 Ca 0.01 0.22 0.13 0.00 -0.01 0.00 0.00 57.90 58.25 2bi8 n TYR 286 Cb 0.29 -0.86 0.50 0.00 -0.02 0.00 0.00 39.34 39.26 2bi8 n TYR 286 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 2bi8 n PHE 287 N -2.01 0.10 -3.15 -0.72 0.99 0.15 -4.22 117.46 108.60 2bi8 n PHE 287 Ca 0.02 0.03 -0.26 0.00 -0.00 0.00 0.00 57.45 57.24 2bi8 n PHE 287 Cb 0.20 -0.48 -0.05 0.00 -1.00 0.00 0.00 39.48 38.14 2bi8 n PHE 287 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 2bi8 n SER 288 N -1.58 3.61 0.18 4.37 7.64 -0.78 -4.95 113.62 122.11 2bi8 n SER 288 Ca 0.06 -3.47 0.13 0.00 1.01 0.00 0.00 58.87 56.60 2bi8 n SER 288 Cb 0.35 -0.61 0.65 0.00 -1.01 0.00 0.00 64.21 63.59 2bi8 n SER 288 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2bi8 h PRO 289 N 3.46 0.00 -0.00 1.43 0.11 -1.73 0.24 132.00 135.51 2bi8 h PRO 289 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 2bi8 h PRO 289 Cb 0.63 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.74 2bi8 h PRO 289 CO 0.77 0.00 -0.03 -2.67 -0.21 0.00 0.00 178.00 175.87 2bi8 n TRP 290 N -2.39 0.00 -4.20 0.65 2.14 -1.26 -4.76 117.44 107.62 2bi8 n TRP 290 Ca -0.01 0.00 -0.31 0.00 2.07 0.00 0.00 57.50 59.25 2bi8 n TRP 290 Cb 0.09 -0.25 -0.09 0.00 -0.81 0.00 0.00 31.31 30.26 2bi8 n TRP 290 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 2bi8 s GLU 291 N -2.53 2.56 -0.16 -2.67 2.02 0.85 -5.13 118.70 113.63 2bi8 s GLU 291 Ca 0.29 -0.80 -0.04 0.00 0.02 0.00 0.00 54.97 54.45 2bi8 s GLU 291 Cb 0.20 -2.54 -0.03 0.00 0.10 0.00 0.00 34.13 31.87 2bi8 s GLU 291 CO 0.46 0.56 -0.04 -0.65 0.02 0.00 0.00 175.26 175.61 2bi8 s GLN 292 N -2.06 3.65 -0.06 1.61 1.11 -1.26 -4.96 119.66 117.68 2bi8 s GLN 292 Ca 0.23 -0.53 0.01 0.00 0.01 0.00 0.00 55.36 55.08 2bi8 s GLN 292 Cb -0.12 -2.92 0.02 0.00 -1.01 0.00 0.00 33.01 28.99 2bi8 s GLN 292 CO 0.15 0.22 -0.06 -1.01 0.01 0.00 0.00 175.29 174.60 2bi8 s HIS 293 N 0.42 0.97 -0.02 0.91 3.76 -1.26 -5.05 115.29 115.03 2bi8 s HIS 293 Ca -0.04 -0.33 -0.24 0.00 -0.15 0.00 0.00 55.06 54.29 2bi8 s HIS 293 Cb -0.14 -0.84 -0.18 0.00 1.11 0.00 0.00 32.58 32.53 2bi8 s HIS 293 CO 0.03 -0.27 1.17 -0.44 -0.85 0.00 0.00 174.74 174.38 2bi8 h ASP 294 N 7.43 -0.17 -3.75 1.40 3.32 -1.93 -3.44 116.42 119.27 2bi8 h ASP 294 Ca -0.33 -0.33 -0.50 0.00 0.02 0.00 0.00 57.03 55.90 2bi8 h ASP 294 Cb 1.15 0.04 0.04 0.00 0.22 0.00 0.00 39.33 40.78 2bi8 h ASP 294 CO 0.43 0.27 0.17 -0.83 -1.72 0.00 0.00 179.24 177.57 2bi8 s GLY 295 N -3.01 1.59 -0.04 2.75 0.00 -1.26 -0.98 107.32 106.38 2bi8 s GLY 295 Ca -0.14 -0.38 -0.01 0.00 0.00 0.00 0.00 44.72 44.19 2bi8 s GLY 295 CO 0.58 -0.19 0.03 -0.45 0.00 0.00 0.00 173.10 173.08 2bi8 s SER 296 N -3.98 0.74 -0.18 1.64 0.15 0.12 -4.84 113.70 107.35 2bi8 s SER 296 Ca 0.49 0.03 -0.20 0.00 0.70 0.00 0.00 55.95 56.97 2bi8 s SER 296 Cb -0.10 -0.17 -0.03 0.00 -1.71 0.00 0.00 66.02 64.01 2bi8 s SER 296 CO 0.45 -0.18 0.60 -0.69 1.20 0.00 0.00 173.24 174.62 2bi8 s VAL 297 N 1.61 5.06 0.13 4.45 1.01 -1.26 -0.48 120.40 130.92 2bi8 s VAL 297 Ca -0.02 1.15 0.09 0.00 0.00 0.00 0.00 61.98 63.20 2bi8 s VAL 297 Cb -0.13 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.29 2bi8 s VAL 297 CO -0.03 0.16 -0.22 0.00 0.00 0.00 0.00 175.10 175.01 2bi8 s TYR 299 N -1.32 2.74 0.06 0.00 4.12 -0.38 -1.74 117.35 120.82 2bi8 s TYR 299 Ca 0.11 -1.40 -0.29 0.00 0.02 0.00 0.00 57.07 55.51 2bi8 s TYR 299 Cb -0.09 -1.87 -0.05 0.00 -1.52 0.00 0.00 41.96 38.43 2bi8 s TYR 299 CO 0.06 -0.66 0.95 0.15 0.02 0.00 0.00 175.55 176.06 2bi8 s LYS 300 N 1.01 4.63 -0.13 -0.62 1.02 -0.63 -1.70 119.74 123.31 2bi8 s LYS 300 Ca -0.02 1.40 -0.01 0.00 0.02 0.00 0.00 55.97 57.36 2bi8 s LYS 300 Cb -0.15 -3.41 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 2bi8 s LYS 300 CO -0.06 0.12 -0.11 -2.00 -0.92 0.00 0.00 175.35 172.39 2bi8 s GLU 301 N 0.38 3.43 -0.10 1.68 2.12 -0.54 -0.81 118.70 124.86 2bi8 s GLU 301 Ca 0.48 -0.64 0.03 0.00 0.36 0.00 0.00 54.97 55.19 2bi8 s GLU 301 Cb -0.22 -2.69 0.01 0.00 0.26 0.00 0.00 34.13 31.49 2bi8 s GLU 301 CO 0.28 0.24 -0.18 0.71 -0.54 0.00 0.00 175.26 175.77 2bi8 s TYR 302 N 0.31 2.10 0.05 5.30 1.51 0.14 -0.25 117.35 126.51 2bi8 s TYR 302 Ca -0.09 -0.92 -0.09 0.00 -1.01 0.00 0.00 57.07 54.96 2bi8 s TYR 302 Cb -0.15 -1.47 -0.05 0.00 -0.11 0.00 0.00 41.96 40.17 2bi8 s TYR 302 CO 0.05 -0.43 0.35 0.45 -1.11 0.00 0.00 175.55 174.86 2bi8 s SER 303 N 0.71 6.59 0.04 2.29 0.15 -1.26 -0.89 113.70 121.33 2bi8 s SER 303 Ca -0.12 0.71 -0.27 0.00 0.70 0.00 0.00 55.95 56.97 2bi8 s SER 303 Cb -0.16 -2.15 0.09 0.00 -1.71 0.00 0.00 66.02 62.09 2bi8 s SER 303 CO 0.03 0.21 0.80 -0.60 1.20 0.00 0.00 173.24 174.87 2bi8 s ARG 304 N -1.80 0.96 0.27 5.44 3.52 -0.79 -4.96 118.95 121.59 2bi8 s ARG 304 Ca 0.30 -0.31 -0.30 0.00 -0.13 0.00 0.00 55.73 55.30 2bi8 s ARG 304 Cb -0.14 0.44 -0.10 0.00 -1.56 0.00 0.00 34.95 33.60 2bi8 s ARG 304 CO 0.17 -0.41 1.41 0.00 -0.81 0.00 0.00 175.30 175.65 2bi8 s ALA 305 N -3.15 3.59 -0.86 6.12 0.00 -1.26 0.53 121.76 126.74 2bi8 s ALA 305 Ca 0.03 1.31 -0.25 0.00 0.00 0.00 0.00 51.96 53.04 2bi8 s ALA 305 Cb -0.01 -3.54 0.04 0.00 0.00 0.00 0.00 23.12 19.61 2bi8 s ALA 305 CO -0.09 -0.72 1.35 0.00 0.00 0.00 0.00 175.76 176.30 2bi8 s GLU 307 N 5.42 -0.12 0.40 0.00 8.01 -1.26 -4.84 118.70 126.32 2bi8 s GLU 307 Ca 0.40 -0.11 0.08 0.00 0.01 0.00 0.00 54.97 55.34 2bi8 s GLU 307 Cb -0.05 -1.73 0.86 0.00 -4.31 0.00 0.00 34.13 28.90 2bi8 s GLU 307 CO 0.04 -2.97 2.03 0.93 0.01 0.00 0.00 175.26 175.31 2bi8 h GLU 308 N -2.05 0.56 -0.04 1.61 5.08 -2.03 -1.97 114.58 115.74 2bi8 h GLU 308 Ca -0.46 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2bi8 h GLU 308 Cb 1.28 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2bi8 h GLU 308 CO 0.41 0.37 0.00 0.09 -1.00 0.00 0.00 179.01 178.88 2bi8 n ASN 309 N -4.47 0.93 -4.88 1.42 3.02 -1.26 -4.96 115.26 105.07 2bi8 n ASN 309 Ca 0.05 -1.40 -0.32 0.00 -0.03 0.00 0.00 54.58 52.89 2bi8 n ASN 309 Cb 0.13 -0.02 -0.05 0.00 -0.61 0.00 0.00 39.78 39.23 2bi8 n ASN 309 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2bi8 s ASP 310 N -1.86 6.61 0.02 6.41 1.01 -0.74 -5.04 116.67 123.08 2bi8 s ASP 310 Ca 0.38 0.85 -0.30 0.00 0.71 0.00 0.00 52.55 54.19 2bi8 s ASP 310 Cb 0.20 -2.20 -0.07 0.00 1.01 0.00 0.00 42.92 41.86 2bi8 s ASP 310 CO 0.31 -0.01 1.66 -0.63 0.21 0.00 0.00 175.17 176.71 2bi8 s ILE 311 N -1.72 3.26 0.20 0.77 1.01 -1.26 -4.94 121.20 118.52 2bi8 s ILE 311 Ca 0.44 0.56 -0.30 0.00 0.00 0.00 0.00 60.65 61.36 2bi8 s ILE 311 Cb -0.12 -3.36 -0.08 0.00 0.01 0.00 0.00 42.46 38.91 2bi8 s ILE 311 CO 0.22 -0.02 1.13 -2.16 0.00 0.00 0.00 174.94 174.11 2bi8 s PRO 312 N 3.22 4.57 0.02 2.79 0.04 -1.26 -4.50 135.00 139.88 2bi8 s PRO 312 Ca 0.74 1.79 -0.00 0.00 0.04 0.00 0.00 61.00 63.57 2bi8 s PRO 312 Cb -0.37 -3.25 -0.00 0.00 0.04 0.00 0.00 34.50 30.92 2bi8 s PRO 312 CO 0.32 0.04 -0.00 0.66 0.04 0.00 0.00 177.00 178.06 2bi8 n TYR 313 N 2.22 0.00 -3.81 0.56 4.02 -0.94 -5.03 117.16 114.17 2bi8 n TYR 313 Ca 0.03 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.56 2bi8 n TYR 313 Cb 0.45 -0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.64 2bi8 n TYR 313 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2bi8 s TYR 314 N -1.18 3.05 0.13 -0.72 4.12 -1.03 -4.96 117.35 116.76 2bi8 s TYR 314 Ca -0.00 -0.71 -0.30 0.00 0.02 0.00 0.00 57.07 56.08 2bi8 s TYR 314 Cb 0.00 -2.19 -0.07 0.00 -1.52 0.00 0.00 41.96 38.18 2bi8 s TYR 314 CO 0.00 -0.46 1.20 -1.25 0.02 0.00 0.00 175.55 175.06 2bi8 s PRO 315 N 1.54 4.47 -0.03 -1.71 0.04 -1.26 0.11 135.00 138.16 2bi8 s PRO 315 Ca 0.06 1.84 -0.23 0.00 0.04 0.00 0.00 61.00 62.70 2bi8 s PRO 315 Cb -0.15 -3.28 -0.17 0.00 0.04 0.00 0.00 34.50 30.93 2bi8 s PRO 315 CO 0.01 -0.16 1.04 0.82 0.04 0.00 0.00 177.00 178.75 2bi8 h ILE 316 N 4.06 0.95 -1.88 0.56 2.04 -1.44 -3.47 117.51 118.33 2bi8 h ILE 316 Ca -0.43 -1.03 -0.29 0.00 1.00 0.00 0.00 64.86 64.10 2bi8 h ILE 316 Cb 1.21 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 38.80 2bi8 h ILE 316 CO 0.78 0.22 -0.36 0.54 0.00 0.00 0.00 178.15 179.33 2bi8 n ARG 317 N -4.95 -1.15 -0.29 2.37 1.74 -1.26 -5.03 116.66 108.10 2bi8 n ARG 317 Ca -0.08 0.75 0.00 0.00 -0.77 0.00 0.00 57.85 57.75 2bi8 n ARG 317 Cb 0.27 -5.04 0.00 0.00 -1.02 0.00 0.00 32.46 26.67 2bi8 n ARG 317 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2bi8 n GLN 318 N -2.43 0.85 0.01 5.56 1.13 -1.26 -4.69 117.38 116.55 2bi8 n GLN 318 Ca -0.17 0.00 -0.12 0.00 -1.94 0.00 0.00 57.00 54.78 2bi8 n GLN 318 Cb 0.61 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.91 2bi8 n GLN 318 CO 0.00 0.00 0.00 0.52 -1.44 0.00 0.00 177.06 176.14 2bi8 h MET 319 N 0.00 -0.44 0.00 -1.09 2.86 -1.99 -1.81 114.93 112.46 2bi8 h MET 319 Ca 0.00 0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.62 2bi8 h MET 319 Cb 0.00 0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 2bi8 h MET 319 CO 0.00 -0.29 -0.26 0.78 1.06 0.00 0.00 176.91 178.20 2bi8 h GLY 320 N -0.46 0.00 0.63 8.32 0.00 -1.99 -0.39 103.07 109.19 2bi8 h GLY 320 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2bi8 h GLY 320 CO -0.36 0.00 -0.14 0.83 0.00 0.00 0.00 176.54 176.87 2bi8 h GLU 321 N 0.00 -0.37 -0.86 4.80 3.07 -1.82 -2.25 114.58 117.15 2bi8 h GLU 321 Ca -0.00 0.03 0.12 0.00 -0.50 0.00 0.00 59.36 59.01 2bi8 h GLU 321 Cb 0.47 0.08 -0.06 0.00 -0.84 0.00 0.00 28.75 28.40 2bi8 h GLU 321 CO 0.03 -0.04 0.56 0.52 -1.40 0.00 0.00 179.01 178.68 2bi8 h MET 322 N -0.76 0.71 -0.35 2.33 2.86 -1.13 0.34 114.93 118.93 2bi8 h MET 322 Ca -0.04 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2bi8 h MET 322 Cb 0.50 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2bi8 h MET 322 CO 0.06 0.47 0.20 0.00 1.06 0.00 0.00 176.91 178.71 2bi8 h ALA 323 N 1.59 0.43 -0.07 6.32 0.00 -1.06 -1.70 119.26 124.78 2bi8 h ALA 323 Ca 0.42 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.19 2bi8 h ALA 323 Cb 0.60 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2bi8 h ALA 323 CO -0.18 -0.15 -0.55 1.25 0.00 0.00 0.00 179.25 179.62 2bi8 h LEU 324 N 0.42 0.21 -0.28 0.00 5.85 -0.44 -3.10 115.31 117.97 2bi8 h LEU 324 Ca 0.14 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2bi8 h LEU 324 Cb -0.00 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 2bi8 h LEU 324 CO -0.06 0.72 0.18 0.25 -0.34 0.00 0.00 178.44 179.19 2bi8 h LEU 325 N 0.15 0.33 -1.98 2.25 5.85 -0.22 -3.00 115.31 118.68 2bi8 h LEU 325 Ca 0.00 -0.03 0.21 0.00 0.84 0.00 0.00 57.88 58.91 2bi8 h LEU 325 Cb 1.01 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 2bi8 h LEU 325 CO 0.08 0.26 0.57 -0.08 -0.34 0.00 0.00 178.44 178.92 2bi8 h GLU 326 N 0.37 0.00 -0.20 1.25 4.57 -1.23 0.18 114.58 119.52 2bi8 h GLU 326 Ca 0.10 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.22 2bi8 h GLU 326 Cb -0.02 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 2bi8 h GLU 326 CO -0.02 0.00 -0.11 0.87 -1.18 0.00 0.00 179.01 178.57 2bi8 h LYS 327 N 0.00 0.42 -0.05 1.92 1.57 -1.59 -2.45 116.57 116.40 2bi8 h LYS 327 Ca 0.35 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 2bi8 h LYS 327 Cb 1.48 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.78 2bi8 h LYS 327 CO -0.00 0.73 -0.00 1.88 -0.57 0.00 0.00 179.45 181.48 2bi8 h TYR 328 N 0.11 0.09 -1.01 -1.35 -1.99 -0.93 -2.90 116.97 108.99 2bi8 h TYR 328 Ca 0.04 -0.02 0.25 0.00 2.00 0.00 0.00 58.73 61.00 2bi8 h TYR 328 Cb 0.61 -0.02 -0.12 0.00 2.00 0.00 0.00 36.73 39.19 2bi8 h TYR 328 CO 0.07 0.39 0.60 -0.07 -0.00 0.00 0.00 178.16 179.15 2bi8 h LEU 329 N -0.23 0.65 0.00 3.88 3.38 -0.83 0.33 115.31 122.48 2bi8 h LEU 329 Ca 0.01 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2bi8 h LEU 329 Cb 0.36 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2bi8 h LEU 329 CO 0.00 0.10 -0.29 0.77 0.09 0.00 0.00 178.44 179.11 2bi8 h SER 330 N 0.56 0.00 -0.02 -0.43 4.64 -1.40 -0.97 113.55 115.93 2bi8 h SER 330 Ca 0.64 -0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.84 2bi8 h SER 330 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2bi8 h SER 330 CO -0.46 0.04 -0.15 -0.07 -0.87 0.00 0.00 176.83 175.31 2bi8 h LEU 331 N 0.00 0.16 -0.52 5.97 3.38 -0.88 -3.35 115.31 120.06 2bi8 h LEU 331 Ca 0.00 -0.71 -0.04 0.00 0.09 0.00 0.00 57.88 57.22 2bi8 h LEU 331 Cb 0.79 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2bi8 h LEU 331 CO 0.00 0.85 0.19 0.00 0.09 0.00 0.00 178.44 179.57 2bi8 h ALA 332 N 0.31 0.68 0.00 1.53 0.00 -0.36 -2.52 119.26 118.90 2bi8 h ALA 332 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2bi8 h ALA 332 Cb 0.86 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2bi8 h ALA 332 CO 0.03 0.32 0.00 0.39 0.00 0.00 0.00 179.25 179.99 2bi8 n GLU 333 N -4.50 0.04 0.00 0.00 1.02 -0.38 -0.38 120.64 116.44 2bi8 n GLU 333 Ca 0.02 0.31 0.13 0.00 -0.02 0.00 0.00 57.16 57.60 2bi8 n GLU 333 Cb 0.18 -1.50 0.42 0.00 -0.02 0.00 0.00 31.44 30.51 2bi8 n GLU 333 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2bi8 n ASN 334 N -1.44 0.70 -4.82 1.62 4.13 -0.95 -4.97 115.26 109.53 2bi8 n ASN 334 Ca 0.03 -0.58 -0.33 0.00 1.68 0.00 0.00 54.58 55.38 2bi8 n ASN 334 Cb 0.09 0.07 -0.07 0.00 -1.54 0.00 0.00 39.78 38.34 2bi8 n ASN 334 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2bi8 s GLU 335 N -2.64 4.20 -0.23 3.52 2.56 0.49 -5.03 118.70 121.56 2bi8 s GLU 335 Ca 0.22 1.04 0.03 0.00 0.00 0.00 0.00 54.97 56.26 2bi8 s GLU 335 Cb 0.19 -2.24 -0.16 0.00 2.00 0.00 0.00 34.13 33.92 2bi8 s GLU 335 CO 0.55 0.01 -0.18 2.41 -0.56 0.00 0.00 175.26 177.50 2bi8 n THR 336 N -0.56 1.32 -2.45 -1.70 -1.04 -1.26 -4.75 114.28 103.84 2bi8 n THR 336 Ca 0.06 -0.54 -0.18 0.00 -2.04 0.00 0.00 64.05 61.36 2bi8 n THR 336 Cb 0.54 -1.23 0.02 0.00 -1.82 0.00 0.00 70.33 67.83 2bi8 n THR 336 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2bi8 n ASN 337 N -3.12 3.56 -3.86 8.00 3.02 -1.26 -4.90 115.26 116.70 2bi8 n ASN 337 Ca -0.40 -3.24 -0.11 0.00 -0.03 0.00 0.00 54.58 50.80 2bi8 n ASN 337 Cb 0.95 -0.45 -0.10 0.00 -0.61 0.00 0.00 39.78 39.58 2bi8 n ASN 337 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 2bi8 s ILE 338 N -4.49 0.08 -0.07 2.41 2.07 -1.26 -1.14 121.20 118.79 2bi8 s ILE 338 Ca 0.41 -0.66 -0.01 0.00 -1.41 0.00 0.00 60.65 58.98 2bi8 s ILE 338 Cb 0.40 -0.45 0.03 0.00 0.13 0.00 0.00 42.46 42.56 2bi8 s ILE 338 CO -0.06 -0.36 -0.02 -0.89 -1.91 0.00 0.00 174.94 171.70 2bi8 s THR 339 N -1.38 0.49 -0.13 4.00 2.01 0.32 -4.19 115.64 116.76 2bi8 s THR 339 Ca -0.15 0.03 -0.22 0.00 0.31 0.00 0.00 61.69 61.66 2bi8 s THR 339 Cb -0.07 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 2bi8 s THR 339 CO 0.02 0.27 0.66 -0.36 -0.69 0.00 0.00 174.62 174.52 2bi8 s PHE 340 N 1.74 3.48 0.26 4.92 0.40 -0.74 -0.63 117.98 127.41 2bi8 s PHE 340 Ca 0.02 1.08 0.04 0.00 -0.60 0.00 0.00 56.93 57.47 2bi8 s PHE 340 Cb -0.13 -2.79 -0.06 0.00 0.51 0.00 0.00 43.02 40.56 2bi8 s PHE 340 CO -0.05 -0.04 0.01 0.14 0.70 0.00 0.00 175.22 175.99 2bi8 s VAL 341 N 1.34 1.14 0.00 -0.44 -7.23 -0.17 -4.71 120.40 110.33 2bi8 s VAL 341 Ca 0.33 -2.04 0.00 0.00 -1.81 0.00 0.00 61.98 58.46 2bi8 s VAL 341 Cb -0.17 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.30 2bi8 s VAL 341 CO 0.13 -0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 2bi8 n GLY 342 N -0.51 -0.69 0.37 2.32 0.00 -1.26 -2.68 105.19 102.74 2bi8 n GLY 342 Ca -0.04 -1.72 0.13 0.00 0.00 0.00 0.00 46.02 44.39 2bi8 n GLY 342 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2bi8 h ARG 343 N 0.00 0.59 0.08 1.61 0.11 -1.89 -2.49 114.38 112.39 2bi8 h ARG 343 Ca 0.00 -0.04 -0.36 0.00 0.10 0.00 0.00 59.98 59.68 2bi8 h ARG 343 Cb 0.00 -0.13 -0.04 0.00 1.11 0.00 0.00 29.97 30.91 2bi8 h ARG 343 CO 0.00 0.39 -2.09 1.28 0.10 0.00 0.00 179.97 179.65 2bi8 n LEU 344 N -4.53 2.40 0.01 0.08 4.77 -1.26 -2.01 117.00 116.46 2bi8 n LEU 344 Ca 0.16 0.14 0.06 0.00 -0.03 0.00 0.00 56.01 56.34 2bi8 n LEU 344 Cb 0.47 -0.85 0.27 0.00 -2.33 0.00 0.00 43.42 40.98 2bi8 n LEU 344 CO 0.31 0.81 0.70 0.61 -1.33 0.00 0.00 177.39 178.48 2bi8 n GLY 345 N 2.00 -0.93 0.00 -0.72 0.00 -1.07 -2.20 105.19 102.27 2bi8 n GLY 345 Ca -0.33 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2bi8 n GLY 345 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bi8 n THR 346 N -1.56 0.00 -3.39 2.61 -2.24 -0.95 -4.48 114.28 104.28 2bi8 n THR 346 Ca 0.03 -0.15 -0.19 0.00 -2.27 0.00 0.00 64.05 61.47 2bi8 n THR 346 Cb 0.14 1.42 0.08 0.00 -2.10 0.00 0.00 70.33 69.86 2bi8 n THR 346 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bi8 n TYR 347 N -0.12 -2.30 -4.26 4.78 9.36 -0.85 -4.96 117.16 118.81 2bi8 n TYR 347 Ca 0.00 0.88 -0.18 0.00 3.32 0.00 0.00 57.90 61.92 2bi8 n TYR 347 Cb 0.10 -4.67 -0.11 0.00 -0.63 0.00 0.00 39.34 34.04 2bi8 n TYR 347 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2bi8 s ARG 348 N -5.74 1.07 -0.15 2.98 0.52 -0.93 -4.96 118.95 111.74 2bi8 s ARG 348 Ca 0.29 -1.32 -0.23 0.00 -0.52 0.00 0.00 55.73 53.95 2bi8 s ARG 348 Cb -0.13 -0.90 -0.02 0.00 0.52 0.00 0.00 34.95 34.42 2bi8 s ARG 348 CO 0.65 0.16 0.72 -0.47 0.02 0.00 0.00 175.30 176.38 2bi8 s TYR 349 N -2.41 3.45 -0.03 -0.53 5.04 -1.26 -4.46 117.35 117.15 2bi8 s TYR 349 Ca 0.12 1.14 0.04 0.00 -2.44 0.00 0.00 57.07 55.93 2bi8 s TYR 349 Cb -0.03 -2.88 -0.00 0.00 0.35 0.00 0.00 41.96 39.40 2bi8 s TYR 349 CO 0.03 -0.12 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.47 2bi8 s LEU 350 N 1.65 1.91 0.84 6.97 1.43 -1.26 -5.06 118.68 125.17 2bi8 s LEU 350 Ca 0.35 -0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 53.04 2bi8 s LEU 350 Cb -0.17 -0.83 0.10 0.00 0.03 0.00 0.00 46.19 45.32 2bi8 s LEU 350 CO 0.13 0.14 1.10 -1.81 0.23 0.00 0.00 176.35 176.15 2bi8 s ASP 351 N -0.03 4.05 0.17 2.29 1.01 -1.26 -4.83 116.67 118.07 2bi8 s ASP 351 Ca -0.01 1.29 -0.14 0.00 0.71 0.00 0.00 52.55 54.40 2bi8 s ASP 351 Cb -0.09 -1.99 0.10 0.00 1.01 0.00 0.00 42.92 41.95 2bi8 s ASP 351 CO 0.01 -2.25 1.77 0.24 0.21 0.00 0.00 175.17 175.16 2bi8 h MET 352 N -1.28 0.41 -0.35 8.23 2.86 -1.92 0.15 114.93 123.03 2bi8 h MET 352 Ca -0.48 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.01 2bi8 h MET 352 Cb 1.28 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 2bi8 h MET 352 CO 0.59 0.27 -0.28 0.38 1.06 0.00 0.00 176.91 178.92 2bi8 h ASP 353 N 0.42 0.75 -0.03 1.22 2.03 -1.94 -1.30 116.42 117.56 2bi8 h ASP 353 Ca 0.19 -0.29 -0.15 0.00 -0.73 0.00 0.00 57.03 56.05 2bi8 h ASP 353 Cb 0.12 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.41 2bi8 h ASP 353 CO -0.15 0.99 -0.50 0.58 -1.03 0.00 0.00 179.24 179.13 2bi8 h VAL 354 N 0.62 1.31 0.19 4.15 2.07 -1.85 -1.54 116.25 121.19 2bi8 h VAL 354 Ca 0.08 -1.71 0.01 0.00 0.82 0.00 0.00 66.70 65.89 2bi8 h VAL 354 Cb 0.80 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.21 2bi8 h VAL 354 CO 0.07 0.54 -0.28 0.74 0.02 0.00 0.00 177.57 178.65 2bi8 h THR 355 N 0.47 0.39 -0.58 2.57 2.02 -0.32 -1.44 112.91 116.02 2bi8 h THR 355 Ca 0.02 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.22 2bi8 h THR 355 Cb 1.03 0.39 -0.03 0.00 -1.74 0.00 0.00 68.15 67.80 2bi8 h THR 355 CO 0.10 0.00 0.37 0.40 0.37 0.00 0.00 175.52 176.75 2bi8 h ILE 356 N -0.54 1.10 -0.04 3.11 2.04 -1.19 -0.21 117.51 121.79 2bi8 h ILE 356 Ca 0.01 -0.25 0.03 0.00 1.00 0.00 0.00 64.86 65.66 2bi8 h ILE 356 Cb 0.53 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 36.86 2bi8 h ILE 356 CO -0.12 0.13 -0.39 0.00 0.00 0.00 0.00 178.15 177.78 2bi8 h ALA 357 N 1.24 -0.58 0.00 1.87 0.00 -1.20 0.11 119.26 120.69 2bi8 h ALA 357 Ca 0.22 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2bi8 h ALA 357 Cb -0.03 0.70 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2bi8 h ALA 357 CO -0.08 -0.91 -0.18 0.93 0.00 0.00 0.00 179.25 179.02 2bi8 h GLU 358 N -0.52 0.00 -0.06 0.00 5.08 -0.94 -2.02 114.58 116.12 2bi8 h GLU 358 Ca 0.06 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.21 2bi8 h GLU 358 Cb 0.62 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2bi8 h GLU 358 CO -0.32 0.18 -0.82 0.00 -1.00 0.00 0.00 179.01 177.05 2bi8 h ALA 359 N 1.82 0.46 -0.39 3.43 0.00 -0.26 0.67 119.26 124.98 2bi8 h ALA 359 Ca -0.00 -0.64 -0.11 0.00 0.00 0.00 0.00 54.91 54.15 2bi8 h ALA 359 Cb 0.32 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2bi8 h ALA 359 CO 0.02 0.77 -0.19 -0.07 0.00 0.00 0.00 179.25 179.78 2bi8 h LEU 360 N 0.30 0.85 -0.25 0.00 3.38 -0.46 -2.53 115.31 116.60 2bi8 h LEU 360 Ca -0.05 -0.40 -0.05 0.00 0.09 0.00 0.00 57.88 57.46 2bi8 h LEU 360 Cb 1.43 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 2bi8 h LEU 360 CO 0.15 1.07 -0.04 0.50 0.09 0.00 0.00 178.44 180.20 2bi8 h LYS 361 N 0.63 0.47 -0.58 1.13 3.64 -1.29 -1.50 116.57 119.07 2bi8 h LYS 361 Ca 0.09 -0.17 0.09 0.00 -1.27 0.00 0.00 60.65 59.39 2bi8 h LYS 361 Cb 0.75 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.46 2bi8 h LYS 361 CO 0.06 0.68 0.19 1.15 -2.27 0.00 0.00 179.45 179.25 2bi8 h THR 362 N 0.22 0.75 -0.45 1.00 2.02 -0.82 0.28 112.91 115.90 2bi8 h THR 362 Ca 0.06 -0.12 -0.11 0.00 0.77 0.00 0.00 66.41 67.01 2bi8 h THR 362 Cb 0.50 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 2bi8 h THR 362 CO 0.02 0.06 -0.17 0.00 0.37 0.00 0.00 175.52 175.80 2bi8 h ALA 363 N 1.41 0.84 -0.42 6.16 0.00 -1.34 -0.82 119.26 125.09 2bi8 h ALA 363 Ca 0.29 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2bi8 h ALA 363 Cb 0.37 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 2bi8 h ALA 363 CO -0.32 0.65 0.20 1.49 0.00 0.00 0.00 179.25 181.27 2bi8 h GLU 364 N 0.78 0.60 -0.33 0.00 4.81 -0.18 0.80 114.58 121.06 2bi8 h GLU 364 Ca 0.11 -0.09 0.01 0.00 -0.13 0.00 0.00 59.36 59.26 2bi8 h GLU 364 Cb 0.71 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 2bi8 h GLU 364 CO 0.05 0.52 0.21 0.28 -0.73 0.00 0.00 179.01 179.34 2bi8 h VAL 365 N 0.53 1.07 -0.28 0.32 2.07 -0.32 -1.00 116.25 118.64 2bi8 h VAL 365 Ca 0.14 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2bi8 h VAL 365 Cb 0.12 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.48 2bi8 h VAL 365 CO -0.02 0.08 0.12 0.22 0.02 0.00 0.00 177.57 177.99 2bi8 h TYR 366 N 0.42 0.41 0.11 1.57 3.20 -0.77 -1.19 116.97 120.72 2bi8 h TYR 366 Ca 0.12 -0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.97 2bi8 h TYR 366 Cb -0.03 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.10 2bi8 h TYR 366 CO -0.06 0.40 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.66 2bi8 h LEU 367 N 0.30 -0.34 -0.69 2.82 3.38 -0.79 -2.29 115.31 117.71 2bi8 h LEU 367 Ca 0.09 0.04 0.15 0.00 0.09 0.00 0.00 57.88 58.25 2bi8 h LEU 367 Cb 0.15 0.12 -0.11 0.00 0.09 0.00 0.00 40.66 40.92 2bi8 h LEU 367 CO -0.01 -0.19 0.09 -1.13 0.09 0.00 0.00 178.44 177.29 2bi8 h ASN 368 N -0.27 -0.14 -0.05 -0.43 -1.24 -1.08 0.25 115.58 112.61 2bi8 h ASN 368 Ca 0.01 0.15 0.02 0.00 0.71 0.00 0.00 56.30 57.19 2bi8 h ASN 368 Cb 0.27 0.24 -0.00 0.00 0.73 0.00 0.00 38.32 39.56 2bi8 h ASN 368 CO -0.05 -0.08 0.15 0.77 -1.29 0.00 0.00 177.43 176.92 2bi8 h SER 369 N 0.19 0.00 0.02 1.15 4.64 -0.63 -0.42 113.55 118.50 2bi8 h SER 369 Ca 0.37 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.62 2bi8 h SER 369 Cb 0.63 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 2bi8 h SER 369 CO -0.53 0.00 -0.41 -0.07 -0.87 0.00 0.00 176.83 174.95 2bi8 h LEU 370 N 0.00 0.06 -0.51 5.97 3.38 -0.74 0.47 115.31 123.94 2bi8 h LEU 370 Ca 0.03 -0.89 -0.01 0.00 0.09 0.00 0.00 57.88 57.10 2bi8 h LEU 370 Cb 0.32 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2bi8 h LEU 370 CO -0.00 1.17 0.28 0.71 0.09 0.00 0.00 178.44 180.69 2bi8 h THR 371 N -0.90 1.17 -0.28 0.22 1.35 -1.18 -2.12 112.91 111.17 2bi8 h THR 371 Ca -0.10 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 2bi8 h THR 371 Cb 1.16 0.53 0.00 0.00 -1.73 0.00 0.00 68.15 68.11 2bi8 h THR 371 CO -0.03 0.18 0.00 -0.62 -0.25 0.00 0.00 175.52 174.80 2bi8 n GLU 372 N -4.66 2.56 -1.78 4.72 4.71 -0.21 -4.96 120.64 121.01 2bi8 n GLU 372 Ca 0.02 -1.40 -0.02 0.00 -0.01 0.00 0.00 57.16 55.75 2bi8 n GLU 372 Cb 0.08 -1.72 0.00 0.00 -1.01 0.00 0.00 31.44 28.79 2bi8 n GLU 372 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2bi8 n ASN 373 N 0.34 -0.38 -4.11 1.62 4.05 -0.80 -4.98 115.26 111.00 2bi8 n ASN 373 Ca 0.12 -0.04 -0.11 0.00 0.45 0.00 0.00 54.58 55.01 2bi8 n ASN 373 Cb 0.59 -0.12 -0.11 0.00 1.23 0.00 0.00 39.78 41.38 2bi8 n ASN 373 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 2bi8 s GLN 374 N -1.05 0.67 0.29 1.20 -0.21 0.16 -5.01 119.66 115.71 2bi8 s GLN 374 Ca 0.02 -1.08 -0.29 0.00 0.02 0.00 0.00 55.36 54.02 2bi8 s GLN 374 Cb -0.00 -0.16 -0.10 0.00 1.00 0.00 0.00 33.01 33.75 2bi8 s GLN 374 CO 0.07 -0.01 1.30 -2.14 -2.12 0.00 0.00 175.29 172.39 2bi8 s PRO 375 N -2.95 4.38 -0.30 2.91 0.02 -1.26 -4.61 135.00 133.20 2bi8 s PRO 375 Ca 0.02 2.14 -0.25 0.00 0.02 0.00 0.00 61.00 62.93 2bi8 s PRO 375 Cb -0.00 -3.12 0.01 0.00 0.02 0.00 0.00 34.50 31.40 2bi8 s PRO 375 CO -0.03 -0.19 0.88 1.41 -0.33 0.00 0.00 177.00 178.74 2bi8 s MET 376 N -1.19 4.01 0.78 5.54 1.75 -1.26 -4.97 119.30 123.95 2bi8 s MET 376 Ca 0.51 0.77 -0.15 0.00 -1.25 0.00 0.00 55.69 55.58 2bi8 s MET 376 Cb -0.38 -3.72 0.03 0.00 2.84 0.00 0.00 34.83 33.60 2bi8 s MET 376 CO 0.47 -0.73 0.93 -0.35 -0.65 0.00 0.00 175.02 174.69 2bi8 n PRO 377 N 6.39 0.26 0.09 4.11 -0.04 -1.26 -4.83 135.00 139.72 2bi8 n PRO 377 Ca 0.07 0.15 -0.05 0.00 -0.04 0.00 0.00 63.50 63.63 2bi8 n PRO 377 Cb 0.48 -2.21 -0.03 0.00 -0.04 0.00 0.00 33.50 31.70 2bi8 n PRO 377 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2bi8 h VAL 378 N -0.67 1.57 -3.66 0.52 2.07 -1.90 -3.42 116.25 110.75 2bi8 h VAL 378 Ca -0.46 -3.00 -0.50 0.00 0.82 0.00 0.00 66.70 63.56 2bi8 h VAL 378 Cb 1.32 2.64 -0.32 0.00 -1.52 0.00 0.00 31.29 33.40 2bi8 h VAL 378 CO 0.44 0.84 -0.81 -0.36 0.02 0.00 0.00 177.57 177.71 2bi8 s PHE 379 N -2.95 1.37 -2.39 1.57 0.40 -1.26 -1.79 117.98 112.93 2bi8 s PHE 379 Ca 0.01 -0.43 0.22 0.00 -0.60 0.00 0.00 56.93 56.12 2bi8 s PHE 379 Cb 0.10 -0.97 0.09 0.00 0.51 0.00 0.00 43.02 42.75 2bi8 s PHE 379 CO 0.80 -0.19 1.13 0.25 0.70 0.00 0.00 175.22 177.90 2bi8 n THR 380 N 3.49 0.00 -4.04 0.64 -2.24 -1.26 -4.92 114.28 105.95 2bi8 n THR 380 Ca -0.20 -0.40 -0.10 0.00 -2.27 0.00 0.00 64.05 61.07 2bi8 n THR 380 Cb 0.53 1.37 -0.11 0.00 -2.10 0.00 0.00 70.33 70.01 2bi8 n THR 380 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2bi8 s VAL 381 N -2.06 0.34 0.18 2.28 0.11 -1.26 -4.99 120.40 115.00 2bi8 s VAL 381 Ca 0.22 -1.16 -0.30 0.00 -2.93 0.00 0.00 61.98 57.81 2bi8 s VAL 381 Cb 0.18 -0.66 -0.08 0.00 -1.53 0.00 0.00 36.38 34.29 2bi8 s VAL 381 CO 0.39 -0.54 0.94 -0.94 -3.33 0.00 0.00 175.10 171.62 2bi8 s SER 382 N -1.81 7.58 -0.09 3.54 1.04 -1.26 -4.96 113.70 117.74 2bi8 s SER 382 Ca -0.09 1.88 0.07 0.00 0.48 0.00 0.00 55.95 58.29 2bi8 s SER 382 Cb -0.07 -2.60 -0.11 0.00 0.10 0.00 0.00 66.02 63.35 2bi8 s SER 382 CO -0.02 0.07 0.02 0.52 0.98 0.00 0.00 173.24 174.81 2bi8 n VAL 383 N 2.03 0.64 0.77 5.02 0.31 -1.26 -5.16 118.33 120.68 2bi8 n VAL 383 Ca -0.00 -0.38 0.06 0.00 -0.01 0.00 0.00 64.34 64.01 2bi8 n VAL 383 Cb 0.48 -0.77 0.37 0.00 -0.91 0.00 0.00 33.84 33.00 2bi8 n VAL 383 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05