#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ax1 s GLU 2 N 0.00 4.14 0.01 1.45 2.02 0.15 -4.85 118.70 121.62 1ax1 s GLU 2 Ca 0.00 0.62 0.06 0.00 0.02 0.00 0.00 54.97 55.67 1ax1 s GLU 2 Cb 0.00 -3.63 -0.02 0.00 0.10 0.00 0.00 34.13 30.58 1ax1 s GLU 2 CO 0.00 -0.39 -0.18 0.99 0.02 0.00 0.00 175.26 175.70 1ax1 s THR 3 N 2.42 1.46 -0.01 3.63 2.01 -1.26 0.77 115.64 124.66 1ax1 s THR 3 Ca 0.28 -0.95 -0.01 0.00 0.31 0.00 0.00 61.69 61.32 1ax1 s THR 3 Cb -0.16 -1.25 0.00 0.00 0.01 0.00 0.00 72.50 71.11 1ax1 s THR 3 CO 0.09 0.28 0.04 -0.51 -0.69 0.00 0.00 174.62 173.83 1ax1 s ILE 4 N -0.61 0.01 0.06 1.82 2.07 -0.39 -4.99 121.20 119.17 1ax1 s ILE 4 Ca 0.06 -0.05 -0.23 0.00 -1.41 0.00 0.00 60.65 59.03 1ax1 s ILE 4 Cb -0.08 -0.08 0.06 0.00 0.13 0.00 0.00 42.46 42.49 1ax1 s ILE 4 CO 0.00 -0.03 0.55 -0.94 -1.91 0.00 0.00 174.94 172.61 1ax1 s SER 5 N -0.06 -0.48 0.03 4.50 1.04 -1.26 -0.46 113.70 117.01 1ax1 s SER 5 Ca -0.01 0.18 -0.21 0.00 0.48 0.00 0.00 55.95 56.39 1ax1 s SER 5 Cb -0.01 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.67 1ax1 s SER 5 CO 0.00 -0.76 0.47 0.72 0.98 0.00 0.00 173.24 174.65 1ax1 s PHE 6 N -2.62 -0.36 -0.16 5.02 -0.12 -0.16 -4.99 117.98 114.58 1ax1 s PHE 6 Ca -0.04 0.42 -0.05 0.00 -0.05 0.00 0.00 56.93 57.20 1ax1 s PHE 6 Cb -0.00 0.28 0.08 0.00 -0.63 0.00 0.00 43.02 42.74 1ax1 s PHE 6 CO -0.03 -0.59 0.33 0.45 -0.05 0.00 0.00 175.22 175.33 1ax1 s SER 7 N -1.85 0.14 -0.35 1.98 0.15 -1.26 -0.87 113.70 111.64 1ax1 s SER 7 Ca -0.07 0.71 -0.00 0.00 0.70 0.00 0.00 55.95 57.30 1ax1 s SER 7 Cb -0.01 0.97 0.09 0.00 -1.71 0.00 0.00 66.02 65.35 1ax1 s SER 7 CO -0.00 -0.24 0.08 -0.36 1.20 0.00 0.00 173.24 173.91 1ax1 s PHE 8 N 2.50 3.53 0.11 3.44 0.08 0.24 -4.93 117.98 122.95 1ax1 s PHE 8 Ca 0.01 -2.44 0.26 0.00 0.12 0.00 0.00 56.93 54.87 1ax1 s PHE 8 Cb -0.12 -2.72 0.98 0.00 -0.57 0.00 0.00 43.02 40.59 1ax1 s PHE 8 CO -0.11 -0.91 1.85 0.77 -0.10 0.00 0.00 175.22 176.72 1ax1 h SER 9 N 7.88 0.00 -4.99 1.36 0.02 -1.87 -1.39 113.55 114.56 1ax1 h SER 9 Ca -0.13 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.86 1ax1 h SER 9 Cb 1.04 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.48 1ax1 h SER 9 CO 0.58 0.18 0.26 -1.83 -1.14 0.00 0.00 176.83 174.88 1ax1 s GLU 10 N -3.64 1.39 -0.11 3.45 -1.05 -1.26 -4.54 118.70 112.95 1ax1 s GLU 10 Ca 0.01 -0.63 -0.04 0.00 -0.15 0.00 0.00 54.97 54.16 1ax1 s GLU 10 Cb 0.10 0.56 -0.04 0.00 -0.44 0.00 0.00 34.13 34.31 1ax1 s GLU 10 CO 0.62 -0.62 0.04 -0.06 0.95 0.00 0.00 175.26 176.19 1ax1 s PHE 11 N -3.71 3.29 -0.17 4.83 0.08 -0.61 -5.00 117.98 116.69 1ax1 s PHE 11 Ca 0.05 0.26 -0.04 0.00 0.12 0.00 0.00 56.93 57.32 1ax1 s PHE 11 Cb -0.03 -1.86 -0.03 0.00 -0.57 0.00 0.00 43.02 40.53 1ax1 s PHE 11 CO -0.05 0.50 -0.02 -1.21 -0.10 0.00 0.00 175.22 174.33 1ax1 s GLU 12 N -0.76 3.69 0.39 0.44 2.02 -1.26 -4.03 118.70 119.19 1ax1 s GLU 12 Ca 0.12 -0.50 -0.27 0.00 0.02 0.00 0.00 54.97 54.34 1ax1 s GLU 12 Cb -0.12 -2.97 -0.10 0.00 0.10 0.00 0.00 34.13 31.04 1ax1 s GLU 12 CO 0.03 0.20 1.38 -2.14 0.02 0.00 0.00 175.26 174.74 1ax1 s PRO 13 N 0.49 4.03 0.00 0.39 0.02 -1.26 -2.51 135.00 136.16 1ax1 s PRO 13 Ca -0.02 2.34 0.00 0.00 0.02 0.00 0.00 61.00 63.33 1ax1 s PRO 13 Cb -0.14 -2.86 0.00 0.00 0.02 0.00 0.00 34.50 31.52 1ax1 s PRO 13 CO 0.02 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.60 1ax1 n GLY 14 N 0.62 2.06 3.61 0.52 0.00 -1.26 -5.02 105.19 105.72 1ax1 n GLY 14 Ca 0.02 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.57 1ax1 n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ax1 n ASN 15 N 0.00 1.76 -1.52 1.61 2.85 -1.04 -4.90 115.26 114.02 1ax1 n ASN 15 Ca 0.00 1.15 0.10 0.00 -0.11 0.00 0.00 54.58 55.71 1ax1 n ASN 15 Cb 0.00 -1.29 0.35 0.00 1.24 0.00 0.00 39.78 40.08 1ax1 n ASN 15 CO 0.00 0.00 0.00 -0.90 -2.11 0.00 0.00 177.26 174.25 1ax1 n ASP 16 N 1.98 4.61 -0.39 1.20 5.68 -1.26 -4.20 116.55 124.18 1ax1 n ASP 16 Ca 0.13 -2.41 0.12 0.00 -0.50 0.00 0.00 54.79 52.14 1ax1 n ASP 16 Cb 0.27 -0.56 0.22 0.00 -1.14 0.00 0.00 41.12 39.92 1ax1 n ASP 16 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1ax1 n ASN 17 N 1.11 1.54 -4.09 -1.12 3.02 -1.26 -4.84 115.26 109.62 1ax1 n ASN 17 Ca 0.25 -1.22 -0.24 0.00 -0.03 0.00 0.00 54.58 53.34 1ax1 n ASN 17 Cb 0.85 0.26 -0.16 0.00 -0.61 0.00 0.00 39.78 40.12 1ax1 n ASN 17 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ax1 s LEU 18 N -2.44 1.87 -0.39 3.41 1.43 -1.26 -0.83 118.68 120.47 1ax1 s LEU 18 Ca 0.23 -0.29 -0.14 0.00 -1.03 0.00 0.00 54.13 52.90 1ax1 s LEU 18 Cb 0.19 -0.81 0.01 0.00 0.03 0.00 0.00 46.19 45.61 1ax1 s LEU 18 CO 0.52 0.12 0.28 -0.89 0.23 0.00 0.00 176.35 176.61 1ax1 s THR 19 N 0.08 5.18 -0.07 5.49 2.01 0.66 -4.89 115.64 124.10 1ax1 s THR 19 Ca -0.03 -0.61 -0.18 0.00 0.31 0.00 0.00 61.69 61.18 1ax1 s THR 19 Cb -0.10 -3.85 -0.05 0.00 0.01 0.00 0.00 72.50 68.51 1ax1 s THR 19 CO 0.01 -0.25 0.49 -0.76 -0.69 0.00 0.00 174.62 173.42 1ax1 s LEU 20 N 1.67 4.34 0.12 4.42 1.02 -1.26 -1.31 118.68 127.69 1ax1 s LEU 20 Ca 0.05 0.91 0.06 0.00 0.02 0.00 0.00 54.13 55.17 1ax1 s LEU 20 Cb -0.19 -2.72 -0.04 0.00 0.02 0.00 0.00 46.19 43.27 1ax1 s LEU 20 CO 0.10 0.08 -0.14 -1.10 0.02 0.00 0.00 176.35 175.31 1ax1 s GLN 21 N 0.13 1.02 7.66 1.70 -0.21 0.07 -4.99 119.66 125.05 1ax1 s GLN 21 Ca 0.26 -1.23 0.00 0.00 0.02 0.00 0.00 55.36 54.41 1ax1 s GLN 21 Cb -0.16 -0.91 0.00 0.00 1.00 0.00 0.00 33.01 32.94 1ax1 s GLN 21 CO 0.12 0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.88 1ax1 n GLY 22 N 0.55 3.48 0.05 3.09 0.00 -1.26 -1.57 105.19 109.53 1ax1 n GLY 22 Ca -0.16 -0.15 0.13 0.00 0.00 0.00 0.00 46.02 45.85 1ax1 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ax1 n ALA 23 N 11.50 2.28 -1.57 4.61 0.00 0.14 -4.92 120.51 132.55 1ax1 n ALA 23 Ca 0.00 -0.06 -0.47 0.00 0.00 0.00 0.00 53.44 52.91 1ax1 n ALA 23 Cb 0.00 -1.46 -0.03 0.00 0.00 0.00 0.00 19.45 17.96 1ax1 n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ax1 n ALA 24 N -1.64 -0.78 -3.51 0.00 0.00 -0.98 -4.57 120.51 109.03 1ax1 n ALA 24 Ca 0.06 0.43 -0.14 0.00 0.00 0.00 0.00 53.44 53.79 1ax1 n ALA 24 Cb 0.37 -1.98 -0.08 0.00 0.00 0.00 0.00 19.45 17.77 1ax1 n ALA 24 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ax1 s LEU 25 N 0.78 -0.37 -0.23 0.00 0.20 -0.83 -4.69 118.68 113.55 1ax1 s LEU 25 Ca 0.67 1.09 -0.09 0.00 0.69 0.00 0.00 54.13 56.49 1ax1 s LEU 25 Cb -0.80 2.17 -0.04 0.00 -0.43 0.00 0.00 46.19 47.08 1ax1 s LEU 25 CO 0.56 -0.30 0.12 -0.63 -0.29 0.00 0.00 176.35 175.80 1ax1 s ILE 26 N -0.04 4.99 0.69 6.68 1.01 -1.26 -0.76 121.20 132.51 1ax1 s ILE 26 Ca -0.03 0.05 -0.10 0.00 0.00 0.00 0.00 60.65 60.57 1ax1 s ILE 26 Cb -0.04 -3.31 0.02 0.00 0.01 0.00 0.00 42.46 39.14 1ax1 s ILE 26 CO 0.03 0.36 1.06 0.42 0.00 0.00 0.00 174.94 176.81 1ax1 s THR 27 N 1.07 3.25 0.31 2.92 -4.23 0.07 -4.74 115.64 114.29 1ax1 s THR 27 Ca 0.06 0.25 0.38 0.00 -1.18 0.00 0.00 61.69 61.20 1ax1 s THR 27 Cb -0.14 -3.38 0.41 0.00 1.34 0.00 0.00 72.50 70.74 1ax1 s THR 27 CO 0.04 -0.46 2.13 1.56 -0.54 0.00 0.00 174.62 177.35 1ax1 h GLN 28 N -0.59 0.00 -0.03 3.99 1.08 -1.95 -1.43 115.11 116.18 1ax1 h GLN 28 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1ax1 h GLN 28 Cb 1.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 1ax1 h GLN 28 CO 0.63 0.00 0.00 -1.13 -0.95 0.00 0.00 178.83 177.38 1ax1 n SER 29 N -3.08 0.65 0.00 1.46 3.41 -1.26 -4.91 113.62 109.89 1ax1 n SER 29 Ca -0.01 -1.35 0.00 0.00 -0.26 0.00 0.00 58.87 57.25 1ax1 n SER 29 Cb 0.22 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.15 1ax1 n SER 29 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ax1 n GLY 30 N 1.01 0.60 3.84 5.00 0.00 -0.54 -4.96 105.19 110.14 1ax1 n GLY 30 Ca 0.19 -0.35 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1ax1 n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ax1 s VAL 31 N -2.00 5.25 -0.43 1.61 1.01 -1.26 -1.58 120.40 123.01 1ax1 s VAL 31 Ca 0.00 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 1ax1 s VAL 31 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 36.38 33.13 1ax1 s VAL 31 CO 0.00 0.61 0.46 -0.22 0.00 0.00 0.00 175.10 175.96 1ax1 s LEU 32 N -0.98 4.83 -0.52 3.92 2.96 -0.32 -0.75 118.68 127.83 1ax1 s LEU 32 Ca 0.14 -0.65 -0.18 0.00 -0.22 0.00 0.00 54.13 53.23 1ax1 s LEU 32 Cb -0.12 -2.43 0.08 0.00 0.50 0.00 0.00 46.19 44.22 1ax1 s LEU 32 CO 0.04 -0.61 0.57 -1.10 -1.32 0.00 0.00 176.35 173.92 1ax1 s GLN 33 N 2.22 3.05 0.20 1.98 -0.21 0.06 -0.43 119.66 126.53 1ax1 s GLN 33 Ca 0.13 -1.19 -0.09 0.00 0.02 0.00 0.00 55.36 54.24 1ax1 s GLN 33 Cb -0.17 -4.16 0.12 0.00 1.00 0.00 0.00 33.01 29.80 1ax1 s GLN 33 CO 0.14 -1.25 1.74 -0.07 -2.12 0.00 0.00 175.29 173.73 1ax1 h LEU 34 N 9.43 1.02 -9.29 2.90 3.38 -1.54 -2.20 115.31 119.02 1ax1 h LEU 34 Ca -0.28 -0.20 -0.62 0.00 0.09 0.00 0.00 57.88 56.87 1ax1 h LEU 34 Cb 1.10 -0.27 -0.14 0.00 0.09 0.00 0.00 40.66 41.44 1ax1 h LEU 34 CO 0.98 0.94 -0.73 0.42 0.09 0.00 0.00 178.44 180.14 1ax1 s THR 35 N -5.46 3.04 0.30 0.22 -4.23 -1.26 -2.84 115.64 105.42 1ax1 s THR 35 Ca -0.12 -1.78 -0.29 0.00 -1.18 0.00 0.00 61.69 58.31 1ax1 s THR 35 Cb 0.15 -2.52 -0.11 0.00 1.34 0.00 0.00 72.50 71.36 1ax1 s THR 35 CO 0.83 -0.15 1.48 -0.75 -0.54 0.00 0.00 174.62 175.50 1ax1 s LYS 36 N -2.91 4.19 -0.17 3.99 2.20 -1.26 -4.77 119.74 121.01 1ax1 s LYS 36 Ca 0.25 2.44 -0.01 0.00 -0.36 0.00 0.00 55.97 58.30 1ax1 s LYS 36 Cb -0.08 -3.04 -0.00 0.00 -1.51 0.00 0.00 37.83 33.19 1ax1 s LYS 36 CO 0.15 -0.49 -0.12 0.42 -0.36 0.00 0.00 175.35 174.95 1ax1 s ILE 37 N -0.42 2.90 1.22 5.43 -1.09 -1.26 -0.10 121.20 127.88 1ax1 s ILE 37 Ca 0.58 -0.68 -0.19 0.00 -2.23 0.00 0.00 60.65 58.13 1ax1 s ILE 37 Cb -0.45 -2.25 0.29 0.00 -1.58 0.00 0.00 42.46 38.47 1ax1 s ILE 37 CO 0.51 0.49 1.07 0.20 -1.23 0.00 0.00 174.94 175.98 1ax1 s ASN 38 N 0.93 0.74 0.36 3.58 0.02 0.17 -4.87 114.94 115.87 1ax1 s ASN 38 Ca -0.02 0.79 0.08 0.00 -1.02 0.00 0.00 52.86 52.69 1ax1 s ASN 38 Cb -0.15 -1.14 0.70 0.00 0.02 0.00 0.00 41.25 40.68 1ax1 s ASN 38 CO -0.01 -4.25 1.87 0.06 0.02 0.00 0.00 177.10 174.79 1ax1 h GLN 39 N -2.67 0.27 0.00 -0.60 -0.00 -2.00 -1.81 115.11 108.30 1ax1 h GLN 39 Ca -0.47 -0.07 0.00 0.00 -0.00 0.00 0.00 58.65 58.11 1ax1 h GLN 39 Cb 1.31 -0.03 0.00 0.00 -0.00 0.00 0.00 27.48 28.76 1ax1 h GLN 39 CO 0.37 0.44 0.00 0.27 -0.00 0.00 0.00 178.83 179.91 1ax1 n ASN 40 N -4.23 0.00 0.00 0.06 6.94 -1.26 -4.87 115.26 111.91 1ax1 n ASN 40 Ca -0.01 -1.00 0.00 0.00 -0.02 0.00 0.00 54.58 53.56 1ax1 n ASN 40 Cb 0.31 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.73 1ax1 n ASN 40 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ax1 n GLY 41 N 0.66 0.76 3.89 4.83 0.00 -0.68 -5.05 105.19 109.61 1ax1 n GLY 41 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1ax1 n GLY 41 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ax1 s MET 42 N -0.16 3.61 0.18 1.61 -1.94 -1.26 -4.79 119.30 116.54 1ax1 s MET 42 Ca 0.00 -0.09 -0.30 0.00 -1.71 0.00 0.00 55.69 53.59 1ax1 s MET 42 Cb 0.00 -2.96 -0.08 0.00 2.01 0.00 0.00 34.83 33.80 1ax1 s MET 42 CO 0.00 0.55 1.26 -1.25 -0.01 0.00 0.00 175.02 175.57 1ax1 s PRO 43 N -2.28 4.43 0.20 2.03 0.04 -1.26 0.42 135.00 138.58 1ax1 s PRO 43 Ca 0.35 1.96 -0.25 0.00 0.04 0.00 0.00 61.00 63.10 1ax1 s PRO 43 Cb -0.13 -3.23 -0.08 0.00 0.04 0.00 0.00 34.50 31.10 1ax1 s PRO 43 CO 0.22 -0.20 0.80 0.00 0.04 0.00 0.00 177.00 177.86 1ax1 s ALA 44 N 0.19 3.41 0.75 8.56 0.00 0.85 -4.71 121.76 130.82 1ax1 s ALA 44 Ca 0.56 0.38 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 1ax1 s ALA 44 Cb -0.34 -2.98 0.07 0.00 0.00 0.00 0.00 23.12 19.87 1ax1 s ALA 44 CO 0.36 0.28 1.09 1.67 0.00 0.00 0.00 175.76 179.16 1ax1 s TRP 45 N -1.25 2.87 -1.32 0.00 1.48 -1.26 -4.32 118.94 115.14 1ax1 s TRP 45 Ca 0.39 0.55 -0.03 0.00 -1.06 0.00 0.00 56.10 55.94 1ax1 s TRP 45 Cb -0.22 -3.34 0.01 0.00 -1.16 0.00 0.00 33.47 28.76 1ax1 s TRP 45 CO 0.26 -1.60 0.90 -3.47 -4.06 0.00 0.00 176.95 168.98 1ax1 n ASP 46 N -3.10 -2.69 -4.12 -2.66 2.03 0.57 -4.93 116.55 101.64 1ax1 n ASP 46 Ca 0.08 -0.72 -0.23 0.00 0.52 0.00 0.00 54.79 54.45 1ax1 n ASP 46 Cb 0.61 -4.48 -0.15 0.00 -0.72 0.00 0.00 41.12 36.38 1ax1 n ASP 46 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1ax1 s SER 47 N -4.06 1.73 -0.02 1.67 0.15 -1.26 -4.97 113.70 106.94 1ax1 s SER 47 Ca 0.18 -0.27 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1ax1 s SER 47 Cb -0.09 -0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.05 1ax1 s SER 47 CO 0.78 0.18 0.00 -0.89 1.20 0.00 0.00 173.24 174.51 1ax1 s THR 48 N -0.36 0.08 -0.05 6.45 2.01 -1.26 -0.53 115.64 121.97 1ax1 s THR 48 Ca 0.06 0.07 -0.11 0.00 0.31 0.00 0.00 61.69 62.02 1ax1 s THR 48 Cb -0.06 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.32 1ax1 s THR 48 CO -0.00 0.09 0.27 -0.83 -0.69 0.00 0.00 174.62 173.45 1ax1 s GLY 49 N 0.64 -0.14 0.10 4.40 0.00 -0.87 0.24 107.32 111.70 1ax1 s GLY 49 Ca -0.06 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.10 1ax1 s GLY 49 CO -0.01 0.29 -0.02 0.50 0.00 0.00 0.00 173.10 173.85 1ax1 s ARG 50 N -0.71 0.81 -0.07 2.90 0.52 -0.61 -1.12 118.95 120.67 1ax1 s ARG 50 Ca -0.08 -1.34 -0.03 0.00 -0.52 0.00 0.00 55.73 53.76 1ax1 s ARG 50 Cb -0.04 0.03 0.04 0.00 0.52 0.00 0.00 34.95 35.50 1ax1 s ARG 50 CO 0.02 -0.11 0.14 0.99 0.02 0.00 0.00 175.30 176.36 1ax1 s THR 51 N -3.82 -0.19 0.01 0.02 2.01 0.04 -0.75 115.64 112.96 1ax1 s THR 51 Ca 0.14 0.32 0.07 0.00 0.31 0.00 0.00 61.69 62.53 1ax1 s THR 51 Cb 0.07 -0.26 -0.03 0.00 0.01 0.00 0.00 72.50 72.29 1ax1 s THR 51 CO -0.04 0.13 -0.21 -0.76 -0.69 0.00 0.00 174.62 173.06 1ax1 s LEU 52 N 1.99 2.42 0.30 4.42 1.02 -0.42 -1.00 118.68 127.41 1ax1 s LEU 52 Ca 0.00 -0.41 -0.29 0.00 0.02 0.00 0.00 54.13 53.45 1ax1 s LEU 52 Cb -0.12 -1.44 -0.10 0.00 0.02 0.00 0.00 46.19 44.55 1ax1 s LEU 52 CO -0.05 0.29 1.30 -0.47 0.02 0.00 0.00 176.35 177.44 1ax1 s TYR 53 N -0.78 3.12 -0.91 0.29 5.04 -0.67 -0.25 117.35 123.20 1ax1 s TYR 53 Ca 0.12 1.38 0.10 0.00 -2.44 0.00 0.00 57.07 56.23 1ax1 s TYR 53 Cb -0.10 -3.65 0.45 0.00 0.35 0.00 0.00 41.96 39.01 1ax1 s TYR 53 CO 0.02 -1.81 1.32 0.00 -1.34 0.00 0.00 175.55 173.74 1ax1 n ALA 54 N 1.22 1.37 -2.59 3.97 0.00 -0.01 -4.70 120.51 119.77 1ax1 n ALA 54 Ca 0.01 -0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.13 1ax1 n ALA 54 Cb 0.42 -1.16 -0.15 0.00 0.00 0.00 0.00 19.45 18.56 1ax1 n ALA 54 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ax1 s LYS 55 N -3.06 2.57 0.58 0.00 1.02 -1.26 -5.06 119.74 114.52 1ax1 s LYS 55 Ca 0.04 -0.79 -0.18 0.00 0.02 0.00 0.00 55.97 55.06 1ax1 s LYS 55 Cb 0.06 -2.30 -0.04 0.00 -0.52 0.00 0.00 37.83 35.03 1ax1 s LYS 55 CO 0.17 0.49 1.10 -2.14 -0.92 0.00 0.00 175.35 174.05 1ax1 s PRO 56 N -0.42 3.25 -0.11 -1.68 0.02 -1.26 -4.77 135.00 130.04 1ax1 s PRO 56 Ca 0.04 1.45 0.00 0.00 0.02 0.00 0.00 61.00 62.52 1ax1 s PRO 56 Cb -0.12 -2.01 -0.02 0.00 0.02 0.00 0.00 34.50 32.37 1ax1 s PRO 56 CO 0.02 -0.90 -0.10 0.08 -0.33 0.00 0.00 177.00 175.76 1ax1 s VAL 57 N -2.07 3.37 -0.73 3.83 1.01 0.39 -4.92 120.40 121.29 1ax1 s VAL 57 Ca 0.69 -0.57 -0.24 0.00 0.00 0.00 0.00 61.98 61.86 1ax1 s VAL 57 Cb -0.21 -2.40 0.06 0.00 0.00 0.00 0.00 36.38 33.83 1ax1 s VAL 57 CO 0.32 0.55 1.11 -2.28 0.00 0.00 0.00 175.10 174.79 1ax1 s HIS 58 N -0.10 2.58 0.01 5.22 2.46 -1.26 -1.31 115.29 122.89 1ax1 s HIS 58 Ca -0.00 -0.48 0.01 0.00 0.47 0.00 0.00 55.06 55.05 1ax1 s HIS 58 Cb -0.14 -4.42 -0.26 0.00 -0.13 0.00 0.00 32.58 27.63 1ax1 s HIS 58 CO 0.03 -1.79 0.87 0.97 -2.47 0.00 0.00 174.74 172.35 1ax1 h ILE 59 N 6.03 1.17 -2.85 0.89 6.09 -1.40 -3.44 117.51 124.00 1ax1 h ILE 59 Ca -0.22 -2.85 -0.05 0.00 -1.37 0.00 0.00 64.86 60.37 1ax1 h ILE 59 Cb 1.06 2.71 -0.15 0.00 0.47 0.00 0.00 36.82 40.91 1ax1 h ILE 59 CO 1.22 0.79 0.09 -1.66 -3.07 0.00 0.00 178.15 175.52 1ax1 s TRP 60 N -2.62 -0.45 -0.19 2.19 1.48 -1.15 0.35 118.94 118.55 1ax1 s TRP 60 Ca -0.07 0.41 -0.01 0.00 -1.06 0.00 0.00 56.10 55.37 1ax1 s TRP 60 Cb 0.07 0.40 0.01 0.00 -1.16 0.00 0.00 33.47 32.79 1ax1 s TRP 60 CO 0.84 -0.71 -0.14 0.34 -4.06 0.00 0.00 176.95 173.22 1ax1 s ASP 61 N -2.24 3.59 0.27 -2.66 2.15 -0.23 -4.54 116.67 113.01 1ax1 s ASP 61 Ca -0.03 -0.54 -0.03 0.00 0.43 0.00 0.00 52.55 52.38 1ax1 s ASP 61 Cb -0.00 -1.58 0.36 0.00 -0.30 0.00 0.00 42.92 41.40 1ax1 s ASP 61 CO -0.05 -0.00 1.88 -0.03 -0.17 0.00 0.00 175.17 176.80 1ax1 h MET 62 N 7.96 1.04 0.60 4.34 1.85 -1.94 0.51 114.93 129.29 1ax1 h MET 62 Ca -0.43 -0.13 -0.03 0.00 -0.61 0.00 0.00 59.70 58.49 1ax1 h MET 62 Cb 1.15 -0.20 0.01 0.00 0.43 0.00 0.00 31.60 32.99 1ax1 h MET 62 CO 0.62 0.79 -0.29 1.15 -0.40 0.00 0.00 176.91 178.79 1ax1 h THR 63 N 1.04 0.30 0.00 -0.77 2.02 -1.97 -3.28 112.91 110.25 1ax1 h THR 63 Ca 0.26 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 67.13 1ax1 h THR 63 Cb 0.08 0.39 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 1ax1 h THR 63 CO -0.04 0.03 -0.43 0.71 0.37 0.00 0.00 175.52 176.17 1ax1 h THR 64 N -1.01 0.15 0.00 3.16 1.35 -2.00 -3.47 112.91 111.09 1ax1 h THR 64 Ca -0.08 -1.23 0.00 0.00 -0.55 0.00 0.00 66.41 64.55 1ax1 h THR 64 Cb 0.67 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 1ax1 h THR 64 CO 0.13 0.09 0.00 0.61 -0.25 0.00 0.00 175.52 176.10 1ax1 n GLY 65 N 1.16 0.74 3.81 5.82 0.00 0.18 -5.01 105.19 111.89 1ax1 n GLY 65 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1ax1 n GLY 65 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ax1 s THR 66 N -3.05 4.09 0.03 2.61 -4.23 -1.21 -4.83 115.64 109.05 1ax1 s THR 66 Ca 0.00 1.18 0.04 0.00 -1.18 0.00 0.00 61.69 61.72 1ax1 s THR 66 Cb 0.00 -3.53 -0.02 0.00 1.34 0.00 0.00 72.50 70.29 1ax1 s THR 66 CO 0.00 -0.40 -0.12 0.54 -0.54 0.00 0.00 174.62 174.10 1ax1 s VAL 67 N -2.25 0.90 0.41 2.29 0.11 -1.26 -1.07 120.40 119.52 1ax1 s VAL 67 Ca 0.64 -0.91 -0.23 0.00 -2.93 0.00 0.00 61.98 58.55 1ax1 s VAL 67 Cb -0.13 -0.84 -0.10 0.00 -1.53 0.00 0.00 36.38 33.78 1ax1 s VAL 67 CO 0.24 -0.06 0.98 0.00 -3.33 0.00 0.00 175.10 172.93 1ax1 s ALA 68 N -0.86 3.06 0.05 1.54 0.00 0.16 -4.54 121.76 121.17 1ax1 s ALA 68 Ca -0.01 0.51 -0.02 0.00 0.00 0.00 0.00 51.96 52.45 1ax1 s ALA 68 Cb -0.07 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.81 1ax1 s ALA 68 CO 0.01 0.02 0.23 -1.12 0.00 0.00 0.00 175.76 174.89 1ax1 s SER 69 N -1.91 6.39 0.18 0.00 0.01 -0.93 -4.43 113.70 113.01 1ax1 s SER 69 Ca 0.59 0.34 -0.11 0.00 1.31 0.00 0.00 55.95 58.08 1ax1 s SER 69 Cb -0.15 -1.99 0.00 0.00 0.21 0.00 0.00 66.02 64.09 1ax1 s SER 69 CO 0.19 0.18 0.36 0.72 0.41 0.00 0.00 173.24 175.11 1ax1 s PHE 70 N -1.47 0.27 -0.13 2.43 -0.12 -0.87 -1.73 117.98 116.36 1ax1 s PHE 70 Ca 0.33 -0.63 -0.12 0.00 -0.05 0.00 0.00 56.93 56.46 1ax1 s PHE 70 Cb -0.13 0.08 0.03 0.00 -0.63 0.00 0.00 43.02 42.37 1ax1 s PHE 70 CO 0.25 -0.80 0.36 -2.00 -0.05 0.00 0.00 175.22 172.98 1ax1 s GLU 71 N -3.95 0.42 0.02 1.99 2.12 -0.54 -0.75 118.70 118.01 1ax1 s GLU 71 Ca 0.16 0.49 0.02 0.00 0.36 0.00 0.00 54.97 56.00 1ax1 s GLU 71 Cb 0.02 0.21 -0.01 0.00 0.26 0.00 0.00 34.13 34.60 1ax1 s GLU 71 CO 0.00 -0.05 -0.06 -0.08 -0.54 0.00 0.00 175.26 174.54 1ax1 s THR 72 N 0.18 0.39 -0.00 -1.70 -1.32 0.32 -1.67 115.64 111.83 1ax1 s THR 72 Ca -0.00 -0.64 0.01 0.00 -1.21 0.00 0.00 61.69 59.85 1ax1 s THR 72 Cb -0.03 -0.41 -0.00 0.00 -1.51 0.00 0.00 72.50 70.55 1ax1 s THR 72 CO 0.01 -0.18 -0.05 -0.13 -2.21 0.00 0.00 174.62 172.06 1ax1 s ARG 73 N -0.88 0.39 0.13 7.08 0.52 -0.81 -0.84 118.95 124.53 1ax1 s ARG 73 Ca -0.05 -0.17 -0.22 0.00 -0.52 0.00 0.00 55.73 54.76 1ax1 s ARG 73 Cb -0.06 -0.37 0.06 0.00 0.52 0.00 0.00 34.95 35.10 1ax1 s ARG 73 CO -0.00 0.10 0.56 -0.59 0.02 0.00 0.00 175.30 175.39 1ax1 s PHE 74 N -0.12 -0.47 -0.06 -0.53 -0.71 -0.82 -1.03 117.98 114.25 1ax1 s PHE 74 Ca 0.02 0.31 0.05 0.00 -1.04 0.00 0.00 56.93 56.27 1ax1 s PHE 74 Cb -0.02 0.47 -0.01 0.00 -1.21 0.00 0.00 43.02 42.25 1ax1 s PHE 74 CO -0.00 -0.78 -0.22 -1.12 -1.34 0.00 0.00 175.22 171.75 1ax1 s SER 75 N -2.57 2.81 0.20 1.98 0.01 -1.09 -0.35 113.70 114.68 1ax1 s SER 75 Ca -0.00 -0.48 -0.03 0.00 1.31 0.00 0.00 55.95 56.75 1ax1 s SER 75 Cb -0.00 -0.91 -0.03 0.00 0.21 0.00 0.00 66.02 65.29 1ax1 s SER 75 CO -0.10 0.20 0.18 0.72 0.41 0.00 0.00 173.24 174.65 1ax1 s PHE 76 N 0.03 0.99 -0.06 2.43 -0.12 -0.83 -0.74 117.98 119.68 1ax1 s PHE 76 Ca -0.07 -1.25 -0.06 0.00 -0.05 0.00 0.00 56.93 55.50 1ax1 s PHE 76 Cb -0.14 -0.43 0.02 0.00 -0.63 0.00 0.00 43.02 41.84 1ax1 s PHE 76 CO 0.04 -0.68 0.17 -1.54 -0.05 0.00 0.00 175.22 173.16 1ax1 s SER 77 N -3.12 -0.17 -0.11 1.98 1.04 -0.09 -0.54 113.70 112.69 1ax1 s SER 77 Ca 0.35 0.34 0.03 0.00 0.48 0.00 0.00 55.95 57.14 1ax1 s SER 77 Cb 0.06 0.33 0.01 0.00 0.10 0.00 0.00 66.02 66.52 1ax1 s SER 77 CO 0.10 -0.07 -0.20 -0.63 0.98 0.00 0.00 173.24 173.42 1ax1 s ILE 78 N 0.20 1.86 -0.15 -1.02 1.01 -1.26 -2.09 121.20 119.75 1ax1 s ILE 78 Ca -0.01 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1ax1 s ILE 78 Cb -0.02 -1.65 0.01 0.00 0.01 0.00 0.00 42.46 40.82 1ax1 s ILE 78 CO -0.00 0.51 -0.21 -0.70 0.00 0.00 0.00 174.94 174.54 1ax1 s GLU 79 N 0.67 3.02 -0.44 2.79 2.12 -1.25 -1.16 118.70 124.45 1ax1 s GLU 79 Ca -0.12 -0.84 -0.03 0.00 0.36 0.00 0.00 54.97 54.34 1ax1 s GLU 79 Cb -0.16 -2.48 0.12 0.00 0.26 0.00 0.00 34.13 31.86 1ax1 s GLU 79 CO 0.02 -0.07 0.25 -0.65 -0.54 0.00 0.00 175.26 174.28 1ax1 s GLN 80 N 0.94 2.12 0.46 4.30 -0.21 -1.26 -1.66 119.66 124.35 1ax1 s GLN 80 Ca -0.04 -1.91 0.26 0.00 0.02 0.00 0.00 55.36 53.70 1ax1 s GLN 80 Cb -0.15 -3.64 0.78 0.00 1.00 0.00 0.00 33.01 31.00 1ax1 s GLN 80 CO -0.05 -1.10 1.76 -1.00 -2.12 0.00 0.00 175.29 172.79 1ax1 h PRO 81 N 7.96 0.00 -6.48 2.91 0.13 -1.98 -3.46 132.00 131.07 1ax1 h PRO 81 Ca -0.12 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.33 1ax1 h PRO 81 Cb 1.04 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 31.99 1ax1 h PRO 81 CO 0.72 0.10 -0.75 0.71 -0.23 0.00 0.00 178.00 178.55 1ax1 s TYR 82 N -3.43 2.73 0.11 1.56 2.02 -1.26 -5.01 117.35 114.07 1ax1 s TYR 82 Ca 0.03 -0.15 0.01 0.00 -0.37 0.00 0.00 57.07 56.59 1ax1 s TYR 82 Cb 0.08 -1.49 -0.22 0.00 -0.40 0.00 0.00 41.96 39.93 1ax1 s TYR 82 CO 0.63 0.37 1.23 1.15 -1.57 0.00 0.00 175.55 177.35 1ax1 h THR 83 N 3.58 1.59 -2.96 -0.71 2.02 -1.98 -3.45 112.91 110.99 1ax1 h THR 83 Ca -0.48 -3.15 -0.13 0.00 0.77 0.00 0.00 66.41 63.41 1ax1 h THR 83 Cb 1.16 2.84 -0.23 0.00 -1.74 0.00 0.00 68.15 70.19 1ax1 h THR 83 CO 0.51 0.91 -0.31 0.00 0.37 0.00 0.00 175.52 177.01 1ax1 s ARG 84 N -2.75 0.49 1.12 6.66 1.70 -1.26 -4.48 118.95 120.42 1ax1 s ARG 84 Ca -0.02 0.24 -0.17 0.00 -0.47 0.00 0.00 55.73 55.31 1ax1 s ARG 84 Cb 0.09 0.23 0.25 0.00 -0.57 0.00 0.00 34.95 34.94 1ax1 s ARG 84 CO 0.85 -0.09 1.14 -1.25 -1.08 0.00 0.00 175.30 174.87 1ax1 s PRO 85 N -0.34 -0.57 0.40 3.89 0.04 -1.26 -5.00 135.00 132.15 1ax1 s PRO 85 Ca -0.05 -0.04 -0.27 0.00 0.04 0.00 0.00 61.00 60.69 1ax1 s PRO 85 Cb -0.03 -1.67 -0.10 0.00 0.04 0.00 0.00 34.50 32.74 1ax1 s PRO 85 CO 0.02 -3.28 1.41 -0.51 0.04 0.00 0.00 177.00 174.67 1ax1 s LEU 86 N -6.65 4.26 0.80 -3.56 1.43 -1.26 -4.79 118.68 108.90 1ax1 s LEU 86 Ca 0.70 2.88 -0.11 0.00 -1.03 0.00 0.00 54.13 56.58 1ax1 s LEU 86 Cb -0.10 -3.79 0.07 0.00 0.03 0.00 0.00 46.19 42.40 1ax1 s LEU 86 CO 0.55 -0.91 1.09 -2.16 0.23 0.00 0.00 176.35 175.16 1ax1 s PRO 87 N -2.18 2.08 0.08 1.29 0.04 -1.26 -4.53 135.00 130.52 1ax1 s PRO 87 Ca 0.55 1.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.38 1ax1 s PRO 87 Cb -0.43 -1.89 0.08 0.00 0.04 0.00 0.00 34.50 32.31 1ax1 s PRO 87 CO 0.57 -1.73 0.83 0.00 0.04 0.00 0.00 177.00 176.71 1ax1 s ALA 88 N -2.93 -1.70 -0.01 8.56 0.00 -1.26 -4.40 121.76 120.02 1ax1 s ALA 88 Ca 0.61 0.62 0.02 0.00 0.00 0.00 0.00 51.96 53.22 1ax1 s ALA 88 Cb -0.17 0.59 -0.03 0.00 0.00 0.00 0.00 23.12 23.52 1ax1 s ALA 88 CO 0.56 -0.80 0.03 -0.25 0.00 0.00 0.00 175.76 175.30 1ax1 n ASP 89 N -0.34 4.57 0.00 0.00 8.00 0.12 -3.33 116.55 125.58 1ax1 n ASP 89 Ca -0.10 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.40 1ax1 n ASP 89 Cb 0.62 0.92 0.00 0.00 -0.02 0.00 0.00 41.12 42.64 1ax1 n ASP 89 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ax1 n GLY 90 N 2.55 0.79 3.19 0.44 0.00 -1.12 -1.93 105.19 109.11 1ax1 n GLY 90 Ca -0.01 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.83 1ax1 n GLY 90 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ax1 s LEU 91 N 0.00 1.85 -0.12 0.99 0.05 -0.75 -1.72 118.68 118.98 1ax1 s LEU 91 Ca 0.00 -1.22 -0.21 0.00 0.05 0.00 0.00 54.13 52.75 1ax1 s LEU 91 Cb 0.00 0.17 0.05 0.00 -2.05 0.00 0.00 46.19 44.36 1ax1 s LEU 91 CO 0.00 -0.68 0.53 0.54 -0.55 0.00 0.00 176.35 176.18 1ax1 s VAL 92 N -3.91 0.01 -0.16 1.48 0.11 0.91 -1.04 120.40 117.80 1ax1 s VAL 92 Ca 0.26 -0.11 -0.11 0.00 -2.93 0.00 0.00 61.98 59.09 1ax1 s VAL 92 Cb 0.07 -0.79 -0.05 0.00 -1.53 0.00 0.00 36.38 34.08 1ax1 s VAL 92 CO 0.04 -0.06 0.19 0.12 -3.33 0.00 0.00 175.10 172.06 1ax1 s PHE 93 N -0.50 3.48 0.09 1.54 5.36 -0.63 -1.02 117.98 126.29 1ax1 s PHE 93 Ca -0.06 0.48 -0.06 0.00 -0.96 0.00 0.00 56.93 56.33 1ax1 s PHE 93 Cb -0.03 -2.18 -0.02 0.00 -0.34 0.00 0.00 43.02 40.46 1ax1 s PHE 93 CO 0.04 0.38 0.13 -0.59 -1.46 0.00 0.00 175.22 173.72 1ax1 s PHE 94 N 0.05 0.36 -0.02 10.12 -0.71 -0.32 -0.64 117.98 126.82 1ax1 s PHE 94 Ca 0.13 -0.81 0.02 0.00 -1.04 0.00 0.00 56.93 55.23 1ax1 s PHE 94 Cb -0.12 -0.19 0.01 0.00 -1.21 0.00 0.00 43.02 41.51 1ax1 s PHE 94 CO 0.02 -0.53 -0.06 -1.64 -1.34 0.00 0.00 175.22 171.67 1ax1 s MET 95 N -3.91 0.70 0.00 1.99 -1.94 0.08 -1.40 119.30 114.81 1ax1 s MET 95 Ca 0.09 -0.17 0.00 0.00 -1.71 0.00 0.00 55.69 53.90 1ax1 s MET 95 Cb 0.06 -0.69 0.00 0.00 2.01 0.00 0.00 34.83 36.21 1ax1 s MET 95 CO -0.08 0.03 0.00 0.41 -0.01 0.00 0.00 175.02 175.37 1ax1 n GLY 96 N 3.49 1.72 3.64 -0.03 0.00 -0.96 -1.30 105.19 111.75 1ax1 n GLY 96 Ca -0.20 -0.92 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 1ax1 n GLY 96 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ax1 n PRO 97 N 0.00 1.56 -1.47 1.61 -0.02 -1.26 -1.00 135.00 134.42 1ax1 n PRO 97 Ca 0.00 0.56 -0.32 0.00 -2.02 0.00 0.00 63.50 61.72 1ax1 n PRO 97 Cb 0.00 -2.14 0.07 0.00 -0.02 0.00 0.00 33.50 31.41 1ax1 n PRO 97 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1ax1 s THR 98 N -1.22 3.19 -1.68 3.45 -4.23 -1.26 -3.76 115.64 110.13 1ax1 s THR 98 Ca 0.62 0.47 0.00 0.00 -1.18 0.00 0.00 61.69 61.60 1ax1 s THR 98 Cb -0.56 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.33 1ax1 s THR 98 CO 0.58 -0.43 0.00 0.29 -0.54 0.00 0.00 174.62 174.52 1ax1 n LYS 99 N -3.01 -1.54 -2.59 3.99 4.76 -1.26 -4.98 118.16 113.53 1ax1 n LYS 99 Ca 0.10 0.96 -0.31 0.00 -2.87 0.00 0.00 58.31 56.19 1ax1 n LYS 99 Cb 0.52 -5.52 -0.03 0.00 -1.84 0.00 0.00 35.03 28.17 1ax1 n LYS 99 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1ax1 s SER 100 N -2.17 6.52 0.33 4.39 1.04 -1.25 -5.09 113.70 117.47 1ax1 s SER 100 Ca 0.00 1.31 0.09 0.00 0.48 0.00 0.00 55.95 57.83 1ax1 s SER 100 Cb 0.00 -2.40 -0.05 0.00 0.10 0.00 0.00 66.02 63.67 1ax1 s SER 100 CO 0.00 -0.52 -0.03 -0.54 0.98 0.00 0.00 173.24 173.13 1ax1 s LYS 101 N -4.09 2.00 0.41 4.02 -0.14 -1.26 -5.10 119.74 115.58 1ax1 s LYS 101 Ca 0.54 -1.76 -0.25 0.00 -1.36 0.00 0.00 55.97 53.13 1ax1 s LYS 101 Cb -0.10 -1.89 -0.10 0.00 -1.68 0.00 0.00 37.83 34.06 1ax1 s LYS 101 CO 0.34 0.17 1.23 -2.30 -0.76 0.00 0.00 175.35 174.03 1ax1 n PRO 102 N -0.88 1.83 0.00 -1.68 -0.02 -1.26 -5.01 135.00 127.98 1ax1 n PRO 102 Ca -0.05 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1ax1 n PRO 102 Cb 0.62 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1ax1 n PRO 102 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ax1 n ALA 103 N -0.21 0.00 -1.77 3.55 0.00 -0.63 -5.02 120.51 116.44 1ax1 n ALA 103 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.12 1ax1 n ALA 103 Cb 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 1ax1 n ALA 103 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ax1 s GLN 104 N 4.74 4.42 0.00 0.00 -1.52 -0.84 -4.73 119.66 121.74 1ax1 s GLN 104 Ca 0.00 1.82 0.00 0.00 -1.95 0.00 0.00 55.36 55.23 1ax1 s GLN 104 Cb 0.00 -2.99 0.00 0.00 -0.22 0.00 0.00 33.01 29.80 1ax1 s GLN 104 CO 0.00 0.01 0.00 0.41 -0.25 0.00 0.00 175.29 175.46 1ax1 n GLY 105 N 0.92 1.21 7.00 3.09 0.00 -1.26 0.09 105.19 116.24 1ax1 n GLY 105 Ca 0.01 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1ax1 n GLY 105 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ax1 n TYR 106 N 0.00 0.00 0.16 1.61 4.01 -1.26 -1.59 117.16 120.09 1ax1 n TYR 106 Ca 0.00 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.84 1ax1 n TYR 106 Cb 0.00 0.02 0.55 0.00 -0.31 0.00 0.00 39.34 39.60 1ax1 n TYR 106 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ax1 n GLY 107 N 0.00 -0.84 0.18 2.72 0.00 -1.26 -1.03 105.19 104.97 1ax1 n GLY 107 Ca 0.00 0.19 0.14 0.00 0.00 0.00 0.00 46.02 46.35 1ax1 n GLY 107 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ax1 n TYR 108 N -2.21 0.00 -1.21 1.61 4.01 -0.62 -4.95 117.16 113.79 1ax1 n TYR 108 Ca -0.01 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.63 1ax1 n TYR 108 Cb 0.04 -0.15 -0.04 0.00 -0.31 0.00 0.00 39.34 38.88 1ax1 n TYR 108 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1ax1 n LEU 109 N -0.78 -0.44 0.00 7.72 4.77 -0.19 -2.17 117.00 125.90 1ax1 n LEU 109 Ca 0.14 0.25 0.00 0.00 -0.03 0.00 0.00 56.01 56.37 1ax1 n LEU 109 Cb 0.31 -2.24 0.00 0.00 -2.33 0.00 0.00 43.42 39.16 1ax1 n LEU 109 CO 0.24 -0.83 0.00 0.61 -1.33 0.00 0.00 177.39 176.08 1ax1 n GLY 110 N 0.11 0.67 0.00 -0.72 0.00 0.11 -4.27 105.19 101.09 1ax1 n GLY 110 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1ax1 n GLY 110 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ax1 n ILE 111 N -2.61 0.00 -4.30 -0.61 -5.35 -0.92 -1.60 119.36 103.96 1ax1 n ILE 111 Ca 0.00 -0.32 -0.16 0.00 -0.27 0.00 0.00 62.75 61.99 1ax1 n ILE 111 Cb 0.00 1.05 -0.10 0.00 -1.74 0.00 0.00 39.64 38.85 1ax1 n ILE 111 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1ax1 s PHE 112 N -0.56 1.47 -0.38 4.28 0.08 -1.16 -4.87 117.98 116.84 1ax1 s PHE 112 Ca 0.00 -0.69 0.13 0.00 0.12 0.00 0.00 56.93 56.49 1ax1 s PHE 112 Cb 0.00 -0.72 -0.17 0.00 -0.57 0.00 0.00 43.02 41.56 1ax1 s PHE 112 CO 0.00 0.19 0.45 0.09 -0.10 0.00 0.00 175.22 175.85 1ax1 n ASN 113 N -0.29 1.13 -1.09 1.36 3.02 -1.26 -1.98 115.26 116.15 1ax1 n ASN 113 Ca -0.09 -0.49 -0.00 0.00 -0.03 0.00 0.00 54.58 53.96 1ax1 n ASN 113 Cb 0.61 1.23 0.00 0.00 -0.61 0.00 0.00 39.78 41.01 1ax1 n ASN 113 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1ax1 n ASN 114 N -1.56 -0.11 -1.45 6.41 0.23 -1.26 -4.90 115.26 112.62 1ax1 n ASN 114 Ca 0.01 -1.08 0.00 0.00 -0.53 0.00 0.00 54.58 52.98 1ax1 n ASN 114 Cb 0.26 0.18 0.28 0.00 -2.08 0.00 0.00 39.78 38.41 1ax1 n ASN 114 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1ax1 n SER 115 N -1.10 4.12 -4.90 0.53 3.41 -1.26 -4.65 113.62 109.78 1ax1 n SER 115 Ca -0.00 -3.24 -0.28 0.00 -0.26 0.00 0.00 58.87 55.08 1ax1 n SER 115 Cb 0.03 -0.65 -0.01 0.00 -0.26 0.00 0.00 64.21 63.31 1ax1 n SER 115 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1ax1 s LYS 116 N -2.98 3.61 -0.71 4.33 -0.14 -1.26 -4.75 119.74 117.85 1ax1 s LYS 116 Ca 0.49 0.25 -0.14 0.00 -1.36 0.00 0.00 55.97 55.20 1ax1 s LYS 116 Cb 0.40 -2.41 0.18 0.00 -1.68 0.00 0.00 37.83 34.33 1ax1 s LYS 116 CO 0.09 -0.12 0.65 -1.14 -0.76 0.00 0.00 175.35 174.08 1ax1 s GLN 117 N -4.39 3.33 -0.20 1.68 0.74 -1.26 -4.45 119.66 115.11 1ax1 s GLN 117 Ca 0.48 -2.18 -0.03 0.00 0.05 0.00 0.00 55.36 53.67 1ax1 s GLN 117 Cb -0.10 -4.35 -0.01 0.00 1.10 0.00 0.00 33.01 29.64 1ax1 s GLN 117 CO 0.40 -1.30 -0.05 0.34 -0.55 0.00 0.00 175.29 174.13 1ax1 s ASP 118 N 2.64 4.36 0.59 6.67 -1.08 -0.75 -5.00 116.67 124.11 1ax1 s ASP 118 Ca 0.12 -0.33 0.34 0.00 -0.52 0.00 0.00 52.55 52.17 1ax1 s ASP 118 Cb -0.18 -1.73 1.89 0.00 -1.46 0.00 0.00 42.92 41.44 1ax1 s ASP 118 CO -0.04 0.04 2.22 -0.55 0.52 0.00 0.00 175.17 177.36 1ax1 h ASN 119 N 7.65 0.00 0.71 -0.34 -1.07 -1.96 -1.91 115.58 118.66 1ax1 h ASN 119 Ca -0.37 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.00 1ax1 h ASN 119 Cb 1.17 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.42 1ax1 h ASN 119 CO 0.60 0.03 0.00 -1.54 0.07 0.00 0.00 177.43 176.59 1ax1 n SER 120 N -3.48 0.52 -0.14 6.14 3.41 -1.26 -2.43 113.62 116.37 1ax1 n SER 120 Ca -0.02 0.62 -0.06 0.00 -0.26 0.00 0.00 58.87 59.15 1ax1 n SER 120 Cb 0.14 -0.73 0.10 0.00 -0.26 0.00 0.00 64.21 63.46 1ax1 n SER 120 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 1ax1 h TYR 121 N 0.00 0.96 -6.58 7.33 0.05 -1.67 -3.47 116.97 113.59 1ax1 h TYR 121 Ca 0.00 -0.16 -0.52 0.00 0.05 0.00 0.00 58.73 58.10 1ax1 h TYR 121 Cb 0.35 -0.25 -0.12 0.00 1.01 0.00 0.00 36.73 37.72 1ax1 h TYR 121 CO 0.00 0.89 -0.84 1.04 -1.05 0.00 0.00 178.16 178.20 1ax1 n GLN 122 N -4.19 -3.62 -4.84 4.88 6.02 -1.02 -4.64 117.38 109.97 1ax1 n GLN 122 Ca 0.02 0.42 -0.26 0.00 -0.01 0.00 0.00 57.00 57.18 1ax1 n GLN 122 Cb 0.34 -4.97 -0.16 0.00 1.02 0.00 0.00 30.24 26.47 1ax1 n GLN 122 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1ax1 s THR 123 N -3.53 1.42 -0.10 5.09 2.01 -1.26 -4.01 115.64 115.26 1ax1 s THR 123 Ca 0.46 -0.73 0.04 0.00 0.31 0.00 0.00 61.69 61.76 1ax1 s THR 123 Cb -0.25 -1.20 0.00 0.00 0.01 0.00 0.00 72.50 71.06 1ax1 s THR 123 CO 0.90 0.41 -0.22 -0.22 -0.69 0.00 0.00 174.62 174.79 1ax1 s LEU 124 N -0.16 2.02 0.02 4.42 0.20 -0.42 -1.02 118.68 123.75 1ax1 s LEU 124 Ca 0.01 -0.52 -0.09 0.00 0.69 0.00 0.00 54.13 54.22 1ax1 s LEU 124 Cb -0.09 -1.32 0.00 0.00 -0.43 0.00 0.00 46.19 44.34 1ax1 s LEU 124 CO 0.01 0.14 0.18 -0.83 -0.29 0.00 0.00 176.35 175.55 1ax1 s GLY 125 N 0.42 0.03 -0.28 7.98 0.00 -0.02 -0.74 107.32 114.71 1ax1 s GLY 125 Ca -0.18 -0.20 0.03 0.00 0.00 0.00 0.00 44.72 44.37 1ax1 s GLY 125 CO 0.08 -0.36 -0.07 0.14 0.00 0.00 0.00 173.10 172.88 1ax1 s VAL 126 N -2.03 2.23 0.29 1.40 1.01 0.19 -0.08 120.40 123.40 1ax1 s VAL 126 Ca -0.09 -1.79 0.00 0.00 0.00 0.00 0.00 61.98 60.10 1ax1 s VAL 126 Cb -0.04 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1ax1 s VAL 126 CO -0.01 -0.16 0.49 -1.83 0.00 0.00 0.00 175.10 173.59 1ax1 s GLU 127 N 1.06 3.51 -0.50 2.72 -1.05 0.36 -1.61 118.70 123.19 1ax1 s GLU 127 Ca -0.04 -0.34 0.03 0.00 -0.15 0.00 0.00 54.97 54.47 1ax1 s GLU 127 Cb -0.20 -2.73 0.16 0.00 -0.44 0.00 0.00 34.13 30.92 1ax1 s GLU 127 CO -0.06 0.25 0.35 -0.06 0.95 0.00 0.00 175.26 176.69 1ax1 s PHE 128 N -2.14 1.98 -0.23 4.83 0.08 -0.20 -1.33 117.98 120.97 1ax1 s PHE 128 Ca 0.39 -2.59 -0.24 0.00 0.12 0.00 0.00 56.93 54.62 1ax1 s PHE 128 Cb -0.10 -1.67 -0.01 0.00 -0.57 0.00 0.00 43.02 40.68 1ax1 s PHE 128 CO 0.33 -0.74 0.81 0.34 -0.10 0.00 0.00 175.22 175.86 1ax1 s ASP 129 N -0.22 6.83 0.00 1.36 -1.08 -0.38 -1.81 116.67 121.38 1ax1 s ASP 129 Ca 0.26 1.03 0.18 0.00 -0.52 0.00 0.00 52.55 53.50 1ax1 s ASP 129 Cb -0.08 -2.43 -0.09 0.00 -1.46 0.00 0.00 42.92 38.87 1ax1 s ASP 129 CO -0.12 -0.48 0.86 0.35 0.52 0.00 0.00 175.17 176.30 1ax1 n THR 130 N 5.16 0.00 -4.68 1.71 -2.24 -0.81 -1.50 114.28 111.91 1ax1 n THR 130 Ca 0.05 -0.21 -0.25 0.00 -2.27 0.00 0.00 64.05 61.37 1ax1 n THR 130 Cb 0.48 1.12 -0.16 0.00 -2.10 0.00 0.00 70.33 69.67 1ax1 n THR 130 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1ax1 s PHE 131 N -2.37 1.56 -0.69 4.78 2.19 -1.23 -4.71 117.98 117.50 1ax1 s PHE 131 Ca 0.12 -0.53 -0.24 0.00 0.33 0.00 0.00 56.93 56.60 1ax1 s PHE 131 Cb 0.14 -1.10 0.05 0.00 -1.31 0.00 0.00 43.02 40.81 1ax1 s PHE 131 CO 0.59 -0.24 1.08 0.45 1.83 0.00 0.00 175.22 178.93 1ax1 s SER 132 N 0.43 6.17 0.76 6.13 0.15 -1.26 -4.99 113.70 121.09 1ax1 s SER 132 Ca -0.11 -0.77 -0.08 0.00 0.70 0.00 0.00 55.95 55.68 1ax1 s SER 132 Cb -0.14 -2.47 0.09 0.00 -1.71 0.00 0.00 66.02 61.79 1ax1 s SER 132 CO 0.03 -1.59 1.08 0.20 1.20 0.00 0.00 173.24 174.17 1ax1 s ASN 133 N 3.69 4.48 0.61 5.45 -0.87 -1.26 -4.92 114.94 122.11 1ax1 s ASN 133 Ca 0.27 0.41 0.37 0.00 -1.57 0.00 0.00 52.86 52.34 1ax1 s ASN 133 Cb -0.13 -0.92 2.02 0.00 -0.02 0.00 0.00 41.25 42.19 1ax1 s ASN 133 CO 0.12 -1.84 2.26 1.55 -2.57 0.00 0.00 177.10 176.63 1ax1 h PRO 134 N -0.82 0.00 -0.01 -0.60 0.13 -1.98 -1.13 132.00 127.59 1ax1 h PRO 134 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1ax1 h PRO 134 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1ax1 h PRO 134 CO 0.56 0.02 -0.16 -2.67 -0.23 0.00 0.00 178.00 175.52 1ax1 n TRP 135 N -3.39 0.00 -3.65 1.56 2.14 -1.26 -4.94 117.44 107.90 1ax1 n TRP 135 Ca -0.02 0.00 -0.23 0.00 2.07 0.00 0.00 57.50 59.31 1ax1 n TRP 135 Cb 0.12 -0.08 -0.02 0.00 -0.81 0.00 0.00 31.31 30.52 1ax1 n TRP 135 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 1ax1 s ASP 136 N -2.32 6.32 0.85 -0.67 1.01 -0.43 -4.79 116.67 116.64 1ax1 s ASP 136 Ca 0.29 0.30 -0.11 0.00 0.71 0.00 0.00 52.55 53.74 1ax1 s ASP 136 Cb 0.20 -1.96 0.10 0.00 1.01 0.00 0.00 42.92 42.27 1ax1 s ASP 136 CO 0.45 -0.17 1.09 -2.16 0.21 0.00 0.00 175.17 174.59 1ax1 s PRO 137 N -4.04 1.64 0.30 8.23 0.04 -1.26 -4.80 135.00 135.12 1ax1 s PRO 137 Ca 0.37 0.78 0.01 0.00 0.04 0.00 0.00 61.00 62.20 1ax1 s PRO 137 Cb -0.10 -1.86 0.47 0.00 0.04 0.00 0.00 34.50 33.05 1ax1 s PRO 137 CO 0.32 -1.96 1.84 -1.35 0.04 0.00 0.00 177.00 175.90 1ax1 h PRO 138 N -1.34 0.73 -6.41 0.56 0.11 -1.98 -3.44 132.00 120.23 1ax1 h PRO 138 Ca -0.48 -0.15 -0.54 0.00 0.11 0.00 0.00 66.00 64.94 1ax1 h PRO 138 Cb 1.27 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1ax1 h PRO 138 CO 0.56 0.68 0.68 -0.65 -0.21 0.00 0.00 178.00 179.07 1ax1 s GLN 139 N -5.15 4.36 0.01 1.05 1.11 -1.26 -4.86 119.66 114.93 1ax1 s GLN 139 Ca -0.09 1.81 0.00 0.00 0.01 0.00 0.00 55.36 57.10 1ax1 s GLN 139 Cb 0.16 -3.46 -0.01 0.00 -1.01 0.00 0.00 33.01 28.69 1ax1 s GLN 139 CO 0.79 -0.41 -0.02 0.14 0.01 0.00 0.00 175.29 175.80 1ax1 s VAL 140 N 1.74 0.13 0.75 1.09 -7.23 -1.26 -4.36 120.40 111.25 1ax1 s VAL 140 Ca 0.60 -0.45 -0.11 0.00 -1.81 0.00 0.00 61.98 60.20 1ax1 s VAL 140 Cb -0.29 -0.19 0.04 0.00 0.56 0.00 0.00 36.38 36.50 1ax1 s VAL 140 CO 0.26 -0.21 1.09 -2.16 -0.31 0.00 0.00 175.10 173.78 1ax1 s PRO 141 N -0.69 2.52 -0.01 4.82 0.04 -1.24 -4.94 135.00 135.49 1ax1 s PRO 141 Ca -0.07 0.57 -0.13 0.00 0.04 0.00 0.00 61.00 61.42 1ax1 s PRO 141 Cb -0.05 -1.97 0.02 0.00 0.04 0.00 0.00 34.50 32.54 1ax1 s PRO 141 CO -0.00 -1.30 0.27 -3.38 0.04 0.00 0.00 177.00 172.63 1ax1 s HIS 142 N -3.25 -0.13 0.13 0.56 -3.43 -0.56 -1.63 115.29 106.98 1ax1 s HIS 142 Ca 0.59 0.19 -0.17 0.00 -0.80 0.00 0.00 55.06 54.87 1ax1 s HIS 142 Cb -0.13 0.06 -0.07 0.00 -1.43 0.00 0.00 32.58 31.02 1ax1 s HIS 142 CO 0.53 -0.36 0.59 0.42 -2.00 0.00 0.00 174.74 173.92 1ax1 s ILE 143 N -1.29 4.76 -0.03 -5.38 1.01 0.13 -1.24 121.20 119.15 1ax1 s ILE 143 Ca -0.13 1.05 -0.05 0.00 0.00 0.00 0.00 60.65 61.52 1ax1 s ILE 143 Cb -0.06 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.60 1ax1 s ILE 143 CO 0.03 0.35 0.13 -0.83 0.00 0.00 0.00 174.94 174.63 1ax1 s GLY 144 N -1.49 -0.04 -0.35 6.18 0.00 -0.44 -0.88 107.32 110.30 1ax1 s GLY 144 Ca 0.36 0.18 -0.11 0.00 0.00 0.00 0.00 44.72 45.14 1ax1 s GLY 144 CO 0.19 0.10 0.20 -0.42 0.00 0.00 0.00 173.10 173.18 1ax1 s ILE 145 N -0.48 4.83 -0.23 0.90 1.01 -0.77 -0.49 121.20 125.98 1ax1 s ILE 145 Ca -0.06 -0.52 -0.09 0.00 0.00 0.00 0.00 60.65 59.99 1ax1 s ILE 145 Cb -0.04 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 1ax1 s ILE 145 CO 0.01 -0.07 0.11 -1.81 0.00 0.00 0.00 174.94 173.17 1ax1 s ASP 146 N 1.63 5.71 -0.33 3.58 1.01 0.88 -1.10 116.67 128.04 1ax1 s ASP 146 Ca 0.04 0.01 0.02 0.00 0.71 0.00 0.00 52.55 53.33 1ax1 s ASP 146 Cb -0.18 -2.02 0.10 0.00 1.01 0.00 0.00 42.92 41.84 1ax1 s ASP 146 CO 0.08 0.06 0.08 -0.69 0.21 0.00 0.00 175.17 174.91 1ax1 s VAL 147 N 1.04 1.61 -2.09 -1.27 1.01 -1.26 -0.84 120.40 118.59 1ax1 s VAL 147 Ca 0.06 -1.93 0.00 0.00 0.00 0.00 0.00 61.98 60.10 1ax1 s VAL 147 Cb -0.14 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 34.05 1ax1 s VAL 147 CO 0.04 -0.65 0.00 0.59 0.00 0.00 0.00 175.10 175.08 1ax1 n ASN 148 N 4.48 -5.57 -3.56 3.32 3.02 -0.19 -4.92 115.26 111.84 1ax1 n ASN 148 Ca 0.01 0.39 -0.10 0.00 -0.03 0.00 0.00 54.58 54.85 1ax1 n ASN 148 Cb 0.42 -4.82 -0.04 0.00 -0.61 0.00 0.00 39.78 34.73 1ax1 n ASN 148 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1ax1 s SER 149 N -2.62 -0.36 0.23 6.41 0.15 -1.26 -1.80 113.70 114.45 1ax1 s SER 149 Ca 0.00 0.30 0.26 0.00 0.70 0.00 0.00 55.95 57.21 1ax1 s SER 149 Cb 0.00 0.31 0.80 0.00 -1.71 0.00 0.00 66.02 65.42 1ax1 s SER 149 CO 0.00 -0.40 1.76 -0.29 1.20 0.00 0.00 173.24 175.51 1ax1 h ILE 150 N 2.41 0.00 -2.23 6.45 6.09 -1.82 -3.41 117.51 125.01 1ax1 h ILE 150 Ca -0.19 -0.49 -0.61 0.00 -1.37 0.00 0.00 64.86 62.20 1ax1 h ILE 150 Cb 1.18 1.47 -0.12 0.00 0.47 0.00 0.00 36.82 39.82 1ax1 h ILE 150 CO 0.31 0.00 0.93 -0.13 -3.07 0.00 0.00 178.15 176.18 1ax1 s ARG 151 N -3.13 3.31 0.48 2.19 0.52 -1.26 -4.97 118.95 116.08 1ax1 s ARG 151 Ca 0.10 -0.87 -0.22 0.00 -0.52 0.00 0.00 55.73 54.22 1ax1 s ARG 151 Cb 0.12 -4.55 -0.09 0.00 0.52 0.00 0.00 34.95 30.95 1ax1 s ARG 151 CO 0.58 -1.98 0.94 0.43 0.02 0.00 0.00 175.30 175.29 1ax1 n SER 152 N 8.24 0.86 0.12 0.23 7.64 -1.26 -4.78 113.62 124.66 1ax1 n SER 152 Ca 0.10 0.95 0.12 0.00 1.01 0.00 0.00 58.87 61.05 1ax1 n SER 152 Cb 0.48 -1.34 0.22 0.00 -1.01 0.00 0.00 64.21 62.56 1ax1 n SER 152 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1ax1 h ILE 153 N 1.14 0.00 -2.53 0.44 3.07 -1.48 -3.46 117.51 114.68 1ax1 h ILE 153 Ca -0.45 -0.68 -0.10 0.00 1.55 0.00 0.00 64.86 65.18 1ax1 h ILE 153 Cb 1.35 1.48 -0.24 0.00 -0.27 0.00 0.00 36.82 39.15 1ax1 h ILE 153 CO 0.54 0.00 -0.15 -0.75 -1.05 0.00 0.00 178.15 176.74 1ax1 s LYS 154 N -3.19 0.56 0.06 0.16 2.47 -1.25 -5.03 119.74 113.52 1ax1 s LYS 154 Ca 0.07 0.72 0.04 0.00 -1.56 0.00 0.00 55.97 55.24 1ax1 s LYS 154 Cb 0.11 0.24 -0.03 0.00 -1.46 0.00 0.00 37.83 36.69 1ax1 s LYS 154 CO 0.68 -0.08 -0.12 0.99 0.16 0.00 0.00 175.35 176.97 1ax1 s THR 155 N 0.46 0.95 -0.20 3.43 2.01 -1.26 -1.85 115.64 119.18 1ax1 s THR 155 Ca -0.02 -1.16 -0.04 0.00 0.31 0.00 0.00 61.69 60.79 1ax1 s THR 155 Cb -0.04 -0.92 0.08 0.00 0.01 0.00 0.00 72.50 71.63 1ax1 s THR 155 CO -0.02 -0.21 0.17 -1.58 -0.69 0.00 0.00 174.62 172.29 1ax1 s GLN 156 N -1.53 0.15 0.53 4.92 2.00 -0.06 -4.97 119.66 120.70 1ax1 s GLN 156 Ca -0.03 0.04 -0.19 0.00 -2.00 0.00 0.00 55.36 53.18 1ax1 s GLN 156 Cb -0.09 -1.43 -0.06 0.00 0.80 0.00 0.00 33.01 32.23 1ax1 s GLN 156 CO 0.02 -0.69 1.08 -1.25 -0.50 0.00 0.00 175.29 173.95 1ax1 s PRO 157 N 2.24 3.50 0.08 1.67 0.04 -1.26 0.18 135.00 141.45 1ax1 s PRO 157 Ca 0.05 1.46 -0.06 0.00 0.04 0.00 0.00 61.00 62.49 1ax1 s PRO 157 Cb -0.16 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 1ax1 s PRO 157 CO -0.13 -0.70 0.12 -0.59 0.04 0.00 0.00 177.00 175.74 1ax1 s PHE 158 N -1.95 0.28 -0.20 0.56 -0.71 -0.64 -4.85 117.98 110.46 1ax1 s PHE 158 Ca 0.69 -0.75 -0.14 0.00 -1.04 0.00 0.00 56.93 55.69 1ax1 s PHE 158 Cb -0.20 -0.17 -0.04 0.00 -1.21 0.00 0.00 43.02 41.40 1ax1 s PHE 158 CO 0.26 -0.49 0.32 -1.14 -1.34 0.00 0.00 175.22 172.83 1ax1 s GLN 159 N -3.88 4.18 0.11 1.99 0.74 -1.26 -3.70 119.66 117.83 1ax1 s GLN 159 Ca 0.06 0.08 -0.30 0.00 0.05 0.00 0.00 55.36 55.25 1ax1 s GLN 159 Cb 0.06 -3.51 -0.06 0.00 1.10 0.00 0.00 33.01 30.60 1ax1 s GLN 159 CO -0.10 0.06 1.10 -1.17 -0.55 0.00 0.00 175.29 174.62 1ax1 s LEU 160 N 1.02 4.44 -0.70 3.68 2.96 -1.26 -4.98 118.68 123.85 1ax1 s LEU 160 Ca 0.16 1.98 -0.12 0.00 -0.22 0.00 0.00 54.13 55.92 1ax1 s LEU 160 Cb -0.14 -3.59 0.18 0.00 0.50 0.00 0.00 46.19 43.14 1ax1 s LEU 160 CO 0.06 -0.29 0.62 -0.62 -1.32 0.00 0.00 176.35 174.80 1ax1 s ASP 161 N 0.42 6.30 -0.40 3.68 -1.08 -1.26 -5.02 116.67 119.32 1ax1 s ASP 161 Ca 0.52 -2.44 -0.40 0.00 -0.52 0.00 0.00 52.55 49.71 1ax1 s ASP 161 Cb -0.28 -2.14 -0.15 0.00 -1.46 0.00 0.00 42.92 38.89 1ax1 s ASP 161 CO 0.32 -0.62 2.03 -3.20 0.52 0.00 0.00 175.17 174.22 1ax1 n ASN 162 N 4.28 1.66 0.00 -0.34 2.85 -1.26 -1.31 115.26 121.13 1ax1 n ASN 162 Ca 0.05 0.70 0.00 0.00 -0.11 0.00 0.00 54.58 55.22 1ax1 n ASN 162 Cb 0.43 -1.09 0.00 0.00 1.24 0.00 0.00 39.78 40.37 1ax1 n ASN 162 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ax1 n GLY 163 N 6.17 1.28 3.88 8.20 0.00 -0.31 -4.98 105.19 119.43 1ax1 n GLY 163 Ca 0.42 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.13 1ax1 n GLY 163 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ax1 s GLN 164 N -0.07 3.79 -0.02 1.61 -1.52 -0.43 -4.85 119.66 118.18 1ax1 s GLN 164 Ca 0.00 0.34 -0.30 0.00 -1.95 0.00 0.00 55.36 53.45 1ax1 s GLN 164 Cb 0.00 -2.53 -0.03 0.00 -0.22 0.00 0.00 33.01 30.23 1ax1 s GLN 164 CO 0.00 0.16 1.04 0.08 -0.25 0.00 0.00 175.29 176.32 1ax1 s VAL 165 N -2.08 4.66 -0.10 1.09 1.01 -1.26 -4.42 120.40 119.30 1ax1 s VAL 165 Ca 0.49 1.92 -0.01 0.00 0.00 0.00 0.00 61.98 64.37 1ax1 s VAL 165 Cb -0.11 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 1ax1 s VAL 165 CO 0.26 0.10 -0.03 0.00 0.00 0.00 0.00 175.10 175.43 1ax1 s ALA 166 N 1.35 3.11 -0.17 5.51 0.00 0.30 -4.22 121.76 127.64 1ax1 s ALA 166 Ca 0.53 -0.84 -0.08 0.00 0.00 0.00 0.00 51.96 51.57 1ax1 s ALA 166 Cb -0.22 -1.41 -0.04 0.00 0.00 0.00 0.00 23.12 21.44 1ax1 s ALA 166 CO 0.25 0.49 0.10 -0.80 0.00 0.00 0.00 175.76 175.80 1ax1 s ASN 167 N -0.54 5.98 -0.03 0.00 0.01 0.48 -1.97 114.94 118.88 1ax1 s ASN 167 Ca 0.09 0.21 0.07 0.00 -0.71 0.00 0.00 52.86 52.52 1ax1 s ASN 167 Cb -0.12 -2.01 -0.02 0.00 0.41 0.00 0.00 41.25 39.51 1ax1 s ASN 167 CO 0.02 0.23 -0.24 -0.69 -1.51 0.00 0.00 177.10 174.90 1ax1 s VAL 168 N 0.07 1.93 -0.10 1.60 1.01 0.52 -1.15 120.40 124.29 1ax1 s VAL 168 Ca 0.08 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.02 1ax1 s VAL 168 Cb -0.12 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1ax1 s VAL 168 CO -0.00 0.54 -0.06 -0.69 0.00 0.00 0.00 175.10 174.89 1ax1 s VAL 169 N -0.44 0.89 -0.14 2.92 1.01 -0.58 -1.93 120.40 122.13 1ax1 s VAL 169 Ca 0.06 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1ax1 s VAL 169 Cb -0.11 -0.92 0.02 0.00 0.00 0.00 0.00 36.38 35.37 1ax1 s VAL 169 CO 0.00 0.34 -0.17 -0.63 0.00 0.00 0.00 175.10 174.64 1ax1 s ILE 170 N 1.61 1.73 0.01 2.22 1.01 -0.02 -0.42 121.20 127.34 1ax1 s ILE 170 Ca 0.02 -0.76 0.05 0.00 0.00 0.00 0.00 60.65 59.95 1ax1 s ILE 170 Cb -0.13 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.75 1ax1 s ILE 170 CO -0.06 0.49 -0.14 -0.75 0.00 0.00 0.00 174.94 174.47 1ax1 s LYS 171 N 1.12 1.09 -0.11 2.79 2.20 0.58 -0.52 119.74 126.89 1ax1 s LYS 171 Ca -0.02 -0.60 0.00 0.00 -0.36 0.00 0.00 55.97 54.99 1ax1 s LYS 171 Cb -0.14 -1.08 0.02 0.00 -1.51 0.00 0.00 37.83 35.12 1ax1 s LYS 171 CO -0.06 0.29 -0.09 -0.47 -0.36 0.00 0.00 175.35 174.66 1ax1 s TYR 172 N -0.50 1.57 -0.41 4.03 5.04 0.07 -0.33 117.35 126.82 1ax1 s TYR 172 Ca 0.04 -0.77 -0.14 0.00 -2.44 0.00 0.00 57.07 53.77 1ax1 s TYR 172 Cb -0.06 -1.25 0.03 0.00 0.35 0.00 0.00 41.96 41.03 1ax1 s TYR 172 CO 0.00 -0.50 0.28 -0.51 -1.34 0.00 0.00 175.55 173.49 1ax1 s ASP 173 N 1.52 5.99 0.39 4.32 1.01 -0.78 -2.04 116.67 127.07 1ax1 s ASP 173 Ca 0.02 -1.02 0.07 0.00 0.71 0.00 0.00 52.55 52.33 1ax1 s ASP 173 Cb -0.13 -2.12 0.80 0.00 1.01 0.00 0.00 42.92 42.49 1ax1 s ASP 173 CO -0.07 -0.46 2.02 0.00 0.21 0.00 0.00 175.17 176.87 1ax1 h ALA 174 N 8.58 1.63 -0.09 5.23 0.00 -1.88 0.42 119.26 133.16 1ax1 h ALA 174 Ca -0.26 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ax1 h ALA 174 Cb 1.11 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1ax1 h ALA 174 CO 0.73 0.31 0.05 0.66 0.00 0.00 0.00 179.25 181.00 1ax1 h SER 175 N 0.53 0.11 0.50 0.00 4.64 -1.93 -3.10 113.55 114.29 1ax1 h SER 175 Ca 0.14 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ax1 h SER 175 Cb 0.04 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1ax1 h SER 175 CO -0.02 0.17 -0.75 -1.54 -0.87 0.00 0.00 176.83 173.82 1ax1 n SER 176 N -4.98 0.62 -1.27 4.97 3.41 -1.13 -4.96 113.62 110.29 1ax1 n SER 176 Ca -0.06 -0.24 -0.14 0.00 -0.26 0.00 0.00 58.87 58.18 1ax1 n SER 176 Cb 0.07 0.49 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 1ax1 n SER 176 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ax1 n LYS 177 N -1.77 -1.02 -3.36 4.33 5.02 0.15 -4.93 118.16 116.59 1ax1 n LYS 177 Ca 0.04 0.85 -0.38 0.00 -2.02 0.00 0.00 58.31 56.79 1ax1 n LYS 177 Cb 0.39 -5.01 -0.07 0.00 -0.02 0.00 0.00 35.03 30.32 1ax1 n LYS 177 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1ax1 s ILE 178 N -2.59 5.18 -0.40 -0.18 1.01 -1.12 -0.39 121.20 122.71 1ax1 s ILE 178 Ca 0.00 0.74 -0.13 0.00 0.00 0.00 0.00 60.65 61.26 1ax1 s ILE 178 Cb 0.00 -3.75 0.02 0.00 0.01 0.00 0.00 42.46 38.75 1ax1 s ILE 178 CO 0.00 0.23 0.26 -0.22 0.00 0.00 0.00 174.94 175.21 1ax1 s LEU 179 N 1.45 4.95 -0.12 2.97 2.96 -0.34 -1.86 118.68 128.70 1ax1 s LEU 179 Ca 0.20 -0.95 0.01 0.00 -0.22 0.00 0.00 54.13 53.16 1ax1 s LEU 179 Cb -0.15 -2.10 -0.01 0.00 0.50 0.00 0.00 46.19 44.43 1ax1 s LEU 179 CO 0.08 -0.43 -0.15 -1.38 -1.32 0.00 0.00 176.35 173.15 1ax1 s HIS 180 N 1.62 2.75 0.04 5.38 -3.43 0.55 -2.07 115.29 120.13 1ax1 s HIS 180 Ca 0.04 -0.68 0.07 0.00 -0.80 0.00 0.00 55.06 53.69 1ax1 s HIS 180 Cb -0.19 -1.79 -0.03 0.00 -1.43 0.00 0.00 32.58 29.14 1ax1 s HIS 180 CO 0.08 -0.22 -0.21 0.00 -2.00 0.00 0.00 174.74 172.40 1ax1 s ALA 181 N 0.24 1.79 -0.02 -1.38 0.00 0.09 -0.31 121.76 122.19 1ax1 s ALA 181 Ca -0.10 -1.07 0.02 0.00 0.00 0.00 0.00 51.96 50.81 1ax1 s ALA 181 Cb -0.16 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.61 1ax1 s ALA 181 CO 0.06 0.41 -0.07 0.08 0.00 0.00 0.00 175.76 176.23 1ax1 s VAL 182 N -0.79 0.63 -0.09 0.00 1.01 0.44 -1.34 120.40 120.25 1ax1 s VAL 182 Ca 0.08 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1ax1 s VAL 182 Cb -0.09 -0.56 0.01 0.00 0.00 0.00 0.00 36.38 35.74 1ax1 s VAL 182 CO 0.02 0.20 -0.19 -0.22 0.00 0.00 0.00 175.10 174.91 1ax1 s LEU 183 N 0.10 1.88 -0.05 3.92 0.20 0.06 -1.52 118.68 123.27 1ax1 s LEU 183 Ca -0.01 -0.46 0.02 0.00 0.69 0.00 0.00 54.13 54.37 1ax1 s LEU 183 Cb -0.06 -1.17 0.01 0.00 -0.43 0.00 0.00 46.19 44.53 1ax1 s LEU 183 CO -0.00 0.09 -0.11 -0.69 -0.29 0.00 0.00 176.35 175.35 1ax1 s VAL 184 N 0.61 1.00 -0.46 1.68 1.01 -0.30 -0.29 120.40 123.65 1ax1 s VAL 184 Ca -0.14 -0.42 -0.08 0.00 0.00 0.00 0.00 61.98 61.33 1ax1 s VAL 184 Cb -0.16 -0.91 0.12 0.00 0.00 0.00 0.00 36.38 35.42 1ax1 s VAL 184 CO 0.04 0.32 0.32 -0.31 0.00 0.00 0.00 175.10 175.47 1ax1 s TYR 185 N 0.53 3.44 0.43 5.22 2.02 -0.47 -0.39 117.35 128.13 1ax1 s TYR 185 Ca -0.11 -1.92 0.15 0.00 -0.37 0.00 0.00 57.07 54.82 1ax1 s TYR 185 Cb -0.14 -3.43 1.05 0.00 -0.40 0.00 0.00 41.96 39.04 1ax1 s TYR 185 CO 0.02 -0.98 1.95 -1.35 -1.57 0.00 0.00 175.55 173.62 1ax1 h PRO 186 N 8.40 0.39 0.21 -1.71 0.11 -1.87 1.10 132.00 138.64 1ax1 h PRO 186 Ca -0.20 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.89 1ax1 h PRO 186 Cb 1.07 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.06 1ax1 h PRO 186 CO 0.83 0.26 -0.28 0.66 -0.21 0.00 0.00 178.00 179.26 1ax1 h SER 187 N 0.40 -0.78 0.20 -2.05 4.64 -1.93 -3.18 113.55 110.86 1ax1 h SER 187 Ca 0.33 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1ax1 h SER 187 Cb 0.72 0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 1ax1 h SER 187 CO -0.10 -0.39 -1.15 -1.54 -0.87 0.00 0.00 176.83 172.78 1ax1 n SER 188 N -5.40 0.64 0.00 4.97 3.41 -1.01 -4.97 113.62 111.27 1ax1 n SER 188 Ca -0.08 -0.48 0.00 0.00 -0.26 0.00 0.00 58.87 58.05 1ax1 n SER 188 Cb 0.31 1.05 0.00 0.00 -0.26 0.00 0.00 64.21 65.30 1ax1 n SER 188 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ax1 n GLY 189 N 1.41 0.79 3.75 5.00 0.00 0.38 -5.00 105.19 111.52 1ax1 n GLY 189 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1ax1 n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ax1 s ALA 190 N -3.15 3.57 -0.08 4.61 0.00 -1.15 -4.81 121.76 120.75 1ax1 s ALA 190 Ca 0.00 1.30 0.02 0.00 0.00 0.00 0.00 51.96 53.29 1ax1 s ALA 190 Cb 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 23.12 19.60 1ax1 s ALA 190 CO 0.00 -0.71 -0.15 0.42 0.00 0.00 0.00 175.76 175.32 1ax1 s ILE 191 N -0.44 1.34 -0.01 0.00 1.01 -1.26 -1.37 121.20 120.47 1ax1 s ILE 191 Ca 0.55 -0.59 0.05 0.00 0.00 0.00 0.00 60.65 60.66 1ax1 s ILE 191 Cb -0.41 -1.21 -0.01 0.00 0.01 0.00 0.00 42.46 40.84 1ax1 s ILE 191 CO 0.47 0.40 -0.17 -0.31 0.00 0.00 0.00 174.94 175.34 1ax1 s TYR 192 N 0.65 1.50 0.03 3.97 2.02 0.60 -4.99 117.35 121.13 1ax1 s TYR 192 Ca -0.14 -0.29 0.03 0.00 -0.37 0.00 0.00 57.07 56.30 1ax1 s TYR 192 Cb -0.16 -0.96 -0.02 0.00 -0.40 0.00 0.00 41.96 40.42 1ax1 s TYR 192 CO 0.04 -0.02 -0.10 -0.08 -1.57 0.00 0.00 175.55 173.82 1ax1 s THR 193 N -0.41 0.74 -0.10 -0.71 -1.32 -1.26 -0.76 115.64 111.83 1ax1 s THR 193 Ca 0.06 -0.84 -0.12 0.00 -1.21 0.00 0.00 61.69 59.59 1ax1 s THR 193 Cb -0.07 -0.71 0.03 0.00 -1.51 0.00 0.00 72.50 70.24 1ax1 s THR 193 CO -0.01 -0.10 0.32 -0.51 -2.21 0.00 0.00 174.62 172.11 1ax1 s ILE 194 N -0.86 0.01 -0.01 5.08 2.07 -0.45 -4.99 121.20 122.06 1ax1 s ILE 194 Ca -0.02 -0.12 -0.17 0.00 -1.41 0.00 0.00 60.65 58.93 1ax1 s ILE 194 Cb -0.07 -0.49 0.03 0.00 0.13 0.00 0.00 42.46 42.05 1ax1 s ILE 194 CO 0.01 -0.06 0.35 0.00 -1.91 0.00 0.00 174.94 173.32 1ax1 s ALA 195 N -0.18 -0.88 -0.02 1.50 0.00 -1.26 -0.73 121.76 120.18 1ax1 s ALA 195 Ca -0.03 0.39 -0.29 0.00 0.00 0.00 0.00 51.96 52.02 1ax1 s ALA 195 Cb -0.03 0.11 0.09 0.00 0.00 0.00 0.00 23.12 23.29 1ax1 s ALA 195 CO 0.01 -0.30 0.76 -2.00 0.00 0.00 0.00 175.76 174.23 1ax1 s GLU 196 N -1.53 0.98 -0.09 0.00 2.56 -0.88 -5.01 118.70 114.73 1ax1 s GLU 196 Ca -0.12 0.02 -0.28 0.00 0.00 0.00 0.00 54.97 54.59 1ax1 s GLU 196 Cb -0.04 0.46 -0.02 0.00 2.00 0.00 0.00 34.13 36.53 1ax1 s GLU 196 CO 0.04 -0.35 0.90 0.42 -0.56 0.00 0.00 175.26 175.71 1ax1 s ILE 197 N -1.94 4.87 -0.05 -3.70 1.01 -1.26 -1.20 121.20 118.93 1ax1 s ILE 197 Ca -0.05 1.84 -0.02 0.00 0.00 0.00 0.00 60.65 62.42 1ax1 s ILE 197 Cb -0.00 -4.22 0.03 0.00 0.01 0.00 0.00 42.46 38.27 1ax1 s ILE 197 CO 0.01 0.09 0.06 -0.69 0.00 0.00 0.00 174.94 174.41 1ax1 s VAL 198 N 1.61 -0.08 -0.55 2.92 1.01 0.47 -4.95 120.40 120.83 1ax1 s VAL 198 Ca 0.45 0.36 -0.18 0.00 0.00 0.00 0.00 61.98 62.60 1ax1 s VAL 198 Cb -0.18 -0.21 0.09 0.00 0.00 0.00 0.00 36.38 36.07 1ax1 s VAL 198 CO 0.19 0.14 0.63 -0.62 0.00 0.00 0.00 175.10 175.44 1ax1 s ASP 199 N 2.16 6.19 0.59 3.32 -1.08 -1.26 -4.65 116.67 121.94 1ax1 s ASP 199 Ca 0.05 -1.29 0.30 0.00 -0.52 0.00 0.00 52.55 51.09 1ax1 s ASP 199 Cb -0.12 -2.28 1.84 0.00 -1.46 0.00 0.00 42.92 40.90 1ax1 s ASP 199 CO -0.04 -0.98 2.26 -0.37 0.52 0.00 0.00 175.17 176.57 1ax1 h VAL 200 N 5.89 0.51 0.00 1.11 -1.51 -1.97 -2.00 116.25 118.28 1ax1 h VAL 200 Ca -0.29 -0.01 -0.02 0.00 -1.23 0.00 0.00 66.70 65.16 1ax1 h VAL 200 Cb 1.09 1.00 -0.00 0.00 -2.13 0.00 0.00 31.29 31.25 1ax1 h VAL 200 CO 1.03 0.00 -0.10 0.11 -1.23 0.00 0.00 177.57 177.39 1ax1 h LYS 201 N 0.00 0.00 0.00 5.19 1.57 -1.92 0.12 116.57 121.54 1ax1 h LYS 201 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ax1 h LYS 201 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1ax1 h LYS 201 CO 0.00 0.10 -0.46 1.96 -0.57 0.00 0.00 179.45 180.47 1ax1 h GLN 202 N 0.00 0.00 0.00 3.15 4.20 -1.78 -3.42 115.11 117.26 1ax1 h GLN 202 Ca -0.00 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1ax1 h GLN 202 Cb 0.24 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1ax1 h GLN 202 CO 0.01 0.00 -0.91 0.28 -0.67 0.00 0.00 178.83 177.55 1ax1 n VAL 203 N -2.17 1.18 -3.31 -0.54 0.31 -0.37 -5.09 118.33 108.34 1ax1 n VAL 203 Ca 0.04 0.13 -0.27 0.00 -0.01 0.00 0.00 64.34 64.22 1ax1 n VAL 203 Cb 0.44 -1.88 -0.02 0.00 -0.91 0.00 0.00 33.84 31.46 1ax1 n VAL 203 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ax1 s LEU 204 N -7.24 4.02 0.84 7.52 1.43 0.28 -4.29 118.68 121.24 1ax1 s LEU 204 Ca -0.16 0.65 -0.12 0.00 -1.03 0.00 0.00 54.13 53.47 1ax1 s LEU 204 Cb 0.04 -3.49 0.10 0.00 0.03 0.00 0.00 46.19 42.87 1ax1 s LEU 204 CO 0.23 -0.24 1.16 -2.16 0.23 0.00 0.00 176.35 175.56 1ax1 s PRO 205 N -3.83 1.70 0.39 1.29 0.04 -1.26 -4.73 135.00 128.61 1ax1 s PRO 205 Ca 0.43 0.18 0.06 0.00 0.04 0.00 0.00 61.00 61.71 1ax1 s PRO 205 Cb -0.10 -1.91 0.80 0.00 0.04 0.00 0.00 34.50 33.33 1ax1 s PRO 205 CO 0.33 -1.79 2.03 0.93 0.04 0.00 0.00 177.00 178.54 1ax1 h GLU 206 N -1.20 0.57 -6.06 4.56 5.08 -1.95 -3.41 114.58 112.17 1ax1 h GLU 206 Ca -0.48 -0.04 -0.69 0.00 -1.00 0.00 0.00 59.36 57.15 1ax1 h GLU 206 Cb 1.33 -0.12 -0.30 0.00 0.50 0.00 0.00 28.75 30.15 1ax1 h GLU 206 CO 0.65 0.40 -0.86 -1.58 -1.00 0.00 0.00 179.01 176.61 1ax1 s TRP 207 N -5.46 2.48 0.09 4.33 0.52 -1.26 -1.08 118.94 118.56 1ax1 s TRP 207 Ca -0.08 -0.63 0.01 0.00 0.02 0.00 0.00 56.10 55.41 1ax1 s TRP 207 Cb 0.17 -1.61 -0.04 0.00 -1.15 0.00 0.00 33.47 30.84 1ax1 s TRP 207 CO 0.74 -0.16 -0.04 0.14 0.02 0.00 0.00 176.95 177.66 1ax1 s VAL 208 N -0.23 0.48 -0.11 4.03 -7.23 -0.42 -4.34 120.40 112.57 1ax1 s VAL 208 Ca -0.01 -1.89 -0.05 0.00 -1.81 0.00 0.00 61.98 58.21 1ax1 s VAL 208 Cb -0.13 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.07 1ax1 s VAL 208 CO 0.03 -0.84 0.09 -1.81 -0.31 0.00 0.00 175.10 172.26 1ax1 s ASP 209 N -3.01 5.99 -0.03 4.85 1.01 -0.17 -0.46 116.67 124.85 1ax1 s ASP 209 Ca 0.12 0.36 0.01 0.00 0.71 0.00 0.00 52.55 53.76 1ax1 s ASP 209 Cb 0.06 -1.86 -0.03 0.00 1.01 0.00 0.00 42.92 42.10 1ax1 s ASP 209 CO -0.05 0.40 -0.04 0.68 0.21 0.00 0.00 175.17 176.37 1ax1 s VAL 210 N -0.98 3.89 0.18 -1.27 -7.23 -1.26 -2.27 120.40 111.46 1ax1 s VAL 210 Ca 0.15 -0.58 -0.15 0.00 -1.81 0.00 0.00 61.98 59.59 1ax1 s VAL 210 Cb -0.12 -2.67 0.05 0.00 0.56 0.00 0.00 36.38 34.20 1ax1 s VAL 210 CO 0.04 0.47 0.72 0.61 -0.31 0.00 0.00 175.10 176.62 1ax1 n GLY 211 N 1.75 0.90 3.11 2.32 0.00 -0.49 -1.66 105.19 111.11 1ax1 n GLY 211 Ca -0.16 -1.12 -0.22 0.00 0.00 0.00 0.00 46.02 44.52 1ax1 n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ax1 s LEU 212 N 0.00 2.03 0.01 0.99 1.43 -0.17 -1.17 118.68 121.80 1ax1 s LEU 212 Ca 0.16 -0.26 0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1ax1 s LEU 212 Cb -0.03 -0.72 -0.01 0.00 0.03 0.00 0.00 46.19 45.47 1ax1 s LEU 212 CO 0.05 0.17 -0.03 -0.55 0.23 0.00 0.00 176.35 176.22 1ax1 s SER 213 N -0.34 0.34 0.05 2.29 0.15 -0.19 -0.78 113.70 115.21 1ax1 s SER 213 Ca 0.05 -0.28 -0.00 0.00 0.70 0.00 0.00 55.95 56.42 1ax1 s SER 213 Cb -0.05 0.03 -0.03 0.00 -1.71 0.00 0.00 66.02 64.25 1ax1 s SER 213 CO -0.00 -0.12 -0.04 -0.83 1.20 0.00 0.00 173.24 173.44 1ax1 s GLY 214 N -0.79 0.45 -0.10 9.45 0.00 -0.27 -0.06 107.32 116.00 1ax1 s GLY 214 Ca -0.07 -1.03 -0.17 0.00 0.00 0.00 0.00 44.72 43.45 1ax1 s GLY 214 CO -0.00 -1.13 0.43 0.00 0.00 0.00 0.00 173.10 172.40 1ax1 s ALA 215 N -3.06 -1.07 0.36 3.20 0.00 -0.70 -2.04 121.76 118.43 1ax1 s ALA 215 Ca 0.00 0.94 0.08 0.00 0.00 0.00 0.00 51.96 52.98 1ax1 s ALA 215 Cb 0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 1ax1 s ALA 215 CO -0.06 -0.25 0.31 0.95 0.00 0.00 0.00 175.76 176.71 1ax1 s THR 216 N -0.49 3.29 1.17 0.00 -4.23 0.31 0.13 115.64 115.82 1ax1 s THR 216 Ca -0.06 -1.37 -0.13 0.00 -1.18 0.00 0.00 61.69 58.95 1ax1 s THR 216 Cb -0.03 -3.13 0.29 0.00 1.34 0.00 0.00 72.50 70.97 1ax1 s THR 216 CO 0.03 -0.13 1.03 -0.83 -0.54 0.00 0.00 174.62 174.18 1ax1 s GLY 217 N -4.03 1.55 0.00 3.99 0.00 0.70 -4.03 107.32 105.50 1ax1 s GLY 217 Ca 0.43 -0.09 0.29 0.00 0.00 0.00 0.00 44.72 45.35 1ax1 s GLY 217 CO 0.27 0.63 1.91 0.00 0.00 0.00 0.00 173.10 175.91 1ax1 n ALA 218 N -4.98 2.71 -2.21 3.20 0.00 -1.26 -0.32 120.51 117.65 1ax1 n ALA 218 Ca 0.03 -0.30 -0.11 0.00 0.00 0.00 0.00 53.44 53.06 1ax1 n ALA 218 Cb 0.54 -1.33 -0.10 0.00 0.00 0.00 0.00 19.45 18.56 1ax1 n ALA 218 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1ax1 s GLN 219 N -2.24 0.84 -0.13 0.00 -2.07 -1.26 -4.95 119.66 109.84 1ax1 s GLN 219 Ca 0.36 -1.31 -0.39 0.00 -1.82 0.00 0.00 55.36 52.20 1ax1 s GLN 219 Cb 0.21 -0.25 -0.16 0.00 -1.09 0.00 0.00 33.01 31.72 1ax1 s GLN 219 CO 0.41 -0.01 1.58 -2.13 -1.32 0.00 0.00 175.29 173.82 1ax1 n ARG 220 N 0.03 1.13 -0.86 9.60 0.63 -1.26 -1.79 116.66 124.13 1ax1 n ARG 220 Ca -0.13 0.41 0.00 0.00 -0.92 0.00 0.00 57.85 57.22 1ax1 n ARG 220 Cb 0.60 -2.08 0.00 0.00 0.45 0.00 0.00 32.46 31.44 1ax1 n ARG 220 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1ax1 n ASP 221 N 4.19 -1.33 -4.54 6.15 8.00 -1.26 -4.72 116.55 123.04 1ax1 n ASP 221 Ca 0.23 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.30 1ax1 n ASP 221 Cb 0.15 -1.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.04 1ax1 n ASP 221 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ax1 n ALA 222 N 1.00 3.66 -2.95 2.24 0.00 -0.74 -4.58 120.51 119.15 1ax1 n ALA 222 Ca 0.00 -3.95 -0.11 0.00 0.00 0.00 0.00 53.44 49.38 1ax1 n ALA 222 Cb 0.06 -3.47 -0.06 0.00 0.00 0.00 0.00 19.45 15.99 1ax1 n ALA 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ax1 s ALA 223 N 3.54 0.22 0.09 0.00 0.00 -1.26 -0.22 121.76 124.14 1ax1 s ALA 223 Ca 0.51 -1.16 -0.27 0.00 0.00 0.00 0.00 51.96 51.04 1ax1 s ALA 223 Cb 0.02 1.14 0.08 0.00 0.00 0.00 0.00 23.12 24.37 1ax1 s ALA 223 CO 0.06 -0.79 1.01 -1.83 0.00 0.00 0.00 175.76 174.20 1ax1 s GLU 224 N -3.82 0.99 0.48 0.00 -1.05 -1.25 -4.38 118.70 109.67 1ax1 s GLU 224 Ca 0.27 -0.52 -0.05 0.00 -0.15 0.00 0.00 54.97 54.52 1ax1 s GLU 224 Cb 0.01 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 34.01 1ax1 s GLU 224 CO 0.12 -0.45 0.78 0.95 0.95 0.00 0.00 175.26 177.61 1ax1 s THR 225 N -3.10 4.91 -0.41 1.83 -4.23 -0.66 -4.83 115.64 109.15 1ax1 s THR 225 Ca 0.11 0.19 0.06 0.00 -1.18 0.00 0.00 61.69 60.87 1ax1 s THR 225 Cb -0.00 -3.87 0.20 0.00 1.34 0.00 0.00 72.50 70.17 1ax1 s THR 225 CO -0.01 -0.84 0.46 1.41 -0.54 0.00 0.00 174.62 175.10 1ax1 n HIS 226 N -2.25 -1.08 -3.70 3.99 -0.00 -1.26 -3.90 115.22 107.04 1ax1 n HIS 226 Ca 0.00 -3.17 -0.36 0.00 -0.00 0.00 0.00 57.72 54.19 1ax1 n HIS 226 Cb 0.55 0.21 -0.07 0.00 -0.00 0.00 0.00 29.99 30.68 1ax1 n HIS 226 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1ax1 s ASP 227 N -0.39 6.35 -0.12 0.41 1.01 -0.89 -1.49 116.67 121.54 1ax1 s ASP 227 Ca 0.33 0.41 0.01 0.00 0.71 0.00 0.00 52.55 54.01 1ax1 s ASP 227 Cb 0.09 -2.12 -0.01 0.00 1.01 0.00 0.00 42.92 41.89 1ax1 s ASP 227 CO -0.16 0.22 -0.15 -0.69 0.21 0.00 0.00 175.17 174.60 1ax1 s VAL 228 N -0.04 2.84 -0.15 -1.27 1.01 0.43 -0.91 120.40 122.30 1ax1 s VAL 228 Ca 0.13 -0.74 0.18 0.00 0.00 0.00 0.00 61.98 61.55 1ax1 s VAL 228 Cb -0.12 -2.17 -0.25 0.00 0.00 0.00 0.00 36.38 33.83 1ax1 s VAL 228 CO 0.02 0.53 0.24 -1.22 0.00 0.00 0.00 175.10 174.68 1ax1 n TYR 229 N 3.50 0.17 -3.50 5.22 4.01 0.08 -1.17 117.16 125.47 1ax1 n TYR 229 Ca -0.18 0.06 -0.11 0.00 -0.16 0.00 0.00 57.90 57.50 1ax1 n TYR 229 Cb 0.53 -0.95 -0.02 0.00 -0.31 0.00 0.00 39.34 38.59 1ax1 n TYR 229 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1ax1 s SER 230 N -5.43 -0.51 -0.29 7.72 1.04 -1.25 -3.99 113.70 110.99 1ax1 s SER 230 Ca -0.09 -0.11 -0.15 0.00 0.48 0.00 0.00 55.95 56.09 1ax1 s SER 230 Cb 0.08 0.62 0.12 0.00 0.10 0.00 0.00 66.02 66.93 1ax1 s SER 230 CO 0.84 -1.03 0.80 0.86 0.98 0.00 0.00 173.24 175.69 1ax1 s TRP 231 N -3.78 -0.94 0.10 5.02 -0.00 -0.53 -2.66 118.94 116.16 1ax1 s TRP 231 Ca 0.03 1.78 0.04 0.00 -0.00 0.00 0.00 56.10 57.95 1ax1 s TRP 231 Cb -0.02 0.56 -0.04 0.00 -0.00 0.00 0.00 33.47 33.98 1ax1 s TRP 231 CO -0.10 -0.47 -0.11 -1.54 -0.00 0.00 0.00 176.95 174.73 1ax1 s SER 232 N 1.92 1.60 -0.05 5.86 1.04 -0.19 -0.59 113.70 123.29 1ax1 s SER 232 Ca -0.08 -0.79 -0.17 0.00 0.48 0.00 0.00 55.95 55.39 1ax1 s SER 232 Cb -0.06 -0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.08 1ax1 s SER 232 CO -0.18 -0.22 0.38 0.12 0.98 0.00 0.00 173.24 174.32 1ax1 s PHE 233 N -2.26 -0.30 -0.15 5.02 5.36 -0.05 -1.93 117.98 123.68 1ax1 s PHE 233 Ca 0.05 0.57 -0.11 0.00 -0.96 0.00 0.00 56.93 56.48 1ax1 s PHE 233 Cb -0.04 0.15 0.04 0.00 -0.34 0.00 0.00 43.02 42.83 1ax1 s PHE 233 CO 0.01 -0.38 0.37 -1.14 -1.46 0.00 0.00 175.22 172.62 1ax1 s GLN 234 N -0.96 0.40 -0.04 10.12 2.00 -0.67 -0.99 119.66 129.52 1ax1 s GLN 234 Ca -0.10 0.60 -0.04 0.00 -2.00 0.00 0.00 55.36 53.82 1ax1 s GLN 234 Cb -0.04 0.11 0.01 0.00 0.80 0.00 0.00 33.01 33.89 1ax1 s GLN 234 CO 0.04 -0.09 0.11 0.00 -0.50 0.00 0.00 175.29 174.85 1ax1 s ALA 235 N 0.66 -0.27 -0.10 1.58 0.00 0.39 -1.47 121.76 122.55 1ax1 s ALA 235 Ca -0.04 0.27 -0.01 0.00 0.00 0.00 0.00 51.96 52.18 1ax1 s ALA 235 Cb -0.05 -0.16 0.03 0.00 0.00 0.00 0.00 23.12 22.94 1ax1 s ALA 235 CO -0.04 -0.07 -0.04 -1.12 0.00 0.00 0.00 175.76 174.49 1ax1 s SER 236 N -0.07 1.96 -0.43 0.00 0.01 -0.71 -1.26 113.70 113.21 1ax1 s SER 236 Ca -0.01 -0.23 -0.14 0.00 1.31 0.00 0.00 55.95 56.88 1ax1 s SER 236 Cb -0.01 -0.66 0.05 0.00 0.21 0.00 0.00 66.02 65.60 1ax1 s SER 236 CO 0.00 -0.16 0.31 -0.22 0.41 0.00 0.00 173.24 173.58 1ax1 s LEU 237 N 1.83 5.23 -0.88 2.44 0.20 0.23 -2.19 118.68 125.53 1ax1 s LEU 237 Ca 0.05 -1.15 -0.26 0.00 0.69 0.00 0.00 54.13 53.46 1ax1 s LEU 237 Cb -0.13 -2.12 -0.13 0.00 -0.43 0.00 0.00 46.19 43.38 1ax1 s LEU 237 CO -0.07 -0.52 2.25 -2.84 -0.29 0.00 0.00 176.35 174.88 1ax1 s PRO 238 N 1.61 1.74 0.00 0.98 0.02 -1.26 -0.67 135.00 137.42 1ax1 s PRO 238 Ca 0.04 0.09 0.00 0.00 0.02 0.00 0.00 61.00 61.15 1ax1 s PRO 238 Cb -0.21 -4.90 0.00 0.00 0.02 0.00 0.00 34.50 29.41 1ax1 s PRO 238 CO 0.07 -4.42 0.00 -1.91 -0.33 0.00 0.00 177.00 170.41