#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b35 s GLY 3 N 0.00 1.71 0.41 3.38 0.00 -1.26 -5.01 107.32 106.55 2b35 s GLY 3 Ca 0.00 -1.50 0.18 0.00 0.00 0.00 0.00 44.72 43.40 2b35 s GLY 3 CO 0.00 -1.53 1.82 -2.00 0.00 0.00 0.00 173.10 171.40 2b35 h LEU 4 N 2.60 0.43 -4.33 0.66 6.46 -1.92 -2.66 115.31 116.55 2b35 h LEU 4 Ca -0.46 0.06 -0.54 0.00 -0.12 0.00 0.00 57.88 56.82 2b35 h LEU 4 Cb 1.22 -0.02 -0.42 0.00 -0.73 0.00 0.00 40.66 40.70 2b35 h LEU 4 CO 0.57 0.14 -0.82 0.18 -0.62 0.00 0.00 178.44 177.89 2b35 n LEU 5 N -4.55 4.37 -4.70 2.25 4.32 -0.72 -4.83 117.00 113.14 2b35 n LEU 5 Ca 0.21 -4.81 -0.42 0.00 -0.02 0.00 0.00 56.01 50.97 2b35 n LEU 5 Cb 0.76 -0.30 -0.03 0.00 -1.62 0.00 0.00 43.42 42.24 2b35 n LEU 5 CO 0.29 2.08 0.85 -0.62 -1.22 0.00 0.00 177.39 178.77 2b35 s ASP 6 N -3.54 7.15 -0.37 -1.43 -1.08 -1.00 -2.76 116.67 113.63 2b35 s ASP 6 Ca 0.46 1.86 0.00 0.00 -0.52 0.00 0.00 52.55 54.35 2b35 s ASP 6 Cb 0.40 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 39.29 2b35 s ASP 6 CO -0.08 -0.45 0.00 0.61 0.52 0.00 0.00 175.17 175.77 2b35 n GLY 7 N 3.18 0.65 3.60 2.66 0.00 -1.20 -4.98 105.19 109.09 2b35 n GLY 7 Ca 0.09 -0.65 -0.34 0.00 0.00 0.00 0.00 46.02 45.11 2b35 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b35 s LYS 8 N -1.92 3.40 -0.40 1.61 1.02 -1.21 -5.00 119.74 117.24 2b35 s LYS 8 Ca 0.00 -0.45 -0.18 0.00 0.02 0.00 0.00 55.97 55.36 2b35 s LYS 8 Cb 0.00 -2.89 0.01 0.00 -0.52 0.00 0.00 37.83 34.43 2b35 s LYS 8 CO 0.00 0.45 0.47 1.03 -0.92 0.00 0.00 175.35 176.38 2b35 s ARG 9 N -0.20 3.28 -0.13 1.68 0.52 -1.26 -1.50 118.95 121.35 2b35 s ARG 9 Ca 0.05 -0.55 0.02 0.00 -0.52 0.00 0.00 55.73 54.73 2b35 s ARG 9 Cb -0.13 -3.91 0.00 0.00 0.52 0.00 0.00 34.95 31.43 2b35 s ARG 9 CO 0.02 -0.79 -0.20 0.42 0.02 0.00 0.00 175.30 174.77 2b35 s ILE 10 N 2.26 2.29 0.01 1.52 1.01 -0.43 -0.32 121.20 127.54 2b35 s ILE 10 Ca 0.15 -0.91 -0.24 0.00 0.00 0.00 0.00 60.65 59.64 2b35 s ILE 10 Cb -0.16 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.34 2b35 s ILE 10 CO 0.14 0.54 0.72 -0.22 0.00 0.00 0.00 174.94 176.12 2b35 s LEU 11 N 0.64 4.41 -0.17 2.97 0.20 -0.71 -1.74 118.68 124.28 2b35 s LEU 11 Ca -0.10 1.33 -0.01 0.00 0.69 0.00 0.00 54.13 56.03 2b35 s LEU 11 Cb -0.16 -3.14 0.05 0.00 -0.43 0.00 0.00 46.19 42.51 2b35 s LEU 11 CO 0.02 -0.00 -0.01 -0.69 -0.29 0.00 0.00 176.35 175.38 2b35 s VAL 12 N 0.13 0.83 0.38 1.68 1.01 0.12 -0.35 120.40 124.19 2b35 s VAL 12 Ca 0.37 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.80 2b35 s VAL 12 Cb -0.19 -1.14 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 2b35 s VAL 12 CO 0.21 -0.01 0.58 -0.94 0.00 0.00 0.00 175.10 174.94 2b35 s SER 13 N 1.74 6.11 0.00 3.32 1.04 -0.77 -2.37 113.70 122.77 2b35 s SER 13 Ca -0.00 0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.75 2b35 s SER 13 Cb -0.16 -1.78 0.00 0.00 0.10 0.00 0.00 66.02 64.18 2b35 s SER 13 CO -0.07 -0.44 0.00 0.61 0.98 0.00 0.00 173.24 174.32 2b35 n GLY 14 N -1.86 0.64 3.67 7.32 0.00 -1.26 -3.95 105.19 109.76 2b35 n GLY 14 Ca -0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.57 2b35 n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b35 s ILE 15 N -2.00 4.02 0.00 -0.61 1.01 -1.26 -4.62 121.20 117.74 2b35 s ILE 15 Ca 0.00 1.28 0.00 0.00 0.00 0.00 0.00 60.65 61.93 2b35 s ILE 15 Cb 0.00 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.64 2b35 s ILE 15 CO 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 174.94 174.86 2b35 n ILE 16 N 5.16 0.00 -4.48 2.92 0.13 -1.26 -4.78 119.36 117.04 2b35 n ILE 16 Ca 0.14 0.00 -0.23 0.00 -1.10 0.00 0.00 62.75 61.56 2b35 n ILE 16 Cb 0.44 -0.61 -0.11 0.00 -0.84 0.00 0.00 39.64 38.53 2b35 n ILE 16 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2b35 s THR 17 N -1.90 1.38 -1.59 9.51 -4.23 -1.26 -4.69 115.64 112.85 2b35 s THR 17 Ca 0.00 -2.01 0.26 0.00 -1.18 0.00 0.00 61.69 58.76 2b35 s THR 17 Cb 0.00 -2.82 0.54 0.00 1.34 0.00 0.00 72.50 71.56 2b35 s THR 17 CO 0.00 -0.01 1.89 -0.90 -0.54 0.00 0.00 174.62 175.06 2b35 n ASP 18 N -0.74 0.00 0.02 3.99 5.75 -1.26 -1.45 116.55 122.86 2b35 n ASP 18 Ca -0.03 -0.30 0.12 0.00 -0.01 0.00 0.00 54.79 54.57 2b35 n ASP 18 Cb 0.67 -0.20 0.21 0.00 -1.03 0.00 0.00 41.12 40.76 2b35 n ASP 18 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2b35 n SER 19 N -1.20 0.56 -4.69 -1.12 7.64 -1.26 -4.81 113.62 108.73 2b35 n SER 19 Ca 0.14 -0.15 -0.41 0.00 1.01 0.00 0.00 58.87 59.46 2b35 n SER 19 Cb 0.17 0.28 0.01 0.00 -1.01 0.00 0.00 64.21 63.66 2b35 n SER 19 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2b35 n SER 20 N -1.70 2.52 -0.21 6.43 7.64 -0.53 -4.69 113.62 123.08 2b35 n SER 20 Ca 0.05 1.14 -0.08 0.00 1.01 0.00 0.00 58.87 60.98 2b35 n SER 20 Cb 0.37 -1.48 0.02 0.00 -1.01 0.00 0.00 64.21 62.11 2b35 n SER 20 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2b35 h ILE 21 N 2.20 1.25 -0.09 0.44 2.04 -1.89 -2.88 117.51 118.59 2b35 h ILE 21 Ca -0.47 -0.96 0.03 0.00 1.00 0.00 0.00 64.86 64.46 2b35 h ILE 21 Cb 1.29 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2b35 h ILE 21 CO 0.61 0.35 0.07 0.00 0.00 0.00 0.00 178.15 179.18 2b35 h ALA 22 N 1.02 1.91 -0.19 1.87 0.00 -1.85 0.40 119.26 122.43 2b35 h ALA 22 Ca 0.18 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2b35 h ALA 22 Cb 0.39 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2b35 h ALA 22 CO 0.01 -0.12 -0.26 0.35 0.00 0.00 0.00 179.25 179.23 2b35 h PHE 23 N 0.00 0.62 0.00 0.00 3.57 -1.79 -0.91 116.94 118.43 2b35 h PHE 23 Ca 0.04 -0.21 -0.12 0.00 3.53 0.00 0.00 57.97 61.21 2b35 h PHE 23 Cb 0.19 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 2b35 h PHE 23 CO 0.00 0.91 -0.59 0.45 -2.23 0.00 0.00 178.31 176.84 2b35 h HIS 24 N 0.16 0.00 -0.33 0.41 3.86 -1.29 -0.20 115.15 117.76 2b35 h HIS 24 Ca 0.02 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2b35 h HIS 24 Cb 0.84 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.29 2b35 h HIS 24 CO 0.09 0.59 0.12 0.82 0.86 0.00 0.00 177.93 180.41 2b35 h ILE 25 N 0.00 1.19 -0.09 2.45 2.04 -0.18 -1.31 117.51 121.61 2b35 h ILE 25 Ca -0.01 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.23 2b35 h ILE 25 Cb 1.13 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 38.18 2b35 h ILE 25 CO 0.08 0.21 0.02 0.00 0.00 0.00 0.00 178.15 178.46 2b35 h ALA 26 N 0.96 0.12 -0.43 1.87 0.00 -1.07 -0.65 119.26 120.06 2b35 h ALA 26 Ca 0.11 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.95 2b35 h ALA 26 Cb 0.21 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 2b35 h ALA 26 CO -0.01 -0.25 0.08 -0.09 0.00 0.00 0.00 179.25 178.98 2b35 h ARG 27 N -0.08 0.20 -0.33 0.00 2.43 -0.95 0.14 114.38 115.79 2b35 h ARG 27 Ca 0.03 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.07 2b35 h ARG 27 Cb 0.26 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 2b35 h ARG 27 CO 0.00 0.13 -0.25 0.28 -1.51 0.00 0.00 179.97 178.63 2b35 h VAL 28 N 0.21 1.29 -0.25 0.20 2.07 -1.23 -1.42 116.25 117.12 2b35 h VAL 28 Ca 0.21 -1.40 0.06 0.00 0.82 0.00 0.00 66.70 66.40 2b35 h VAL 28 Cb 0.27 1.46 -0.07 0.00 -1.52 0.00 0.00 31.29 31.43 2b35 h VAL 28 CO -0.28 0.45 -0.23 0.00 0.02 0.00 0.00 177.57 177.53 2b35 h ALA 29 N 0.75 -0.11 -0.52 1.67 0.00 -0.33 -2.31 119.26 118.40 2b35 h ALA 29 Ca 0.06 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 2b35 h ALA 29 Cb 0.81 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 2b35 h ALA 29 CO 0.07 -0.66 0.04 1.96 0.00 0.00 0.00 179.25 180.66 2b35 h GLN 30 N -0.23 0.90 -0.68 0.00 4.20 -0.70 -1.61 115.11 116.97 2b35 h GLN 30 Ca 0.14 -0.26 0.20 0.00 0.06 0.00 0.00 58.65 58.78 2b35 h GLN 30 Cb 0.45 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 2b35 h GLN 30 CO -0.39 0.90 0.53 0.93 -0.67 0.00 0.00 178.83 180.13 2b35 h GLU 31 N 0.77 0.00 -0.64 1.46 5.08 -1.13 -2.35 114.58 117.77 2b35 h GLU 31 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 2b35 h GLU 31 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2b35 h GLU 31 CO 0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 2b35 n GLN 32 N -4.18 3.94 -0.40 2.33 1.13 -0.62 -4.94 117.38 114.64 2b35 n GLN 32 Ca 0.13 -2.76 0.00 0.00 -1.94 0.00 0.00 57.00 52.43 2b35 n GLN 32 Cb 0.79 -1.99 0.00 0.00 0.11 0.00 0.00 30.24 29.15 2b35 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2b35 n GLY 33 N 0.91 0.78 3.85 1.08 0.00 -0.88 -1.76 105.19 109.17 2b35 n GLY 33 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 2b35 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b35 s ALA 34 N -2.20 3.15 -0.14 4.61 0.00 -1.11 -3.25 121.76 122.82 2b35 s ALA 34 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 51.96 52.01 2b35 s ALA 34 Cb 0.00 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 20.10 2b35 s ALA 34 CO 0.00 -0.18 -0.09 -1.14 0.00 0.00 0.00 175.76 174.34 2b35 s GLN 35 N -4.03 3.46 0.01 0.00 0.74 -0.56 -4.51 119.66 114.77 2b35 s GLN 35 Ca 0.57 -0.62 0.05 0.00 0.05 0.00 0.00 55.36 55.41 2b35 s GLN 35 Cb -0.10 -2.73 -0.03 0.00 1.10 0.00 0.00 33.01 31.25 2b35 s GLN 35 CO 0.32 0.24 -0.13 -0.51 -0.55 0.00 0.00 175.29 174.66 2b35 s LEU 36 N 0.30 2.82 -0.18 3.68 1.43 -1.26 -1.31 118.68 124.17 2b35 s LEU 36 Ca -0.08 -0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 52.72 2b35 s LEU 36 Cb -0.15 -1.63 -0.01 0.00 0.03 0.00 0.00 46.19 44.43 2b35 s LEU 36 CO 0.05 0.28 -0.10 -0.69 0.23 0.00 0.00 176.35 176.11 2b35 s VAL 37 N -0.91 3.04 0.28 -1.59 1.01 -0.71 -4.06 120.40 117.46 2b35 s VAL 37 Ca 0.15 -0.63 0.09 0.00 0.00 0.00 0.00 61.98 61.59 2b35 s VAL 37 Cb -0.11 -2.33 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 2b35 s VAL 37 CO 0.05 0.48 0.06 -0.76 0.00 0.00 0.00 175.10 174.93 2b35 s LEU 38 N 1.00 3.30 0.10 3.92 1.43 -0.81 0.11 118.68 127.73 2b35 s LEU 38 Ca -0.01 -0.62 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 2b35 s LEU 38 Cb -0.15 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.22 2b35 s LEU 38 CO -0.01 -0.07 -0.08 0.42 0.23 0.00 0.00 176.35 176.84 2b35 s THR 39 N -2.32 0.77 0.05 5.49 -4.23 -1.00 -0.82 115.64 113.58 2b35 s THR 39 Ca 0.33 -1.81 -0.00 0.00 -1.18 0.00 0.00 61.69 59.03 2b35 s THR 39 Cb -0.06 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.22 2b35 s THR 39 CO 0.21 -0.75 -0.04 -0.83 -0.54 0.00 0.00 174.62 172.67 2b35 s GLY 40 N -2.80 0.48 -0.09 3.99 0.00 0.28 -4.24 107.32 104.94 2b35 s GLY 40 Ca 0.09 -1.08 -0.07 0.00 0.00 0.00 0.00 44.72 43.66 2b35 s GLY 40 CO -0.03 -1.18 -0.13 0.33 0.00 0.00 0.00 173.10 172.09 2b35 n PHE 41 N 0.48 0.34 0.09 1.90 7.35 -1.25 0.48 117.46 126.84 2b35 n PHE 41 Ca -0.16 0.15 0.00 0.00 -0.76 0.00 0.00 57.45 56.67 2b35 n PHE 41 Cb 0.59 -0.45 0.00 0.00 0.35 0.00 0.00 39.48 39.98 2b35 n PHE 41 CO 0.00 0.00 0.00 -3.47 -0.76 0.00 0.00 176.76 172.53 2b35 n ASP 42 N -3.57 0.46 -3.51 -2.13 2.03 -1.26 -4.58 116.55 103.99 2b35 n ASP 42 Ca -0.05 0.29 -0.38 0.00 0.52 0.00 0.00 54.79 55.17 2b35 n ASP 42 Cb 0.20 0.02 -0.03 0.00 -0.72 0.00 0.00 41.12 40.59 2b35 n ASP 42 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2b35 n ARG 43 N -3.44 2.29 0.01 -0.67 1.74 -1.26 -4.73 116.66 110.60 2b35 n ARG 43 Ca 0.00 -2.00 -0.02 0.00 -0.77 0.00 0.00 57.85 55.05 2b35 n ARG 43 Cb 0.02 -2.89 0.23 0.00 -1.02 0.00 0.00 32.46 28.80 2b35 n ARG 43 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2b35 h LEU 44 N 10.63 0.49 -0.03 0.55 3.38 -1.94 -2.08 115.31 126.31 2b35 h LEU 44 Ca 0.54 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.36 2b35 h LEU 44 Cb 0.49 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2b35 h LEU 44 CO 1.80 0.68 -0.01 0.03 0.09 0.00 0.00 178.44 181.03 2b35 h ARG 45 N 0.45 0.06 -0.99 1.13 3.08 -2.01 -2.82 114.38 113.28 2b35 h ARG 45 Ca 0.08 -0.02 0.10 0.00 0.07 0.00 0.00 59.98 60.20 2b35 h ARG 45 Cb 0.55 -0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.53 2b35 h ARG 45 CO 0.04 0.45 0.63 1.25 -1.07 0.00 0.00 179.97 181.27 2b35 h LEU 46 N -0.34 0.96 0.00 3.04 6.46 -1.91 -2.80 115.31 120.72 2b35 h LEU 46 Ca 0.01 0.03 -0.22 0.00 -0.12 0.00 0.00 57.88 57.58 2b35 h LEU 46 Cb 0.44 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 2b35 h LEU 46 CO 0.00 0.55 -1.12 0.16 -0.62 0.00 0.00 178.44 177.41 2b35 h ILE 47 N 1.05 1.48 -0.89 4.05 3.07 -1.42 -3.11 117.51 121.74 2b35 h ILE 47 Ca 0.46 -3.19 0.18 0.00 1.55 0.00 0.00 64.86 63.86 2b35 h ILE 47 Cb 0.36 2.73 -0.11 0.00 -0.27 0.00 0.00 36.82 39.53 2b35 h ILE 47 CO -0.22 0.84 0.45 1.56 -1.05 0.00 0.00 178.15 179.73 2b35 h GLN 48 N 0.00 0.54 -0.52 0.16 1.08 -1.23 0.45 115.11 115.59 2b35 h GLN 48 Ca -0.07 -0.03 0.01 0.00 -1.45 0.00 0.00 58.65 57.11 2b35 h GLN 48 Cb 1.80 -0.12 -0.03 0.00 -0.05 0.00 0.00 27.48 29.08 2b35 h GLN 48 CO 0.11 0.36 0.34 -0.09 -0.95 0.00 0.00 178.83 178.60 2b35 h ARG 49 N 0.55 0.67 -0.13 1.46 2.43 -1.46 -1.62 114.38 116.28 2b35 h ARG 49 Ca 0.52 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 59.45 2b35 h ARG 49 Cb 0.87 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2b35 h ARG 49 CO -0.43 0.44 -0.73 0.82 -1.51 0.00 0.00 179.97 178.56 2b35 h ILE 50 N 0.69 1.32 0.00 1.20 1.08 -1.05 -3.21 117.51 117.54 2b35 h ILE 50 Ca 0.19 -2.02 -0.00 0.00 -0.39 0.00 0.00 64.86 62.65 2b35 h ILE 50 Cb -0.06 2.00 0.00 0.00 -3.07 0.00 0.00 36.82 35.69 2b35 h ILE 50 CO -0.05 0.63 -0.00 0.71 -0.69 0.00 0.00 178.15 178.74 2b35 h THR 51 N 0.43 1.19 -1.53 -0.27 1.35 -0.11 -2.68 112.91 111.29 2b35 h THR 51 Ca -0.04 -0.58 0.47 0.00 -0.55 0.00 0.00 66.41 65.71 2b35 h THR 51 Cb 1.33 1.59 -0.10 0.00 -1.73 0.00 0.00 68.15 69.23 2b35 h THR 51 CO 0.14 0.15 1.05 0.44 -0.25 0.00 0.00 175.52 177.05 2b35 h ASP 52 N -0.25 0.13 0.42 5.36 3.45 -1.33 2.14 116.42 126.34 2b35 h ASP 52 Ca -0.00 0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.53 2b35 h ASP 52 Cb 0.25 0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.09 2b35 h ASP 52 CO 0.00 -0.09 0.00 0.54 -1.57 0.00 0.00 179.24 178.12 2b35 n ARG 53 N -4.37 0.14 -1.85 3.56 1.74 -1.01 -4.80 116.66 110.08 2b35 n ARG 53 Ca 0.38 0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 57.29 2b35 n ARG 53 Cb 1.61 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 31.58 2b35 n ARG 53 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2b35 s LEU 54 N -2.74 3.43 0.51 0.55 1.43 0.72 -4.96 118.68 117.62 2b35 s LEU 54 Ca 0.13 1.97 0.15 0.00 -1.03 0.00 0.00 54.13 55.35 2b35 s LEU 54 Cb 0.11 -4.55 1.23 0.00 0.03 0.00 0.00 46.19 43.01 2b35 s LEU 54 CO 0.27 -1.50 2.13 -0.65 0.23 0.00 0.00 176.35 176.83 2b35 h PRO 55 N 0.18 0.02 -4.92 1.29 0.11 -1.87 -3.42 132.00 123.40 2b35 h PRO 55 Ca -0.47 -0.00 -0.32 0.00 0.11 0.00 0.00 66.00 65.32 2b35 h PRO 55 Cb 1.24 -0.01 -0.19 0.00 0.11 0.00 0.00 31.00 32.16 2b35 h PRO 55 CO 0.55 0.03 -0.74 0.00 -0.21 0.00 0.00 178.00 177.63 2b35 s ALA 56 N -5.05 1.00 0.49 -0.75 0.00 -1.26 -5.08 121.76 111.10 2b35 s ALA 56 Ca -0.05 -1.08 -0.22 0.00 0.00 0.00 0.00 51.96 50.61 2b35 s ALA 56 Cb 0.17 0.02 -0.07 0.00 0.00 0.00 0.00 23.12 23.24 2b35 s ALA 56 CO 0.67 -0.02 1.16 -1.59 0.00 0.00 0.00 175.76 175.99 2b35 s LYS 57 N -2.44 3.62 -0.07 0.00 -2.85 -1.26 -4.98 119.74 111.75 2b35 s LYS 57 Ca 0.01 1.74 -0.17 0.00 -1.00 0.00 0.00 55.97 56.56 2b35 s LYS 57 Cb -0.05 -2.29 0.04 0.00 -2.06 0.00 0.00 37.83 33.47 2b35 s LYS 57 CO 0.00 -0.66 0.41 0.00 0.10 0.00 0.00 175.35 175.20 2b35 s ALA 58 N -1.60 -1.04 0.38 0.59 0.00 -1.26 -4.80 121.76 114.03 2b35 s ALA 58 Ca 0.66 0.80 -0.28 0.00 0.00 0.00 0.00 51.96 53.15 2b35 s ALA 58 Cb -0.28 -0.22 -0.10 0.00 0.00 0.00 0.00 23.12 22.52 2b35 s ALA 58 CO 0.33 -0.26 1.41 -2.14 0.00 0.00 0.00 175.76 175.10 2b35 s PRO 59 N -0.74 4.11 -0.23 0.00 0.02 -1.26 -4.89 135.00 132.01 2b35 s PRO 59 Ca -0.08 2.41 -0.02 0.00 0.02 0.00 0.00 61.00 63.32 2b35 s PRO 59 Cb -0.04 -2.93 0.01 0.00 0.02 0.00 0.00 34.50 31.56 2b35 s PRO 59 CO 0.04 -0.47 -0.07 -1.17 -0.33 0.00 0.00 177.00 175.00 2b35 s LEU 60 N -2.13 2.94 0.37 -5.54 0.20 -1.26 -1.92 118.68 111.35 2b35 s LEU 60 Ca 0.53 -0.67 0.07 0.00 0.69 0.00 0.00 54.13 54.75 2b35 s LEU 60 Cb -0.43 -1.67 -0.00 0.00 -0.43 0.00 0.00 46.19 43.66 2b35 s LEU 60 CO 0.58 -0.07 0.52 -0.76 -0.29 0.00 0.00 176.35 176.32 2b35 s LEU 61 N 1.38 3.83 -0.21 -0.68 1.43 -0.00 -4.97 118.68 119.46 2b35 s LEU 61 Ca 0.03 -0.26 -0.07 0.00 -1.03 0.00 0.00 54.13 52.80 2b35 s LEU 61 Cb -0.15 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.30 2b35 s LEU 61 CO -0.05 -0.58 0.07 -0.70 0.23 0.00 0.00 176.35 175.32 2b35 s GLU 62 N -4.26 3.86 -0.24 1.70 2.12 -1.26 -0.56 118.70 120.06 2b35 s GLU 62 Ca 0.49 -0.39 -0.03 0.00 0.36 0.00 0.00 54.97 55.40 2b35 s GLU 62 Cb -0.10 -3.26 0.10 0.00 0.26 0.00 0.00 34.13 31.13 2b35 s GLU 62 CO 0.32 0.10 0.22 -1.17 -0.54 0.00 0.00 175.26 174.19 2b35 s LEU 63 N 0.84 -0.01 -0.40 2.70 2.96 0.18 -4.84 118.68 120.11 2b35 s LEU 63 Ca 0.04 -0.55 -0.09 0.00 -0.22 0.00 0.00 54.13 53.30 2b35 s LEU 63 Cb -0.14 0.25 0.06 0.00 0.50 0.00 0.00 46.19 46.87 2b35 s LEU 63 CO 0.02 -0.36 0.23 -0.62 -1.32 0.00 0.00 176.35 174.30 2b35 s ASP 64 N 2.29 5.61 0.00 3.68 2.15 -1.26 -3.96 116.67 125.18 2b35 s ASP 64 Ca 0.07 -1.34 0.08 0.00 0.43 0.00 0.00 52.55 51.79 2b35 s ASP 64 Cb -0.15 -1.98 0.50 0.00 -0.30 0.00 0.00 42.92 40.98 2b35 s ASP 64 CO -0.21 -0.48 0.95 1.33 -0.17 0.00 0.00 175.17 176.60 2b35 n VAL 65 N 4.92 0.00 0.97 1.11 0.24 -1.26 0.78 118.33 125.09 2b35 n VAL 65 Ca -0.11 0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.30 2b35 n VAL 65 Cb 0.44 -0.87 0.01 0.00 -1.47 0.00 0.00 33.84 31.95 2b35 n VAL 65 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2b35 n GLN 66 N -1.00 1.45 -3.48 7.34 6.02 -1.26 -4.86 117.38 121.59 2b35 n GLN 66 Ca 0.06 -1.15 -0.41 0.00 -0.01 0.00 0.00 57.00 55.49 2b35 n GLN 66 Cb 0.03 -1.45 -0.10 0.00 1.02 0.00 0.00 30.24 29.73 2b35 n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2b35 s ASN 67 N -2.32 6.10 0.50 1.08 3.04 0.23 -4.95 114.94 118.63 2b35 s ASN 67 Ca 0.20 -0.39 0.30 0.00 0.04 0.00 0.00 52.86 53.00 2b35 s ASN 67 Cb 0.18 -2.16 1.02 0.00 -1.54 0.00 0.00 41.25 38.75 2b35 s ASN 67 CO 0.50 -0.29 1.86 -0.08 -3.04 0.00 0.00 177.10 176.06 2b35 h GLU 68 N 8.49 0.00 0.01 0.43 4.57 -1.91 -2.23 114.58 123.95 2b35 h GLU 68 Ca -0.31 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 57.82 2b35 h GLU 68 Cb 1.15 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.75 2b35 h GLU 68 CO 0.66 0.00 -0.23 0.93 -1.18 0.00 0.00 179.01 179.19 2b35 h GLU 69 N 0.00 0.13 -0.45 1.92 5.08 -1.94 -2.89 114.58 116.42 2b35 h GLU 69 Ca 0.00 -0.16 0.08 0.00 -1.00 0.00 0.00 59.36 58.29 2b35 h GLU 69 Cb 0.67 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.89 2b35 h GLU 69 CO 0.00 0.95 0.02 0.45 -1.00 0.00 0.00 179.01 179.43 2b35 h HIS 70 N -0.62 0.02 -0.47 4.33 3.86 -1.83 -0.96 115.15 119.48 2b35 h HIS 70 Ca -0.03 0.03 0.05 0.00 -1.16 0.00 0.00 60.37 59.26 2b35 h HIS 70 Cb 1.04 0.06 -0.05 0.00 1.06 0.00 0.00 27.41 29.52 2b35 h HIS 70 CO 0.20 -0.07 0.20 -0.07 0.86 0.00 0.00 177.93 179.06 2b35 h LEU 71 N 0.14 0.26 -1.18 2.43 4.07 -1.53 -2.16 115.31 117.35 2b35 h LEU 71 Ca 0.23 0.04 -0.07 0.00 0.08 0.00 0.00 57.88 58.15 2b35 h LEU 71 Cb 0.32 -0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.05 2b35 h LEU 71 CO -0.35 0.19 -0.21 0.00 -1.08 0.00 0.00 178.44 176.98 2b35 h ALA 72 N 1.28 1.31 -0.01 1.53 0.00 -1.07 -2.85 119.26 119.46 2b35 h ALA 72 Ca 0.21 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2b35 h ALA 72 Cb 0.17 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2b35 h ALA 72 CO -0.18 0.46 -0.40 -1.13 0.00 0.00 0.00 179.25 178.01 2b35 n SER 73 N -4.18 1.11 -0.12 0.00 3.41 -0.46 -4.55 113.62 108.82 2b35 n SER 73 Ca -0.01 -0.89 -0.04 0.00 -0.26 0.00 0.00 58.87 57.67 2b35 n SER 73 Cb 0.35 0.28 0.03 0.00 -0.26 0.00 0.00 64.21 64.61 2b35 n SER 73 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2b35 h LEU 74 N 1.12 -0.03 0.04 1.04 6.46 -1.14 -2.42 115.31 120.38 2b35 h LEU 74 Ca 0.00 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.85 2b35 h LEU 74 Cb 0.55 0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.56 2b35 h LEU 74 CO 0.00 0.02 -0.17 0.00 -0.62 0.00 0.00 178.44 177.67 2b35 h ALA 75 N 1.32 -0.25 0.32 1.25 0.00 -1.79 0.07 119.26 120.18 2b35 h ALA 75 Ca 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2b35 h ALA 75 Cb 0.25 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2b35 h ALA 75 CO -0.27 -0.68 -0.25 0.78 0.00 0.00 0.00 179.25 178.83 2b35 h GLY 76 N -0.31 -0.60 0.08 0.00 0.00 -1.86 -1.67 103.07 98.71 2b35 h GLY 76 Ca 0.04 0.28 0.19 0.00 0.00 0.00 0.00 47.33 47.84 2b35 h GLY 76 CO -0.14 -0.23 0.54 3.21 0.00 0.00 0.00 176.54 179.92 2b35 h ARG 77 N -0.57 0.65 -0.33 4.80 3.08 -1.19 0.34 114.38 121.17 2b35 h ARG 77 Ca -0.03 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 2b35 h ARG 77 Cb 0.50 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2b35 h ARG 77 CO -0.00 0.43 -0.03 0.28 -1.07 0.00 0.00 179.97 179.58 2b35 h VAL 78 N 0.67 1.27 -0.80 2.04 2.07 -0.86 -2.74 116.25 117.89 2b35 h VAL 78 Ca 0.56 -1.02 0.05 0.00 0.82 0.00 0.00 66.70 67.11 2b35 h VAL 78 Cb 0.89 1.27 -0.05 0.00 -1.52 0.00 0.00 31.29 31.88 2b35 h VAL 78 CO -0.40 0.33 0.50 0.74 0.02 0.00 0.00 177.57 178.75 2b35 h THR 79 N 0.39 1.07 -0.96 2.57 2.02 -0.09 -0.55 112.91 117.37 2b35 h THR 79 Ca 0.09 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.95 2b35 h THR 79 Cb 0.49 0.05 -0.05 0.00 -1.74 0.00 0.00 68.15 66.90 2b35 h THR 79 CO 0.02 0.17 0.59 -0.08 0.37 0.00 0.00 175.52 176.59 2b35 h GLU 80 N 0.93 1.29 -0.02 6.66 4.81 -1.01 1.80 114.58 129.04 2b35 h GLU 80 Ca 0.34 -0.11 -0.17 0.00 -0.13 0.00 0.00 59.36 59.29 2b35 h GLU 80 Cb 0.10 -0.28 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 2b35 h GLU 80 CO -0.15 0.89 -0.76 0.00 -0.73 0.00 0.00 179.01 178.26 2b35 h ALA 81 N 1.33 0.68 0.00 2.92 0.00 -1.00 -3.26 119.26 119.92 2b35 h ALA 81 Ca 0.34 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2b35 h ALA 81 Cb -0.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2b35 h ALA 81 CO -0.07 0.86 -1.71 0.44 0.00 0.00 0.00 179.25 178.77 2b35 n ILE 82 N -3.73 0.00 0.00 0.00 -5.35 -0.30 -4.99 119.36 105.00 2b35 n ILE 82 Ca -0.03 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.09 2b35 n ILE 82 Cb 0.73 0.26 0.00 0.00 -1.74 0.00 0.00 39.64 38.88 2b35 n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b35 n GLY 83 N 1.35 0.91 3.60 3.28 0.00 0.61 -4.83 105.19 110.12 2b35 n GLY 83 Ca -0.02 -1.41 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 2b35 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b35 n ALA 84 N 1.72 0.08 -0.32 4.61 0.00 -1.20 -2.22 120.51 123.19 2b35 n ALA 84 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2b35 n ALA 84 Cb 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.37 2b35 n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b35 n GLY 85 N 1.31 1.68 3.79 0.00 0.00 -1.26 -5.02 105.19 105.69 2b35 n GLY 85 Ca 0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 2b35 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2b35 s ASN 86 N -3.30 5.34 0.12 1.61 0.01 -0.94 -5.14 114.94 112.64 2b35 s ASN 86 Ca 0.00 -0.32 -0.06 0.00 -0.71 0.00 0.00 52.86 51.77 2b35 s ASN 86 Cb 0.00 -1.30 -0.02 0.00 0.41 0.00 0.00 41.25 40.34 2b35 s ASN 86 CO 0.00 -0.02 0.17 -0.54 -1.51 0.00 0.00 177.10 175.19 2b35 s LYS 87 N -3.76 0.95 0.27 -0.60 1.02 -1.26 -4.93 119.74 111.42 2b35 s LYS 87 Ca 0.32 -1.18 -0.21 0.00 0.02 0.00 0.00 55.97 54.92 2b35 s LYS 87 Cb -0.08 0.32 -0.09 0.00 -0.52 0.00 0.00 37.83 37.46 2b35 s LYS 87 CO 0.24 -0.30 0.80 -0.51 -0.92 0.00 0.00 175.35 174.66 2b35 s LEU 88 N -2.95 4.30 0.00 3.17 1.43 0.11 -4.62 118.68 120.13 2b35 s LEU 88 Ca 0.14 1.54 0.14 0.00 -1.03 0.00 0.00 54.13 54.92 2b35 s LEU 88 Cb 0.05 -3.79 0.17 0.00 0.03 0.00 0.00 46.19 42.64 2b35 s LEU 88 CO -0.04 -0.03 1.02 0.47 0.23 0.00 0.00 176.35 177.99 2b35 n ASP 89 N 0.53 2.37 -3.69 2.29 8.00 0.57 0.67 116.55 127.28 2b35 n ASP 89 Ca -0.00 -1.67 -0.14 0.00 0.71 0.00 0.00 54.79 53.69 2b35 n ASP 89 Cb 0.51 -0.06 -0.08 0.00 -0.02 0.00 0.00 41.12 41.47 2b35 n ASP 89 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2b35 s GLY 90 N -1.13 -0.32 -0.05 0.44 0.00 -1.04 -1.52 107.32 103.70 2b35 s GLY 90 Ca 0.19 0.95 -0.01 0.00 0.00 0.00 0.00 44.72 45.85 2b35 s GLY 90 CO 0.18 0.72 0.03 0.14 0.00 0.00 0.00 173.10 174.17 2b35 s VAL 91 N -0.63 0.08 -0.36 1.40 1.01 -0.30 -1.74 120.40 119.86 2b35 s VAL 91 Ca -0.07 0.28 -0.08 0.00 0.00 0.00 0.00 61.98 62.10 2b35 s VAL 91 Cb -0.03 -0.28 0.04 0.00 0.00 0.00 0.00 36.38 36.11 2b35 s VAL 91 CO 0.04 0.19 0.16 -0.69 0.00 0.00 0.00 175.10 174.80 2b35 s VAL 92 N 1.89 4.14 -0.43 2.92 1.01 0.52 -0.98 120.40 129.47 2b35 s VAL 92 Ca 0.02 -1.04 -0.22 0.00 0.00 0.00 0.00 61.98 60.74 2b35 s VAL 92 Cb -0.12 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 32.93 2b35 s VAL 92 CO -0.03 -0.23 0.70 -2.28 0.00 0.00 0.00 175.10 173.26 2b35 s HIS 93 N 1.47 3.05 -0.43 5.22 2.46 0.12 -1.84 115.29 125.34 2b35 s HIS 93 Ca 0.00 0.11 0.10 0.00 0.47 0.00 0.00 55.06 55.74 2b35 s HIS 93 Cb -0.20 -3.43 0.38 0.00 -0.13 0.00 0.00 32.58 29.20 2b35 s HIS 93 CO 0.04 -0.87 0.89 0.45 -2.47 0.00 0.00 174.74 172.79 2b35 n SER 94 N 6.40 2.52 -4.26 9.88 2.88 -1.25 -1.81 113.62 127.97 2b35 n SER 94 Ca 0.00 -3.23 -0.30 0.00 -1.33 0.00 0.00 58.87 54.01 2b35 n SER 94 Cb 0.48 -0.56 -0.16 0.00 -0.75 0.00 0.00 64.21 63.22 2b35 n SER 94 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2b35 s ILE 95 N -3.59 1.92 -0.22 2.46 1.01 -1.26 -4.21 121.20 117.31 2b35 s ILE 95 Ca 0.41 -1.02 -0.28 0.00 0.00 0.00 0.00 60.65 59.76 2b35 s ILE 95 Cb 0.36 -1.61 0.14 0.00 0.01 0.00 0.00 42.46 41.36 2b35 s ILE 95 CO -0.09 0.54 1.08 -0.83 0.00 0.00 0.00 174.94 175.64 2b35 s GLY 96 N -0.37 -0.15 -0.25 6.18 0.00 -1.26 -4.64 107.32 106.82 2b35 s GLY 96 Ca 0.04 2.41 -0.25 0.00 0.00 0.00 0.00 44.72 46.92 2b35 s GLY 96 CO 0.01 1.33 0.70 -0.12 0.00 0.00 0.00 173.10 175.02 2b35 s PHE 97 N -0.64 -0.76 -0.16 1.90 5.36 -1.26 -4.96 117.98 117.45 2b35 s PHE 97 Ca 0.01 1.84 -0.08 0.00 -0.96 0.00 0.00 56.93 57.75 2b35 s PHE 97 Cb -0.02 0.27 0.06 0.00 -0.34 0.00 0.00 43.02 42.99 2b35 s PHE 97 CO -0.03 -0.38 0.37 1.41 -1.46 0.00 0.00 175.22 175.14 2b35 s MET 98 N 0.30 0.33 0.82 10.12 -2.45 -1.26 -4.06 119.30 123.10 2b35 s MET 98 Ca -0.00 0.78 -0.12 0.00 -1.25 0.00 0.00 55.69 55.10 2b35 s MET 98 Cb -0.05 0.01 0.09 0.00 1.25 0.00 0.00 34.83 36.14 2b35 s MET 98 CO 0.01 -0.18 1.15 -2.14 1.05 0.00 0.00 175.02 174.91 2b35 s PRO 99 N 1.63 1.67 0.51 4.11 0.02 -1.26 -4.86 135.00 136.81 2b35 s PRO 99 Ca -0.08 1.53 0.34 0.00 0.02 0.00 0.00 61.00 62.81 2b35 s PRO 99 Cb -0.09 -1.80 1.59 0.00 0.02 0.00 0.00 34.50 34.22 2b35 s PRO 99 CO -0.12 -2.14 2.01 1.96 -0.33 0.00 0.00 177.00 178.39 2b35 h GLN 100 N -1.18 0.00 -0.93 5.54 1.08 -2.02 -1.78 115.11 115.82 2b35 h GLN 100 Ca -0.45 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 56.79 2b35 h GLN 100 Cb 1.27 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.65 2b35 h GLN 100 CO 0.46 0.00 0.61 0.00 -0.95 0.00 0.00 178.83 178.95 2b35 h THR 101 N 0.00 1.17 -0.37 -0.54 1.03 -1.96 -2.89 112.91 109.35 2b35 h THR 101 Ca 0.00 -0.40 -0.26 0.00 -0.01 0.00 0.00 66.41 65.73 2b35 h THR 101 Cb 0.27 -0.11 -0.19 0.00 -1.07 0.00 0.00 68.15 67.05 2b35 h THR 101 CO 0.00 0.22 -0.51 0.61 -0.01 0.00 0.00 175.52 175.82 2b35 n GLY 102 N -1.39 5.63 3.32 2.99 0.00 -0.67 -4.07 105.19 110.99 2b35 n GLY 102 Ca 0.12 -1.86 0.03 0.00 0.00 0.00 0.00 46.02 44.31 2b35 n GLY 102 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2b35 s MET 103 N -3.40 0.36 0.00 1.61 -2.45 -1.09 -1.84 119.30 112.49 2b35 s MET 103 Ca 0.45 0.78 0.00 0.00 -1.25 0.00 0.00 55.69 55.67 2b35 s MET 103 Cb 0.40 0.46 0.00 0.00 1.25 0.00 0.00 34.83 36.93 2b35 s MET 103 CO -0.02 -0.24 0.00 0.41 1.05 0.00 0.00 175.02 176.22 2b35 n GLY 104 N 5.25 0.59 0.08 2.11 0.00 0.19 -4.55 105.19 108.87 2b35 n GLY 104 Ca -0.07 -1.15 0.12 0.00 0.00 0.00 0.00 46.02 44.91 2b35 n GLY 104 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2b35 h ILE 105 N 0.00 0.00 -3.35 -0.61 6.09 -1.86 -3.35 117.51 114.43 2b35 h ILE 105 Ca 0.00 -0.54 -0.52 0.00 -1.37 0.00 0.00 64.86 62.43 2b35 h ILE 105 Cb 0.00 1.19 0.02 0.00 0.47 0.00 0.00 36.82 38.50 2b35 h ILE 105 CO 0.00 0.00 0.59 0.21 -3.07 0.00 0.00 178.15 175.88 2b35 s ASN 106 N -4.40 7.02 0.27 2.19 2.47 -1.26 -4.97 114.94 116.25 2b35 s ASN 106 Ca 0.07 2.23 -0.30 0.00 0.42 0.00 0.00 52.86 55.27 2b35 s ASN 106 Cb 0.13 -2.60 -0.12 0.00 -1.45 0.00 0.00 41.25 37.20 2b35 s ASN 106 CO 0.70 -0.45 1.52 -2.65 -3.72 0.00 0.00 177.10 172.50 2b35 n PRO 107 N 2.96 2.42 -0.29 0.43 -0.02 -1.26 -4.67 135.00 134.57 2b35 n PRO 107 Ca 0.06 0.86 0.11 0.00 -2.02 0.00 0.00 63.50 62.52 2b35 n PRO 107 Cb 0.44 -2.59 0.26 0.00 -0.02 0.00 0.00 33.50 31.59 2b35 n PRO 107 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2b35 h PHE 108 N 4.52 0.20 0.00 6.00 3.57 -1.93 -0.78 116.94 128.52 2b35 h PHE 108 Ca -0.46 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.06 2b35 h PHE 108 Cb 1.25 0.05 -0.01 0.00 2.79 0.00 0.00 35.95 40.03 2b35 h PHE 108 CO 0.57 -0.25 -0.18 0.74 -2.23 0.00 0.00 178.31 176.96 2b35 h PHE 109 N 0.15 0.00 -0.19 0.41 0.04 -1.97 -3.27 116.94 112.11 2b35 h PHE 109 Ca 0.53 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.30 2b35 h PHE 109 Cb 1.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.20 2b35 h PHE 109 CO -0.34 0.18 0.00 -0.25 -0.60 0.00 0.00 178.31 177.31 2b35 n ASP 110 N -3.34 1.28 -4.62 2.17 8.00 -0.30 -4.75 116.55 114.99 2b35 n ASP 110 Ca 0.00 -1.83 -0.42 0.00 0.71 0.00 0.00 54.79 53.25 2b35 n ASP 110 Cb 0.41 -0.13 -0.04 0.00 -0.02 0.00 0.00 41.12 41.34 2b35 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b35 s ALA 111 N -1.74 3.53 0.29 2.24 0.00 -1.24 -4.91 121.76 119.93 2b35 s ALA 111 Ca 0.23 -0.30 -0.29 0.00 0.00 0.00 0.00 51.96 51.60 2b35 s ALA 111 Cb 0.12 -3.41 -0.10 0.00 0.00 0.00 0.00 23.12 19.73 2b35 s ALA 111 CO 0.17 -1.27 1.15 -2.14 0.00 0.00 0.00 175.76 173.67 2b35 s PRO 112 N 3.15 4.58 0.46 0.00 0.02 -1.26 -4.92 135.00 137.03 2b35 s PRO 112 Ca 0.36 1.90 0.23 0.00 0.02 0.00 0.00 61.00 63.51 2b35 s PRO 112 Cb -0.14 -3.16 1.25 0.00 0.02 0.00 0.00 34.50 32.47 2b35 s PRO 112 CO 0.13 0.12 1.86 -0.92 -0.33 0.00 0.00 177.00 177.87 2b35 h TYR 113 N 3.73 0.33 0.00 6.54 3.20 -1.97 -1.33 116.97 127.47 2b35 h TYR 113 Ca -0.47 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.35 2b35 h TYR 113 Cb 1.21 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.38 2b35 h TYR 113 CO 0.58 0.08 -0.27 0.00 -1.64 0.00 0.00 178.16 176.91 2b35 h ALA 114 N 1.59 1.34 0.27 1.82 0.00 -1.98 0.33 119.26 122.63 2b35 h ALA 114 Ca 0.46 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2b35 h ALA 114 Cb 1.40 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2b35 h ALA 114 CO -0.12 0.34 -0.13 -0.44 0.00 0.00 0.00 179.25 178.90 2b35 h ASP 115 N 0.00 -0.31 -1.01 0.00 3.45 -1.63 -3.02 116.42 113.90 2b35 h ASP 115 Ca -0.00 -0.09 0.27 0.00 0.43 0.00 0.00 57.03 57.64 2b35 h ASP 115 Cb 0.55 0.08 -0.06 0.00 -0.56 0.00 0.00 39.33 39.34 2b35 h ASP 115 CO 0.04 0.18 0.69 0.58 -1.57 0.00 0.00 179.24 179.15 2b35 h VAL 116 N -1.05 0.53 -0.30 -1.35 2.07 -1.43 0.15 116.25 114.87 2b35 h VAL 116 Ca -0.04 -0.07 -0.10 0.00 0.82 0.00 0.00 66.70 67.31 2b35 h VAL 116 Cb 0.38 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2b35 h VAL 116 CO 0.06 0.04 -0.25 -1.28 0.02 0.00 0.00 177.57 176.16 2b35 h SER 117 N 0.20 0.59 -0.05 0.57 0.87 -0.39 -0.90 113.55 114.44 2b35 h SER 117 Ca 0.52 -0.21 -0.09 0.00 -1.23 0.00 0.00 61.79 60.78 2b35 h SER 117 Cb 1.67 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 63.47 2b35 h SER 117 CO -0.13 0.83 -0.34 0.50 -0.53 0.00 0.00 176.83 177.16 2b35 h LYS 118 N 0.51 0.31 -0.34 2.24 3.64 -0.86 -0.68 116.57 121.39 2b35 h LYS 118 Ca 0.07 -0.27 0.07 0.00 -1.27 0.00 0.00 60.65 59.25 2b35 h LYS 118 Cb 0.70 0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.51 2b35 h LYS 118 CO 0.05 0.93 -0.13 0.78 -2.27 0.00 0.00 179.45 178.81 2b35 h GLY 119 N -0.21 0.16 0.90 5.01 0.00 -1.34 -0.44 103.07 107.15 2b35 h GLY 119 Ca -0.03 0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.43 2b35 h GLY 119 CO 0.07 -0.16 0.03 -2.22 0.00 0.00 0.00 176.54 174.26 2b35 h ILE 120 N -0.07 1.24 -0.41 2.60 2.04 -1.16 0.52 117.51 122.28 2b35 h ILE 120 Ca 0.17 -0.87 0.08 0.00 1.00 0.00 0.00 64.86 65.24 2b35 h ILE 120 Cb 0.33 1.19 -0.08 0.00 -0.74 0.00 0.00 36.82 37.52 2b35 h ILE 120 CO -0.39 0.29 -0.10 -0.74 0.00 0.00 0.00 178.15 177.21 2b35 h HIS 121 N 0.36 -0.21 -0.14 1.37 2.76 -0.96 0.36 115.15 118.69 2b35 h HIS 121 Ca 0.09 0.04 -0.22 0.00 -2.20 0.00 0.00 60.37 58.08 2b35 h HIS 121 Cb 0.39 0.16 0.01 0.00 1.55 0.00 0.00 27.41 29.51 2b35 h HIS 121 CO 0.03 -0.17 -0.78 0.82 -1.30 0.00 0.00 177.93 176.53 2b35 h ILE 122 N 0.00 1.28 0.06 6.26 2.04 -0.84 -1.52 117.51 124.81 2b35 h ILE 122 Ca 0.20 -1.98 -0.31 0.00 1.00 0.00 0.00 64.86 63.78 2b35 h ILE 122 Cb 0.30 2.02 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 2b35 h ILE 122 CO -0.42 0.63 -1.66 0.28 0.00 0.00 0.00 178.15 176.97 2b35 h SER 123 N 0.50 0.21 0.00 1.72 0.02 0.32 -3.40 113.55 112.92 2b35 h SER 123 Ca -0.06 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2b35 h SER 123 Cb 1.41 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.88 2b35 h SER 123 CO 0.16 1.33 -0.24 0.00 -1.14 0.00 0.00 176.83 176.93 2b35 n ALA 124 N -2.67 2.48 -0.28 3.77 0.00 0.12 -4.73 120.51 119.19 2b35 n ALA 124 Ca -0.19 -0.20 0.20 0.00 0.00 0.00 0.00 53.44 53.25 2b35 n ALA 124 Cb 1.04 0.19 0.49 0.00 0.00 0.00 0.00 19.45 21.17 2b35 n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2b35 h TYR 125 N -0.24 0.64 0.00 0.00 5.03 -1.42 -1.19 116.97 119.79 2b35 h TYR 125 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.33 2b35 h TYR 125 Cb 0.24 -0.19 0.00 0.00 1.55 0.00 0.00 36.73 38.33 2b35 h TYR 125 CO -0.11 0.13 0.00 -1.13 -1.32 0.00 0.00 178.16 175.74 2b35 n SER 126 N -4.57 0.05 -0.06 -2.11 3.41 -0.57 -2.12 113.62 107.66 2b35 n SER 126 Ca 0.22 0.51 -0.16 0.00 -0.26 0.00 0.00 58.87 59.18 2b35 n SER 126 Cb 0.74 -0.53 -0.06 0.00 -0.26 0.00 0.00 64.21 64.11 2b35 n SER 126 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2b35 h TYR 127 N 0.00 1.09 -0.08 7.33 3.20 -1.50 -1.59 116.97 125.42 2b35 h TYR 127 Ca 0.00 -0.43 -0.02 0.00 3.14 0.00 0.00 58.73 61.42 2b35 h TYR 127 Cb 0.25 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.33 2b35 h TYR 127 CO 0.00 1.26 -0.04 0.00 -1.64 0.00 0.00 178.16 177.74 2b35 h ALA 128 N 0.62 0.12 0.00 1.82 0.00 -1.55 -2.84 119.26 117.42 2b35 h ALA 128 Ca -0.01 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.57 2b35 h ALA 128 Cb 1.26 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2b35 h ALA 128 CO 0.14 -0.12 -0.40 0.66 0.00 0.00 0.00 179.25 179.53 2b35 h SER 129 N -0.20 0.00 -0.11 0.00 4.64 -1.46 0.32 113.55 116.74 2b35 h SER 129 Ca 0.02 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.28 2b35 h SER 129 Cb 0.49 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 2b35 h SER 129 CO 0.01 0.40 -0.17 -0.03 -0.87 0.00 0.00 176.83 176.18 2b35 h MET 130 N 0.00 0.31 -0.54 4.77 -1.53 -1.36 -2.95 114.93 113.62 2b35 h MET 130 Ca -0.00 -0.18 -0.01 0.00 -3.44 0.00 0.00 59.70 56.06 2b35 h MET 130 Cb 0.75 0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 31.79 2b35 h MET 130 CO 0.05 0.76 0.28 0.00 0.14 0.00 0.00 176.91 178.14 2b35 h ALA 131 N 0.55 1.48 -1.00 0.39 0.00 -1.19 -0.99 119.26 118.49 2b35 h ALA 131 Ca 0.01 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2b35 h ALA 131 Cb 0.73 -0.22 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 2b35 h ALA 131 CO 0.04 0.43 0.65 -0.22 0.00 0.00 0.00 179.25 180.14 2b35 h LYS 132 N 0.76 1.16 0.00 0.00 3.64 -0.36 -0.77 116.57 120.99 2b35 h LYS 132 Ca 0.19 -0.07 -0.19 0.00 -1.27 0.00 0.00 60.65 59.31 2b35 h LYS 132 Cb 0.04 -0.26 -0.03 0.00 -0.41 0.00 0.00 32.23 31.57 2b35 h LYS 132 CO -0.03 0.77 -1.19 0.00 -2.27 0.00 0.00 179.45 176.73 2b35 h ALA 133 N 1.45 0.62 0.00 5.00 0.00 -1.24 -3.39 119.26 121.70 2b35 h ALA 133 Ca 0.43 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2b35 h ALA 133 Cb 0.14 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2b35 h ALA 133 CO -0.17 1.08 -1.46 1.28 0.00 0.00 0.00 179.25 179.98 2b35 n LEU 134 N -3.10 0.12 -0.31 0.00 4.77 -0.43 -4.45 117.00 113.61 2b35 n LEU 134 Ca -0.07 -0.09 0.03 0.00 -0.03 0.00 0.00 56.01 55.85 2b35 n LEU 134 Cb 0.89 0.00 0.23 0.00 -2.33 0.00 0.00 43.42 42.20 2b35 n LEU 134 CO 0.44 0.03 1.25 0.25 -1.33 0.00 0.00 177.39 178.03 2b35 h LEU 135 N 0.00 0.93 -0.56 2.23 5.85 -1.33 -2.36 115.31 120.08 2b35 h LEU 135 Ca 0.00 0.00 0.08 0.00 0.84 0.00 0.00 57.88 58.80 2b35 h LEU 135 Cb 0.59 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.36 2b35 h LEU 135 CO 0.00 0.61 0.21 -0.65 -0.34 0.00 0.00 178.44 178.27 2b35 h PRO 136 N 1.06 0.39 -1.02 5.25 0.11 -1.80 -2.76 132.00 133.22 2b35 h PRO 136 Ca 0.38 -0.02 -0.43 0.00 0.11 0.00 0.00 66.00 66.04 2b35 h PRO 136 Cb 0.15 -0.09 -0.24 0.00 0.11 0.00 0.00 31.00 30.93 2b35 h PRO 136 CO -0.14 0.26 0.54 0.44 -0.21 0.00 0.00 178.00 178.89 2b35 n ILE 137 N -4.98 2.82 -4.04 4.15 -5.35 -0.92 -4.91 119.36 106.13 2b35 n ILE 137 Ca 0.07 -1.63 -0.29 0.00 -0.27 0.00 0.00 62.75 60.63 2b35 n ILE 137 Cb 0.23 -0.65 -0.06 0.00 -1.74 0.00 0.00 39.64 37.42 2b35 n ILE 137 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2b35 s MET 138 N -2.67 2.98 0.12 6.28 -1.94 -1.01 0.09 119.30 123.14 2b35 s MET 138 Ca 0.46 -0.70 -0.07 0.00 -1.71 0.00 0.00 55.69 53.67 2b35 s MET 138 Cb 0.38 -2.76 -0.06 0.00 2.01 0.00 0.00 34.83 34.41 2b35 s MET 138 CO 0.08 0.55 0.39 -0.80 -0.01 0.00 0.00 175.02 175.23 2b35 s ASN 139 N -2.61 6.55 0.40 3.03 0.02 0.21 -4.82 114.94 117.73 2b35 s ASN 139 Ca 0.31 0.68 -0.24 0.00 -1.02 0.00 0.00 52.86 52.59 2b35 s ASN 139 Cb -0.12 -2.13 -0.12 0.00 0.02 0.00 0.00 41.25 38.90 2b35 s ASN 139 CO 0.23 0.10 0.75 -2.65 0.02 0.00 0.00 177.10 175.55 2b35 n PRO 140 N 0.43 0.87 -0.91 -0.60 -0.02 -1.25 -0.58 135.00 132.94 2b35 n PRO 140 Ca -0.05 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 2b35 n PRO 140 Cb 0.52 -1.70 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 2b35 n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b35 n GLY 141 N 1.54 0.66 3.52 -1.23 0.00 -0.31 -5.00 105.19 104.36 2b35 n GLY 141 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2b35 n GLY 141 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b35 s GLY 142 N -2.00 1.53 -0.07 -0.02 0.00 0.26 -4.87 107.32 102.14 2b35 s GLY 142 Ca 0.00 -0.70 -0.06 0.00 0.00 0.00 0.00 44.72 43.95 2b35 s GLY 142 CO 0.00 0.15 0.19 -0.45 0.00 0.00 0.00 173.10 172.99 2b35 s SER 143 N -3.43 -0.20 -0.11 1.64 0.15 -0.57 -2.27 113.70 108.91 2b35 s SER 143 Ca 0.69 0.39 0.02 0.00 0.70 0.00 0.00 55.95 57.75 2b35 s SER 143 Cb -0.14 0.37 0.02 0.00 -1.71 0.00 0.00 66.02 64.56 2b35 s SER 143 CO 0.58 -0.08 -0.15 -0.63 1.20 0.00 0.00 173.24 174.16 2b35 s ILE 144 N 0.33 1.49 -0.01 6.45 1.01 0.12 -1.15 121.20 129.44 2b35 s ILE 144 Ca -0.02 -0.63 0.06 0.00 0.00 0.00 0.00 60.65 60.06 2b35 s ILE 144 Cb -0.03 -1.37 -0.02 0.00 0.01 0.00 0.00 42.46 41.06 2b35 s ILE 144 CO -0.01 0.44 -0.19 0.54 0.00 0.00 0.00 174.94 175.72 2b35 s VAL 145 N 1.04 1.51 0.04 2.92 0.11 -0.16 -0.30 120.40 125.56 2b35 s VAL 145 Ca -0.06 -0.83 0.05 0.00 -2.93 0.00 0.00 61.98 58.21 2b35 s VAL 145 Cb -0.15 -1.26 -0.02 0.00 -1.53 0.00 0.00 36.38 33.42 2b35 s VAL 145 CO -0.02 0.41 -0.15 -0.83 -3.33 0.00 0.00 175.10 171.18 2b35 s GLY 146 N -0.49 0.85 0.17 6.54 0.00 -0.79 0.11 107.32 113.71 2b35 s GLY 146 Ca 0.07 -0.88 -0.22 0.00 0.00 0.00 0.00 44.72 43.69 2b35 s GLY 146 CO -0.01 -0.85 0.72 1.06 0.00 0.00 0.00 173.10 174.03 2b35 s MET 147 N -1.18 4.40 0.13 2.90 -1.94 -0.75 -0.46 119.30 122.40 2b35 s MET 147 Ca 0.02 0.99 0.01 0.00 -1.71 0.00 0.00 55.69 55.00 2b35 s MET 147 Cb -0.08 -3.13 -0.04 0.00 2.01 0.00 0.00 34.83 33.58 2b35 s MET 147 CO 0.01 0.53 0.00 0.34 -0.01 0.00 0.00 175.02 175.90 2b35 s ASP 148 N -1.30 0.84 -0.15 3.03 2.15 0.36 -4.86 116.67 116.73 2b35 s ASP 148 Ca 0.37 -1.14 -0.04 0.00 0.43 0.00 0.00 52.55 52.17 2b35 s ASP 148 Cb -0.20 0.18 0.07 0.00 -0.30 0.00 0.00 42.92 42.66 2b35 s ASP 148 CO 0.23 -0.60 0.16 0.12 -0.17 0.00 0.00 175.17 174.91 2b35 s PHE 149 N -3.80 -0.12 -0.30 -5.34 2.19 -1.26 -2.25 117.98 107.10 2b35 s PHE 149 Ca 0.20 0.20 -0.27 0.00 0.33 0.00 0.00 56.93 57.40 2b35 s PHE 149 Cb 0.07 -0.42 -0.11 0.00 -1.31 0.00 0.00 43.02 41.24 2b35 s PHE 149 CO 0.00 -0.47 1.24 -3.47 1.83 0.00 0.00 175.22 174.36 2b35 n ASP 150 N 5.31 0.48 -1.08 6.13 2.03 -1.26 -4.81 116.55 123.35 2b35 n ASP 150 Ca -0.06 0.44 0.10 0.00 0.52 0.00 0.00 54.79 55.80 2b35 n ASP 150 Cb 0.49 -0.54 0.23 0.00 -0.72 0.00 0.00 41.12 40.58 2b35 n ASP 150 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2b35 n PRO 151 N 4.24 2.50 0.23 -0.67 -0.04 -1.26 -4.66 135.00 135.34 2b35 n PRO 151 Ca 0.31 -2.29 0.15 0.00 -0.04 0.00 0.00 63.50 61.63 2b35 n PRO 151 Cb -0.03 -1.47 0.81 0.00 -0.04 0.00 0.00 33.50 32.78 2b35 n PRO 151 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2b35 h SER 152 N 3.81 0.00 -3.86 3.54 0.02 -1.94 -3.40 113.55 111.72 2b35 h SER 152 Ca 0.00 0.00 -0.45 0.00 -0.84 0.00 0.00 61.79 60.50 2b35 h SER 152 Cb 0.91 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 63.14 2b35 h SER 152 CO 0.00 0.00 -0.80 -0.13 -1.14 0.00 0.00 176.83 174.76 2b35 s ARG 153 N -4.75 1.09 0.92 3.45 0.52 -1.26 -5.13 118.95 113.79 2b35 s ARG 153 Ca -0.05 -0.37 -0.11 0.00 -0.52 0.00 0.00 55.73 54.69 2b35 s ARG 153 Cb 0.16 -1.01 0.15 0.00 0.52 0.00 0.00 34.95 34.77 2b35 s ARG 153 CO 0.59 0.15 1.12 0.00 0.02 0.00 0.00 175.30 177.17 2b35 s ALA 154 N 0.12 1.34 0.09 2.13 0.00 -1.26 -5.06 121.76 119.11 2b35 s ALA 154 Ca -0.02 0.41 -0.26 0.00 0.00 0.00 0.00 51.96 52.09 2b35 s ALA 154 Cb -0.09 -3.38 0.07 0.00 0.00 0.00 0.00 23.12 19.72 2b35 s ALA 154 CO 0.01 -2.73 0.64 0.00 0.00 0.00 0.00 175.76 173.67 2b35 s MET 155 N -4.68 1.19 0.93 0.00 0.23 -1.26 -5.15 119.30 110.55 2b35 s MET 155 Ca 0.66 -0.23 -0.10 0.00 -1.03 0.00 0.00 55.69 54.98 2b35 s MET 155 Cb -0.22 0.55 0.15 0.00 -1.53 0.00 0.00 34.83 33.79 2b35 s MET 155 CO 0.58 -0.48 1.14 -1.25 -2.03 0.00 0.00 175.02 172.98 2b35 s PRO 156 N -2.91 0.91 0.00 3.16 0.04 -1.26 -4.02 135.00 130.91 2b35 s PRO 156 Ca -0.03 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2b35 s PRO 156 Cb -0.01 -1.72 0.00 0.00 0.04 0.00 0.00 34.50 32.81 2b35 s PRO 156 CO -0.06 -2.69 0.00 0.00 0.04 0.00 0.00 177.00 174.29 2b35 n ALA 157 N -4.27 0.00 -0.17 8.56 0.00 -1.26 -4.41 120.51 118.96 2b35 n ALA 157 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.68 2b35 n ALA 157 Cb 0.52 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.43 2b35 n ALA 157 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2b35 h TYR 158 N 0.00 0.57 0.00 0.00 3.20 -1.86 0.55 116.97 119.44 2b35 h TYR 158 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 2b35 h TYR 158 Cb 0.00 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.09 2b35 h TYR 158 CO 0.00 0.24 0.00 0.09 -1.64 0.00 0.00 178.16 176.85 2b35 n ASN 159 N -4.49 0.00 0.21 -2.11 3.02 -1.26 -1.04 115.26 109.59 2b35 n ASN 159 Ca 0.13 0.00 0.14 0.00 -0.03 0.00 0.00 54.58 54.82 2b35 n ASN 159 Cb 0.44 0.00 0.38 0.00 -0.61 0.00 0.00 39.78 40.00 2b35 n ASN 159 CO 0.00 0.00 0.00 -0.50 -2.62 0.00 0.00 177.26 174.14 2b35 h TRP 160 N 0.00 0.00 -0.38 3.10 4.06 -1.65 -2.83 115.95 118.25 2b35 h TRP 160 Ca 0.00 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 60.88 2b35 h TRP 160 Cb 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 2b35 h TRP 160 CO 0.00 0.00 -0.07 1.98 -3.56 0.00 0.00 178.44 176.79 2b35 h MET 161 N 0.00 0.63 -0.57 0.49 4.05 -1.24 -1.94 114.93 116.36 2b35 h MET 161 Ca 0.00 -0.18 0.02 0.00 -0.28 0.00 0.00 59.70 59.27 2b35 h MET 161 Cb 0.76 -0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 31.45 2b35 h MET 161 CO 0.00 0.71 0.35 1.15 0.23 0.00 0.00 176.91 179.35 2b35 h THR 162 N 0.59 1.07 -0.13 -0.77 2.02 -1.50 0.16 112.91 114.35 2b35 h THR 162 Ca 0.11 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 2b35 h THR 162 Cb 0.48 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 2b35 h THR 162 CO 0.03 0.13 -0.20 0.58 0.37 0.00 0.00 175.52 176.42 2b35 h VAL 163 N 0.70 1.21 -0.15 3.16 2.07 -1.53 -0.93 116.25 120.78 2b35 h VAL 163 Ca 0.23 -0.96 -0.21 0.00 0.82 0.00 0.00 66.70 66.57 2b35 h VAL 163 Cb 0.01 1.34 0.01 0.00 -1.52 0.00 0.00 31.29 31.12 2b35 h VAL 163 CO -0.09 0.29 -0.74 0.00 0.02 0.00 0.00 177.57 177.05 2b35 h ALA 164 N 1.59 0.39 -0.80 1.67 0.00 -0.73 -2.44 119.26 118.95 2b35 h ALA 164 Ca 0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 2b35 h ALA 164 Cb 0.48 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2b35 h ALA 164 CO 0.03 0.70 0.46 0.87 0.00 0.00 0.00 179.25 181.31 2b35 h LYS 165 N 0.50 1.10 -0.72 0.00 1.79 -0.22 0.06 116.57 119.08 2b35 h LYS 165 Ca -0.04 -0.11 0.08 0.00 -2.18 0.00 0.00 60.65 58.39 2b35 h LYS 165 Cb 1.36 -0.22 -0.06 0.00 -1.58 0.00 0.00 32.23 31.72 2b35 h LYS 165 CO 0.15 0.79 0.39 0.77 -1.08 0.00 0.00 179.45 180.47 2b35 h SER 166 N 1.10 0.56 -0.00 0.86 0.02 -1.12 -0.68 113.55 114.28 2b35 h SER 166 Ca 0.28 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2b35 h SER 166 Cb -0.01 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 2b35 h SER 166 CO -0.05 0.34 0.00 0.00 -1.14 0.00 0.00 176.83 175.98 2b35 h ALA 167 N 1.39 0.00 -0.57 3.77 0.00 -1.00 -2.84 119.26 120.01 2b35 h ALA 167 Ca 0.34 -0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.29 2b35 h ALA 167 Cb 0.27 -0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.96 2b35 h ALA 167 CO -0.22 -0.43 -0.12 1.25 0.00 0.00 0.00 179.25 179.74 2b35 h LEU 168 N -0.14 -0.48 -0.87 0.00 7.12 -0.63 0.33 115.31 120.64 2b35 h LEU 168 Ca 0.00 0.17 0.09 0.00 0.13 0.00 0.00 57.88 58.26 2b35 h LEU 168 Cb 0.14 0.33 -0.07 0.00 -0.53 0.00 0.00 40.66 40.54 2b35 h LEU 168 CO -0.00 -0.17 0.52 -0.33 -0.13 0.00 0.00 178.44 178.33 2b35 h GLU 169 N 0.02 0.88 -0.16 1.25 5.08 -1.05 0.49 114.58 121.09 2b35 h GLU 169 Ca 0.28 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.54 2b35 h GLU 169 Cb 0.43 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 2b35 h GLU 169 CO -0.57 0.58 -0.09 1.03 -1.00 0.00 0.00 179.01 178.96 2b35 h SER 170 N 0.90 0.36 -0.90 1.42 0.87 -1.07 -2.54 113.55 112.58 2b35 h SER 170 Ca 0.41 -0.42 0.05 0.00 -1.23 0.00 0.00 61.79 60.59 2b35 h SER 170 Cb 0.31 -0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 62.11 2b35 h SER 170 CO -0.22 0.70 0.58 0.58 -0.53 0.00 0.00 176.83 177.93 2b35 h VAL 171 N 0.01 1.11 -0.68 2.23 2.07 0.42 -2.42 116.25 118.99 2b35 h VAL 171 Ca 0.04 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 67.23 2b35 h VAL 171 Cb 0.57 -0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.21 2b35 h VAL 171 CO 0.03 0.20 0.40 -1.13 0.02 0.00 0.00 177.57 177.09 2b35 h ASN 172 N 1.09 0.63 -0.12 0.57 -1.24 0.06 0.45 115.58 117.01 2b35 h ASN 172 Ca 0.37 0.01 -0.04 0.00 0.71 0.00 0.00 56.30 57.36 2b35 h ASN 172 Cb 0.08 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.00 2b35 h ASN 172 CO -0.14 0.43 -0.02 0.03 -1.29 0.00 0.00 177.43 176.43 2b35 h ARG 173 N 0.77 0.36 0.11 6.67 3.08 -1.03 -1.27 114.38 123.08 2b35 h ARG 173 Ca 0.29 -0.07 -0.27 0.00 0.07 0.00 0.00 59.98 60.00 2b35 h ARG 173 Cb 0.10 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2b35 h ARG 173 CO -0.14 0.41 -1.21 0.74 -1.07 0.00 0.00 179.97 178.70 2b35 h PHE 174 N 0.35 0.44 -0.52 3.04 -1.00 -0.88 -3.29 116.94 115.09 2b35 h PHE 174 Ca 0.08 -0.32 -0.06 0.00 2.81 0.00 0.00 57.97 60.48 2b35 h PHE 174 Cb 0.28 -0.02 -0.02 0.00 3.61 0.00 0.00 35.95 39.80 2b35 h PHE 174 CO 0.01 1.25 0.09 0.28 -1.61 0.00 0.00 178.31 178.32 2b35 h VAL 175 N 0.07 1.23 -0.03 -0.55 2.07 0.04 -2.44 116.25 116.63 2b35 h VAL 175 Ca -0.12 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.51 2b35 h VAL 175 Cb 1.94 0.74 -0.00 0.00 -1.52 0.00 0.00 31.29 32.44 2b35 h VAL 175 CO 0.20 0.32 -0.07 0.00 0.02 0.00 0.00 177.57 178.03 2b35 h ALA 176 N 1.32 1.83 -0.24 1.67 0.00 -1.32 0.37 119.26 122.89 2b35 h ALA 176 Ca 0.17 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 2b35 h ALA 176 Cb 0.34 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.11 2b35 h ALA 176 CO 0.00 0.13 -0.56 0.00 0.00 0.00 0.00 179.25 178.82 2b35 h ARG 177 N 0.04 0.75 0.01 0.00 3.08 -1.51 -1.50 114.38 115.24 2b35 h ARG 177 Ca 0.01 -0.48 -0.19 0.00 0.07 0.00 0.00 59.98 59.39 2b35 h ARG 177 Cb 0.16 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 2b35 h ARG 177 CO 0.01 1.11 -0.88 0.93 -1.07 0.00 0.00 179.97 180.06 2b35 h GLU 178 N 0.57 0.07 0.00 0.04 4.39 -1.37 -3.32 114.58 114.97 2b35 h GLU 178 Ca 0.01 -0.08 -0.13 0.00 0.34 0.00 0.00 59.36 59.50 2b35 h GLU 178 Cb 1.15 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.80 2b35 h GLU 178 CO 0.12 0.90 -0.61 0.00 -1.16 0.00 0.00 179.01 178.27 2b35 h ALA 179 N 1.06 0.92 0.00 3.43 0.00 -0.82 -3.14 119.26 120.72 2b35 h ALA 179 Ca -0.02 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 2b35 h ALA 179 Cb 1.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2b35 h ALA 179 CO 0.12 0.76 -0.17 0.78 0.00 0.00 0.00 179.25 180.74 2b35 h GLY 180 N 2.02 0.00 2.00 0.00 0.00 -1.23 0.89 103.07 106.74 2b35 h GLY 180 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2b35 h GLY 180 CO 0.08 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.90 2b35 n LYS 181 N -4.24 0.02 0.00 4.80 5.02 -1.19 -2.01 118.16 120.56 2b35 n LYS 181 Ca -0.02 0.43 0.02 0.00 -2.02 0.00 0.00 58.31 56.72 2b35 n LYS 181 Cb 0.24 -1.55 0.02 0.00 -0.02 0.00 0.00 35.03 33.71 2b35 n LYS 181 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2b35 n TYR 182 N -1.60 0.00 -1.09 2.13 4.02 0.18 -4.98 117.16 115.82 2b35 n TYR 182 Ca 0.01 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.87 2b35 n TYR 182 Cb 0.07 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.37 2b35 n TYR 182 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2b35 n GLY 183 N 0.32 0.63 3.72 2.72 0.00 -0.85 -3.94 105.19 107.79 2b35 n GLY 183 Ca 0.03 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 44.93 2b35 n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b35 s VAL 184 N -2.09 4.52 0.00 1.61 1.01 -0.44 -1.16 120.40 123.85 2b35 s VAL 184 Ca 0.00 -0.17 -0.08 0.00 0.00 0.00 0.00 61.98 61.73 2b35 s VAL 184 Cb 0.00 -2.91 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 2b35 s VAL 184 CO 0.00 0.61 0.29 -0.13 0.00 0.00 0.00 175.10 175.87 2b35 s ARG 185 N -0.91 3.63 -0.11 2.72 0.52 -0.96 -3.20 118.95 120.65 2b35 s ARG 185 Ca 0.14 0.02 0.02 0.00 -0.52 0.00 0.00 55.73 55.39 2b35 s ARG 185 Cb -0.11 -3.10 0.01 0.00 0.52 0.00 0.00 34.95 32.27 2b35 s ARG 185 CO 0.03 0.66 -0.17 0.45 0.02 0.00 0.00 175.30 176.28 2b35 s SER 186 N -1.55 2.53 0.12 0.23 0.15 -1.26 0.16 113.70 114.08 2b35 s SER 186 Ca 0.26 -0.45 -0.09 0.00 0.70 0.00 0.00 55.95 56.38 2b35 s SER 186 Cb -0.14 -1.14 -0.00 0.00 -1.71 0.00 0.00 66.02 63.02 2b35 s SER 186 CO 0.15 0.04 0.22 0.20 1.20 0.00 0.00 173.24 175.05 2b35 s ASN 187 N 0.84 0.09 -0.02 5.45 0.01 0.58 0.20 114.94 122.10 2b35 s ASN 187 Ca -0.09 -0.74 0.06 0.00 -0.71 0.00 0.00 52.86 51.38 2b35 s ASN 187 Cb -0.15 0.37 -0.01 0.00 0.41 0.00 0.00 41.25 41.86 2b35 s ASN 187 CO 0.00 -0.79 -0.22 -0.76 -1.51 0.00 0.00 177.10 173.83 2b35 s LEU 188 N -2.90 2.03 -0.40 0.60 1.02 0.07 -1.89 118.68 117.21 2b35 s LEU 188 Ca 0.10 -0.40 -0.10 0.00 0.02 0.00 0.00 54.13 53.74 2b35 s LEU 188 Cb 0.04 -1.13 0.06 0.00 0.02 0.00 0.00 46.19 45.18 2b35 s LEU 188 CO -0.07 0.26 0.24 -0.69 0.02 0.00 0.00 176.35 176.11 2b35 s VAL 189 N -0.43 4.43 -0.73 -1.59 1.01 0.39 -1.83 120.40 121.66 2b35 s VAL 189 Ca 0.06 -1.15 -0.27 0.00 0.00 0.00 0.00 61.98 60.63 2b35 s VAL 189 Cb -0.09 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.72 2b35 s VAL 189 CO -0.00 -0.39 1.26 0.00 0.00 0.00 0.00 175.10 175.96 2b35 s ALA 190 N 1.49 2.78 0.37 5.51 0.00 -0.60 -0.49 121.76 130.82 2b35 s ALA 190 Ca 0.02 -1.36 -0.10 0.00 0.00 0.00 0.00 51.96 50.51 2b35 s ALA 190 Cb -0.21 -4.23 -0.07 0.00 0.00 0.00 0.00 23.12 18.61 2b35 s ALA 190 CO 0.04 -3.23 0.73 0.00 0.00 0.00 0.00 175.76 173.30 2b35 s ALA 191 N 5.61 3.39 1.12 0.00 0.00 -0.96 0.37 121.76 131.29 2b35 s ALA 191 Ca 0.35 -0.21 -0.17 0.00 0.00 0.00 0.00 51.96 51.93 2b35 s ALA 191 Cb -0.08 -2.65 0.25 0.00 0.00 0.00 0.00 23.12 20.63 2b35 s ALA 191 CO 0.15 0.10 1.14 0.20 0.00 0.00 0.00 175.76 177.35 2b35 s GLY 192 N -2.98 1.61 -0.13 0.00 0.00 -0.37 -4.60 107.32 100.84 2b35 s GLY 192 Ca 0.51 -0.88 -0.29 0.00 0.00 0.00 0.00 44.72 44.06 2b35 s GLY 192 CO 0.28 -0.07 1.75 2.56 0.00 0.00 0.00 173.10 177.62 2b35 s PRO 193 N -5.41 3.88 -0.23 2.90 0.04 -1.26 -4.98 135.00 129.94 2b35 s PRO 193 Ca 0.70 2.00 -0.06 0.00 0.04 0.00 0.00 61.00 63.68 2b35 s PRO 193 Cb -0.10 -4.08 -0.03 0.00 0.04 0.00 0.00 34.50 30.33 2b35 s PRO 193 CO 0.56 -1.21 0.04 0.42 0.04 0.00 0.00 177.00 176.85 2b35 s ILE 194 N 5.12 4.13 -0.53 0.56 -1.09 -1.26 -4.51 121.20 123.62 2b35 s ILE 194 Ca 0.78 -0.24 -0.21 0.00 -2.23 0.00 0.00 60.65 58.76 2b35 s ILE 194 Cb -0.31 -2.91 -0.21 0.00 -1.58 0.00 0.00 42.46 37.45 2b35 s ILE 194 CO 0.32 0.37 1.64 0.54 -1.23 0.00 0.00 174.94 176.58 2b35 n ARG 195 N 4.70 0.04 0.06 2.79 5.12 0.11 -5.04 116.66 124.45 2b35 n ARG 195 Ca -0.17 -1.07 0.12 0.00 -1.93 0.00 0.00 57.85 54.80 2b35 n ARG 195 Cb 0.51 -2.80 0.22 0.00 -1.16 0.00 0.00 32.46 29.24 2b35 n ARG 195 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 2b35 n THR 196 N 7.26 0.33 0.00 0.55 -1.04 -1.26 -4.94 114.28 115.18 2b35 n THR 196 Ca 0.31 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 2b35 n THR 196 Cb 0.44 -0.15 0.00 0.00 -1.82 0.00 0.00 70.33 68.81 2b35 n THR 196 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2b35 n LEU 217 N -2.04 0.00 0.24 -4.42 4.32 -1.26 -5.04 117.00 108.81 2b35 n LEU 217 Ca 0.04 0.00 0.08 0.00 -0.02 0.00 0.00 56.01 56.11 2b35 n LEU 217 Cb 0.42 0.00 0.61 0.00 -1.62 0.00 0.00 43.42 42.83 2b35 n LEU 217 CO 0.35 0.00 0.97 -0.07 -1.22 0.00 0.00 177.39 177.42 2b35 h LEU 218 N 0.00 0.00 0.14 2.23 3.38 -2.02 -2.80 115.31 116.24 2b35 h LEU 218 Ca 0.00 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.61 2b35 h LEU 218 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 2b35 h LEU 218 CO 0.00 0.12 -1.93 -0.33 0.09 0.00 0.00 178.44 176.39 2b35 h GLU 219 N 0.00 0.30 -0.91 1.13 5.08 -2.00 -3.24 114.58 114.95 2b35 h GLU 219 Ca -0.00 -0.51 0.06 0.00 -1.00 0.00 0.00 59.36 57.91 2b35 h GLU 219 Cb 0.22 0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.60 2b35 h GLU 219 CO 0.02 1.24 0.59 1.49 -1.00 0.00 0.00 179.01 181.34 2b35 h GLU 220 N 0.08 1.01 -0.00 2.33 4.81 -1.99 -1.80 114.58 119.01 2b35 h GLU 220 Ca -0.40 -0.06 -0.13 0.00 -0.13 0.00 0.00 59.36 58.64 2b35 h GLU 220 Cb 2.05 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 31.19 2b35 h GLU 220 CO 0.11 0.67 -0.62 0.78 -0.73 0.00 0.00 179.01 179.22 2b35 h GLY 221 N 1.04 0.02 0.90 1.92 0.00 -1.64 -2.73 103.07 102.58 2b35 h GLY 221 Ca 0.39 -0.02 -0.00 0.00 0.00 0.00 0.00 47.33 47.69 2b35 h GLY 221 CO -0.14 0.02 -0.03 -0.25 0.00 0.00 0.00 176.54 176.14 2b35 h TRP 222 N 0.01 -0.08 -0.35 5.60 2.91 -1.35 0.20 115.95 122.89 2b35 h TRP 222 Ca -0.01 -0.00 -0.05 0.00 1.13 0.00 0.00 58.89 59.96 2b35 h TRP 222 Cb 1.10 0.03 -0.02 0.00 -0.51 0.00 0.00 29.16 29.76 2b35 h TRP 222 CO 0.00 0.04 0.01 0.22 -1.03 0.00 0.00 178.44 177.69 2b35 h ASP 223 N -0.18 0.50 0.19 2.65 3.58 -1.58 -0.44 116.42 121.14 2b35 h ASP 223 Ca -0.01 -0.09 -0.01 0.00 0.42 0.00 0.00 57.03 57.34 2b35 h ASP 223 Cb 0.16 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2b35 h ASP 223 CO 0.01 0.56 -0.09 1.56 -2.88 0.00 0.00 179.24 178.40 2b35 h GLN 224 N 0.52 -0.24 0.26 0.28 4.20 -1.11 -3.29 115.11 115.73 2b35 h GLN 224 Ca 0.11 0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 2b35 h GLN 224 Cb 0.31 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2b35 h GLN 224 CO 0.01 0.03 -0.20 -0.09 -0.67 0.00 0.00 178.83 177.91 2b35 h ARG 225 N -0.51 -0.45 -5.77 1.46 2.43 -0.55 -3.43 114.38 107.57 2b35 h ARG 225 Ca -0.03 0.03 -0.62 0.00 -0.81 0.00 0.00 59.98 58.56 2b35 h ARG 225 Cb 0.38 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 2b35 h ARG 225 CO 0.04 -0.30 1.50 0.00 -1.51 0.00 0.00 179.97 179.70 2b35 n ALA 226 N -2.41 0.86 -0.23 2.80 0.00 -0.18 -4.66 120.51 116.69 2b35 n ALA 226 Ca -0.09 -0.22 0.02 0.00 0.00 0.00 0.00 53.44 53.16 2b35 n ALA 226 Cb 0.23 -2.58 0.15 0.00 0.00 0.00 0.00 19.45 17.25 2b35 n ALA 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2b35 h PRO 227 N 13.27 0.46 0.00 0.00 0.11 -1.76 0.40 132.00 144.48 2b35 h PRO 227 Ca -0.22 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2b35 h PRO 227 Cb 1.32 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2b35 h PRO 227 CO 1.10 0.30 -0.20 0.44 -0.21 0.00 0.00 178.00 179.44 2b35 n ILE 228 N -4.97 0.47 0.00 4.15 -5.35 -1.25 -5.06 119.36 107.35 2b35 n ILE 228 Ca 0.11 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 62.34 2b35 n ILE 228 Cb 0.33 -0.42 0.00 0.00 -1.74 0.00 0.00 39.64 37.81 2b35 n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2b35 n GLY 229 N 1.34 0.22 2.88 3.28 0.00 0.14 -5.01 105.19 108.04 2b35 n GLY 229 Ca 0.05 -1.93 -0.14 0.00 0.00 0.00 0.00 46.02 44.00 2b35 n GLY 229 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2b35 s TRP 230 N -1.43 -0.51 -0.60 1.61 -0.11 -1.26 -4.56 118.94 112.08 2b35 s TRP 230 Ca 0.00 0.64 -0.21 0.00 1.22 0.00 0.00 56.10 57.75 2b35 s TRP 230 Cb 0.00 -0.14 0.07 0.00 -1.50 0.00 0.00 33.47 31.90 2b35 s TRP 230 CO 0.00 -0.59 0.85 1.21 -4.62 0.00 0.00 176.95 173.80 2b35 s ASN 231 N 2.43 6.21 -0.00 5.86 3.84 -1.26 -4.61 114.94 127.41 2b35 s ASN 231 Ca 0.07 -0.95 0.00 0.00 0.21 0.00 0.00 52.86 52.19 2b35 s ASN 231 Cb -0.15 -2.38 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 2b35 s ASN 231 CO -0.13 -1.24 0.71 1.15 -2.79 0.00 0.00 177.10 174.81 2b35 n MET 232 N 7.12 1.00 0.00 0.43 0.00 -1.26 -1.85 117.12 122.55 2b35 n MET 232 Ca -0.04 -0.00 0.01 0.00 0.00 0.00 0.00 57.70 57.66 2b35 n MET 232 Cb 0.45 -1.29 0.01 0.00 0.00 0.00 0.00 33.22 32.39 2b35 n MET 232 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2b35 n LYS 233 N -0.21 0.84 -3.91 3.17 5.02 -1.26 0.10 118.16 121.91 2b35 n LYS 233 Ca 0.00 -0.50 -0.34 0.00 -2.02 0.00 0.00 58.31 55.45 2b35 n LYS 233 Cb 0.14 -0.95 -0.13 0.00 -0.02 0.00 0.00 35.03 34.07 2b35 n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b35 s ASP 234 N -0.42 4.94 0.00 4.39 2.15 -0.77 -4.95 116.67 122.01 2b35 s ASP 234 Ca 0.02 -1.81 0.29 0.00 0.43 0.00 0.00 52.55 51.48 2b35 s ASP 234 Cb 0.02 -1.71 1.22 0.00 -0.30 0.00 0.00 42.92 42.14 2b35 s ASP 234 CO 0.04 -0.39 1.90 0.00 -0.17 0.00 0.00 175.17 176.55 2b35 n ALA 235 N 4.49 2.49 0.03 3.66 0.00 -1.26 -4.29 120.51 125.63 2b35 n ALA 235 Ca -0.04 -0.14 -0.15 0.00 0.00 0.00 0.00 53.44 53.11 2b35 n ALA 235 Cb 0.42 -1.44 -0.09 0.00 0.00 0.00 0.00 19.45 18.34 2b35 n ALA 235 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2b35 h THR 236 N 0.02 0.00 -0.60 0.00 2.02 -1.95 -2.87 112.91 109.54 2b35 h THR 236 Ca 0.00 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.28 2b35 h THR 236 Cb 0.46 0.00 -0.04 0.00 -1.74 0.00 0.00 68.15 66.83 2b35 h THR 236 CO 0.00 0.00 0.41 -0.65 0.37 0.00 0.00 175.52 175.65 2b35 h PRO 237 N -0.61 0.37 0.35 6.66 0.11 -1.99 -1.40 132.00 135.49 2b35 h PRO 237 Ca 0.02 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.09 2b35 h PRO 237 Cb 0.67 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.70 2b35 h PRO 237 CO -0.36 0.25 -0.17 0.28 -0.21 0.00 0.00 178.00 177.79 2b35 h VAL 238 N 0.38 0.67 -0.25 3.15 2.07 -1.82 -2.69 116.25 117.75 2b35 h VAL 238 Ca 0.28 -0.37 0.07 0.00 0.82 0.00 0.00 66.70 67.51 2b35 h VAL 238 Cb 0.59 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 2b35 h VAL 238 CO -0.08 0.07 0.18 0.00 0.02 0.00 0.00 177.57 177.77 2b35 h ALA 239 N -0.10 2.23 -0.14 1.67 0.00 -1.07 -1.86 119.26 120.00 2b35 h ALA 239 Ca -0.05 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 2b35 h ALA 239 Cb 0.47 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2b35 h ALA 239 CO 0.08 -0.31 -0.34 0.87 0.00 0.00 0.00 179.25 179.55 2b35 h LYS 240 N 0.00 0.47 -0.46 0.00 1.57 -1.26 -2.98 116.57 113.90 2b35 h LYS 240 Ca 0.12 -0.32 0.09 0.00 -1.87 0.00 0.00 60.65 58.67 2b35 h LYS 240 Cb 0.49 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 2b35 h LYS 240 CO -0.00 0.93 0.32 1.15 -0.57 0.00 0.00 179.45 181.28 2b35 h THR 241 N 0.07 0.87 -0.20 -0.16 2.02 -1.09 0.13 112.91 114.56 2b35 h THR 241 Ca -0.00 -0.07 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 2b35 h THR 241 Cb 0.94 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2b35 h THR 241 CO 0.07 0.04 0.03 0.58 0.37 0.00 0.00 175.52 176.61 2b35 h VAL 242 N 0.22 1.23 -0.18 3.16 2.07 -1.31 -3.16 116.25 118.27 2b35 h VAL 242 Ca 0.21 -0.74 -0.11 0.00 0.82 0.00 0.00 66.70 66.88 2b35 h VAL 242 Cb 0.56 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2b35 h VAL 242 CO -0.04 0.23 -0.36 0.00 0.02 0.00 0.00 177.57 177.42 2b35 h ALA 244 N 1.29 1.39 -0.01 0.00 0.00 -1.17 0.57 119.26 121.34 2b35 h ALA 244 Ca 0.04 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 2b35 h ALA 244 Cb 0.80 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 2b35 h ALA 244 CO 0.06 0.32 -0.71 -0.07 0.00 0.00 0.00 179.25 178.86 2b35 h LEU 245 N 1.06 0.04 -0.48 0.00 -0.00 -1.31 -2.55 115.31 112.07 2b35 h LEU 245 Ca 0.45 -0.03 0.00 0.00 -0.00 0.00 0.00 57.88 58.30 2b35 h LEU 245 Cb 0.30 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 2b35 h LEU 245 CO -0.21 0.74 0.00 -0.07 -0.00 0.00 0.00 178.44 178.89 2b35 h LEU 246 N 0.02 0.00-10.72 1.67 3.38 -0.49 -3.44 115.31 105.73 2b35 h LEU 246 Ca -0.01 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.52 2b35 h LEU 246 Cb 1.25 0.00 0.17 0.00 0.09 0.00 0.00 40.66 42.17 2b35 h LEU 246 CO 0.09 0.00 0.35 -0.94 0.09 0.00 0.00 178.44 178.04 2b35 s SER 247 N -5.06 2.59 -0.38 -0.43 1.04 0.19 -4.82 113.70 106.82 2b35 s SER 247 Ca 0.06 0.36 0.07 0.00 0.48 0.00 0.00 55.95 56.92 2b35 s SER 247 Cb 0.09 -0.45 0.70 0.00 0.10 0.00 0.00 66.02 66.46 2b35 s SER 247 CO 0.55 -3.07 1.85 0.47 0.98 0.00 0.00 173.24 174.02 2b35 n ASP 248 N -4.01 4.25 -0.51 7.02 8.00 -1.26 -4.39 116.55 125.65 2b35 n ASP 248 Ca 0.15 -3.40 0.07 0.00 0.71 0.00 0.00 54.79 52.32 2b35 n ASP 248 Cb 0.59 -0.79 0.05 0.00 -0.02 0.00 0.00 41.12 40.95 2b35 n ASP 248 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2b35 n TRP 249 N -0.65 0.00 -3.08 1.24 7.02 -1.26 -4.41 117.44 116.30 2b35 n TRP 249 Ca 0.50 0.00 -0.24 0.00 -1.02 0.00 0.00 57.50 56.74 2b35 n TRP 249 Cb 1.53 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 30.38 2b35 n TRP 249 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2b35 n LEU 250 N 0.63 3.00 -0.01 -0.99 4.77 -1.26 -4.98 117.00 118.16 2b35 n LEU 250 Ca 0.08 -5.39 0.14 0.00 -0.03 0.00 0.00 56.01 50.80 2b35 n LEU 250 Cb 0.33 -0.09 0.52 0.00 -2.33 0.00 0.00 43.42 41.86 2b35 n LEU 250 CO 0.10 2.29 0.82 -0.81 -1.33 0.00 0.00 177.39 178.46 2b35 n PRO 251 N 0.12 0.07 -0.10 3.23 -0.05 -1.26 -3.47 135.00 133.54 2b35 n PRO 251 Ca 0.28 -0.02 0.10 0.00 -0.05 0.00 0.00 63.50 63.81 2b35 n PRO 251 Cb 0.49 -1.50 0.14 0.00 -0.05 0.00 0.00 33.50 32.58 2b35 n PRO 251 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2b35 n ALA 252 N -1.45 2.33 -3.96 0.55 0.00 -1.26 -4.93 120.51 111.79 2b35 n ALA 252 Ca 0.07 -2.66 -0.29 0.00 0.00 0.00 0.00 53.44 50.57 2b35 n ALA 252 Cb 0.33 -0.38 -0.16 0.00 0.00 0.00 0.00 19.45 19.23 2b35 n ALA 252 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2b35 s THR 253 N -2.89 1.35 0.08 0.00 -1.32 -1.23 -5.12 115.64 106.51 2b35 s THR 253 Ca 0.32 -0.60 -0.06 0.00 -1.21 0.00 0.00 61.69 60.14 2b35 s THR 253 Cb 0.28 -1.36 -0.01 0.00 -1.51 0.00 0.00 72.50 69.90 2b35 s THR 253 CO 0.03 0.32 0.13 0.28 -2.21 0.00 0.00 174.62 173.17 2b35 s THR 254 N 1.56 0.16 -1.91 5.08 -1.32 -1.26 -4.67 115.64 113.28 2b35 s THR 254 Ca 0.03 -1.36 0.00 0.00 -1.21 0.00 0.00 61.69 59.16 2b35 s THR 254 Cb -0.14 -1.38 0.00 0.00 -1.51 0.00 0.00 72.50 69.47 2b35 s THR 254 CO -0.09 -0.75 0.00 0.61 -2.21 0.00 0.00 174.62 172.18 2b35 n GLY 255 N -0.00 1.42 3.39 6.08 0.00 0.54 -4.91 105.19 111.71 2b35 n GLY 255 Ca -0.15 -0.12 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 2b35 n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b35 s ASP 256 N -2.69 2.22 -0.21 1.61 -1.08 -1.24 -4.49 116.67 110.80 2b35 s ASP 256 Ca 0.00 -1.27 0.01 0.00 -0.52 0.00 0.00 52.55 50.77 2b35 s ASP 256 Cb 0.00 -0.06 0.04 0.00 -1.46 0.00 0.00 42.92 41.44 2b35 s ASP 256 CO 0.00 -0.51 -0.13 -0.63 0.52 0.00 0.00 175.17 174.43 2b35 s ILE 257 N -3.29 1.84 -0.18 4.11 1.01 -1.26 -0.75 121.20 122.68 2b35 s ILE 257 Ca 0.32 -1.11 -0.10 0.00 0.00 0.00 0.00 60.65 59.76 2b35 s ILE 257 Cb 0.06 -1.85 -0.05 0.00 0.01 0.00 0.00 42.46 40.63 2b35 s ILE 257 CO 0.12 0.22 0.15 -0.63 0.00 0.00 0.00 174.94 174.79 2b35 s ILE 258 N 1.32 5.42 -0.40 2.92 1.09 -0.76 -4.96 121.20 125.82 2b35 s ILE 258 Ca -0.01 0.22 -0.16 0.00 -1.10 0.00 0.00 60.65 59.60 2b35 s ILE 258 Cb -0.16 -3.47 0.01 0.00 -1.06 0.00 0.00 42.46 37.78 2b35 s ILE 258 CO -0.09 0.47 0.38 -0.31 -0.10 0.00 0.00 174.94 175.30 2b35 s TYR 259 N 0.11 3.20 -1.12 3.97 1.51 -1.26 -1.56 117.35 122.19 2b35 s TYR 259 Ca 0.10 -0.37 -0.07 0.00 -1.01 0.00 0.00 57.07 55.72 2b35 s TYR 259 Cb -0.11 -2.76 0.28 0.00 -0.11 0.00 0.00 41.96 39.25 2b35 s TYR 259 CO -0.00 -0.62 1.36 0.00 -1.11 0.00 0.00 175.55 175.18 2b35 n ALA 260 N 5.43 4.75 -2.13 3.71 0.00 0.16 -4.70 120.51 127.73 2b35 n ALA 260 Ca -0.09 -4.69 0.01 0.00 0.00 0.00 0.00 53.44 48.67 2b35 n ALA 260 Cb 0.48 -2.47 0.01 0.00 0.00 0.00 0.00 19.45 17.46 2b35 n ALA 260 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2b35 n ASP 261 N 2.25 0.25 -0.83 0.00 5.75 -1.26 -1.24 116.55 121.48 2b35 n ASP 261 Ca 0.27 -2.00 -0.11 0.00 -0.01 0.00 0.00 54.79 52.94 2b35 n ASP 261 Cb 0.36 -0.23 -0.05 0.00 -1.03 0.00 0.00 41.12 40.18 2b35 n ASP 261 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2b35 n GLY 262 N 0.13 1.12 2.34 6.12 0.00 -1.26 -2.20 105.19 111.42 2b35 n GLY 262 Ca 0.02 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 2b35 n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b35 n GLY 263 N -0.57 1.12 0.21 -0.02 0.00 -1.26 -2.74 105.19 101.93 2b35 n GLY 263 Ca -0.11 -0.47 0.01 0.00 0.00 0.00 0.00 46.02 45.45 2b35 n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b35 h ALA 264 N 0.00 1.33 0.00 4.61 0.00 -1.71 -2.37 119.26 121.11 2b35 h ALA 264 Ca -0.20 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2b35 h ALA 264 Cb 0.69 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2b35 h ALA 264 CO 0.30 0.47 0.00 1.12 0.00 0.00 0.00 179.25 181.13 2b35 h HIS 265 N 0.16 0.00 -0.01 0.00 2.07 -1.92 -3.05 115.15 112.40 2b35 h HIS 265 Ca 0.02 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.54 2b35 h HIS 265 Cb 0.61 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.59 2b35 h HIS 265 CO 0.01 0.00 -0.04 0.25 -3.07 0.00 0.00 177.93 175.08 2b35 n THR 266 N -2.55 0.00 -4.47 6.12 -2.24 -0.89 -4.89 114.28 105.36 2b35 n THR 266 Ca 0.02 -0.18 -0.22 0.00 -2.27 0.00 0.00 64.05 61.40 2b35 n THR 266 Cb 0.30 0.29 -0.14 0.00 -2.10 0.00 0.00 70.33 68.69 2b35 n THR 266 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2b35 s GLN 267 N -2.09 1.07 -0.15 -0.78 -1.52 -1.15 -5.10 119.66 109.94 2b35 s GLN 267 Ca 0.37 -0.76 -0.10 0.00 -1.95 0.00 0.00 55.36 52.92 2b35 s GLN 267 Cb 0.21 -1.10 -0.05 0.00 -0.22 0.00 0.00 33.01 31.85 2b35 s GLN 267 CO 0.37 0.28 -0.10 1.25 -0.25 0.00 0.00 175.29 176.84 2b35 h LEU 268 N 5.05 0.00 -1.35 2.90 5.85 -1.90 -3.49 115.31 122.37 2b35 h LEU 268 Ca -0.38 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2b35 h LEU 268 Cb 1.17 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.20 2b35 h LEU 268 CO 0.45 0.83 0.00 0.18 -0.34 0.00 0.00 178.44 179.55