#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b06 s SER 2 N 0.00 6.27 0.55 6.12 1.04 -1.26 -4.95 113.70 121.47 2b06 s SER 2 Ca 0.00 1.57 0.29 0.00 0.48 0.00 0.00 55.95 58.29 2b06 s SER 2 Cb 0.00 -2.50 1.61 0.00 0.10 0.00 0.00 66.02 65.23 2b06 s SER 2 CO 0.00 -0.83 2.14 0.08 0.98 0.00 0.00 173.24 175.61 2b06 h ARG 3 N 0.36 0.00 -0.00 4.02 0.11 -2.00 -1.78 114.38 115.09 2b06 h ARG 3 Ca -0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.62 2b06 h ARG 3 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 2b06 h ARG 3 CO 0.61 0.07 -0.00 -1.13 0.10 0.00 0.00 179.97 179.62 2b06 n SER 4 N -3.67 0.03 0.00 0.08 3.41 -1.26 -2.81 113.62 109.40 2b06 n SER 4 Ca -0.02 -0.78 0.10 0.00 -0.26 0.00 0.00 58.87 57.91 2b06 n SER 4 Cb 0.18 -0.07 -0.08 0.00 -0.26 0.00 0.00 64.21 63.98 2b06 n SER 4 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b06 n GLN 5 N -1.06 0.13 -2.77 4.33 6.02 -0.67 -1.18 117.38 122.18 2b06 n GLN 5 Ca 0.21 -0.03 -0.33 0.00 -0.01 0.00 0.00 57.00 56.85 2b06 n GLN 5 Cb 0.15 -1.51 -0.06 0.00 1.02 0.00 0.00 30.24 29.84 2b06 n GLN 5 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2b06 s LEU 6 N -3.32 3.88 -0.31 1.08 1.43 -1.12 -3.76 118.68 116.56 2b06 s LEU 6 Ca 0.06 1.57 -0.11 0.00 -1.03 0.00 0.00 54.13 54.61 2b06 s LEU 6 Cb 0.16 -4.43 -0.02 0.00 0.03 0.00 0.00 46.19 41.92 2b06 s LEU 6 CO 0.85 -0.39 0.19 -0.89 0.23 0.00 0.00 176.35 176.34 2b06 s THR 7 N -2.27 4.99 -0.21 5.49 2.01 -1.26 -1.30 115.64 123.09 2b06 s THR 7 Ca 0.59 -0.20 -0.07 0.00 0.31 0.00 0.00 61.69 62.33 2b06 s THR 7 Cb -0.09 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 2b06 s THR 7 CO 0.19 0.10 0.07 -0.63 -0.69 0.00 0.00 174.62 173.65 2b06 s ILE 8 N 1.69 4.57 -0.26 1.82 -1.09 -0.19 -4.96 121.20 122.77 2b06 s ILE 8 Ca 0.06 -0.10 -0.06 0.00 -2.23 0.00 0.00 60.65 58.32 2b06 s ILE 8 Cb -0.17 -3.09 -0.01 0.00 -1.58 0.00 0.00 42.46 37.61 2b06 s ILE 8 CO 0.09 0.40 0.05 -0.76 -1.23 0.00 0.00 174.94 173.48 2b06 s LEU 9 N 0.93 3.46 0.24 2.97 1.43 -1.26 -0.74 118.68 125.70 2b06 s LEU 9 Ca 0.04 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 2b06 s LEU 9 Cb -0.14 -1.86 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 2b06 s LEU 9 CO 0.03 -0.09 0.11 0.42 0.23 0.00 0.00 176.35 177.05 2b06 s THR 10 N 1.54 0.33 0.10 5.49 -4.23 -0.13 -1.09 115.64 117.66 2b06 s THR 10 Ca 0.05 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 2b06 s THR 10 Cb -0.16 -2.58 -0.04 0.00 1.34 0.00 0.00 72.50 71.06 2b06 s THR 10 CO 0.01 0.00 -0.03 0.54 -0.54 0.00 0.00 174.62 174.61 2b06 s ASN 11 N -3.25 0.87 0.06 3.99 2.20 0.57 -0.43 114.94 118.94 2b06 s ASN 11 Ca 0.38 -1.06 -0.00 0.00 -0.94 0.00 0.00 52.86 51.24 2b06 s ASN 11 Cb 0.07 0.15 -0.04 0.00 -2.00 0.00 0.00 41.25 39.44 2b06 s ASN 11 CO 0.13 -0.56 -0.04 0.27 -2.94 0.00 0.00 177.10 173.96 2b06 s ILE 12 N -3.77 0.36 -0.03 0.54 -4.36 -0.49 -2.08 121.20 111.38 2b06 s ILE 12 Ca 0.14 -1.81 0.01 0.00 -0.26 0.00 0.00 60.65 58.73 2b06 s ILE 12 Cb 0.06 -1.52 0.02 0.00 1.25 0.00 0.00 42.46 42.28 2b06 s ILE 12 CO -0.04 -0.94 -0.01 0.00 0.24 0.00 0.00 174.94 174.20 2b06 s LEU 14 N 0.86 4.18 -0.38 0.00 0.20 0.04 -4.14 118.68 119.43 2b06 s LEU 14 Ca -0.09 -0.15 -0.13 0.00 0.69 0.00 0.00 54.13 54.45 2b06 s LEU 14 Cb -0.12 -2.96 0.01 0.00 -0.43 0.00 0.00 46.19 42.69 2b06 s LEU 14 CO -0.01 -1.03 0.26 -0.63 -0.29 0.00 0.00 176.35 174.65 2b06 s ILE 15 N 3.55 5.08 -0.18 6.68 1.01 -1.26 -0.95 121.20 135.13 2b06 s ILE 15 Ca 0.31 -0.61 -0.01 0.00 0.00 0.00 0.00 60.65 60.34 2b06 s ILE 15 Cb -0.12 -3.78 -0.00 0.00 0.01 0.00 0.00 42.46 38.57 2b06 s ILE 15 CO 0.22 -0.22 -0.12 -0.70 0.00 0.00 0.00 174.94 174.12 2b06 s GLU 16 N 1.66 3.25 -0.54 2.79 2.12 -0.36 -1.80 118.70 125.82 2b06 s GLU 16 Ca 0.05 -0.71 -0.23 0.00 0.36 0.00 0.00 54.97 54.44 2b06 s GLU 16 Cb -0.19 -2.74 0.05 0.00 0.26 0.00 0.00 34.13 31.51 2b06 s GLU 16 CO 0.09 -0.06 0.85 0.34 -0.54 0.00 0.00 175.26 175.94 2b06 s ASP 17 N 1.03 6.30 0.56 -1.70 -1.08 0.02 -4.30 116.67 117.49 2b06 s ASP 17 Ca -0.01 -0.55 0.34 0.00 -0.52 0.00 0.00 52.55 51.81 2b06 s ASP 17 Cb -0.15 -2.39 1.56 0.00 -1.46 0.00 0.00 42.92 40.48 2b06 s ASP 17 CO -0.03 -1.13 2.06 -0.07 0.52 0.00 0.00 175.17 176.53 2b06 h LEU 18 N 10.60 0.00 -0.44 -1.34 3.38 -1.86 0.25 115.31 125.90 2b06 h LEU 18 Ca -0.27 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.53 2b06 h LEU 18 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2b06 h LEU 18 CO 1.05 0.05 -0.72 -0.33 0.09 0.00 0.00 178.44 178.58 2b06 h GLU 19 N 0.00 0.36 0.00 1.13 5.08 -1.96 -3.35 114.58 115.84 2b06 h GLU 19 Ca -0.00 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 2b06 h GLU 19 Cb 0.40 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2b06 h GLU 19 CO 0.01 0.93 -0.78 0.25 -1.00 0.00 0.00 179.01 178.42 2b06 n THR 20 N -3.83 0.00 -3.36 1.13 -2.24 -1.03 -5.00 114.28 99.94 2b06 n THR 20 Ca -0.04 -0.26 -0.24 0.00 -2.27 0.00 0.00 64.05 61.24 2b06 n THR 20 Cb 0.70 0.76 0.05 0.00 -2.10 0.00 0.00 70.33 69.74 2b06 n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b06 n GLN 21 N -1.43 -6.22 -4.29 -0.78 6.02 0.84 -4.94 117.38 106.58 2b06 n GLN 21 Ca 0.01 0.83 -0.25 0.00 -0.01 0.00 0.00 57.00 57.57 2b06 n GLN 21 Cb 0.19 -5.78 -0.09 0.00 1.02 0.00 0.00 30.24 25.58 2b06 n GLN 21 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2b06 s ARG 22 N -6.06 2.14 0.03 -1.09 0.52 -1.20 -1.14 118.95 112.15 2b06 s ARG 22 Ca 0.46 -1.32 0.05 0.00 -0.52 0.00 0.00 55.73 54.40 2b06 s ARG 22 Cb -0.21 -2.16 -0.02 0.00 0.52 0.00 0.00 34.95 33.08 2b06 s ARG 22 CO 0.57 0.41 -0.16 0.08 0.02 0.00 0.00 175.30 176.22 2b06 s VAL 23 N -1.93 1.27 -0.14 3.52 1.01 0.21 -0.80 120.40 123.53 2b06 s VAL 23 Ca 0.27 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 61.01 2b06 s VAL 23 Cb -0.08 -1.11 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 2b06 s VAL 23 CO 0.17 0.15 1.19 -0.69 0.00 0.00 0.00 175.10 175.92 2b06 s VAL 24 N -0.69 4.38 0.05 2.92 1.01 -0.75 -1.07 120.40 126.25 2b06 s VAL 24 Ca 0.04 1.67 0.06 0.00 0.00 0.00 0.00 61.98 63.75 2b06 s VAL 24 Cb -0.07 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 2b06 s VAL 24 CO 0.01 -0.10 -0.12 -0.04 0.00 0.00 0.00 175.10 174.85 2b06 s MET 25 N 3.02 2.24 -0.07 2.72 -1.94 -0.06 -4.61 119.30 120.61 2b06 s MET 25 Ca 0.53 -0.91 0.05 0.00 -1.71 0.00 0.00 55.69 53.65 2b06 s MET 25 Cb -0.21 -2.32 -0.01 0.00 2.01 0.00 0.00 34.83 34.30 2b06 s MET 25 CO 0.15 0.55 -0.24 -1.14 -0.01 0.00 0.00 175.02 174.33 2b06 s GLN 26 N -1.68 2.61 -0.31 2.03 0.74 0.16 -1.45 119.66 121.76 2b06 s GLN 26 Ca 0.17 -0.87 -0.15 0.00 0.05 0.00 0.00 55.36 54.56 2b06 s GLN 26 Cb -0.11 -2.14 -0.02 0.00 1.10 0.00 0.00 33.01 31.84 2b06 s GLN 26 CO 0.09 0.31 0.39 -0.47 -0.55 0.00 0.00 175.29 175.06 2b06 s TYR 27 N -0.00 3.22 -0.31 1.67 5.04 -0.13 -0.87 117.35 125.97 2b06 s TYR 27 Ca -0.08 0.20 -0.03 0.00 -2.44 0.00 0.00 57.07 54.71 2b06 s TYR 27 Cb -0.15 -2.67 0.04 0.00 0.35 0.00 0.00 41.96 39.54 2b06 s TYR 27 CO 0.05 -0.36 0.03 -0.98 -1.34 0.00 0.00 175.55 172.95 2b06 s ARG 28 N 2.10 2.53 0.00 4.97 1.70 -0.93 -3.84 118.95 125.48 2b06 s ARG 28 Ca 0.14 -1.21 0.00 0.00 -0.47 0.00 0.00 55.73 54.19 2b06 s ARG 28 Cb -0.16 -3.26 0.00 0.00 -0.57 0.00 0.00 34.95 30.96 2b06 s ARG 28 CO 0.11 -0.62 0.04 0.00 -1.08 0.00 0.00 175.30 173.76 2b06 n ALA 29 N 4.69 0.00 -1.29 7.88 0.00 -1.26 -1.21 120.51 129.32 2b06 n ALA 29 Ca -0.13 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.92 2b06 n ALA 29 Cb 0.44 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.90 2b06 n ALA 29 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 2b06 n TRP 35 N -0.51 -2.45 -2.03 0.00 -0.00 -1.26 -4.66 117.44 106.52 2b06 n TRP 35 Ca 0.00 0.48 -0.38 0.00 -0.00 0.00 0.00 57.50 57.60 2b06 n TRP 35 Cb 0.04 -1.74 0.01 0.00 -0.00 0.00 0.00 31.31 29.62 2b06 n TRP 35 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 177.69 176.57 2b06 s SER 36 N -1.02 5.94 0.00 5.87 0.01 -1.26 -4.70 113.70 118.53 2b06 s SER 36 Ca 0.59 2.58 0.00 0.00 1.31 0.00 0.00 55.95 60.43 2b06 s SER 36 Cb -0.51 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.09 2b06 s SER 36 CO 0.64 -1.10 0.00 0.61 0.41 0.00 0.00 173.24 173.80 2b06 n GLY 37 N 0.61 0.54 3.74 3.44 0.00 -0.35 -3.57 105.19 109.59 2b06 n GLY 37 Ca 0.07 -2.25 -0.41 0.00 0.00 0.00 0.00 46.02 43.42 2b06 n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b06 s TYR 38 N -0.57 3.20 0.31 1.61 2.02 0.47 -2.18 117.35 122.22 2b06 s TYR 38 Ca 0.00 1.15 -0.03 0.00 -0.37 0.00 0.00 57.07 57.82 2b06 s TYR 38 Cb 0.00 -3.66 0.01 0.00 -0.40 0.00 0.00 41.96 37.91 2b06 s TYR 38 CO 0.00 -2.11 0.46 0.00 -1.57 0.00 0.00 175.55 172.33 2b06 n ALA 39 N 2.70 -0.44 -2.03 3.71 0.00 -0.05 -0.96 120.51 123.44 2b06 n ALA 39 Ca 0.07 -1.38 -0.36 0.00 0.00 0.00 0.00 53.44 51.77 2b06 n ALA 39 Cb 0.42 1.11 -0.06 0.00 0.00 0.00 0.00 19.45 20.92 2b06 n ALA 39 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2b06 s PHE 40 N -3.18 3.60 0.80 0.00 0.08 -1.26 -0.66 117.98 117.36 2b06 s PHE 40 Ca 0.24 1.44 -0.11 0.00 0.12 0.00 0.00 56.93 58.62 2b06 s PHE 40 Cb -0.01 -2.67 0.07 0.00 -0.57 0.00 0.00 43.02 39.84 2b06 s PHE 40 CO 0.17 0.25 1.09 -1.25 -0.10 0.00 0.00 175.22 175.39 2b06 s PRO 41 N -2.20 2.02 0.00 0.24 0.04 -1.26 -4.79 135.00 129.05 2b06 s PRO 41 Ca 0.47 0.80 0.00 0.00 0.04 0.00 0.00 61.00 62.31 2b06 s PRO 41 Cb -0.16 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.49 2b06 s PRO 41 CO 0.20 -1.70 0.00 0.41 0.04 0.00 0.00 177.00 175.95 2b06 n GLY 42 N -1.72 -1.12 0.00 0.56 0.00 -1.26 -1.24 105.19 100.40 2b06 n GLY 42 Ca 0.07 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.52 2b06 n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b06 n GLY 43 N -1.13 2.27 3.82 -0.02 0.00 -0.88 -4.93 105.19 104.33 2b06 n GLY 43 Ca 0.00 -0.70 -0.37 0.00 0.00 0.00 0.00 46.02 44.95 2b06 n GLY 43 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b06 s HIS 44 N -2.67 3.71 -0.10 1.61 3.76 -1.26 -0.32 115.29 120.02 2b06 s HIS 44 Ca 0.00 1.22 -0.29 0.00 -0.15 0.00 0.00 55.06 55.84 2b06 s HIS 44 Cb 0.00 -2.48 -0.01 0.00 1.11 0.00 0.00 32.58 31.20 2b06 s HIS 44 CO 0.00 0.48 0.98 0.08 -0.85 0.00 0.00 174.74 175.44 2b06 s VAL 45 N -1.32 4.81 0.56 -0.90 1.01 -0.25 -4.94 120.40 119.37 2b06 s VAL 45 Ca 0.35 2.00 -0.16 0.00 0.00 0.00 0.00 61.98 64.17 2b06 s VAL 45 Cb -0.17 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.86 2b06 s VAL 45 CO 0.20 0.03 1.03 -1.61 0.00 0.00 0.00 175.10 174.74 2b06 s GLU 46 N 1.89 3.57 0.46 2.72 2.02 -1.26 -4.90 118.70 123.20 2b06 s GLU 46 Ca 0.48 1.10 0.18 0.00 0.02 0.00 0.00 54.97 56.75 2b06 s GLU 46 Cb -0.18 -2.07 1.15 0.00 0.10 0.00 0.00 34.13 33.12 2b06 s GLU 46 CO 0.19 -0.60 1.95 -0.91 0.02 0.00 0.00 175.26 175.91 2b06 h ASN 47 N 0.63 0.27 -0.01 -0.19 2.35 -2.02 -2.87 115.58 113.74 2b06 h ASN 47 Ca -0.47 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 2b06 h ASN 47 Cb 1.21 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2b06 h ASN 47 CO 0.59 0.15 -0.49 -0.90 -1.65 0.00 0.00 177.43 175.12 2b06 n ASP 48 N -4.45 1.46 -4.92 5.81 5.75 -1.26 -5.01 116.55 113.93 2b06 n ASP 48 Ca 0.12 -1.23 -0.29 0.00 -0.01 0.00 0.00 54.79 53.38 2b06 n ASP 48 Cb 0.52 0.62 -0.04 0.00 -1.03 0.00 0.00 41.12 41.20 2b06 n ASP 48 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 2b06 s GLU 49 N -2.21 3.49 0.84 0.11 -1.05 -1.09 -5.08 118.70 113.72 2b06 s GLU 49 Ca 0.12 -0.39 -0.11 0.00 -0.15 0.00 0.00 54.97 54.45 2b06 s GLU 49 Cb 0.14 -2.93 0.10 0.00 -0.44 0.00 0.00 34.13 30.99 2b06 s GLU 49 CO 0.52 0.51 1.09 0.00 0.95 0.00 0.00 175.26 178.33 2b06 s ALA 50 N -1.69 1.87 0.19 -0.84 0.00 -1.26 -4.80 121.76 115.22 2b06 s ALA 50 Ca 0.37 0.15 -0.11 0.00 0.00 0.00 0.00 51.96 52.37 2b06 s ALA 50 Cb -0.12 -3.25 0.11 0.00 0.00 0.00 0.00 23.12 19.86 2b06 s ALA 50 CO 0.28 -2.10 1.79 0.74 0.00 0.00 0.00 175.76 176.46 2b06 h PHE 51 N -1.37 0.92 -0.57 0.00 0.04 -1.98 -0.41 116.94 113.56 2b06 h PHE 51 Ca -0.46 -0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.18 2b06 h PHE 51 Cb 1.26 -0.29 -0.02 0.00 2.20 0.00 0.00 35.95 39.10 2b06 h PHE 51 CO 0.51 0.67 -0.00 0.00 -0.60 0.00 0.00 178.31 178.89 2b06 h ALA 52 N 1.16 0.77 -0.82 2.45 0.00 -1.98 -2.03 119.26 118.81 2b06 h ALA 52 Ca 0.23 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2b06 h ALA 52 Cb 0.08 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 2b06 h ALA 52 CO -0.03 0.60 0.53 0.93 0.00 0.00 0.00 179.25 181.28 2b06 h GLU 53 N 0.90 1.02 -0.46 0.00 5.08 -1.87 -2.02 114.58 117.22 2b06 h GLU 53 Ca 0.16 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2b06 h GLU 53 Cb 0.55 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 2b06 h GLU 53 CO 0.03 0.68 0.17 1.03 -1.00 0.00 0.00 179.01 179.92 2b06 h SER 54 N 1.05 0.65 -0.35 1.42 0.87 -0.61 -1.22 113.55 115.36 2b06 h SER 54 Ca 0.32 -0.18 -0.16 0.00 -1.23 0.00 0.00 61.79 60.54 2b06 h SER 54 Cb -0.04 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2b06 h SER 54 CO -0.10 0.65 -0.38 1.62 -0.53 0.00 0.00 176.83 178.10 2b06 h VAL 55 N 0.61 1.27 -0.30 2.23 3.04 -1.18 0.33 116.25 122.25 2b06 h VAL 55 Ca 0.15 -1.55 0.00 0.00 -1.01 0.00 0.00 66.70 64.29 2b06 h VAL 55 Cb 0.22 1.38 -0.01 0.00 -2.01 0.00 0.00 31.29 30.87 2b06 h VAL 55 CO -0.01 0.52 0.19 0.40 -1.01 0.00 0.00 177.57 177.65 2b06 h ILE 56 N 0.74 1.09 -0.13 3.17 2.04 -1.29 -0.55 117.51 122.59 2b06 h ILE 56 Ca 0.06 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 2b06 h ILE 56 Cb 0.96 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 2b06 h ILE 56 CO 0.09 0.09 0.02 -0.09 0.00 0.00 0.00 178.15 178.27 2b06 h ARG 57 N 0.39 0.21 -0.62 2.37 2.43 -1.01 -1.27 114.38 116.87 2b06 h ARG 57 Ca 0.11 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2b06 h ARG 57 Cb -0.01 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2b06 h ARG 57 CO -0.02 0.39 0.37 0.93 -1.51 0.00 0.00 179.97 180.13 2b06 h GLU 58 N -0.01 0.85 -0.74 0.20 4.39 -0.88 -1.03 114.58 117.37 2b06 h GLU 58 Ca 0.04 -0.08 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 2b06 h GLU 58 Cb 0.28 -0.18 -0.03 0.00 -0.10 0.00 0.00 28.75 28.72 2b06 h GLU 58 CO 0.00 0.62 0.31 0.82 -1.16 0.00 0.00 179.01 179.60 2b06 h ILE 59 N 0.85 1.25 -0.29 3.13 1.08 -1.02 0.38 117.51 122.89 2b06 h ILE 59 Ca 0.22 -0.76 -0.00 0.00 -0.39 0.00 0.00 64.86 63.93 2b06 h ILE 59 Cb -0.00 0.37 -0.01 0.00 -3.07 0.00 0.00 36.82 34.10 2b06 h ILE 59 CO -0.04 0.31 0.18 0.22 -0.69 0.00 0.00 178.15 178.13 2b06 h TYR 60 N 1.06 0.38 -0.76 1.37 3.20 -0.82 0.37 116.97 121.77 2b06 h TYR 60 Ca 0.25 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.09 2b06 h TYR 60 Cb 0.19 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.30 2b06 h TYR 60 CO 0.02 0.27 0.37 0.93 -1.64 0.00 0.00 178.16 178.10 2b06 h GLU 61 N 0.38 1.10 0.00 1.82 5.08 -0.84 0.72 114.58 122.84 2b06 h GLU 61 Ca 0.10 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 2b06 h GLU 61 Cb -0.00 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 2b06 h GLU 61 CO -0.02 0.86 -0.71 0.93 -1.00 0.00 0.00 179.01 179.06 2b06 h GLU 62 N 1.08 0.00 0.00 2.33 5.08 -0.71 -3.40 114.58 118.96 2b06 h GLU 62 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2b06 h GLU 62 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2b06 h GLU 62 CO -0.03 0.07 -0.28 0.25 -1.00 0.00 0.00 179.01 178.02 2b06 n THR 63 N -2.87 0.00 -0.17 1.13 -2.24 0.10 -4.01 114.28 106.22 2b06 n THR 63 Ca 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2b06 n THR 63 Cb 0.59 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 2b06 n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b06 n GLY 64 N 0.99 2.66 3.82 3.38 0.00 0.24 -0.48 105.19 115.82 2b06 n GLY 64 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2b06 n GLY 64 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b06 s LEU 65 N 0.00 4.48 -0.38 0.99 1.43 -1.26 -4.06 118.68 119.88 2b06 s LEU 65 Ca 0.00 1.14 -0.14 0.00 -1.03 0.00 0.00 54.13 54.10 2b06 s LEU 65 Cb 0.00 -2.88 0.01 0.00 0.03 0.00 0.00 46.19 43.35 2b06 s LEU 65 CO 0.00 0.26 0.27 -0.89 0.23 0.00 0.00 176.35 176.21 2b06 s THR 66 N -1.17 5.19 0.21 5.49 2.01 0.05 -3.16 115.64 124.26 2b06 s THR 66 Ca 0.29 -0.52 -0.17 0.00 0.31 0.00 0.00 61.69 61.60 2b06 s THR 66 Cb -0.18 -3.81 -0.08 0.00 0.01 0.00 0.00 72.50 68.44 2b06 s THR 66 CO 0.17 -0.19 0.66 0.27 -0.69 0.00 0.00 174.62 174.84 2b06 s ILE 67 N 1.68 4.70 -0.02 1.82 -4.36 -1.26 -1.26 121.20 122.50 2b06 s ILE 67 Ca 0.05 1.05 0.04 0.00 -0.26 0.00 0.00 60.65 61.53 2b06 s ILE 67 Cb -0.18 -3.77 -0.03 0.00 1.25 0.00 0.00 42.46 39.72 2b06 s ILE 67 CO 0.10 0.15 -0.12 -1.10 0.24 0.00 0.00 174.94 174.21 2b06 s GLN 68 N -2.15 2.46 -1.46 0.37 1.11 0.11 -4.81 119.66 115.29 2b06 s GLN 68 Ca 0.43 -0.74 -0.04 0.00 0.01 0.00 0.00 55.36 55.02 2b06 s GLN 68 Cb -0.15 -2.40 0.03 0.00 -1.01 0.00 0.00 33.01 29.49 2b06 s GLN 68 CO 0.20 0.61 0.54 0.09 0.01 0.00 0.00 175.29 176.73 2b06 n ASN 69 N 1.96 -1.18 -4.75 5.90 3.02 -1.26 -4.48 115.26 114.47 2b06 n ASN 69 Ca -0.17 -0.98 -0.41 0.00 -0.03 0.00 0.00 54.58 53.00 2b06 n ASN 69 Cb 0.52 -3.13 0.01 0.00 -0.61 0.00 0.00 39.78 36.58 2b06 n ASN 69 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2b06 n PRO 70 N -4.41 2.32 -4.05 3.52 -0.04 -1.26 -4.95 135.00 126.12 2b06 n PRO 70 Ca -0.22 0.82 -0.34 0.00 -0.04 0.00 0.00 63.50 63.72 2b06 n PRO 70 Cb 0.64 -2.58 -0.10 0.00 -0.04 0.00 0.00 33.50 31.42 2b06 n PRO 70 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2b06 s GLN 71 N -2.27 3.91 0.04 0.54 -1.52 -0.14 -4.92 119.66 115.30 2b06 s GLN 71 Ca 0.58 -0.38 -0.30 0.00 -1.95 0.00 0.00 55.36 53.31 2b06 s GLN 71 Cb -0.47 -3.17 -0.07 0.00 -0.22 0.00 0.00 33.01 29.07 2b06 s GLN 71 CO 0.60 0.24 1.56 -1.17 -0.25 0.00 0.00 175.29 176.27 2b06 s LEU 72 N 0.44 4.34 0.00 2.90 2.96 -1.26 -0.92 118.68 127.14 2b06 s LEU 72 Ca 0.02 2.34 0.00 0.00 -0.22 0.00 0.00 54.13 56.27 2b06 s LEU 72 Cb -0.13 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.00 2b06 s LEU 72 CO 0.01 -0.83 0.16 1.33 -1.32 0.00 0.00 176.35 175.70 2b06 n VAL 73 N 4.74 0.00 0.00 1.68 0.24 0.02 -4.92 118.33 120.09 2b06 n VAL 73 Ca 0.15 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 62.02 2b06 n VAL 73 Cb 0.42 1.05 0.00 0.00 -1.47 0.00 0.00 33.84 33.84 2b06 n VAL 73 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2b06 n GLY 74 N 0.54 -0.77 2.89 7.63 0.00 -1.15 -4.57 105.19 109.75 2b06 n GLY 74 Ca 0.00 -1.27 -0.22 0.00 0.00 0.00 0.00 46.02 44.53 2b06 n GLY 74 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b06 s ILE 75 N -2.00 0.65 -0.18 -0.61 1.01 0.51 -0.67 121.20 119.91 2b06 s ILE 75 Ca 0.00 -0.14 -0.08 0.00 0.00 0.00 0.00 60.65 60.43 2b06 s ILE 75 Cb 0.00 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.75 2b06 s ILE 75 CO 0.00 0.27 0.08 -0.75 0.00 0.00 0.00 174.94 174.54 2b06 s LYS 76 N 1.19 3.94 0.16 2.79 2.20 -0.12 -0.91 119.74 128.99 2b06 s LYS 76 Ca -0.06 -0.31 -0.20 0.00 -0.36 0.00 0.00 55.97 55.04 2b06 s LYS 76 Cb -0.14 -3.23 0.05 0.00 -1.51 0.00 0.00 37.83 33.00 2b06 s LYS 76 CO -0.01 0.33 0.53 0.54 -0.36 0.00 0.00 175.35 176.38 2b06 s ASN 77 N 0.21 -0.41 -0.09 1.43 4.22 -0.09 -0.08 114.94 120.13 2b06 s ASN 77 Ca 0.05 -0.18 -0.25 0.00 -2.14 0.00 0.00 52.86 50.34 2b06 s ASN 77 Cb -0.12 0.56 0.06 0.00 1.28 0.00 0.00 41.25 43.03 2b06 s ASN 77 CO -0.00 -0.96 0.59 -1.66 -2.04 0.00 0.00 177.10 173.03 2b06 s TRP 78 N -3.79 -0.57 0.55 1.54 -2.14 -0.69 -2.17 118.94 111.68 2b06 s TRP 78 Ca 0.03 1.10 -0.19 0.00 2.66 0.00 0.00 56.10 59.70 2b06 s TRP 78 Cb -0.00 0.30 -0.05 0.00 -3.10 0.00 0.00 33.47 30.61 2b06 s TRP 78 CO -0.11 -0.49 1.12 -2.14 -2.66 0.00 0.00 176.95 172.67 2b06 s PRO 79 N -0.80 3.34 0.40 3.25 0.02 -1.26 -0.83 135.00 139.12 2b06 s PRO 79 Ca -0.08 1.57 0.08 0.00 0.02 0.00 0.00 61.00 62.58 2b06 s PRO 79 Cb -0.02 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.49 2b06 s PRO 79 CO 0.06 -0.85 0.52 -0.51 -0.33 0.00 0.00 177.00 175.89 2b06 s LEU 80 N -3.89 3.67 0.56 -5.54 1.43 0.15 -4.81 118.68 110.26 2b06 s LEU 80 Ca 0.72 -0.43 0.24 0.00 -1.03 0.00 0.00 54.13 53.63 2b06 s LEU 80 Cb -0.23 -2.58 1.59 0.00 0.03 0.00 0.00 46.19 45.00 2b06 s LEU 80 CO 0.28 -0.68 2.20 0.44 0.23 0.00 0.00 176.35 178.82 2b06 h ASP 81 N 0.75 0.00 -1.03 2.29 3.32 -1.86 -3.22 116.42 116.66 2b06 h ASP 81 Ca -0.41 0.00 -0.43 0.00 0.02 0.00 0.00 57.03 56.21 2b06 h ASP 81 Cb 1.27 0.00 -0.41 0.00 0.22 0.00 0.00 39.33 40.41 2b06 h ASP 81 CO 0.48 0.01 -1.01 0.41 -1.72 0.00 0.00 179.24 177.42 2b06 n THR 82 N -4.10 1.61 -0.08 0.35 -1.04 -0.74 -4.93 114.28 105.35 2b06 n THR 82 Ca -0.03 -3.71 0.00 0.00 -2.04 0.00 0.00 64.05 58.27 2b06 n THR 82 Cb 0.10 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 2b06 n THR 82 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b06 n GLY 83 N -0.34 0.67 3.91 3.41 0.00 -1.22 -4.05 105.19 107.56 2b06 n GLY 83 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 2b06 n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b06 s GLY 84 N -1.74 1.75 -0.18 -0.02 0.00 -0.32 -4.87 107.32 101.93 2b06 s GLY 84 Ca 0.00 -1.12 -0.17 0.00 0.00 0.00 0.00 44.72 43.43 2b06 s GLY 84 CO 0.00 -0.37 0.49 -1.60 0.00 0.00 0.00 173.10 171.62 2b06 s ARG 85 N -5.82 0.58 -0.21 2.90 3.52 -0.42 -0.67 118.95 118.82 2b06 s ARG 85 Ca 0.72 0.67 -0.09 0.00 -0.13 0.00 0.00 55.73 56.90 2b06 s ARG 85 Cb -0.05 0.28 -0.05 0.00 -1.56 0.00 0.00 34.95 33.57 2b06 s ARG 85 CO 0.53 -0.07 0.12 -0.47 -0.81 0.00 0.00 175.30 174.60 2b06 s TYR 86 N 0.23 3.31 -0.09 5.12 5.04 -0.01 -1.02 117.35 129.93 2b06 s TYR 86 Ca -0.00 0.18 0.03 0.00 -2.44 0.00 0.00 57.07 54.84 2b06 s TYR 86 Cb -0.03 -2.19 0.01 0.00 0.35 0.00 0.00 41.96 40.09 2b06 s TYR 86 CO 0.01 0.13 -0.18 0.42 -1.34 0.00 0.00 175.55 174.59 2b06 s ILE 87 N 0.71 1.62 -0.25 3.14 1.01 0.08 -1.70 121.20 125.81 2b06 s ILE 87 Ca 0.06 -0.75 0.03 0.00 0.00 0.00 0.00 60.65 59.99 2b06 s ILE 87 Cb -0.13 -1.44 0.06 0.00 0.01 0.00 0.00 42.46 40.96 2b06 s ILE 87 CO 0.01 0.46 -0.11 -0.69 0.00 0.00 0.00 174.94 174.61 2b06 s VAL 88 N 0.60 2.19 -0.18 2.92 1.01 0.89 -0.95 120.40 126.88 2b06 s VAL 88 Ca -0.15 -1.56 -0.25 0.00 0.00 0.00 0.00 61.98 60.02 2b06 s VAL 88 Cb -0.17 -2.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 2b06 s VAL 88 CO 0.05 0.02 0.85 -0.63 0.00 0.00 0.00 175.10 175.38 2b06 s ILE 89 N 1.12 4.86 -0.20 2.22 -1.09 0.42 -0.94 121.20 127.60 2b06 s ILE 89 Ca -0.08 1.65 -0.08 0.00 -2.23 0.00 0.00 60.65 59.92 2b06 s ILE 89 Cb -0.19 -4.15 -0.04 0.00 -1.58 0.00 0.00 42.46 36.50 2b06 s ILE 89 CO -0.06 -0.00 0.08 0.00 -1.23 0.00 0.00 174.94 173.73 2b06 s TYR 91 N 0.58 2.19 -0.03 0.00 2.02 -0.19 -0.80 117.35 121.12 2b06 s TYR 91 Ca 0.04 -0.38 0.06 0.00 -0.37 0.00 0.00 57.07 56.42 2b06 s TYR 91 Cb -0.13 -1.03 -0.01 0.00 -0.40 0.00 0.00 41.96 40.40 2b06 s TYR 91 CO 0.01 0.56 -0.20 0.21 -1.57 0.00 0.00 175.55 174.55 2b06 s LYS 92 N -3.09 1.82 -0.05 -0.62 2.20 -0.10 -0.78 119.74 119.14 2b06 s LYS 92 Ca 0.24 -0.72 0.01 0.00 -0.36 0.00 0.00 55.97 55.14 2b06 s LYS 92 Cb -0.06 -1.67 0.02 0.00 -1.51 0.00 0.00 37.83 34.61 2b06 s LYS 92 CO 0.11 0.38 -0.06 0.00 -0.36 0.00 0.00 175.35 175.42 2b06 s ALA 93 N -0.29 0.75 -0.25 3.13 0.00 -0.13 -0.97 121.76 124.01 2b06 s ALA 93 Ca 0.03 -0.11 0.06 0.00 0.00 0.00 0.00 51.96 51.94 2b06 s ALA 93 Cb -0.10 -0.43 -0.07 0.00 0.00 0.00 0.00 23.12 22.53 2b06 s ALA 93 CO 0.01 0.02 0.23 0.25 0.00 0.00 0.00 175.76 176.27 2b06 n THR 94 N 3.96 0.00 -3.75 0.00 -2.24 -1.26 -1.23 114.28 109.76 2b06 n THR 94 Ca -0.25 -0.34 -0.37 0.00 -2.27 0.00 0.00 64.05 60.82 2b06 n THR 94 Cb 0.51 0.94 -0.13 0.00 -2.10 0.00 0.00 70.33 69.55 2b06 n THR 94 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2b06 s GLU 95 N -1.63 3.59 0.22 -0.78 2.02 -1.26 -4.69 118.70 116.17 2b06 s GLU 95 Ca 0.02 -0.52 -0.22 0.00 0.02 0.00 0.00 54.97 54.26 2b06 s GLU 95 Cb 0.04 -3.33 0.04 0.00 0.10 0.00 0.00 34.13 30.98 2b06 s GLU 95 CO 0.24 -0.22 0.72 -0.59 0.02 0.00 0.00 175.26 175.42 2b06 s PHE 96 N 1.60 -0.29 0.23 1.61 -0.12 -1.26 -0.72 117.98 119.04 2b06 s PHE 96 Ca 0.06 -0.08 -0.01 0.00 -0.05 0.00 0.00 56.93 56.85 2b06 s PHE 96 Cb -0.15 0.66 -0.03 0.00 -0.63 0.00 0.00 43.02 42.86 2b06 s PHE 96 CO 0.03 -1.07 0.20 -1.54 -0.05 0.00 0.00 175.22 172.80 2b06 s SER 97 N -2.86 0.34 0.00 1.98 1.04 -0.39 -4.98 113.70 108.84 2b06 s SER 97 Ca 0.08 -1.39 0.00 0.00 0.48 0.00 0.00 55.95 55.12 2b06 s SER 97 Cb -0.04 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.52 2b06 s SER 97 CO 0.00 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.91 2b06 n GLY 98 N -0.34 0.83 3.36 7.32 0.00 -1.26 -0.77 105.19 114.33 2b06 n GLY 98 Ca 0.02 -2.22 -0.33 0.00 0.00 0.00 0.00 46.02 43.50 2b06 n GLY 98 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2b06 s THR 99 N -1.12 2.98 0.20 2.61 2.01 -1.26 -4.91 115.64 116.15 2b06 s THR 99 Ca 0.00 -0.69 -0.32 0.00 0.31 0.00 0.00 61.69 60.99 2b06 s THR 99 Cb 0.00 -2.24 -0.13 0.00 0.01 0.00 0.00 72.50 70.14 2b06 s THR 99 CO 0.00 0.53 1.61 -0.11 -0.69 0.00 0.00 174.62 175.96 2b06 n LEU 100 N 3.53 3.58 -3.68 4.42 7.94 -1.26 -4.39 117.00 127.14 2b06 n LEU 100 Ca -0.18 1.09 -0.10 0.00 -1.11 0.00 0.00 56.01 55.71 2b06 n LEU 100 Cb 0.53 -1.50 -0.10 0.00 0.53 0.00 0.00 43.42 42.87 2b06 n LEU 100 CO 0.30 -0.09 0.05 -1.58 -1.11 0.00 0.00 177.39 174.96 2b06 s GLN 101 N 0.66 0.37 0.86 1.96 0.74 0.37 -4.97 119.66 119.66 2b06 s GLN 101 Ca 0.74 0.86 -0.12 0.00 0.05 0.00 0.00 55.36 56.89 2b06 s GLN 101 Cb -0.59 0.06 0.11 0.00 1.10 0.00 0.00 33.01 33.69 2b06 s GLN 101 CO 0.39 -0.18 1.09 -1.12 -0.55 0.00 0.00 175.29 174.92 2b06 s SER 102 N 1.72 3.85 0.33 6.67 0.01 -1.26 -3.65 113.70 121.38 2b06 s SER 102 Ca -0.07 1.41 0.04 0.00 1.31 0.00 0.00 55.95 58.63 2b06 s SER 102 Cb -0.09 -2.11 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 2b06 s SER 102 CO -0.13 -2.39 0.15 -0.94 0.41 0.00 0.00 173.24 170.35 2b06 s SER 103 N -3.61 1.93 0.63 2.44 1.04 -1.18 -4.92 113.70 110.02 2b06 s SER 103 Ca 0.62 -1.59 0.32 0.00 0.48 0.00 0.00 55.95 55.78 2b06 s SER 103 Cb -0.17 0.40 1.74 0.00 0.10 0.00 0.00 66.02 68.10 2b06 s SER 103 CO 0.56 -0.90 2.04 -0.08 0.98 0.00 0.00 173.24 175.85 2b06 h GLU 104 N 2.09 0.00 -0.00 4.02 4.81 -1.95 -1.87 114.58 121.68 2b06 h GLU 104 Ca -0.34 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2b06 h GLU 104 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 2b06 h GLU 104 CO 0.53 0.00 -0.08 0.39 -0.73 0.00 0.00 179.01 179.12 2b06 n GLU 105 N -3.34 0.38 0.00 1.92 1.02 -1.26 -4.93 120.64 114.42 2b06 n GLU 105 Ca 0.01 -0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2b06 n GLU 105 Cb 0.36 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2b06 n GLU 105 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b06 n GLY 106 N 1.35 3.84 3.72 0.62 0.00 -0.70 -4.85 105.19 109.17 2b06 n GLY 106 Ca 0.12 -0.68 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 2b06 n GLY 106 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b06 s GLU 107 N -2.40 4.39 0.10 1.61 0.41 -1.25 -3.11 118.70 118.46 2b06 s GLU 107 Ca 0.00 1.93 0.07 0.00 -0.41 0.00 0.00 54.97 56.56 2b06 s GLU 107 Cb 0.00 -3.28 -0.04 0.00 -1.78 0.00 0.00 34.13 29.03 2b06 s GLU 107 CO 0.00 -0.30 -0.10 0.14 -0.49 0.00 0.00 175.26 174.51 2b06 s VAL 108 N 0.81 3.37 0.03 2.63 -7.23 -1.26 -0.95 120.40 117.80 2b06 s VAL 108 Ca 0.60 -1.25 -0.18 0.00 -1.81 0.00 0.00 61.98 59.33 2b06 s VAL 108 Cb -0.33 -2.57 0.04 0.00 0.56 0.00 0.00 36.38 34.07 2b06 s VAL 108 CO 0.32 0.12 0.41 -0.94 -0.31 0.00 0.00 175.10 174.70 2b06 s SER 109 N -2.18 -0.29 -0.34 4.85 1.04 -0.53 -4.79 113.70 111.47 2b06 s SER 109 Ca 0.21 0.05 -0.25 0.00 0.48 0.00 0.00 55.95 56.45 2b06 s SER 109 Cb -0.11 0.42 0.01 0.00 0.10 0.00 0.00 66.02 66.43 2b06 s SER 109 CO 0.13 -0.63 0.85 0.26 0.98 0.00 0.00 173.24 174.83 2b06 s TRP 110 N -2.25 3.14 -0.11 5.02 0.52 -1.26 -0.88 118.94 123.13 2b06 s TRP 110 Ca -0.07 0.77 0.01 0.00 0.02 0.00 0.00 56.10 56.83 2b06 s TRP 110 Cb -0.01 -3.42 -0.02 0.00 -1.15 0.00 0.00 33.47 28.87 2b06 s TRP 110 CO -0.01 -0.69 -0.13 0.08 0.02 0.00 0.00 176.95 176.22 2b06 s VAL 111 N 3.19 3.13 0.15 4.03 1.01 -0.23 -4.86 120.40 126.81 2b06 s VAL 111 Ca 0.35 -0.65 -0.34 0.00 0.00 0.00 0.00 61.98 61.33 2b06 s VAL 111 Cb -0.13 -2.29 -0.14 0.00 0.00 0.00 0.00 36.38 33.82 2b06 s VAL 111 CO 0.15 0.54 1.60 0.00 0.00 0.00 0.00 175.10 177.40 2b06 n GLN 112 N 3.14 2.16 -0.33 2.72 6.02 -1.26 -0.62 117.38 129.20 2b06 n GLN 112 Ca -0.18 0.78 0.05 0.00 -0.01 0.00 0.00 57.00 57.64 2b06 n GLN 112 Cb 0.53 -2.56 0.20 0.00 1.02 0.00 0.00 30.24 29.43 2b06 n GLN 112 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 2b06 h LYS 113 N 6.15 0.90 0.00 -1.09 3.64 -1.46 0.11 116.57 124.81 2b06 h LYS 113 Ca -0.45 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2b06 h LYS 113 Cb 1.25 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2b06 h LYS 113 CO 0.89 0.59 0.00 -0.40 -2.27 0.00 0.00 179.45 178.27 2b06 n ASP 114 N -4.66 0.00 -0.46 4.20 5.75 -1.26 -2.51 116.55 117.61 2b06 n ASP 114 Ca 0.16 0.35 0.10 0.00 -0.01 0.00 0.00 54.79 55.39 2b06 n ASP 114 Cb 0.31 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 39.97 2b06 n ASP 114 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2b06 n GLN 115 N -1.43 1.47 -0.25 0.11 1.13 0.35 -4.59 117.38 114.18 2b06 n GLN 115 Ca 0.05 -0.97 0.04 0.00 -1.94 0.00 0.00 57.00 54.18 2b06 n GLN 115 Cb 0.18 -1.38 0.17 0.00 0.11 0.00 0.00 30.24 29.31 2b06 n GLN 115 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 2b06 h ILE 116 N 2.27 0.69 0.00 5.09 2.04 -1.25 -1.10 117.51 125.26 2b06 h ILE 116 Ca 0.00 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2b06 h ILE 116 Cb 0.67 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 2b06 h ILE 116 CO 0.00 0.08 0.00 -0.65 0.00 0.00 0.00 178.15 177.58 2b06 h PRO 117 N 0.45 0.00 -0.00 2.37 0.11 -1.82 -2.25 132.00 130.86 2b06 h PRO 117 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 2b06 h PRO 117 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 2b06 h PRO 117 CO -0.37 0.00 -0.12 0.09 -0.21 0.00 0.00 178.00 177.38 2b06 n ASN 118 N -2.78 0.53 -4.89 -2.05 3.02 -0.41 -4.87 115.26 103.80 2b06 n ASN 118 Ca -0.02 -0.61 -0.29 0.00 -0.03 0.00 0.00 54.58 53.63 2b06 n ASN 118 Cb 0.06 -0.05 0.02 0.00 -0.61 0.00 0.00 39.78 39.20 2b06 n ASN 118 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b06 s LEU 119 N -2.48 3.24 -0.83 3.41 1.43 -0.85 -5.00 118.68 117.61 2b06 s LEU 119 Ca 0.28 1.06 -0.25 0.00 -1.03 0.00 0.00 54.13 54.19 2b06 s LEU 119 Cb 0.20 -3.97 0.02 0.00 0.03 0.00 0.00 46.19 42.47 2b06 s LEU 119 CO 0.48 -0.97 1.50 0.20 0.23 0.00 0.00 176.35 177.79 2b06 s ASN 120 N -4.24 6.00 0.21 2.29 0.02 -1.26 -4.99 114.94 112.97 2b06 s ASN 120 Ca 0.54 -0.66 -0.08 0.00 -1.02 0.00 0.00 52.86 51.64 2b06 s ASN 120 Cb -0.11 -2.56 -0.07 0.00 0.02 0.00 0.00 41.25 38.54 2b06 s ASN 120 CO 0.49 -1.93 0.51 -0.76 0.02 0.00 0.00 177.10 175.43 2b06 s LEU 121 N 6.55 4.19 0.68 0.60 1.43 -1.26 -0.40 118.68 130.47 2b06 s LEU 121 Ca 0.48 0.83 -0.17 0.00 -1.03 0.00 0.00 54.13 54.24 2b06 s LEU 121 Cb -0.06 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 2b06 s LEU 121 CO 0.06 -0.05 0.97 0.00 0.23 0.00 0.00 176.35 177.57 2b06 n ALA 122 N -0.12 -0.04 -1.63 4.21 0.00 -0.13 -4.67 120.51 118.14 2b06 n ALA 122 Ca -0.00 -0.11 -0.49 0.00 0.00 0.00 0.00 53.44 52.84 2b06 n ALA 122 Cb 0.52 -2.12 -0.05 0.00 0.00 0.00 0.00 19.45 17.80 2b06 n ALA 122 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2b06 n TYR 123 N -2.21 1.86 -1.21 0.00 9.36 -1.26 -1.93 117.16 121.77 2b06 n TYR 123 Ca 0.13 0.47 -0.07 0.00 3.32 0.00 0.00 57.90 61.76 2b06 n TYR 123 Cb 0.49 -2.43 -0.03 0.00 -0.63 0.00 0.00 39.34 36.74 2b06 n TYR 123 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2b06 n ASP 124 N 2.85 -4.71 -0.27 2.98 8.00 -1.26 -4.91 116.55 119.23 2b06 n ASP 124 Ca 0.17 0.18 0.01 0.00 0.71 0.00 0.00 54.79 55.86 2b06 n ASP 124 Cb 0.24 -2.83 0.14 0.00 -0.02 0.00 0.00 41.12 38.65 2b06 n ASP 124 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2b06 h MET 125 N 0.17 0.73 0.02 -1.24 2.86 -1.74 -1.34 114.93 114.39 2b06 h MET 125 Ca -0.15 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.45 2b06 h MET 125 Cb 0.75 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.24 2b06 h MET 125 CO 0.21 0.48 -0.01 -0.07 1.06 0.00 0.00 176.91 178.58 2b06 h LEU 126 N 0.75 -0.03 -1.67 1.22 3.38 -1.91 0.03 115.31 117.09 2b06 h LEU 126 Ca 0.36 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2b06 h LEU 126 Cb 0.29 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 2b06 h LEU 126 CO -0.22 0.34 -0.11 1.55 0.09 0.00 0.00 178.44 180.08 2b06 h PRO 127 N -0.40 0.07 -0.06 1.13 0.13 -1.97 -0.27 132.00 130.62 2b06 h PRO 127 Ca -0.00 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.11 2b06 h PRO 127 Cb 0.38 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 31.50 2b06 h PRO 127 CO 0.01 0.19 0.01 1.25 -0.23 0.00 0.00 178.00 179.23 2b06 h LEU 128 N 0.07 0.09 -1.09 1.56 5.85 -1.09 -0.70 115.31 120.01 2b06 h LEU 128 Ca 0.01 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.50 2b06 h LEU 128 Cb 0.25 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2b06 h LEU 128 CO 0.02 0.31 0.60 -0.03 -0.34 0.00 0.00 178.44 179.00 2b06 h MET 129 N -0.13 1.21 -0.49 1.25 4.05 -0.68 -1.06 114.93 119.09 2b06 h MET 129 Ca 0.02 -0.08 -0.00 0.00 -0.28 0.00 0.00 59.70 59.36 2b06 h MET 129 Cb 0.25 -0.27 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 2b06 h MET 129 CO 0.00 0.81 0.29 1.49 0.23 0.00 0.00 176.91 179.72 2b06 h GLU 130 N 1.25 0.66 -0.62 0.39 4.81 -0.91 -0.24 114.58 119.91 2b06 h GLU 130 Ca 0.34 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2b06 h GLU 130 Cb -0.14 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.07 2b06 h GLU 130 CO -0.07 0.49 0.38 1.98 -0.73 0.00 0.00 179.01 181.06 2b06 h MET 131 N 0.65 0.84 -0.20 1.92 4.05 -0.64 -1.23 114.93 120.32 2b06 h MET 131 Ca 0.17 -0.07 -0.01 0.00 -0.28 0.00 0.00 59.70 59.51 2b06 h MET 131 Cb 0.01 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 30.62 2b06 h MET 131 CO -0.03 0.59 0.07 0.52 0.23 0.00 0.00 176.91 178.29 2b06 h MET 132 N 0.84 0.31 0.00 0.39 2.86 -0.86 -3.01 114.93 115.46 2b06 h MET 132 Ca 0.22 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.75 2b06 h MET 132 Cb -0.03 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 2b06 h MET 132 CO -0.04 0.39 -0.26 0.93 1.06 0.00 0.00 176.91 178.99 2b06 h GLU 133 N 0.16 0.00 -6.37 1.72 4.39 -0.90 -3.44 114.58 110.14 2b06 h GLU 133 Ca 0.07 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.22 2b06 h GLU 133 Cb 0.21 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2b06 h GLU 133 CO -0.00 0.26 0.75 0.00 -1.16 0.00 0.00 179.01 178.86 2b06 s ALA 134 N -3.80 3.53 -0.06 3.43 0.00 -0.48 -4.91 121.76 119.48 2b06 s ALA 134 Ca -0.01 0.79 0.31 0.00 0.00 0.00 0.00 51.96 53.05 2b06 s ALA 134 Cb 0.11 -3.55 1.29 0.00 0.00 0.00 0.00 23.12 20.98 2b06 s ALA 134 CO 0.65 -0.79 1.91 -1.00 0.00 0.00 0.00 175.76 176.53 2b06 h PRO 135 N 7.54 0.00 -0.32 0.00 0.13 -1.86 -3.11 132.00 134.38 2b06 h PRO 135 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2b06 h PRO 135 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2b06 h PRO 135 CO 0.88 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.25 2b06 n ASP 136 N -2.82 3.20 -4.21 1.44 5.75 -1.26 -4.95 116.55 113.70 2b06 n ASP 136 Ca 0.01 -2.30 -0.25 0.00 -0.01 0.00 0.00 54.79 52.24 2b06 n ASP 136 Cb 0.27 -0.32 -0.15 0.00 -1.03 0.00 0.00 41.12 39.89 2b06 n ASP 136 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2b06 s LYS 137 N -1.53 1.44 0.00 0.11 -0.14 -1.18 -5.03 119.74 113.41 2b06 s LYS 137 Ca 0.28 -0.79 0.00 0.00 -1.36 0.00 0.00 55.97 54.11 2b06 s LYS 137 Cb 0.18 -1.46 0.00 0.00 -1.68 0.00 0.00 37.83 34.88 2b06 s LYS 137 CO 0.14 0.39 0.13 -1.13 -0.76 0.00 0.00 175.35 174.11 2b06 n SER 138 N 2.27 0.00 -3.81 2.83 3.41 0.98 -4.75 113.62 114.56 2b06 n SER 138 Ca -0.16 -1.00 -0.13 0.00 -0.26 0.00 0.00 58.87 57.32 2b06 n SER 138 Cb 0.53 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.35 2b06 n SER 138 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2b06 s GLU 139 N 0.00 0.08 -0.23 4.33 2.12 -0.57 -0.37 118.70 124.07 2b06 s GLU 139 Ca 0.00 0.19 0.02 0.00 0.36 0.00 0.00 54.97 55.54 2b06 s GLU 139 Cb 0.00 -0.04 0.04 0.00 0.26 0.00 0.00 34.13 34.39 2b06 s GLU 139 CO 0.00 -0.07 -0.14 0.12 -0.54 0.00 0.00 175.26 174.63 2b06 s PHE 140 N 0.45 3.04 -0.05 5.30 5.36 -0.09 -1.11 117.98 130.89 2b06 s PHE 140 Ca -0.03 -1.95 0.04 0.00 -0.96 0.00 0.00 56.93 54.03 2b06 s PHE 140 Cb -0.05 -1.94 -0.00 0.00 -0.34 0.00 0.00 43.02 40.69 2b06 s PHE 140 CO -0.02 -0.83 -0.17 0.12 -1.46 0.00 0.00 175.22 172.87 2b06 s PHE 141 N 1.21 1.68 -0.35 10.12 5.36 0.19 -0.91 117.98 135.28 2b06 s PHE 141 Ca -0.02 -0.50 -0.12 0.00 -0.96 0.00 0.00 56.93 55.33 2b06 s PHE 141 Cb -0.17 -1.14 0.01 0.00 -0.34 0.00 0.00 43.02 41.38 2b06 s PHE 141 CO -0.08 -0.18 0.21 0.71 -1.46 0.00 0.00 175.22 174.42 2b06 s TYR 142 N 0.11 3.22 0.43 10.12 2.02 -0.92 -0.49 117.35 131.83 2b06 s TYR 142 Ca -0.05 -0.64 0.28 0.00 -0.37 0.00 0.00 57.07 56.29 2b06 s TYR 142 Cb -0.12 -2.45 1.52 0.00 -0.40 0.00 0.00 41.96 40.51 2b06 s TYR 142 CO 0.02 -0.53 2.10 -1.35 -1.57 0.00 0.00 175.55 174.23 2b06 h PRO 143 N 8.45 0.00 -6.36 -1.71 0.11 -1.89 -3.36 132.00 127.24 2b06 h PRO 143 Ca -0.29 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.35 2b06 h PRO 143 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 2b06 h PRO 143 CO 0.66 0.10 -0.87 0.54 -0.21 0.00 0.00 178.00 178.21 2b06 n ARG 144 N -3.63 -3.72 -0.02 1.05 5.12 -1.26 -4.79 116.66 109.42 2b06 n ARG 144 Ca -0.02 0.47 -0.11 0.00 -1.93 0.00 0.00 57.85 56.26 2b06 n ARG 144 Cb 0.22 -4.71 0.03 0.00 -1.16 0.00 0.00 32.46 26.83 2b06 n ARG 144 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2b06 h ARG 145 N -1.85 0.65 -5.61 5.56 3.08 -1.91 -3.44 114.38 110.86 2b06 h ARG 145 Ca -0.63 -0.41 -0.55 0.00 0.07 0.00 0.00 59.98 58.46 2b06 h ARG 145 Cb 1.37 0.05 -0.14 0.00 0.08 0.00 0.00 29.97 31.33 2b06 h ARG 145 CO 0.60 1.03 -0.65 0.95 -1.07 0.00 0.00 179.97 180.83 2b06 s THR 146 N -4.04 1.81 0.36 2.04 -4.23 -1.26 -5.03 115.64 105.29 2b06 s THR 146 Ca -0.08 -2.10 0.03 0.00 -1.18 0.00 0.00 61.69 58.36 2b06 s THR 146 Cb 0.11 -2.68 0.26 0.00 1.34 0.00 0.00 72.50 71.53 2b06 s THR 146 CO 0.86 -0.16 2.01 -0.08 -0.54 0.00 0.00 174.62 176.71 2b06 h GLU 147 N 2.07 0.74 -0.25 3.99 4.22 -2.02 -1.90 114.58 121.43 2b06 h GLU 147 Ca -0.41 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 58.97 2b06 h GLU 147 Cb 1.24 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2b06 h GLU 147 CO 0.71 0.51 0.00 -0.40 -2.18 0.00 0.00 179.01 177.65 2b06 n ASP 148 N -4.44 2.85 -4.57 1.04 5.75 -1.26 -4.90 116.55 111.02 2b06 n ASP 148 Ca 0.05 -1.90 -0.41 0.00 -0.01 0.00 0.00 54.79 52.52 2b06 n ASP 148 Cb 0.06 -0.15 -0.03 0.00 -1.03 0.00 0.00 41.12 39.97 2b06 n ASP 148 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2b06 s ASP 149 N -1.64 5.97 -0.21 -1.12 2.15 -0.72 -4.81 116.67 116.30 2b06 s ASP 149 Ca 0.35 0.27 0.14 0.00 0.43 0.00 0.00 52.55 53.74 2b06 s ASP 149 Cb 0.21 -2.54 0.43 0.00 -0.30 0.00 0.00 42.92 40.72 2b06 s ASP 149 CO 0.30 -1.84 1.32 0.79 -0.17 0.00 0.00 175.17 175.57 2b06 n TRP 150 N 10.14 0.52 -1.85 -5.34 7.02 -1.26 -4.12 117.44 122.55 2b06 n TRP 150 Ca 0.13 -1.26 -0.37 0.00 -1.02 0.00 0.00 57.50 54.98 2b06 n TRP 150 Cb 0.50 -0.31 0.05 0.00 -2.42 0.00 0.00 31.31 29.13 2b06 n TRP 150 CO 0.00 0.00 0.00 -2.00 -2.02 0.00 0.00 177.69 173.67 2b06 s GLU 151 N -3.06 2.82 0.24 -0.99 2.56 -1.26 -5.03 118.70 113.99 2b06 s GLU 151 Ca 0.39 2.02 0.10 0.00 0.00 0.00 0.00 54.97 57.48 2b06 s GLU 151 Cb 0.35 -1.96 -0.05 0.00 2.00 0.00 0.00 34.13 34.47 2b06 s GLU 151 CO 0.01 -1.38 -0.18 -1.59 -0.56 0.00 0.00 175.26 171.57 2b06 s LYS 152 N -3.25 1.52 -0.02 4.30 -2.85 -1.26 -4.07 119.74 114.11 2b06 s LYS 152 Ca 0.79 -1.68 0.05 0.00 -1.00 0.00 0.00 55.97 54.12 2b06 s LYS 152 Cb -0.36 -1.49 -0.01 0.00 -2.06 0.00 0.00 37.83 33.91 2b06 s LYS 152 CO 0.39 0.27 -0.16 0.15 0.10 0.00 0.00 175.35 176.10 2b06 s LYS 153 N -3.54 1.47 -0.16 1.78 1.02 0.35 -4.98 119.74 115.68 2b06 s LYS 153 Ca 0.26 -0.58 -0.01 0.00 0.02 0.00 0.00 55.97 55.67 2b06 s LYS 153 Cb -0.03 -1.37 -0.01 0.00 -0.52 0.00 0.00 37.83 35.90 2b06 s LYS 153 CO 0.11 0.30 -0.12 0.42 -0.92 0.00 0.00 175.35 175.14 2b06 s ILE 154 N -0.20 2.94 -0.38 2.17 -1.09 -1.26 -0.63 121.20 122.74 2b06 s ILE 154 Ca 0.02 -0.68 0.03 0.00 -2.23 0.00 0.00 60.65 57.79 2b06 s ILE 154 Cb -0.08 -2.26 0.02 0.00 -1.58 0.00 0.00 42.46 38.57 2b06 s ILE 154 CO 0.00 0.50 0.60 0.49 -1.23 0.00 0.00 174.94 175.30