#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x23 s GLY 3 N 0.00 2.28 0.50 3.41 0.00 -1.26 -4.95 107.32 107.30 2x23 s GLY 3 Ca 0.00 0.30 0.23 0.00 0.00 0.00 0.00 44.72 45.25 2x23 s GLY 3 CO 0.00 0.57 1.96 -2.00 0.00 0.00 0.00 173.10 173.63 2x23 h LEU 4 N 1.63 0.12 -2.96 0.66 5.85 -1.92 -2.69 115.31 116.00 2x23 h LEU 4 Ca -0.48 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.21 2x23 h LEU 4 Cb 1.18 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 2x23 h LEU 4 CO 0.61 0.06 -0.52 0.18 -0.34 0.00 0.00 178.44 178.43 2x23 n LEU 5 N -4.40 2.26 -4.68 2.25 4.77 -0.25 -4.69 117.00 112.28 2x23 n LEU 5 Ca 0.12 -3.35 -0.47 0.00 -0.03 0.00 0.00 56.01 52.28 2x23 n LEU 5 Cb 0.63 -0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 2x23 n LEU 5 CO 0.36 1.11 1.39 -0.67 -1.33 0.00 0.00 177.39 178.25 2x23 n ASP 6 N -0.84 3.40 0.00 -1.43 2.03 -0.92 -1.38 116.55 117.41 2x23 n ASP 6 Ca 0.16 1.01 0.00 0.00 0.52 0.00 0.00 54.79 56.48 2x23 n ASP 6 Cb 0.76 -1.41 0.00 0.00 -0.72 0.00 0.00 41.12 39.75 2x23 n ASP 6 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2x23 n GLY 7 N 4.05 1.99 3.74 0.27 0.00 -1.14 -4.95 105.19 109.14 2x23 n GLY 7 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2x23 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x23 s LYS 8 N -0.01 4.62 -0.28 1.61 1.02 -0.48 -4.84 119.74 121.38 2x23 s LYS 8 Ca 0.00 1.66 -0.10 0.00 0.02 0.00 0.00 55.97 57.55 2x23 s LYS 8 Cb 0.00 -3.29 -0.04 0.00 -0.52 0.00 0.00 37.83 33.98 2x23 s LYS 8 CO 0.00 0.11 0.16 1.03 -0.92 0.00 0.00 175.35 175.74 2x23 s ARG 9 N -0.33 3.79 -0.07 1.68 0.52 -1.26 -0.59 118.95 122.69 2x23 s ARG 9 Ca 0.49 -0.42 0.01 0.00 -0.52 0.00 0.00 55.73 55.29 2x23 s ARG 9 Cb -0.28 -3.59 0.02 0.00 0.52 0.00 0.00 34.95 31.62 2x23 s ARG 9 CO 0.34 -0.22 -0.09 0.42 0.02 0.00 0.00 175.30 175.77 2x23 s ILE 10 N 1.71 0.94 -0.04 1.52 1.01 -0.38 0.86 121.20 126.83 2x23 s ILE 10 Ca 0.07 -0.33 -0.21 0.00 0.00 0.00 0.00 60.65 60.18 2x23 s ILE 10 Cb -0.16 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.35 2x23 s ILE 10 CO 0.09 0.32 0.60 -0.22 0.00 0.00 0.00 174.94 175.73 2x23 s LEU 11 N 1.02 4.37 -0.15 2.97 0.20 -0.20 -1.49 118.68 125.40 2x23 s LEU 11 Ca -0.08 1.11 0.00 0.00 0.69 0.00 0.00 54.13 55.84 2x23 s LEU 11 Cb -0.15 -2.92 0.03 0.00 -0.43 0.00 0.00 46.19 42.72 2x23 s LEU 11 CO -0.00 0.03 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.29 2x23 s VAL 12 N 0.20 1.41 0.29 1.68 1.01 0.79 -0.25 120.40 125.54 2x23 s VAL 12 Ca 0.32 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.72 2x23 s VAL 12 Cb -0.18 -1.41 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 2x23 s VAL 12 CO 0.16 0.34 0.40 -0.94 0.00 0.00 0.00 175.10 175.06 2x23 s SER 13 N 1.53 6.05 0.00 3.32 1.04 -0.62 -2.00 113.70 123.02 2x23 s SER 13 Ca 0.03 -0.11 0.00 0.00 0.48 0.00 0.00 55.95 56.35 2x23 s SER 13 Cb -0.14 -1.47 0.00 0.00 0.10 0.00 0.00 66.02 64.51 2x23 s SER 13 CO -0.09 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.47 2x23 n GLY 14 N -1.51 0.82 3.70 7.32 0.00 -1.23 -3.87 105.19 110.43 2x23 n GLY 14 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 2x23 n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x23 s ILE 15 N -2.09 4.20 0.00 -0.61 1.01 -1.26 -4.53 121.20 117.92 2x23 s ILE 15 Ca 0.00 1.57 0.00 0.00 0.00 0.00 0.00 60.65 62.22 2x23 s ILE 15 Cb 0.00 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2x23 s ILE 15 CO 0.00 0.08 0.00 0.00 0.00 0.00 0.00 174.94 175.02 2x23 n ILE 16 N 4.16 0.00 -4.37 2.92 0.13 -1.26 -4.74 119.36 116.21 2x23 n ILE 16 Ca 0.09 0.00 -0.20 0.00 -1.10 0.00 0.00 62.75 61.54 2x23 n ILE 16 Cb 0.47 -0.32 -0.09 0.00 -0.84 0.00 0.00 39.64 38.86 2x23 n ILE 16 CO 0.00 0.00 0.00 0.42 2.80 0.00 0.00 176.55 179.77 2x23 s THR 17 N -1.61 0.37 -1.77 9.51 -4.23 -1.26 -4.67 115.64 111.98 2x23 s THR 17 Ca 0.00 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.76 2x23 s THR 17 Cb 0.00 -2.49 0.60 0.00 1.34 0.00 0.00 72.50 71.95 2x23 s THR 17 CO 0.00 0.00 1.83 -0.90 -0.54 0.00 0.00 174.62 175.01 2x23 n ASP 18 N -1.05 0.00 -0.09 3.99 5.75 -1.26 -1.84 116.55 122.05 2x23 n ASP 18 Ca 0.00 -0.50 0.11 0.00 -0.01 0.00 0.00 54.79 54.40 2x23 n ASP 18 Cb 0.65 -0.11 0.13 0.00 -1.03 0.00 0.00 41.12 40.75 2x23 n ASP 18 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2x23 n SER 19 N -1.11 0.90 -4.77 -1.12 7.64 -1.26 -4.80 113.62 109.09 2x23 n SER 19 Ca 0.16 -0.72 -0.41 0.00 1.01 0.00 0.00 58.87 58.91 2x23 n SER 19 Cb 0.13 0.49 -0.01 0.00 -1.01 0.00 0.00 64.21 63.81 2x23 n SER 19 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2x23 s SER 20 N -2.87 6.34 0.26 6.43 0.01 -0.77 -4.62 113.70 118.48 2x23 s SER 20 Ca 0.13 3.03 -0.02 0.00 1.31 0.00 0.00 55.95 60.40 2x23 s SER 20 Cb 0.17 -2.66 0.50 0.00 0.21 0.00 0.00 66.02 64.24 2x23 s SER 20 CO 0.71 -0.89 1.76 0.40 0.41 0.00 0.00 173.24 175.63 2x23 h ILE 21 N 3.09 0.73 0.00 1.44 2.04 -1.90 -0.94 117.51 121.98 2x23 h ILE 21 Ca -0.50 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.12 2x23 h ILE 21 Cb 1.23 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 2x23 h ILE 21 CO 0.69 0.11 -0.17 0.00 0.00 0.00 0.00 178.15 178.78 2x23 h ALA 22 N 1.54 1.72 -0.69 1.87 0.00 -1.86 0.74 119.26 122.59 2x23 h ALA 22 Ca 0.44 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.17 2x23 h ALA 22 Cb 0.62 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2x23 h ALA 22 CO -0.36 0.21 0.31 0.35 0.00 0.00 0.00 179.25 179.76 2x23 h PHE 23 N 0.00 1.01 0.04 0.00 3.57 -1.43 -0.42 116.94 119.71 2x23 h PHE 23 Ca -0.00 -0.06 -0.27 0.00 3.53 0.00 0.00 57.97 61.17 2x23 h PHE 23 Cb 0.29 -0.31 0.02 0.00 2.79 0.00 0.00 35.95 38.74 2x23 h PHE 23 CO 0.00 0.76 -1.09 0.45 -2.23 0.00 0.00 178.31 176.20 2x23 h HIS 24 N 0.96 0.91 -0.54 0.41 3.86 -1.08 -1.17 115.15 118.50 2x23 h HIS 24 Ca 0.23 -0.53 0.09 0.00 -1.16 0.00 0.00 60.37 59.00 2x23 h HIS 24 Cb 0.15 -0.09 -0.07 0.00 1.06 0.00 0.00 27.41 28.46 2x23 h HIS 24 CO 0.01 1.37 0.15 0.82 0.86 0.00 0.00 177.93 181.14 2x23 h ILE 25 N 0.31 0.74 -0.44 2.45 2.04 -0.76 -1.14 117.51 120.71 2x23 h ILE 25 Ca -0.14 -0.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.60 2x23 h ILE 25 Cb 1.75 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 38.22 2x23 h ILE 25 CO 0.21 0.06 0.20 0.00 0.00 0.00 0.00 178.15 178.62 2x23 h ALA 26 N 1.40 0.57 0.39 1.87 0.00 -0.85 -0.31 119.26 122.33 2x23 h ALA 26 Ca 0.27 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2x23 h ALA 26 Cb 0.35 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2x23 h ALA 26 CO -0.32 0.14 -0.19 -0.09 0.00 0.00 0.00 179.25 178.80 2x23 h ARG 27 N 0.57 -0.50 -0.87 0.00 2.43 -0.96 -0.65 114.38 114.41 2x23 h ARG 27 Ca 0.15 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.39 2x23 h ARG 27 Cb 0.14 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.75 2x23 h ARG 27 CO -0.02 -0.29 0.56 0.28 -1.51 0.00 0.00 179.97 178.99 2x23 h VAL 28 N -0.59 1.15 -0.56 0.20 2.07 -1.16 0.81 116.25 118.17 2x23 h VAL 28 Ca -0.05 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2x23 h VAL 28 Cb 0.44 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.14 2x23 h VAL 28 CO 0.09 0.20 0.35 0.00 0.02 0.00 0.00 177.57 178.23 2x23 h ALA 29 N 1.35 0.71 -0.25 1.67 0.00 -0.88 -1.53 119.26 120.34 2x23 h ALA 29 Ca 0.34 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.05 2x23 h ALA 29 Cb -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2x23 h ALA 29 CO -0.11 0.18 -0.45 1.96 0.00 0.00 0.00 179.25 180.82 2x23 h GLN 30 N 0.75 0.63 -0.30 0.00 4.20 -0.67 -1.46 115.11 118.26 2x23 h GLN 30 Ca 0.20 -0.35 0.09 0.00 0.06 0.00 0.00 58.65 58.65 2x23 h GLN 30 Cb -0.04 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 2x23 h GLN 30 CO -0.04 0.96 0.26 0.93 -0.67 0.00 0.00 178.83 180.26 2x23 h GLU 31 N 0.51 0.00 -0.60 1.46 5.08 -0.36 -1.54 114.58 119.13 2x23 h GLU 31 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2x23 h GLU 31 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 2x23 h GLU 31 CO 0.09 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.14 2x23 n GLN 32 N -4.15 4.71 -0.59 2.33 1.13 -0.62 -4.91 117.38 115.28 2x23 n GLN 32 Ca 0.04 -3.09 0.00 0.00 -1.94 0.00 0.00 57.00 52.02 2x23 n GLN 32 Cb 0.42 -2.21 0.00 0.00 0.11 0.00 0.00 30.24 28.56 2x23 n GLN 32 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2x23 n GLY 33 N 0.70 0.88 3.76 1.08 0.00 -0.58 -1.09 105.19 109.95 2x23 n GLY 33 Ca 0.27 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.92 2x23 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x23 s ALA 34 N -3.22 2.89 -0.28 4.61 0.00 -0.73 -2.90 121.76 122.13 2x23 s ALA 34 Ca 0.00 1.05 -0.10 0.00 0.00 0.00 0.00 51.96 52.90 2x23 s ALA 34 Cb 0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2x23 s ALA 34 CO 0.00 -0.89 0.16 -0.65 0.00 0.00 0.00 175.76 174.38 2x23 s GLN 35 N -2.82 3.82 0.09 0.00 -1.52 0.25 -4.49 119.66 114.98 2x23 s GLN 35 Ca 0.67 -0.40 0.02 0.00 -1.95 0.00 0.00 55.36 53.70 2x23 s GLN 35 Cb -0.32 -3.58 -0.04 0.00 -0.22 0.00 0.00 33.01 28.85 2x23 s GLN 35 CO 0.38 -0.21 0.18 -0.51 -0.25 0.00 0.00 175.29 174.88 2x23 s LEU 36 N 1.72 4.14 -0.08 2.90 1.43 -1.26 -1.24 118.68 126.29 2x23 s LEU 36 Ca 0.07 0.14 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 2x23 s LEU 36 Cb -0.16 -2.76 -0.00 0.00 0.03 0.00 0.00 46.19 43.30 2x23 s LEU 36 CO 0.09 0.14 -0.21 -0.69 0.23 0.00 0.00 176.35 175.91 2x23 s VAL 37 N -1.53 1.81 -0.02 -1.59 1.01 -0.56 -4.23 120.40 115.30 2x23 s VAL 37 Ca 0.33 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.42 2x23 s VAL 37 Cb -0.12 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 2x23 s VAL 37 CO 0.26 0.51 -0.02 -0.76 0.00 0.00 0.00 175.10 175.09 2x23 s LEU 38 N 0.23 3.43 -0.00 3.92 1.43 -0.08 -0.15 118.68 127.44 2x23 s LEU 38 Ca -0.12 -0.01 0.08 0.00 -1.03 0.00 0.00 54.13 53.04 2x23 s LEU 38 Cb -0.16 -1.92 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 2x23 s LEU 38 CO 0.06 0.30 -0.25 0.42 0.23 0.00 0.00 176.35 177.12 2x23 s THR 39 N -1.01 2.21 0.14 5.49 -4.23 -0.85 -0.01 115.64 117.37 2x23 s THR 39 Ca 0.17 -1.15 0.04 0.00 -1.18 0.00 0.00 61.69 59.57 2x23 s THR 39 Cb -0.11 -1.80 -0.04 0.00 1.34 0.00 0.00 72.50 71.88 2x23 s THR 39 CO 0.08 0.51 -0.09 -0.83 -0.54 0.00 0.00 174.62 173.75 2x23 s GLY 40 N -0.83 1.01 -0.09 3.99 0.00 -0.14 -3.50 107.32 107.76 2x23 s GLY 40 Ca 0.11 -1.47 0.04 0.00 0.00 0.00 0.00 44.72 43.40 2x23 s GLY 40 CO 0.00 -1.56 -0.23 -0.12 0.00 0.00 0.00 173.10 171.19 2x23 s PHE 41 N -3.40 2.46 0.00 1.90 5.36 -1.26 -0.24 117.98 122.81 2x23 s PHE 41 Ca 0.16 -0.98 0.00 0.00 -0.96 0.00 0.00 56.93 55.15 2x23 s PHE 41 Cb 0.03 -1.65 0.00 0.00 -0.34 0.00 0.00 43.02 41.06 2x23 s PHE 41 CO -0.00 -0.39 0.00 -3.47 -1.46 0.00 0.00 175.22 169.90 2x23 n ASP 42 N 3.49 0.00 -3.52 6.13 2.03 -1.26 -4.58 116.55 118.83 2x23 n ASP 42 Ca -0.19 0.00 -0.40 0.00 0.52 0.00 0.00 54.79 54.72 2x23 n ASP 42 Cb 0.53 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.94 2x23 n ASP 42 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2x23 n ARG 43 N 0.00 4.91 -0.00 -0.67 5.12 -1.26 -4.80 116.66 119.96 2x23 n ARG 43 Ca 0.00 -4.01 -0.05 0.00 -1.93 0.00 0.00 57.85 51.86 2x23 n ARG 43 Cb 0.00 -2.53 0.16 0.00 -1.16 0.00 0.00 32.46 28.93 2x23 n ARG 43 CO 0.00 0.00 0.00 -0.07 -1.93 0.00 0.00 177.63 175.63 2x23 h LEU 44 N 4.82 0.55 -0.46 0.55 -0.00 -1.94 -0.77 115.31 118.06 2x23 h LEU 44 Ca 0.62 -0.21 -0.06 0.00 -0.00 0.00 0.00 57.88 58.23 2x23 h LEU 44 Cb 0.31 -0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 40.81 2x23 h LEU 44 CO 1.32 0.82 0.07 0.03 -0.00 0.00 0.00 178.44 180.68 2x23 h ARG 45 N 0.46 0.76 -0.38 1.13 3.08 -1.99 -0.09 114.38 117.35 2x23 h ARG 45 Ca 0.06 -0.21 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2x23 h ARG 45 Cb 0.75 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 2x23 h ARG 45 CO 0.06 0.78 0.18 1.25 -1.07 0.00 0.00 179.97 181.17 2x23 h LEU 46 N 0.63 0.51 -0.75 3.04 5.85 -1.84 -2.48 115.31 120.26 2x23 h LEU 46 Ca 0.14 -0.14 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2x23 h LEU 46 Cb 0.39 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 2x23 h LEU 46 CO 0.01 0.51 -0.17 0.40 -0.34 0.00 0.00 178.44 178.84 2x23 h ILE 47 N 0.48 1.26 -0.66 4.05 2.04 -0.96 -0.78 117.51 122.94 2x23 h ILE 47 Ca 0.13 -1.26 0.05 0.00 1.00 0.00 0.00 64.86 64.78 2x23 h ILE 47 Cb 0.14 1.14 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 2x23 h ILE 47 CO -0.01 0.42 0.38 -0.61 0.00 0.00 0.00 178.15 178.33 2x23 h GLN 48 N 0.68 0.71 -0.41 2.37 4.15 -0.94 -0.71 115.11 120.96 2x23 h GLN 48 Ca 0.10 -0.04 -0.04 0.00 0.77 0.00 0.00 58.65 59.45 2x23 h GLN 48 Cb 0.67 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.18 2x23 h GLN 48 CO 0.05 0.47 0.12 -0.09 -1.93 0.00 0.00 178.83 177.44 2x23 h ARG 49 N 0.73 0.64 -0.41 1.69 2.43 -0.84 -2.54 114.38 116.07 2x23 h ARG 49 Ca 0.28 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.27 2x23 h ARG 49 Cb 0.12 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2x23 h ARG 49 CO -0.15 0.64 0.10 0.82 -1.51 0.00 0.00 179.97 179.87 2x23 h ILE 50 N 0.51 1.23 0.00 1.20 1.08 -0.91 -2.46 117.51 118.16 2x23 h ILE 50 Ca 0.13 -0.79 0.00 0.00 -0.39 0.00 0.00 64.86 63.81 2x23 h ILE 50 Cb 0.28 0.97 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 2x23 h ILE 50 CO -0.00 0.28 0.00 0.35 -0.69 0.00 0.00 178.15 178.08 2x23 n THR 51 N -4.55 0.79 0.28 -0.27 -2.24 -0.30 -1.08 114.28 106.91 2x23 n THR 51 Ca -0.00 0.16 0.18 0.00 -2.27 0.00 0.00 64.05 62.11 2x23 n THR 51 Cb 0.21 -1.00 0.95 0.00 -2.10 0.00 0.00 70.33 68.39 2x23 n THR 51 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2x23 h ASP 52 N 0.00 0.00 1.08 3.42 5.19 -1.00 -2.48 116.42 122.63 2x23 h ASP 52 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2x23 h ASP 52 Cb 0.39 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.90 2x23 h ASP 52 CO 0.00 0.00 -0.25 0.54 -3.12 0.00 0.00 179.24 176.41 2x23 n ARG 53 N -2.77 0.19 -1.08 3.56 1.74 -0.24 -4.92 116.66 113.14 2x23 n ARG 53 Ca -0.02 0.11 -0.32 0.00 -0.77 0.00 0.00 57.85 56.85 2x23 n ARG 53 Cb 0.08 -1.67 0.12 0.00 -1.02 0.00 0.00 32.46 29.97 2x23 n ARG 53 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2x23 s LEU 54 N -3.94 3.02 0.39 0.55 1.43 -0.94 -4.92 118.68 114.27 2x23 s LEU 54 Ca 0.10 2.06 0.14 0.00 -1.03 0.00 0.00 54.13 55.40 2x23 s LEU 54 Cb 0.15 -4.55 0.98 0.00 0.03 0.00 0.00 46.19 42.80 2x23 s LEU 54 CO 0.63 -2.48 1.85 -0.65 0.23 0.00 0.00 176.35 175.93 2x23 h PRO 55 N -1.25 0.50 -4.63 1.29 0.11 -1.89 -3.43 132.00 122.69 2x23 h PRO 55 Ca -0.44 -0.03 -0.28 0.00 0.11 0.00 0.00 66.00 65.36 2x23 h PRO 55 Cb 1.26 -0.11 -0.20 0.00 0.11 0.00 0.00 31.00 32.05 2x23 h PRO 55 CO 0.47 0.33 -0.73 0.00 -0.21 0.00 0.00 178.00 177.86 2x23 s ALA 56 N -5.53 0.68 0.00 -0.75 0.00 -1.26 -5.13 121.76 109.77 2x23 s ALA 56 Ca -0.09 -0.88 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 2x23 s ALA 56 Cb 0.23 0.05 -0.05 0.00 0.00 0.00 0.00 23.12 23.35 2x23 s ALA 56 CO 0.79 -0.04 1.37 0.21 0.00 0.00 0.00 175.76 178.08 2x23 s LYS 57 N -1.96 4.30 0.11 0.00 2.47 -1.26 -4.97 119.74 118.43 2x23 s LYS 57 Ca -0.06 1.93 0.10 0.00 -1.56 0.00 0.00 55.97 56.38 2x23 s LYS 57 Cb -0.08 -3.55 -0.04 0.00 -1.46 0.00 0.00 37.83 32.71 2x23 s LYS 57 CO -0.00 -0.54 -0.22 0.00 0.16 0.00 0.00 175.35 174.74 2x23 s ALA 58 N 2.27 2.53 0.44 3.13 0.00 -1.26 -5.01 121.76 123.86 2x23 s ALA 58 Ca 0.63 -1.39 -0.25 0.00 0.00 0.00 0.00 51.96 50.95 2x23 s ALA 58 Cb -0.31 -0.53 -0.08 0.00 0.00 0.00 0.00 23.12 22.20 2x23 s ALA 58 CO 0.26 0.57 1.28 -1.25 0.00 0.00 0.00 175.76 176.62 2x23 s PRO 59 N -2.02 3.79 -0.15 0.00 0.04 -1.26 -4.83 135.00 130.57 2x23 s PRO 59 Ca 0.16 2.09 0.02 0.00 0.04 0.00 0.00 61.00 63.30 2x23 s PRO 59 Cb -0.10 -2.60 0.01 0.00 0.04 0.00 0.00 34.50 31.84 2x23 s PRO 59 CO 0.08 -0.62 -0.20 -1.17 0.04 0.00 0.00 177.00 175.13 2x23 s LEU 60 N -2.73 2.19 -0.04 -3.56 2.96 -1.26 -0.91 118.68 115.34 2x23 s LEU 60 Ca 0.61 -0.59 0.03 0.00 -0.22 0.00 0.00 54.13 53.96 2x23 s LEU 60 Cb -0.36 -1.48 -0.03 0.00 0.50 0.00 0.00 46.19 44.82 2x23 s LEU 60 CO 0.46 0.07 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.67 2x23 s LEU 61 N 0.91 2.87 0.07 -0.68 1.43 0.98 -4.98 118.68 119.28 2x23 s LEU 61 Ca -0.04 -0.18 -0.31 0.00 -1.03 0.00 0.00 54.13 52.57 2x23 s LEU 61 Cb -0.15 -1.62 -0.06 0.00 0.03 0.00 0.00 46.19 44.39 2x23 s LEU 61 CO -0.04 0.33 1.27 -0.70 0.23 0.00 0.00 176.35 177.44 2x23 s GLU 62 N -0.93 4.39 -0.21 1.70 2.12 -1.26 -0.96 118.70 123.54 2x23 s GLU 62 Ca 0.13 1.88 -0.04 0.00 0.36 0.00 0.00 54.97 57.30 2x23 s GLU 62 Cb -0.11 -3.33 0.10 0.00 0.26 0.00 0.00 34.13 31.06 2x23 s GLU 62 CO 0.02 -0.33 0.24 -1.17 -0.54 0.00 0.00 175.26 173.48 2x23 s LEU 63 N 1.14 -0.15 -0.35 2.70 2.96 0.67 -4.84 118.68 120.81 2x23 s LEU 63 Ca 0.61 -0.24 -0.15 0.00 -0.22 0.00 0.00 54.13 54.13 2x23 s LEU 63 Cb -0.32 0.44 -0.01 0.00 0.50 0.00 0.00 46.19 46.80 2x23 s LEU 63 CO 0.29 -0.33 0.36 -0.62 -1.32 0.00 0.00 176.35 174.73 2x23 s ASP 64 N 2.34 6.17 0.25 3.68 -1.08 -1.26 -4.13 116.67 122.64 2x23 s ASP 64 Ca 0.08 -0.31 0.20 0.00 -0.52 0.00 0.00 52.55 52.00 2x23 s ASP 64 Cb -0.16 -2.19 0.96 0.00 -1.46 0.00 0.00 42.92 40.06 2x23 s ASP 64 CO -0.14 -0.36 1.62 1.33 0.52 0.00 0.00 175.17 178.13 2x23 n VAL 65 N 5.25 1.02 1.27 1.11 0.24 -1.26 -1.11 118.33 124.85 2x23 n VAL 65 Ca -0.09 0.46 0.13 0.00 -2.04 0.00 0.00 64.34 62.81 2x23 n VAL 65 Cb 0.49 -1.42 0.50 0.00 -1.47 0.00 0.00 33.84 31.94 2x23 n VAL 65 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2x23 n GLN 66 N -2.13 0.58 -3.38 7.34 6.02 -1.26 -4.80 117.38 119.75 2x23 n GLN 66 Ca 0.01 -0.26 -0.43 0.00 -0.01 0.00 0.00 57.00 56.31 2x23 n GLN 66 Cb 0.13 -1.49 -0.09 0.00 1.02 0.00 0.00 30.24 29.80 2x23 n GLN 66 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2x23 s ASN 67 N -2.59 6.16 0.36 1.08 3.84 -0.27 -4.96 114.94 118.55 2x23 s ASN 67 Ca 0.24 -0.78 0.04 0.00 0.21 0.00 0.00 52.86 52.57 2x23 s ASN 67 Cb 0.19 -2.20 0.70 0.00 -0.55 0.00 0.00 41.25 39.40 2x23 s ASN 67 CO 0.52 -0.53 1.99 -0.33 -2.79 0.00 0.00 177.10 175.96 2x23 h GLU 68 N 8.69 0.77 -0.41 0.43 4.39 -1.87 -2.52 114.58 124.06 2x23 h GLU 68 Ca -0.27 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.33 2x23 h GLU 68 Cb 1.11 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 29.58 2x23 h GLU 68 CO 0.77 0.51 0.03 0.93 -1.16 0.00 0.00 179.01 180.08 2x23 h GLU 69 N 0.79 0.71 -0.66 2.33 5.08 -1.95 0.33 114.58 121.20 2x23 h GLU 69 Ca 0.27 -0.21 0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2x23 h GLU 69 Cb 0.09 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2x23 h GLU 69 CO -0.08 0.77 0.40 0.45 -1.00 0.00 0.00 179.01 179.56 2x23 h HIS 70 N 0.55 0.75 -0.21 4.33 3.86 -1.81 -1.69 115.15 120.93 2x23 h HIS 70 Ca 0.12 0.02 -0.15 0.00 -1.16 0.00 0.00 60.37 59.20 2x23 h HIS 70 Cb 0.44 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.66 2x23 h HIS 70 CO 0.03 0.42 -0.50 -0.07 0.86 0.00 0.00 177.93 178.67 2x23 h LEU 71 N 0.78 0.63 -0.89 2.43 3.38 -1.21 -1.85 115.31 118.59 2x23 h LEU 71 Ca 0.27 -0.32 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2x23 h LEU 71 Cb 0.05 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2x23 h LEU 71 CO -0.12 1.02 -0.48 0.00 0.09 0.00 0.00 178.44 178.95 2x23 h ALA 72 N 1.00 1.07 -0.00 1.53 0.00 -0.68 -3.06 119.26 119.11 2x23 h ALA 72 Ca 0.02 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2x23 h ALA 72 Cb 1.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2x23 h ALA 72 CO 0.10 0.63 -0.53 -1.13 0.00 0.00 0.00 179.25 178.32 2x23 n SER 73 N -3.97 1.00 0.22 0.00 3.41 -0.66 -4.64 113.62 108.98 2x23 n SER 73 Ca -0.02 -0.79 -0.15 0.00 -0.26 0.00 0.00 58.87 57.65 2x23 n SER 73 Cb 0.52 0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 64.81 2x23 n SER 73 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2x23 h LEU 74 N 0.73 -0.71 -0.48 1.04 5.85 -1.23 -1.71 115.31 118.80 2x23 h LEU 74 Ca 0.00 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.87 2x23 h LEU 74 Cb 0.54 0.23 -0.08 0.00 0.37 0.00 0.00 40.66 41.72 2x23 h LEU 74 CO 0.00 -0.41 0.01 0.00 -0.34 0.00 0.00 178.44 177.70 2x23 h ALA 75 N -0.06 0.47 -0.52 1.25 0.00 -1.80 0.55 119.26 119.15 2x23 h ALA 75 Ca -0.03 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.09 2x23 h ALA 75 Cb 0.55 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 2x23 h ALA 75 CO -0.01 -0.38 0.17 0.78 0.00 0.00 0.00 179.25 179.82 2x23 h GLY 76 N 0.13 0.68 1.25 0.00 0.00 -1.83 -0.72 103.07 102.58 2x23 h GLY 76 Ca 0.24 -0.09 -0.11 0.00 0.00 0.00 0.00 47.33 47.38 2x23 h GLY 76 CO -0.39 -0.01 -0.13 3.21 0.00 0.00 0.00 176.54 179.21 2x23 h ARG 77 N 0.34 0.88 -0.46 4.80 3.08 -0.40 -2.29 114.38 120.34 2x23 h ARG 77 Ca 0.25 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 2x23 h ARG 77 Cb 0.29 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 2x23 h ARG 77 CO -0.27 0.96 0.16 0.28 -1.07 0.00 0.00 179.97 180.03 2x23 h VAL 78 N 0.79 1.22 -0.84 2.04 2.07 -0.72 -1.97 116.25 118.83 2x23 h VAL 78 Ca 0.12 -0.70 0.01 0.00 0.82 0.00 0.00 66.70 66.95 2x23 h VAL 78 Cb 0.66 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 2x23 h VAL 78 CO 0.05 0.26 0.56 0.74 0.02 0.00 0.00 177.57 179.19 2x23 h THR 79 N 0.60 1.20 -0.28 2.57 2.02 -0.95 0.47 112.91 118.54 2x23 h THR 79 Ca 0.15 -0.39 -0.00 0.00 0.77 0.00 0.00 66.41 66.94 2x23 h THR 79 Cb 0.24 -0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.62 2x23 h THR 79 CO -0.01 0.20 0.17 -0.33 0.37 0.00 0.00 175.52 175.92 2x23 h GLU 80 N 1.12 0.38 -0.61 6.66 5.08 -1.28 0.55 114.58 126.48 2x23 h GLU 80 Ca 0.31 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.54 2x23 h GLU 80 Cb -0.11 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 2x23 h GLU 80 CO -0.07 0.30 0.00 0.00 -1.00 0.00 0.00 179.01 178.24 2x23 h ALA 81 N 1.06 0.84 0.00 3.43 0.00 -0.23 -3.29 119.26 121.07 2x23 h ALA 81 Ca 0.10 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2x23 h ALA 81 Cb 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.58 2x23 h ALA 81 CO -0.02 0.67 -1.18 0.44 0.00 0.00 0.00 179.25 179.16 2x23 n ILE 82 N -4.18 0.11 0.00 0.00 -5.35 0.15 -4.99 119.36 105.10 2x23 n ILE 82 Ca 0.03 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.27 2x23 n ILE 82 Cb 0.35 0.32 0.00 0.00 -1.74 0.00 0.00 39.64 38.57 2x23 n ILE 82 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2x23 n GLY 83 N 1.37 2.16 3.70 3.28 0.00 0.19 -4.78 105.19 111.12 2x23 n GLY 83 Ca 0.01 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 2x23 n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x23 n ALA 84 N 2.24 1.30 -0.81 4.61 0.00 -1.21 -1.65 120.51 124.99 2x23 n ALA 84 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.80 2x23 n ALA 84 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.19 2x23 n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x23 n GLY 85 N 0.87 1.15 3.72 0.00 0.00 -1.26 -5.02 105.19 104.65 2x23 n GLY 85 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2x23 n GLY 85 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2x23 s ASN 86 N -3.09 5.22 0.29 1.61 0.01 -0.66 -5.14 114.94 113.20 2x23 s ASN 86 Ca 0.00 -0.12 0.05 0.00 -0.71 0.00 0.00 52.86 52.08 2x23 s ASN 86 Cb 0.00 -1.31 -0.06 0.00 0.41 0.00 0.00 41.25 40.29 2x23 s ASN 86 CO 0.00 0.17 -0.00 -0.54 -1.51 0.00 0.00 177.10 175.22 2x23 s LYS 87 N -2.38 1.57 0.41 -0.60 1.02 -1.26 -4.86 119.74 113.64 2x23 s LYS 87 Ca 0.27 -1.83 -0.17 0.00 0.02 0.00 0.00 55.97 54.26 2x23 s LYS 87 Cb -0.12 -0.97 -0.09 0.00 -0.52 0.00 0.00 37.83 36.13 2x23 s LYS 87 CO 0.20 -0.07 0.87 -0.51 -0.92 0.00 0.00 175.35 174.91 2x23 s LEU 88 N -3.45 3.91 -0.02 3.17 1.43 0.59 -4.73 118.68 119.58 2x23 s LEU 88 Ca 0.32 1.47 0.14 0.00 -1.03 0.00 0.00 54.13 55.04 2x23 s LEU 88 Cb 0.06 -4.33 -0.21 0.00 0.03 0.00 0.00 46.19 41.74 2x23 s LEU 88 CO 0.13 -0.36 0.38 0.47 0.23 0.00 0.00 176.35 177.20 2x23 n ASP 89 N -0.80 1.46 -3.74 2.29 8.00 0.25 -0.64 116.55 123.37 2x23 n ASP 89 Ca 0.05 -0.18 -0.13 0.00 0.71 0.00 0.00 54.79 55.25 2x23 n ASP 89 Cb 0.54 1.52 -0.08 0.00 -0.02 0.00 0.00 41.12 43.08 2x23 n ASP 89 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2x23 s GLY 90 N -3.39 -0.17 -0.04 0.44 0.00 -0.85 -1.00 107.32 102.31 2x23 s GLY 90 Ca -0.03 0.22 -0.00 0.00 0.00 0.00 0.00 44.72 44.90 2x23 s GLY 90 CO 0.60 -0.01 0.01 0.14 0.00 0.00 0.00 173.10 173.85 2x23 s VAL 91 N -2.00 0.12 -0.22 1.40 1.01 -0.12 -1.03 120.40 119.57 2x23 s VAL 91 Ca -0.09 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.04 2x23 s VAL 91 Cb -0.03 -0.26 0.01 0.00 0.00 0.00 0.00 36.38 36.10 2x23 s VAL 91 CO 0.00 0.16 -0.09 -0.69 0.00 0.00 0.00 175.10 174.48 2x23 s VAL 92 N 1.33 2.88 -0.34 2.92 1.01 0.66 -0.53 120.40 128.33 2x23 s VAL 92 Ca -0.05 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 60.99 2x23 s VAL 92 Cb -0.13 -2.33 -0.01 0.00 0.00 0.00 0.00 36.38 33.91 2x23 s VAL 92 CO -0.02 0.39 0.47 -2.28 0.00 0.00 0.00 175.10 173.66 2x23 s HIS 93 N 1.38 3.20 -0.42 5.22 2.46 0.63 -1.59 115.29 126.17 2x23 s HIS 93 Ca 0.04 0.19 0.09 0.00 0.47 0.00 0.00 55.06 55.86 2x23 s HIS 93 Cb -0.15 -2.84 0.31 0.00 -0.13 0.00 0.00 32.58 29.78 2x23 s HIS 93 CO -0.06 -0.48 0.68 0.45 -2.47 0.00 0.00 174.74 172.86 2x23 n SER 94 N 5.63 1.18 -4.00 9.88 2.88 -1.25 -2.18 113.62 125.76 2x23 n SER 94 Ca -0.06 -3.00 -0.16 0.00 -1.33 0.00 0.00 58.87 54.33 2x23 n SER 94 Cb 0.49 -0.62 -0.14 0.00 -0.75 0.00 0.00 64.21 63.19 2x23 n SER 94 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2x23 s ILE 95 N -2.21 0.49 -0.14 2.46 1.01 -1.26 -4.09 121.20 117.47 2x23 s ILE 95 Ca 0.39 -0.46 -0.31 0.00 0.00 0.00 0.00 60.65 60.27 2x23 s ILE 95 Cb 0.27 -0.46 0.13 0.00 0.01 0.00 0.00 42.46 42.41 2x23 s ILE 95 CO -0.09 0.00 1.07 -0.83 0.00 0.00 0.00 174.94 175.09 2x23 s GLY 96 N -0.51 -0.29 -0.16 6.18 0.00 -1.26 -4.69 107.32 106.59 2x23 s GLY 96 Ca -0.01 1.72 -0.29 0.00 0.00 0.00 0.00 44.72 46.14 2x23 s GLY 96 CO -0.00 0.71 0.82 -0.12 0.00 0.00 0.00 173.10 174.51 2x23 s PHE 97 N -2.02 -0.58 -0.11 1.90 5.36 -1.26 -4.95 117.98 116.31 2x23 s PHE 97 Ca 0.04 1.16 -0.06 0.00 -0.96 0.00 0.00 56.93 57.12 2x23 s PHE 97 Cb -0.01 0.39 0.05 0.00 -0.34 0.00 0.00 43.02 43.11 2x23 s PHE 97 CO -0.04 -0.44 0.27 1.41 -1.46 0.00 0.00 175.22 174.96 2x23 s MET 98 N -0.65 0.23 0.67 10.12 -2.45 -1.26 -4.27 119.30 121.70 2x23 s MET 98 Ca -0.04 0.57 -0.17 0.00 -1.25 0.00 0.00 55.69 54.80 2x23 s MET 98 Cb -0.02 -0.11 -0.03 0.00 1.25 0.00 0.00 34.83 35.93 2x23 s MET 98 CO 0.04 -0.16 0.85 -2.30 1.05 0.00 0.00 175.02 174.49 2x23 n PRO 99 N 4.26 0.59 -0.23 4.11 -0.02 -1.26 -4.87 135.00 137.57 2x23 n PRO 99 Ca -0.25 0.25 0.15 0.00 -2.02 0.00 0.00 63.50 61.62 2x23 n PRO 99 Cb 0.53 -2.09 0.45 0.00 -0.02 0.00 0.00 33.50 32.37 2x23 n PRO 99 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2x23 h GLN 100 N -0.01 0.52 -0.00 -0.52 1.08 -1.94 1.00 115.11 115.23 2x23 h GLN 100 Ca -0.47 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 2x23 h GLN 100 Cb 1.35 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.67 2x23 h GLN 100 CO 0.47 0.34 0.00 1.79 -0.95 0.00 0.00 178.83 180.49 2x23 h THR 101 N 0.53 0.43 -0.40 -0.54 1.35 -1.97 -1.63 112.91 110.70 2x23 h THR 101 Ca 0.42 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.28 2x23 h THR 101 Cb 0.85 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.27 2x23 h THR 101 CO -0.17 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.71 2x23 n GLY 102 N -1.28 1.57 3.14 5.82 0.00 0.35 -4.26 105.19 110.52 2x23 n GLY 102 Ca -0.03 -0.50 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 2x23 n GLY 102 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2x23 s MET 103 N -1.67 0.83 6.49 1.61 1.00 -0.61 -1.65 119.30 125.30 2x23 s MET 103 Ca 0.30 -1.37 0.00 0.00 0.00 0.00 0.00 55.69 54.62 2x23 s MET 103 Cb 0.19 0.17 0.00 0.00 0.00 0.00 0.00 34.83 35.19 2x23 s MET 103 CO 0.16 -0.19 0.00 0.41 0.00 0.00 0.00 175.02 175.39 2x23 n GLY 104 N -0.04 2.24 0.48 -0.03 0.00 0.11 -2.54 105.19 105.41 2x23 n GLY 104 Ca -0.09 -0.42 0.13 0.00 0.00 0.00 0.00 46.02 45.65 2x23 n GLY 104 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2x23 n ILE 105 N 0.00 0.03 -2.36 -0.61 -5.35 0.15 -4.00 119.36 107.22 2x23 n ILE 105 Ca 0.00 -0.26 -0.42 0.00 -0.27 0.00 0.00 62.75 61.80 2x23 n ILE 105 Cb 0.00 0.45 -0.03 0.00 -1.74 0.00 0.00 39.64 38.33 2x23 n ILE 105 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2x23 s ASN 106 N -1.93 6.98 0.16 7.28 0.01 -1.05 -4.91 114.94 121.47 2x23 s ASN 106 Ca 0.37 1.97 -0.34 0.00 -0.71 0.00 0.00 52.86 54.16 2x23 s ASN 106 Cb 0.20 -2.56 -0.15 0.00 0.41 0.00 0.00 41.25 39.15 2x23 s ASN 106 CO 0.32 -0.62 1.32 -2.65 -1.51 0.00 0.00 177.10 173.97 2x23 n PRO 107 N 5.00 1.46 -0.24 -0.60 -0.02 -1.26 -4.66 135.00 134.67 2x23 n PRO 107 Ca 0.11 0.52 0.05 0.00 -2.02 0.00 0.00 63.50 62.17 2x23 n PRO 107 Cb 0.45 -2.13 0.17 0.00 -0.02 0.00 0.00 33.50 31.97 2x23 n PRO 107 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2x23 h PHE 108 N 4.26 0.18 0.00 6.00 3.57 -1.90 -2.03 116.94 127.02 2x23 h PHE 108 Ca -0.45 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.09 2x23 h PHE 108 Cb 1.32 0.03 0.00 0.00 2.79 0.00 0.00 35.95 40.09 2x23 h PHE 108 CO 0.57 -0.12 0.00 1.19 -2.23 0.00 0.00 178.31 177.72 2x23 n PHE 109 N -5.20 0.00 1.01 0.41 3.72 -1.26 -3.24 117.46 112.89 2x23 n PHE 109 Ca 0.13 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.65 2x23 n PHE 109 Cb 0.45 -0.46 0.06 0.00 -0.94 0.00 0.00 39.48 38.59 2x23 n PHE 109 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2x23 n ASP 110 N -1.46 2.51 -4.63 4.37 8.00 -0.76 -4.86 116.55 119.71 2x23 n ASP 110 Ca 0.05 -1.76 -0.43 0.00 0.71 0.00 0.00 54.79 53.36 2x23 n ASP 110 Cb 0.19 0.23 -0.02 0.00 -0.02 0.00 0.00 41.12 41.49 2x23 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2x23 s ALA 111 N -2.23 3.43 0.63 2.24 0.00 -1.20 -5.01 121.76 119.62 2x23 s ALA 111 Ca 0.24 0.02 -0.17 0.00 0.00 0.00 0.00 51.96 52.04 2x23 s ALA 111 Cb 0.19 -3.73 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 2x23 s ALA 111 CO 0.43 -1.63 1.16 -1.25 0.00 0.00 0.00 175.76 174.47 2x23 s PRO 112 N 3.91 2.85 0.45 0.00 0.04 -1.26 -4.84 135.00 136.16 2x23 s PRO 112 Ca 0.51 1.63 0.13 0.00 0.04 0.00 0.00 61.00 63.30 2x23 s PRO 112 Cb -0.14 -1.94 1.03 0.00 0.04 0.00 0.00 34.50 33.49 2x23 s PRO 112 CO 0.19 -1.25 2.04 -0.92 0.04 0.00 0.00 177.00 177.10 2x23 h TYR 113 N 0.47 0.12 -0.46 0.56 3.20 -1.99 -1.96 116.97 116.91 2x23 h TYR 113 Ca -0.49 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.44 2x23 h TYR 113 Cb 1.27 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 39.46 2x23 h TYR 113 CO 0.50 0.18 0.17 0.00 -1.64 0.00 0.00 178.16 177.38 2x23 h ALA 114 N 1.83 0.56 -0.02 1.82 0.00 -1.99 0.44 119.26 121.91 2x23 h ALA 114 Ca 0.03 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2x23 h ALA 114 Cb 0.18 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 2x23 h ALA 114 CO 0.01 -0.21 0.01 -0.44 0.00 0.00 0.00 179.25 178.62 2x23 h ASP 115 N 0.35 0.02 -0.60 0.00 3.32 -1.75 -2.52 116.42 115.24 2x23 h ASP 115 Ca 0.22 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 2x23 h ASP 115 Cb 0.20 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2x23 h ASP 115 CO -0.21 0.06 0.36 0.58 -1.72 0.00 0.00 179.24 178.31 2x23 h VAL 116 N -0.02 1.18 -0.94 -1.35 2.07 -0.87 -2.30 116.25 114.03 2x23 h VAL 116 Ca 0.01 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 2x23 h VAL 116 Cb 0.04 0.35 -0.05 0.00 -1.52 0.00 0.00 31.29 30.12 2x23 h VAL 116 CO -0.00 0.18 0.57 -1.28 0.02 0.00 0.00 177.57 177.07 2x23 h SER 117 N 0.81 1.11 -0.40 0.57 0.87 -0.14 0.68 113.55 117.06 2x23 h SER 117 Ca 0.22 -0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 2x23 h SER 117 Cb -0.02 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.64 2x23 h SER 117 CO -0.04 0.85 0.12 0.50 -0.53 0.00 0.00 176.83 177.72 2x23 h LYS 118 N 1.29 0.62 -0.56 2.24 3.64 -1.08 0.11 116.57 122.83 2x23 h LYS 118 Ca 0.34 -0.14 0.03 0.00 -1.27 0.00 0.00 60.65 59.61 2x23 h LYS 118 Cb -0.07 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 2x23 h LYS 118 CO -0.07 0.63 0.33 0.78 -2.27 0.00 0.00 179.45 178.86 2x23 h GLY 119 N 0.50 0.80 1.86 5.01 0.00 -0.92 -1.63 103.07 108.70 2x23 h GLY 119 Ca 0.13 -0.25 -0.14 0.00 0.00 0.00 0.00 47.33 47.07 2x23 h GLY 119 CO -0.00 0.20 -0.64 -2.22 0.00 0.00 0.00 176.54 173.88 2x23 h ILE 120 N 0.66 1.42 0.41 2.60 2.04 -0.54 -0.05 117.51 124.05 2x23 h ILE 120 Ca 0.23 -2.11 -0.02 0.00 1.00 0.00 0.00 64.86 63.96 2x23 h ILE 120 Cb 0.04 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.23 2x23 h ILE 120 CO -0.11 0.61 -0.20 -0.74 0.00 0.00 0.00 178.15 177.72 2x23 h HIS 121 N 0.10 -0.51 -0.52 1.37 2.76 -0.36 -0.10 115.15 117.89 2x23 h HIS 121 Ca -0.01 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.05 2x23 h HIS 121 Cb 1.14 0.17 -0.02 0.00 1.55 0.00 0.00 27.41 30.26 2x23 h HIS 121 CO 0.01 -0.26 -0.07 0.82 -1.30 0.00 0.00 177.93 177.14 2x23 h ILE 122 N -0.67 1.27 0.00 6.26 2.04 -1.27 -1.46 117.51 123.67 2x23 h ILE 122 Ca -0.06 -1.20 -0.06 0.00 1.00 0.00 0.00 64.86 64.54 2x23 h ILE 122 Cb 0.49 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 2x23 h ILE 122 CO 0.09 0.42 -1.22 -1.20 0.00 0.00 0.00 178.15 176.25 2x23 n SER 123 N -4.22 0.80 0.06 1.72 7.64 -0.04 -4.40 113.62 115.19 2x23 n SER 123 Ca 0.01 0.33 0.00 0.00 1.01 0.00 0.00 58.87 60.22 2x23 n SER 123 Cb 0.37 0.43 0.00 0.00 -1.01 0.00 0.00 64.21 64.00 2x23 n SER 123 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2x23 n ALA 124 N -2.27 3.00 -0.25 -0.43 0.00 -0.12 -4.78 120.51 115.67 2x23 n ALA 124 Ca -0.04 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.45 2x23 n ALA 124 Cb 0.66 0.21 0.30 0.00 0.00 0.00 0.00 19.45 20.61 2x23 n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2x23 h TYR 125 N 0.00 0.91 0.00 0.00 5.03 -1.33 -2.06 116.97 119.52 2x23 h TYR 125 Ca 0.00 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.33 2x23 h TYR 125 Cb 0.15 -0.30 0.00 0.00 1.55 0.00 0.00 36.73 38.13 2x23 h TYR 125 CO 0.00 0.47 0.00 0.66 -1.32 0.00 0.00 178.16 177.97 2x23 h SER 126 N 0.89 0.00 -0.38 -2.11 4.64 -1.47 -1.57 113.55 113.56 2x23 h SER 126 Ca 0.36 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.65 2x23 h SER 126 Cb 0.24 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.32 2x23 h SER 126 CO -0.13 0.00 0.13 0.22 -0.87 0.00 0.00 176.83 176.18 2x23 h TYR 127 N 0.00 0.60 -0.51 4.77 3.20 -1.67 -0.89 116.97 122.47 2x23 h TYR 127 Ca 0.00 -0.06 -0.06 0.00 3.14 0.00 0.00 58.73 61.75 2x23 h TYR 127 Cb 0.23 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 2x23 h TYR 127 CO 0.00 0.56 0.07 0.00 -1.64 0.00 0.00 178.16 177.15 2x23 h ALA 128 N 0.97 0.68 -0.49 1.82 0.00 -1.45 -2.19 119.26 118.61 2x23 h ALA 128 Ca 0.12 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.84 2x23 h ALA 128 Cb 0.23 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 2x23 h ALA 128 CO -0.01 0.43 0.22 0.77 0.00 0.00 0.00 179.25 180.67 2x23 h SER 129 N 0.73 0.30 -0.43 0.00 0.02 -1.18 0.27 113.55 113.26 2x23 h SER 129 Ca 0.15 0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 61.02 2x23 h SER 129 Cb 0.42 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.94 2x23 h SER 129 CO 0.01 0.21 -0.20 0.24 -1.14 0.00 0.00 176.83 175.95 2x23 h MET 130 N 0.44 0.89 -0.51 3.45 2.07 -1.16 -2.35 114.93 117.76 2x23 h MET 130 Ca 0.22 -0.38 -0.01 0.00 -2.07 0.00 0.00 59.70 57.46 2x23 h MET 130 Cb 0.16 -0.03 -0.02 0.00 -1.87 0.00 0.00 31.60 29.84 2x23 h MET 130 CO -0.18 1.03 0.28 0.00 1.07 0.00 0.00 176.91 179.12 2x23 h ALA 131 N 0.83 0.65 -0.73 6.32 0.00 -0.81 -1.39 119.26 124.14 2x23 h ALA 131 Ca 0.10 -0.09 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2x23 h ALA 131 Cb 0.76 -0.20 -0.08 0.00 0.00 0.00 0.00 17.79 18.27 2x23 h ALA 131 CO 0.06 0.17 0.33 -0.22 0.00 0.00 0.00 179.25 179.58 2x23 h LYS 132 N 0.68 0.51 -0.33 0.00 3.64 -0.37 -0.94 116.57 119.75 2x23 h LYS 132 Ca 0.18 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.36 2x23 h LYS 132 Cb 0.04 -0.11 -0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2x23 h LYS 132 CO -0.03 0.34 -0.47 0.00 -2.27 0.00 0.00 179.45 177.01 2x23 h ALA 133 N 1.48 0.53 0.00 5.00 0.00 -0.90 -3.37 119.26 122.01 2x23 h ALA 133 Ca 0.38 -0.49 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 2x23 h ALA 133 Cb 0.49 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2x23 h ALA 133 CO -0.33 0.68 -2.06 1.28 0.00 0.00 0.00 179.25 178.82 2x23 n LEU 134 N -4.03 0.00 -0.30 0.00 4.77 -0.57 -4.38 117.00 112.49 2x23 n LEU 134 Ca -0.03 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.00 2x23 n LEU 134 Cb 0.59 0.22 0.20 0.00 -2.33 0.00 0.00 43.42 42.10 2x23 n LEU 134 CO 0.49 0.22 1.14 -0.07 -1.33 0.00 0.00 177.39 177.84 2x23 h LEU 135 N 0.00 0.65 -1.35 2.23 3.38 -1.33 0.13 115.31 119.02 2x23 h LEU 135 Ca -0.24 0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.79 2x23 h LEU 135 Cb 1.49 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.19 2x23 h LEU 135 CO 0.01 0.34 0.03 -2.65 0.09 0.00 0.00 178.44 176.26 2x23 n PRO 136 N -4.77 0.13 -0.85 1.13 -0.02 -1.26 -1.77 135.00 127.58 2x23 n PRO 136 Ca 0.15 0.63 0.02 0.00 -2.02 0.00 0.00 63.50 62.28 2x23 n PRO 136 Cb 0.34 -1.96 0.17 0.00 -0.02 0.00 0.00 33.50 32.04 2x23 n PRO 136 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 2x23 n ILE 137 N -2.22 2.10 -4.67 4.25 -5.35 0.42 -5.03 119.36 108.87 2x23 n ILE 137 Ca -0.01 -3.23 -0.33 0.00 -0.27 0.00 0.00 62.75 58.91 2x23 n ILE 137 Cb 0.06 -0.26 -0.12 0.00 -1.74 0.00 0.00 39.64 37.58 2x23 n ILE 137 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 2x23 s MET 138 N -3.09 2.53 0.45 6.28 -1.94 -0.73 -0.30 119.30 122.50 2x23 s MET 138 Ca 0.39 -0.70 -0.18 0.00 -1.71 0.00 0.00 55.69 53.50 2x23 s MET 138 Cb 0.38 -2.45 -0.09 0.00 2.01 0.00 0.00 34.83 34.68 2x23 s MET 138 CO -0.06 0.62 0.92 -0.80 -0.01 0.00 0.00 175.02 175.69 2x23 s ASN 139 N -1.02 6.78 0.61 3.03 0.02 0.19 -4.88 114.94 119.66 2x23 s ASN 139 Ca 0.14 1.56 -0.19 0.00 -1.02 0.00 0.00 52.86 53.34 2x23 s ASN 139 Cb -0.11 -2.49 -0.03 0.00 0.02 0.00 0.00 41.25 38.64 2x23 s ASN 139 CO 0.03 -0.43 1.27 -2.65 0.02 0.00 0.00 177.10 175.35 2x23 n PRO 140 N -0.99 1.25 -0.73 -0.60 -0.02 -1.25 -1.48 135.00 131.17 2x23 n PRO 140 Ca 0.06 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 2x23 n PRO 140 Cb 0.54 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2x23 n PRO 140 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x23 n GLY 141 N 0.92 1.25 3.55 -1.23 0.00 0.64 -4.99 105.19 105.33 2x23 n GLY 141 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2x23 n GLY 141 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x23 s GLY 142 N -1.91 1.56 -0.09 -0.02 0.00 -0.55 -4.85 107.32 101.47 2x23 s GLY 142 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 44.72 44.56 2x23 s GLY 142 CO 0.00 0.54 0.20 -0.45 0.00 0.00 0.00 173.10 173.39 2x23 s SER 143 N -2.78 -0.17 -0.13 1.64 0.15 -0.17 -1.40 113.70 110.84 2x23 s SER 143 Ca 0.67 0.42 -0.01 0.00 0.70 0.00 0.00 55.95 57.73 2x23 s SER 143 Cb -0.23 0.30 -0.02 0.00 -1.71 0.00 0.00 66.02 64.36 2x23 s SER 143 CO 0.62 -0.16 -0.09 -0.63 1.20 0.00 0.00 173.24 174.18 2x23 s ILE 144 N 1.25 3.39 -0.03 6.45 1.01 0.35 -0.94 121.20 132.67 2x23 s ILE 144 Ca -0.09 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.04 2x23 s ILE 144 Cb -0.11 -2.44 0.01 0.00 0.01 0.00 0.00 42.46 39.93 2x23 s ILE 144 CO -0.07 0.53 -0.09 -0.69 0.00 0.00 0.00 174.94 174.61 2x23 s VAL 145 N 0.17 0.83 0.30 2.92 1.01 0.31 -1.18 120.40 124.76 2x23 s VAL 145 Ca -0.05 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 61.64 2x23 s VAL 145 Cb -0.15 -0.75 -0.06 0.00 0.00 0.00 0.00 36.38 35.42 2x23 s VAL 145 CO 0.04 0.27 -0.07 -0.83 0.00 0.00 0.00 175.10 174.50 2x23 s GLY 146 N 0.34 1.97 -0.18 4.51 0.00 -0.48 -0.27 107.32 113.21 2x23 s GLY 146 Ca -0.06 -1.98 -0.09 0.00 0.00 0.00 0.00 44.72 42.60 2x23 s GLY 146 CO 0.01 -1.92 0.10 1.06 0.00 0.00 0.00 173.10 172.36 2x23 s MET 147 N -3.68 4.03 0.30 2.90 -1.94 -0.93 -0.95 119.30 119.03 2x23 s MET 147 Ca 0.31 -0.26 0.10 0.00 -1.71 0.00 0.00 55.69 54.12 2x23 s MET 147 Cb 0.03 -3.32 -0.06 0.00 2.01 0.00 0.00 34.83 33.50 2x23 s MET 147 CO 0.14 0.34 -0.13 0.34 -0.01 0.00 0.00 175.02 175.70 2x23 s ASP 148 N 0.22 3.42 -0.08 3.03 2.15 0.70 -4.90 116.67 121.20 2x23 s ASP 148 Ca 0.07 -1.13 -0.01 0.00 0.43 0.00 0.00 52.55 51.91 2x23 s ASP 148 Cb -0.12 -0.28 0.03 0.00 -0.30 0.00 0.00 42.92 42.25 2x23 s ASP 148 CO -0.01 -0.15 -0.03 0.12 -0.17 0.00 0.00 175.17 174.93 2x23 s PHE 149 N -2.68 0.96 -0.38 -5.34 2.19 -1.26 -2.29 117.98 109.17 2x23 s PHE 149 Ca 0.30 -0.37 -0.39 0.00 0.33 0.00 0.00 56.93 56.81 2x23 s PHE 149 Cb 0.00 -0.94 -0.14 0.00 -1.31 0.00 0.00 43.02 40.63 2x23 s PHE 149 CO 0.14 -0.38 2.11 -3.47 1.83 0.00 0.00 175.22 175.45 2x23 n ASP 150 N 4.99 1.76 -1.41 6.13 2.03 -1.26 -4.84 116.55 123.95 2x23 n ASP 150 Ca -0.10 0.59 0.08 0.00 0.52 0.00 0.00 54.79 55.88 2x23 n ASP 150 Cb 0.50 -1.14 0.33 0.00 -0.72 0.00 0.00 41.12 40.10 2x23 n ASP 150 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2x23 n PRO 151 N 7.56 3.91 0.28 -0.67 -0.04 -1.26 -4.66 135.00 140.11 2x23 n PRO 151 Ca 0.43 -2.97 0.15 0.00 -0.04 0.00 0.00 63.50 61.08 2x23 n PRO 151 Cb 0.13 -2.02 0.77 0.00 -0.04 0.00 0.00 33.50 32.35 2x23 n PRO 151 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2x23 h SER 152 N 3.04 0.00 -4.15 3.54 4.64 -1.94 -3.42 113.55 115.25 2x23 h SER 152 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 2x23 h SER 152 Cb 1.67 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 63.52 2x23 h SER 152 CO 0.34 0.08 -0.86 -0.13 -0.87 0.00 0.00 176.83 175.39 2x23 s ARG 153 N -3.98 1.43 0.76 4.77 0.52 -1.26 -5.15 118.95 116.03 2x23 s ARG 153 Ca -0.02 -1.15 -0.11 0.00 -0.52 0.00 0.00 55.73 53.93 2x23 s ARG 153 Cb 0.12 -1.71 0.05 0.00 0.52 0.00 0.00 34.95 33.93 2x23 s ARG 153 CO 0.55 0.42 1.08 0.00 0.02 0.00 0.00 175.30 177.37 2x23 s ALA 154 N -0.96 2.38 0.20 2.13 0.00 -1.26 -5.08 121.76 119.17 2x23 s ALA 154 Ca 0.10 0.01 -0.21 0.00 0.00 0.00 0.00 51.96 51.86 2x23 s ALA 154 Cb -0.10 -3.17 0.04 0.00 0.00 0.00 0.00 23.12 19.90 2x23 s ALA 154 CO 0.04 -1.56 0.60 0.00 0.00 0.00 0.00 175.76 174.84 2x23 s MET 155 N -5.05 1.43 0.68 0.00 0.23 -1.26 -5.15 119.30 110.19 2x23 s MET 155 Ca 0.60 -0.72 -0.17 0.00 -1.03 0.00 0.00 55.69 54.37 2x23 s MET 155 Cb -0.15 0.57 -0.00 0.00 -1.53 0.00 0.00 34.83 33.72 2x23 s MET 155 CO 0.55 -0.63 1.09 -2.30 -2.03 0.00 0.00 175.02 171.70 2x23 n PRO 156 N -0.39 0.76 0.00 3.16 -0.02 -1.26 -4.14 135.00 133.12 2x23 n PRO 156 Ca -0.12 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2x23 n PRO 156 Cb 0.63 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2x23 n PRO 156 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x23 n ALA 157 N -2.23 0.00 0.16 3.55 0.00 -1.26 -4.55 120.51 116.19 2x23 n ALA 157 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.59 2x23 n ALA 157 Cb 0.49 0.00 0.25 0.00 0.00 0.00 0.00 19.45 20.19 2x23 n ALA 157 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2x23 h TYR 158 N 0.00 0.00 0.00 0.00 3.20 -1.88 0.32 116.97 118.62 2x23 h TYR 158 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2x23 h TYR 158 Cb 0.00 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.27 2x23 h TYR 158 CO 0.00 0.51 0.00 0.09 -1.64 0.00 0.00 178.16 177.12 2x23 n ASN 159 N -3.80 0.00 0.26 -2.11 4.13 -1.26 -0.95 115.26 111.53 2x23 n ASN 159 Ca -0.01 0.00 0.15 0.00 1.68 0.00 0.00 54.58 56.40 2x23 n ASN 159 Cb 0.55 0.00 0.59 0.00 -1.54 0.00 0.00 39.78 39.38 2x23 n ASN 159 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 2x23 h TRP 160 N 0.00 0.00 -0.20 3.10 4.06 -1.64 -1.65 115.95 119.62 2x23 h TRP 160 Ca 0.00 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 60.89 2x23 h TRP 160 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 2x23 h TRP 160 CO 0.00 0.06 -0.15 1.98 -3.56 0.00 0.00 178.44 176.77 2x23 h MET 161 N 0.00 0.34 -0.89 0.49 4.05 -1.19 -1.12 114.93 116.61 2x23 h MET 161 Ca -0.00 -0.09 0.03 0.00 -0.28 0.00 0.00 59.70 59.36 2x23 h MET 161 Cb 0.61 -0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 31.32 2x23 h MET 161 CO 0.01 0.49 0.57 1.15 0.23 0.00 0.00 176.91 179.36 2x23 h THR 162 N 0.31 1.15 -0.37 -0.77 2.02 -1.12 0.06 112.91 114.19 2x23 h THR 162 Ca 0.06 -0.38 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 2x23 h THR 162 Cb 0.45 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 2x23 h THR 162 CO 0.03 0.20 0.07 0.58 0.37 0.00 0.00 175.52 176.77 2x23 h VAL 163 N 1.12 1.23 -0.73 3.16 2.07 -1.32 -0.67 116.25 121.10 2x23 h VAL 163 Ca 0.35 -0.82 0.07 0.00 0.82 0.00 0.00 66.70 67.13 2x23 h VAL 163 Cb -0.00 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 30.77 2x23 h VAL 163 CO -0.12 0.28 0.41 0.00 0.02 0.00 0.00 177.57 178.16 2x23 h ALA 164 N 0.92 1.00 -0.45 1.67 0.00 -0.61 -1.18 119.26 120.62 2x23 h ALA 164 Ca 0.11 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 2x23 h ALA 164 Cb 0.34 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2x23 h ALA 164 CO 0.00 0.08 -0.10 0.87 0.00 0.00 0.00 179.25 180.11 2x23 h LYS 165 N 0.74 0.86 -0.75 0.00 1.79 -0.79 0.12 116.57 118.55 2x23 h LYS 165 Ca 0.33 -0.33 0.13 0.00 -2.18 0.00 0.00 60.65 58.61 2x23 h LYS 165 Cb 0.24 -0.05 -0.09 0.00 -1.58 0.00 0.00 32.23 30.75 2x23 h LYS 165 CO -0.20 0.96 0.33 0.77 -1.08 0.00 0.00 179.45 180.23 2x23 h SER 166 N 0.70 0.36 -0.23 0.86 0.02 -0.82 0.33 113.55 114.76 2x23 h SER 166 Ca 0.11 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.14 2x23 h SER 166 Cb 0.64 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.22 2x23 h SER 166 CO 0.04 0.16 0.06 0.00 -1.14 0.00 0.00 176.83 175.95 2x23 h ALA 167 N 1.51 0.30 -0.86 3.77 0.00 -0.92 -2.74 119.26 120.32 2x23 h ALA 167 Ca 0.40 -0.15 0.12 0.00 0.00 0.00 0.00 54.91 55.27 2x23 h ALA 167 Cb 0.55 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.17 2x23 h ALA 167 CO -0.36 -0.06 0.49 1.25 0.00 0.00 0.00 179.25 180.57 2x23 h LEU 168 N 0.19 0.67 -0.74 0.00 5.85 -0.17 0.29 115.31 121.39 2x23 h LEU 168 Ca 0.07 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.81 2x23 h LEU 168 Cb 0.27 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.20 2x23 h LEU 168 CO 0.00 0.35 0.30 -0.33 -0.34 0.00 0.00 178.44 178.42 2x23 h GLU 169 N 0.77 1.11 -0.23 1.25 5.08 -0.84 0.65 114.58 122.37 2x23 h GLU 169 Ca 0.44 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.51 2x23 h GLU 169 Cb 0.49 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 2x23 h GLU 169 CO -0.29 0.91 -0.19 1.03 -1.00 0.00 0.00 179.01 179.46 2x23 h SER 170 N 1.07 0.57 -0.65 1.42 0.87 -0.89 -2.93 113.55 113.01 2x23 h SER 170 Ca 0.25 -0.46 0.10 0.00 -1.23 0.00 0.00 61.79 60.46 2x23 h SER 170 Cb 0.21 -0.16 -0.08 0.00 -0.44 0.00 0.00 62.40 61.93 2x23 h SER 170 CO -0.02 0.91 0.24 0.58 -0.53 0.00 0.00 176.83 178.01 2x23 h VAL 171 N 0.24 0.74 -0.98 2.23 2.07 -0.08 -2.12 116.25 118.35 2x23 h VAL 171 Ca 0.04 -0.14 0.10 0.00 0.82 0.00 0.00 66.70 67.52 2x23 h VAL 171 Cb 0.73 0.29 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 2x23 h VAL 171 CO 0.05 0.08 0.62 -1.13 0.02 0.00 0.00 177.57 177.20 2x23 h ASN 172 N 0.42 0.93 -0.20 0.57 -1.24 -0.71 0.08 115.58 115.43 2x23 h ASN 172 Ca 0.33 0.04 -0.06 0.00 0.71 0.00 0.00 56.30 57.32 2x23 h ASN 172 Cb 0.43 -0.15 -0.02 0.00 0.73 0.00 0.00 38.32 39.31 2x23 h ASN 172 CO -0.33 0.53 -0.03 0.03 -1.29 0.00 0.00 177.43 176.34 2x23 h ARG 173 N 1.02 0.52 0.09 6.67 3.08 -1.22 -1.39 114.38 123.15 2x23 h ARG 173 Ca 0.47 -0.12 -0.26 0.00 0.07 0.00 0.00 59.98 60.13 2x23 h ARG 173 Cb 0.38 -0.07 0.01 0.00 0.08 0.00 0.00 29.97 30.37 2x23 h ARG 173 CO -0.24 0.57 -1.15 0.74 -1.07 0.00 0.00 179.97 178.82 2x23 h PHE 174 N 0.49 0.60 -0.94 3.04 -1.00 -1.06 -3.12 116.94 114.95 2x23 h PHE 174 Ca 0.10 -0.39 0.06 0.00 2.81 0.00 0.00 57.97 60.55 2x23 h PHE 174 Cb 0.37 -0.04 -0.06 0.00 3.61 0.00 0.00 35.95 39.83 2x23 h PHE 174 CO 0.01 1.26 0.60 0.28 -1.61 0.00 0.00 178.31 178.86 2x23 h VAL 175 N 0.14 1.07 -1.00 -0.55 2.07 -0.88 -2.29 116.25 114.82 2x23 h VAL 175 Ca -0.13 -0.38 0.03 0.00 0.82 0.00 0.00 66.70 67.05 2x23 h VAL 175 Cb 1.84 -0.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.44 2x23 h VAL 175 CO 0.20 0.20 0.65 0.00 0.02 0.00 0.00 177.57 178.64 2x23 h ALA 176 N 1.43 1.31 -0.58 1.67 0.00 -1.24 0.71 119.26 122.56 2x23 h ALA 176 Ca 0.41 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.26 2x23 h ALA 176 Cb 0.16 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2x23 h ALA 176 CO -0.17 0.57 0.35 0.00 0.00 0.00 0.00 179.25 179.99 2x23 h ARG 177 N 1.28 0.79 -0.05 0.00 3.08 -1.36 -0.69 114.38 117.43 2x23 h ARG 177 Ca 0.39 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.32 2x23 h ARG 177 Cb -0.03 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 29.86 2x23 h ARG 177 CO -0.12 0.57 -0.14 0.93 -1.07 0.00 0.00 179.97 180.15 2x23 h GLU 178 N 0.79 0.18 -0.14 0.04 4.39 -1.03 -3.25 114.58 115.55 2x23 h GLU 178 Ca 0.21 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.78 2x23 h GLU 178 Cb -0.01 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 2x23 h GLU 178 CO -0.04 0.74 0.07 0.00 -1.16 0.00 0.00 179.01 178.62 2x23 h ALA 179 N 0.44 1.86 0.00 3.43 0.00 0.46 -2.01 119.26 123.44 2x23 h ALA 179 Ca -0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2x23 h ALA 179 Cb 0.75 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.48 2x23 h ALA 179 CO 0.03 0.12 -0.10 0.78 0.00 0.00 0.00 179.25 180.08 2x23 h GLY 180 N 0.26 0.00 1.84 0.00 0.00 -1.02 0.34 103.07 104.48 2x23 h GLY 180 Ca 0.05 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.40 2x23 h GLY 180 CO -0.01 0.00 0.07 0.50 0.00 0.00 0.00 176.54 177.10 2x23 h LYS 181 N 0.00 0.00 -0.09 4.80 1.57 -1.46 -1.86 116.57 119.53 2x23 h LYS 181 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2x23 h LYS 181 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.49 2x23 h LYS 181 CO 0.01 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.55 2x23 n TYR 182 N -3.85 0.09 -1.65 -1.35 4.02 -0.00 -4.96 117.16 109.46 2x23 n TYR 182 Ca -0.02 -0.04 -0.06 0.00 -0.01 0.00 0.00 57.90 57.77 2x23 n TYR 182 Cb 0.16 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.47 2x23 n TYR 182 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2x23 n GLY 183 N 1.38 0.47 3.56 2.72 0.00 -0.70 -3.91 105.19 108.71 2x23 n GLY 183 Ca 0.15 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 2x23 n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x23 s VAL 184 N -2.25 3.49 0.16 1.61 1.01 -0.55 -0.26 120.40 123.61 2x23 s VAL 184 Ca 0.00 -0.75 -0.06 0.00 0.00 0.00 0.00 61.98 61.17 2x23 s VAL 184 Cb 0.00 -2.48 -0.06 0.00 0.00 0.00 0.00 36.38 33.85 2x23 s VAL 184 CO 0.00 0.46 0.41 -0.13 0.00 0.00 0.00 175.10 175.84 2x23 s ARG 185 N -1.21 3.65 -0.06 2.72 0.52 -0.49 -3.01 118.95 121.07 2x23 s ARG 185 Ca 0.15 -0.03 0.01 0.00 -0.52 0.00 0.00 55.73 55.34 2x23 s ARG 185 Cb -0.11 -2.81 0.02 0.00 0.52 0.00 0.00 34.95 32.57 2x23 s ARG 185 CO 0.05 0.43 -0.06 0.45 0.02 0.00 0.00 175.30 176.20 2x23 s SER 186 N -2.45 1.41 0.09 0.23 0.15 -1.26 -0.49 113.70 111.39 2x23 s SER 186 Ca 0.42 -0.18 -0.10 0.00 0.70 0.00 0.00 55.95 56.79 2x23 s SER 186 Cb -0.12 -0.58 0.01 0.00 -1.71 0.00 0.00 66.02 63.61 2x23 s SER 186 CO 0.24 -0.07 0.24 0.20 1.20 0.00 0.00 173.24 175.05 2x23 s ASN 187 N 1.16 0.04 0.14 5.45 0.01 -0.32 0.11 114.94 121.53 2x23 s ASN 187 Ca -0.07 -0.56 0.08 0.00 -0.71 0.00 0.00 52.86 51.61 2x23 s ASN 187 Cb -0.14 0.37 -0.04 0.00 0.41 0.00 0.00 41.25 41.84 2x23 s ASN 187 CO -0.01 -0.74 -0.09 -0.76 -1.51 0.00 0.00 177.10 173.98 2x23 s LEU 188 N -2.79 3.03 -0.26 0.60 1.43 0.26 -1.38 118.68 119.57 2x23 s LEU 188 Ca 0.04 -0.46 -0.04 0.00 -1.03 0.00 0.00 54.13 52.63 2x23 s LEU 188 Cb 0.04 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.49 2x23 s LEU 188 CO -0.11 0.14 0.01 -0.69 0.23 0.00 0.00 176.35 175.93 2x23 s VAL 189 N -1.42 3.48 -0.50 -1.59 1.01 -0.12 -0.61 120.40 120.65 2x23 s VAL 189 Ca 0.23 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 61.22 2x23 s VAL 189 Cb -0.10 -2.74 0.04 0.00 0.00 0.00 0.00 36.38 33.57 2x23 s VAL 189 CO 0.15 0.19 0.84 0.00 0.00 0.00 0.00 175.10 176.28 2x23 s ALA 190 N 1.44 3.24 0.21 5.51 0.00 0.18 -0.22 121.76 132.13 2x23 s ALA 190 Ca 0.02 -1.17 -0.04 0.00 0.00 0.00 0.00 51.96 50.78 2x23 s ALA 190 Cb -0.16 -3.58 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 2x23 s ALA 190 CO -0.01 -2.13 0.44 0.00 0.00 0.00 0.00 175.76 174.06 2x23 s ALA 191 N 3.52 3.74 1.08 0.00 0.00 -0.97 -0.42 121.76 128.71 2x23 s ALA 191 Ca 0.29 -0.63 -0.17 0.00 0.00 0.00 0.00 51.96 51.44 2x23 s ALA 191 Cb -0.13 -2.15 0.24 0.00 0.00 0.00 0.00 23.12 21.07 2x23 s ALA 191 CO 0.20 0.45 1.19 0.20 0.00 0.00 0.00 175.76 177.81 2x23 s GLY 192 N -2.89 1.66 0.20 0.00 0.00 -0.80 -4.70 107.32 100.79 2x23 s GLY 192 Ca 0.41 -0.99 -0.30 0.00 0.00 0.00 0.00 44.72 43.85 2x23 s GLY 192 CO 0.27 -0.19 1.34 2.56 0.00 0.00 0.00 173.10 177.09 2x23 s PRO 193 N -5.57 4.36 0.00 2.90 0.04 -1.26 -5.02 135.00 130.45 2x23 s PRO 193 Ca 0.71 2.11 0.05 0.00 0.04 0.00 0.00 61.00 63.91 2x23 s PRO 193 Cb -0.08 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.27 2x23 s PRO 193 CO 0.55 -0.30 -0.14 0.42 0.04 0.00 0.00 177.00 177.56 2x23 s ILE 194 N 0.16 1.13 -0.97 0.56 -1.09 -1.26 -4.31 121.20 115.42 2x23 s ILE 194 Ca 0.58 -0.70 -0.24 0.00 -2.23 0.00 0.00 60.65 58.06 2x23 s ILE 194 Cb -0.38 -0.96 -0.04 0.00 -1.58 0.00 0.00 42.46 39.50 2x23 s ILE 194 CO 0.39 0.25 1.90 -0.13 -1.23 0.00 0.00 174.94 176.11 2x23 s ARG 195 N -0.51 2.66 0.44 2.79 0.52 -0.23 -4.72 118.95 119.90 2x23 s ARG 195 Ca 0.05 -0.54 0.06 0.00 -0.52 0.00 0.00 55.73 54.78 2x23 s ARG 195 Cb -0.06 -5.13 -0.04 0.00 0.52 0.00 0.00 34.95 30.25 2x23 s ARG 195 CO -0.00 -3.36 0.17 0.95 0.02 0.00 0.00 175.30 173.08 2x23 s THR 196 N 9.69 2.02 0.17 0.02 -4.23 -1.26 -4.90 115.64 117.15 2x23 s THR 196 Ca 0.67 -1.74 -0.17 0.00 -1.18 0.00 0.00 61.69 59.28 2x23 s THR 196 Cb -0.05 -2.76 0.09 0.00 1.34 0.00 0.00 72.50 71.12 2x23 s THR 196 CO 0.01 0.00 1.67 0.25 -0.54 0.00 0.00 174.62 176.01 2x23 h LEU 197 N 1.36 -0.35 -0.68 4.79 5.85 -1.92 -1.32 115.31 123.04 2x23 h LEU 197 Ca -0.42 0.12 0.06 0.00 0.84 0.00 0.00 57.88 58.48 2x23 h LEU 197 Cb 1.27 0.24 -0.06 0.00 0.37 0.00 0.00 40.66 42.48 2x23 h LEU 197 CO 0.70 -0.12 0.38 0.00 -0.34 0.00 0.00 178.44 179.06 2x23 h ALA 198 N 1.39 0.91 -0.29 1.25 0.00 -1.96 0.65 119.26 121.22 2x23 h ALA 198 Ca 0.19 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2x23 h ALA 198 Cb 0.29 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2x23 h ALA 198 CO -0.40 0.06 0.15 1.98 0.00 0.00 0.00 179.25 181.04 2x23 h MET 199 N 0.70 0.31 -0.02 0.00 1.85 -1.72 -0.06 114.93 115.98 2x23 h MET 199 Ca 0.31 -0.02 -0.20 0.00 -0.61 0.00 0.00 59.70 59.18 2x23 h MET 199 Cb 0.19 -0.07 0.01 0.00 0.43 0.00 0.00 31.60 32.17 2x23 h MET 199 CO -0.19 0.20 -0.76 0.66 -0.40 0.00 0.00 176.91 176.42 2x23 h SER 200 N 0.32 0.71 0.15 1.39 4.64 -0.43 0.05 113.55 120.38 2x23 h SER 200 Ca 0.12 -0.73 -0.27 0.00 -0.47 0.00 0.00 61.79 60.44 2x23 h SER 200 Cb 0.02 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 61.91 2x23 h SER 200 CO -0.07 1.34 -1.29 0.00 -0.87 0.00 0.00 176.83 175.94 2x23 h ALA 201 N 0.38 0.06 0.00 5.18 0.00 0.26 -2.52 119.26 122.61 2x23 h ALA 201 Ca -0.09 -0.96 -0.02 0.00 0.00 0.00 0.00 54.91 53.85 2x23 h ALA 201 Cb 1.44 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 2x23 h ALA 201 CO 0.15 0.71 -0.50 0.82 0.00 0.00 0.00 179.25 180.42 2x23 h ILE 202 N -0.22 0.10 0.45 0.00 2.04 -1.16 -3.14 117.51 115.57 2x23 h ILE 202 Ca -0.26 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 64.47 2x23 h ILE 202 Cb 1.82 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 2x23 h ILE 202 CO 0.13 0.03 -0.22 0.58 0.00 0.00 0.00 178.15 178.67 2x23 h VAL 203 N -1.00 0.00 -0.72 1.67 2.07 -1.49 -2.85 116.25 113.93 2x23 h VAL 203 Ca -0.03 -0.20 0.06 0.00 0.82 0.00 0.00 66.70 67.36 2x23 h VAL 203 Cb 0.52 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 2x23 h VAL 203 CO -0.02 0.00 0.47 1.23 0.02 0.00 0.00 177.57 179.28 2x23 h GLY 204 N -0.80 0.95 1.72 2.17 0.00 -0.98 -1.37 103.07 104.76 2x23 h GLY 204 Ca -0.06 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 46.96 2x23 h GLY 204 CO 0.10 0.22 0.16 -1.33 0.00 0.00 0.00 176.54 175.70 2x23 h GLY 205 N 0.75 0.40 -0.35 4.60 0.00 -1.40 -2.75 103.07 104.32 2x23 h GLY 205 Ca 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2x23 h GLY 205 CO -0.10 0.15 -0.29 0.00 0.00 0.00 0.00 176.54 176.30 2x23 n ALA 206 N -2.49 3.15 1.16 3.60 0.00 -0.55 -4.11 120.51 121.27 2x23 n ALA 206 Ca 0.01 -0.50 0.13 0.00 0.00 0.00 0.00 53.44 53.08 2x23 n ALA 206 Cb 0.09 -1.01 0.44 0.00 0.00 0.00 0.00 19.45 18.97 2x23 n ALA 206 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2x23 n LEU 207 N -0.25 0.50 0.00 0.00 4.77 -1.00 -0.68 117.00 120.34 2x23 n LEU 207 Ca 0.12 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2x23 n LEU 207 Cb 0.40 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2x23 n LEU 207 CO 0.25 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 2x23 n GLY 208 N 1.41 1.58 0.16 -0.72 0.00 -1.25 -3.96 105.19 102.40 2x23 n GLY 208 Ca 0.10 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.32 2x23 n GLY 208 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2x23 h GLU 209 N 0.00 0.42 -4.84 1.61 4.39 -1.96 -3.34 114.58 110.86 2x23 h GLU 209 Ca 0.00 -0.45 -0.73 0.00 0.34 0.00 0.00 59.36 58.51 2x23 h GLU 209 Cb 0.00 0.13 -0.16 0.00 -0.10 0.00 0.00 28.75 28.62 2x23 h GLU 209 CO 0.00 1.12 1.51 0.39 -1.16 0.00 0.00 179.01 180.87 2x23 n GLU 210 N -3.75 3.35 0.05 2.33 1.02 -1.25 -4.56 120.64 117.83 2x23 n GLU 210 Ca -0.07 -3.76 0.00 0.00 -0.02 0.00 0.00 57.16 53.31 2x23 n GLU 210 Cb 0.84 -3.10 0.00 0.00 -0.02 0.00 0.00 31.44 29.16 2x23 n GLU 210 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x23 n ALA 211 N 5.93 3.00 -0.36 0.62 0.00 -1.25 -4.33 120.51 124.12 2x23 n ALA 211 Ca 0.39 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.80 2x23 n ALA 211 Cb 0.43 0.24 0.10 0.00 0.00 0.00 0.00 19.45 20.22 2x23 n ALA 211 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2x23 h GLY 212 N 0.00 1.36 0.85 0.00 0.00 -1.89 0.20 103.07 103.60 2x23 h GLY 212 Ca 0.00 -0.54 -0.16 0.00 0.00 0.00 0.00 47.33 46.63 2x23 h GLY 212 CO 0.00 0.52 -0.60 0.00 0.00 0.00 0.00 176.54 176.46 2x23 h ALA 213 N 1.33 0.12 -0.95 3.60 0.00 -1.89 -2.49 119.26 118.99 2x23 h ALA 213 Ca 0.35 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2x23 h ALA 213 Cb -0.11 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2x23 h ALA 213 CO -0.07 0.39 0.60 1.96 0.00 0.00 0.00 179.25 182.12 2x23 h GLN 214 N 0.02 1.27 -0.67 0.00 1.08 -1.70 0.29 115.11 115.40 2x23 h GLN 214 Ca -0.06 -0.10 -0.07 0.00 -1.45 0.00 0.00 58.65 56.97 2x23 h GLN 214 Cb 1.28 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 28.41 2x23 h GLN 214 CO 0.12 0.87 0.16 0.82 -0.95 0.00 0.00 178.83 179.84 2x23 h ILE 215 N 1.30 1.26 -0.81 2.54 2.04 -0.68 -1.82 117.51 121.34 2x23 h ILE 215 Ca 0.34 -0.96 -0.00 0.00 1.00 0.00 0.00 64.86 65.24 2x23 h ILE 215 Cb -0.10 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.54 2x23 h ILE 215 CO -0.07 0.37 0.49 -0.61 0.00 0.00 0.00 178.15 178.33 2x23 h GLN 216 N 1.00 1.10 0.00 2.37 5.75 -0.91 -2.14 115.11 122.27 2x23 h GLN 216 Ca 0.21 -0.09 -0.06 0.00 -0.15 0.00 0.00 58.65 58.55 2x23 h GLN 216 Cb 0.38 -0.23 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 2x23 h GLN 216 CO 0.00 0.77 -0.31 1.25 -2.65 0.00 0.00 178.83 177.89 2x23 h LEU 217 N 1.12 0.00 -0.10 -2.39 5.85 -0.71 -1.63 115.31 117.45 2x23 h LEU 217 Ca 0.29 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.98 2x23 h LEU 217 Cb -0.05 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 40.97 2x23 h LEU 217 CO -0.06 0.31 -0.06 0.25 -0.34 0.00 0.00 178.44 178.55 2x23 h LEU 218 N 0.00 0.23 -0.26 2.25 5.85 -0.86 -2.30 115.31 120.22 2x23 h LEU 218 Ca -0.00 -0.43 0.06 0.00 0.84 0.00 0.00 57.88 58.35 2x23 h LEU 218 Cb 0.69 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 2x23 h LEU 218 CO 0.04 0.61 -0.12 -0.08 -0.34 0.00 0.00 178.44 178.55 2x23 h GLU 219 N -0.14 -0.08 -0.96 1.25 4.81 -1.21 -0.59 114.58 117.65 2x23 h GLU 219 Ca 0.02 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.30 2x23 h GLU 219 Cb 0.52 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.86 2x23 h GLU 219 CO 0.02 -0.05 0.63 0.93 -0.73 0.00 0.00 179.01 179.80 2x23 h GLU 220 N -0.09 1.16 0.10 1.92 5.08 -1.31 -0.64 114.58 120.81 2x23 h GLU 220 Ca 0.14 -0.07 -0.26 0.00 -1.00 0.00 0.00 59.36 58.16 2x23 h GLU 220 Cb 0.29 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2x23 h GLU 220 CO -0.31 0.77 -1.21 0.78 -1.00 0.00 0.00 179.01 178.04 2x23 h GLY 221 N 1.20 0.24 0.89 -3.84 0.00 -1.11 -1.75 103.07 98.70 2x23 h GLY 221 Ca 0.39 -0.61 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 2x23 h GLY 221 CO -0.12 0.53 -0.20 -0.25 0.00 0.00 0.00 176.54 176.50 2x23 h TRP 222 N 0.06 0.68 -0.44 5.60 2.91 -0.90 -2.19 115.95 121.67 2x23 h TRP 222 Ca -0.11 -0.19 -0.08 0.00 1.13 0.00 0.00 58.89 59.63 2x23 h TRP 222 Cb 1.93 -0.15 -0.02 0.00 -0.51 0.00 0.00 29.16 30.41 2x23 h TRP 222 CO 0.05 0.88 -0.06 0.22 -1.03 0.00 0.00 178.44 178.50 2x23 h ASP 223 N 0.29 0.72 -0.48 2.65 3.58 -1.14 -0.82 116.42 121.23 2x23 h ASP 223 Ca 0.05 -0.19 -0.08 0.00 0.42 0.00 0.00 57.03 57.23 2x23 h ASP 223 Cb 0.74 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.58 2x23 h ASP 223 CO 0.05 0.83 -0.02 1.56 -2.88 0.00 0.00 179.24 178.78 2x23 h GLN 224 N 0.69 0.85 -0.08 0.28 4.20 -1.30 -3.29 115.11 116.46 2x23 h GLN 224 Ca 0.13 -0.28 -0.24 0.00 0.06 0.00 0.00 58.65 58.31 2x23 h GLN 224 Cb 0.51 -0.07 0.02 0.00 0.30 0.00 0.00 27.48 28.23 2x23 h GLN 224 CO 0.03 0.90 -0.91 -0.09 -0.67 0.00 0.00 178.83 178.09 2x23 h ARG 225 N 0.70 0.75 -6.09 1.46 2.43 -1.16 -3.43 114.38 109.04 2x23 h ARG 225 Ca 0.13 -0.70 -0.59 0.00 -0.81 0.00 0.00 59.98 58.01 2x23 h ARG 225 Cb 0.53 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2x23 h ARG 225 CO 0.03 1.29 1.39 0.00 -1.51 0.00 0.00 179.97 181.17 2x23 n ALA 226 N -2.63 1.55 0.11 2.80 0.00 -0.33 -4.62 120.51 117.40 2x23 n ALA 226 Ca -0.09 -0.07 0.17 0.00 0.00 0.00 0.00 53.44 53.44 2x23 n ALA 226 Cb 0.81 -2.78 0.71 0.00 0.00 0.00 0.00 19.45 18.20 2x23 n ALA 226 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2x23 h PRO 227 N 13.18 0.00 -0.60 0.00 0.11 -1.80 -1.40 132.00 141.49 2x23 h PRO 227 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2x23 h PRO 227 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2x23 h PRO 227 CO 0.96 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 179.19 2x23 n ILE 228 N -4.27 1.72 -0.16 4.15 -5.35 -1.21 -5.09 119.36 109.15 2x23 n ILE 228 Ca 0.05 -1.21 0.02 0.00 -0.27 0.00 0.00 62.75 61.34 2x23 n ILE 228 Cb 0.42 0.17 -0.01 0.00 -1.74 0.00 0.00 39.64 38.48 2x23 n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2x23 n GLY 229 N 1.01 -1.94 3.33 3.28 0.00 -0.53 -5.02 105.19 105.32 2x23 n GLY 229 Ca 0.24 -1.46 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 2x23 n GLY 229 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2x23 s TRP 230 N -2.02 -0.68 -0.30 1.61 -0.11 -1.26 -4.53 118.94 111.65 2x23 s TRP 230 Ca 0.00 1.42 0.00 0.00 1.22 0.00 0.00 56.10 58.74 2x23 s TRP 230 Cb 0.00 0.32 0.06 0.00 -1.50 0.00 0.00 33.47 32.36 2x23 s TRP 230 CO 0.00 -0.38 -0.01 1.21 -4.62 0.00 0.00 176.95 173.15 2x23 s ASN 231 N 1.47 4.78 0.44 5.86 3.84 -1.26 -4.54 114.94 125.52 2x23 s ASN 231 Ca -0.09 -1.45 0.30 0.00 0.21 0.00 0.00 52.86 51.83 2x23 s ASN 231 Cb -0.08 -1.67 1.37 0.00 -0.55 0.00 0.00 41.25 40.33 2x23 s ASN 231 CO -0.14 -0.27 1.91 0.24 -2.79 0.00 0.00 177.10 176.05 2x23 h MET 232 N 7.90 0.00 -0.02 0.43 2.86 -1.94 -2.32 114.93 121.84 2x23 h MET 232 Ca -0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2x23 h MET 232 Cb 1.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.71 2x23 h MET 232 CO 0.52 0.00 0.00 1.63 1.06 0.00 0.00 176.91 180.12 2x23 n LYS 233 N -2.68 1.41 -3.90 1.72 5.02 -1.26 -1.07 118.16 117.39 2x23 n LYS 233 Ca 0.00 -0.59 -0.30 0.00 -2.02 0.00 0.00 58.31 55.40 2x23 n LYS 233 Cb 0.21 -1.47 -0.15 0.00 -0.02 0.00 0.00 35.03 33.59 2x23 n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2x23 s ASP 234 N -1.96 4.26 0.20 4.39 2.15 -0.87 -4.95 116.67 119.89 2x23 s ASP 234 Ca 0.41 -1.71 0.26 0.00 0.43 0.00 0.00 52.55 51.94 2x23 s ASP 234 Cb 0.21 -1.24 0.84 0.00 -0.30 0.00 0.00 42.92 42.43 2x23 s ASP 234 CO 0.34 -0.35 1.79 0.00 -0.17 0.00 0.00 175.17 176.77 2x23 n ALA 235 N 4.58 2.28 -0.15 3.66 0.00 -1.26 -4.28 120.51 125.33 2x23 n ALA 235 Ca -0.02 -0.03 -0.04 0.00 0.00 0.00 0.00 53.44 53.34 2x23 n ALA 235 Cb 0.43 -1.47 0.05 0.00 0.00 0.00 0.00 19.45 18.45 2x23 n ALA 235 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2x23 h THR 236 N 0.00 0.92 -0.39 0.00 2.02 -1.95 -1.12 112.91 112.39 2x23 h THR 236 Ca 0.00 -0.15 0.06 0.00 0.77 0.00 0.00 66.41 67.09 2x23 h THR 236 Cb 0.72 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 2x23 h THR 236 CO 0.00 0.08 0.27 -0.65 0.37 0.00 0.00 175.52 175.59 2x23 h PRO 237 N 0.43 0.27 -0.15 6.66 0.11 -1.99 0.20 132.00 137.53 2x23 h PRO 237 Ca 0.22 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 2x23 h PRO 237 Cb 0.16 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.20 2x23 h PRO 237 CO -0.17 0.18 -0.11 0.28 -0.21 0.00 0.00 178.00 177.97 2x23 h VAL 238 N 0.28 1.33 -0.76 3.15 2.07 -1.53 -2.63 116.25 118.16 2x23 h VAL 238 Ca 0.17 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.52 2x23 h VAL 238 Cb 0.33 1.80 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 2x23 h VAL 238 CO -0.04 0.35 0.48 0.00 0.02 0.00 0.00 177.57 178.39 2x23 h ALA 239 N 0.64 1.00 -0.71 1.67 0.00 -0.81 -1.98 119.26 119.07 2x23 h ALA 239 Ca 0.03 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.94 2x23 h ALA 239 Cb 0.61 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2x23 h ALA 239 CO 0.03 0.28 0.45 0.87 0.00 0.00 0.00 179.25 180.88 2x23 h LYS 240 N 0.94 0.86 -0.51 0.00 1.57 -0.98 -1.13 116.57 117.32 2x23 h LYS 240 Ca 0.31 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 59.00 2x23 h LYS 240 Cb 0.02 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 2x23 h LYS 240 CO -0.11 0.57 0.20 1.15 -0.57 0.00 0.00 179.45 180.69 2x23 h THR 241 N 0.89 1.22 -0.51 -0.16 2.02 -1.03 -0.36 112.91 114.97 2x23 h THR 241 Ca 0.28 -0.68 0.03 0.00 0.77 0.00 0.00 66.41 66.81 2x23 h THR 241 Cb -0.00 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 2x23 h THR 241 CO -0.10 0.26 0.30 0.58 0.37 0.00 0.00 175.52 176.92 2x23 h VAL 242 N 0.69 1.03 -0.73 3.16 2.07 -1.15 -2.27 116.25 119.05 2x23 h VAL 242 Ca 0.17 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.52 2x23 h VAL 242 Cb 0.20 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.33 2x23 h VAL 242 CO -0.01 0.11 0.48 0.00 0.02 0.00 0.00 177.57 178.16 2x23 h ALA 244 N 1.57 0.79 -0.02 0.00 0.00 -0.58 -1.32 119.26 119.70 2x23 h ALA 244 Ca 0.28 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 2x23 h ALA 244 Cb 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2x23 h ALA 244 CO -0.08 0.26 -0.46 -0.07 0.00 0.00 0.00 179.25 178.91 2x23 h LEU 245 N 0.84 0.05 -1.21 0.00 3.38 -0.82 -2.65 115.31 114.90 2x23 h LEU 245 Ca 0.22 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 2x23 h LEU 245 Cb -0.03 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2x23 h LEU 245 CO -0.04 0.50 -0.31 -0.07 0.09 0.00 0.00 178.44 178.61 2x23 h LEU 246 N 0.04 0.00 0.00 1.67 3.38 -0.72 -3.46 115.31 116.22 2x23 h LEU 246 Ca -0.00 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.60 2x23 h LEU 246 Cb 0.82 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.73 2x23 h LEU 246 CO 0.06 0.31 0.27 -1.54 0.09 0.00 0.00 178.44 177.63 2x23 n SER 247 N -3.63 -0.68 -0.60 -0.43 3.41 -0.53 -4.76 113.62 106.40 2x23 n SER 247 Ca -0.01 -1.30 0.06 0.00 -0.26 0.00 0.00 58.87 57.37 2x23 n SER 247 Cb 0.43 -0.89 0.19 0.00 -0.26 0.00 0.00 64.21 63.67 2x23 n SER 247 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2x23 n ASP 248 N -4.09 1.74 -0.69 4.04 8.00 -1.26 -4.29 116.55 120.00 2x23 n ASP 248 Ca 0.14 -1.95 0.13 0.00 0.71 0.00 0.00 54.79 53.82 2x23 n ASP 248 Cb 0.51 -0.20 0.27 0.00 -0.02 0.00 0.00 41.12 41.68 2x23 n ASP 248 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2x23 n TRP 249 N 0.44 0.00 -3.10 1.24 7.02 -1.26 -4.05 117.44 117.72 2x23 n TRP 249 Ca 0.12 0.00 -0.22 0.00 -1.02 0.00 0.00 57.50 56.38 2x23 n TRP 249 Cb 0.28 -0.01 -0.04 0.00 -2.42 0.00 0.00 31.31 29.13 2x23 n TRP 249 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2x23 n LEU 250 N 0.64 2.35 0.00 -0.99 4.77 -1.26 -4.95 117.00 117.55 2x23 n LEU 250 Ca 0.15 -5.28 0.13 0.00 -0.03 0.00 0.00 56.01 50.99 2x23 n LEU 250 Cb 0.48 0.16 0.60 0.00 -2.33 0.00 0.00 43.42 42.33 2x23 n LEU 250 CO 0.18 2.30 0.93 -0.81 -1.33 0.00 0.00 177.39 178.65 2x23 n PRO 251 N 0.16 0.12 -0.21 3.23 -0.04 -1.26 -3.49 135.00 133.51 2x23 n PRO 251 Ca 0.27 0.04 0.07 0.00 -0.04 0.00 0.00 63.50 63.84 2x23 n PRO 251 Cb 0.54 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.66 2x23 n PRO 251 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2x23 n ALA 252 N -1.43 2.44 -3.88 0.55 0.00 -1.26 -4.96 120.51 111.96 2x23 n ALA 252 Ca 0.08 -1.86 -0.34 0.00 0.00 0.00 0.00 53.44 51.33 2x23 n ALA 252 Cb 0.28 -0.44 -0.15 0.00 0.00 0.00 0.00 19.45 19.14 2x23 n ALA 252 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2x23 s THR 253 N -2.06 2.56 -0.05 0.00 2.01 -1.23 -5.10 115.64 111.78 2x23 s THR 253 Ca 0.27 -0.87 -0.22 0.00 0.31 0.00 0.00 61.69 61.18 2x23 s THR 253 Cb 0.21 -2.17 0.05 0.00 0.01 0.00 0.00 72.50 70.59 2x23 s THR 253 CO 0.08 0.42 0.49 0.28 -0.69 0.00 0.00 174.62 175.19 2x23 s THR 254 N 1.34 0.03 -0.20 -0.82 -1.32 -1.26 -4.65 115.64 108.75 2x23 s THR 254 Ca 0.04 -0.21 0.00 0.00 -1.21 0.00 0.00 61.69 60.30 2x23 s THR 254 Cb -0.14 -0.79 0.00 0.00 -1.51 0.00 0.00 72.50 70.05 2x23 s THR 254 CO -0.08 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 172.82 2x23 n GLY 255 N 1.31 0.54 3.70 6.08 0.00 0.12 -4.95 105.19 111.99 2x23 n GLY 255 Ca -0.19 -0.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.83 2x23 n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2x23 s ASP 256 N -2.69 3.93 -0.08 1.61 -1.08 -1.23 -4.50 116.67 112.63 2x23 s ASP 256 Ca 0.00 -1.58 0.00 0.00 -0.52 0.00 0.00 52.55 50.45 2x23 s ASP 256 Cb 0.00 0.28 0.02 0.00 -1.46 0.00 0.00 42.92 41.77 2x23 s ASP 256 CO 0.00 -0.76 -0.07 -0.63 0.52 0.00 0.00 175.17 174.24 2x23 s ILE 257 N -2.87 0.83 -0.12 4.11 1.01 -1.26 -0.58 121.20 122.33 2x23 s ILE 257 Ca 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 2x23 s ILE 257 Cb 0.04 -0.84 -0.03 0.00 0.01 0.00 0.00 42.46 41.64 2x23 s ILE 257 CO 0.08 0.31 -0.04 -0.63 0.00 0.00 0.00 174.94 174.65 2x23 s ILE 258 N 1.29 3.87 -0.36 2.92 -1.09 0.21 -4.97 121.20 123.08 2x23 s ILE 258 Ca -0.04 -0.39 -0.14 0.00 -2.23 0.00 0.00 60.65 57.86 2x23 s ILE 258 Cb -0.14 -2.65 -0.01 0.00 -1.58 0.00 0.00 42.46 38.09 2x23 s ILE 258 CO -0.03 0.54 0.27 -0.31 -1.23 0.00 0.00 174.94 174.18 2x23 s TYR 259 N -0.20 3.23 -0.88 3.97 1.51 -1.26 -0.65 117.35 123.07 2x23 s TYR 259 Ca 0.03 -0.32 -0.00 0.00 -1.01 0.00 0.00 57.07 55.78 2x23 s TYR 259 Cb -0.13 -2.52 0.25 0.00 -0.11 0.00 0.00 41.96 39.45 2x23 s TYR 259 CO 0.02 -0.43 0.94 0.00 -1.11 0.00 0.00 175.55 174.97 2x23 n ALA 260 N 5.14 4.19 -1.75 3.71 0.00 0.44 -4.76 120.51 127.48 2x23 n ALA 260 Ca -0.12 -4.69 0.00 0.00 0.00 0.00 0.00 53.44 48.63 2x23 n ALA 260 Cb 0.49 -1.66 0.01 0.00 0.00 0.00 0.00 19.45 18.29 2x23 n ALA 260 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2x23 n ASP 261 N 1.71 0.10 0.00 0.00 5.75 -1.26 -1.90 116.55 120.95 2x23 n ASP 261 Ca 0.25 -1.85 0.00 0.00 -0.01 0.00 0.00 54.79 53.18 2x23 n ASP 261 Cb 0.37 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 2x23 n ASP 261 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2x23 n GLY 262 N -0.06 0.70 1.80 6.12 0.00 -1.26 -2.52 105.19 109.98 2x23 n GLY 262 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2x23 n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x23 n GLY 263 N -2.05 0.50 0.31 -0.02 0.00 -1.26 -2.99 105.19 99.67 2x23 n GLY 263 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.55 2x23 n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x23 h ALA 264 N 0.00 1.45 0.00 4.61 0.00 -1.75 -2.10 119.26 121.48 2x23 h ALA 264 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2x23 h ALA 264 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2x23 h ALA 264 CO 0.00 0.44 0.00 -2.39 0.00 0.00 0.00 179.25 177.30 2x23 n HIS 265 N -4.37 0.35 1.26 0.00 1.44 -1.26 -2.09 115.22 110.54 2x23 n HIS 265 Ca 0.04 0.15 0.13 0.00 -2.01 0.00 0.00 57.72 56.04 2x23 n HIS 265 Cb 0.13 -0.75 0.32 0.00 0.12 0.00 0.00 29.99 29.81 2x23 n HIS 265 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2x23 n THR 266 N -1.83 0.00 -4.74 0.61 -2.24 -0.79 -4.89 114.28 100.40 2x23 n THR 266 Ca 0.01 -0.27 -0.24 0.00 -2.27 0.00 0.00 64.05 61.29 2x23 n THR 266 Cb 0.12 0.79 -0.15 0.00 -2.10 0.00 0.00 70.33 68.99 2x23 n THR 266 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2x23 s GLN 267 N -2.20 1.30 -0.13 -0.78 -1.52 -0.89 -5.04 119.66 110.40 2x23 s GLN 267 Ca 0.30 -0.56 -0.12 0.00 -1.95 0.00 0.00 55.36 53.03 2x23 s GLN 267 Cb 0.20 -1.25 -0.25 0.00 -0.22 0.00 0.00 33.01 31.49 2x23 s GLN 267 CO 0.41 0.33 0.37 1.25 -0.25 0.00 0.00 175.29 177.40 2x23 h LEU 268 N 5.79 0.33 0.00 2.90 5.85 -1.90 -3.49 115.31 124.79 2x23 h LEU 268 Ca -0.35 -0.84 0.00 0.00 0.84 0.00 0.00 57.88 57.53 2x23 h LEU 268 Cb 1.16 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.08 2x23 h LEU 268 CO 0.49 1.74 0.00 -0.11 -0.34 0.00 0.00 178.44 180.22