#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d23 s ILE 3 N 0.00 0.07 0.17 -0.61 -5.25 -1.26 -4.92 121.20 109.40 3d23 s ILE 3 Ca 0.00 -0.59 -0.11 0.00 -0.99 0.00 0.00 60.65 58.96 3d23 s ILE 3 Cb 0.00 -0.40 -0.00 0.00 2.95 0.00 0.00 42.46 45.01 3d23 s ILE 3 CO 0.00 -0.32 0.33 0.68 -1.79 0.00 0.00 174.94 173.84 3d23 s VAL 4 N -1.17 0.06 -0.90 8.37 -7.23 -1.26 -5.08 120.40 113.20 3d23 s VAL 4 Ca -0.13 -1.27 -0.24 0.00 -1.81 0.00 0.00 61.98 58.54 3d23 s VAL 4 Cb -0.07 -1.79 0.05 0.00 0.56 0.00 0.00 36.38 35.14 3d23 s VAL 4 CO 0.01 -0.27 1.33 -0.54 -0.31 0.00 0.00 175.10 175.33 3d23 s LYS 5 N -3.95 3.43 -0.32 4.82 -0.14 -1.26 -4.98 119.74 117.34 3d23 s LYS 5 Ca 0.15 -0.89 -0.29 0.00 -1.36 0.00 0.00 55.97 53.59 3d23 s LYS 5 Cb 0.02 -4.88 0.01 0.00 -1.68 0.00 0.00 37.83 31.31 3d23 s LYS 5 CO -0.01 -2.12 1.25 1.41 -0.76 0.00 0.00 175.35 175.12 3d23 s MET 6 N 4.94 3.92 0.13 1.68 -2.45 -1.26 -4.82 119.30 121.44 3d23 s MET 6 Ca 0.40 1.15 -0.20 0.00 -1.25 0.00 0.00 55.69 55.79 3d23 s MET 6 Cb -0.04 -3.86 -0.07 0.00 1.25 0.00 0.00 34.83 32.11 3d23 s MET 6 CO -0.01 -1.11 0.64 0.08 1.05 0.00 0.00 175.02 175.67 3d23 s VAL 7 N 4.28 4.64 0.56 10.11 1.01 -1.26 -4.89 120.40 134.85 3d23 s VAL 7 Ca 0.54 1.28 -0.19 0.00 0.00 0.00 0.00 61.98 63.60 3d23 s VAL 7 Cb -0.15 -3.92 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 3d23 s VAL 7 CO 0.23 0.44 1.17 -0.44 0.00 0.00 0.00 175.10 176.50 3d23 s SER 8 N -1.30 5.50 0.51 3.32 0.01 -1.26 -5.00 113.70 115.48 3d23 s SER 8 Ca 0.34 2.29 -0.22 0.00 1.31 0.00 0.00 55.95 59.67 3d23 s SER 8 Cb -0.19 -2.59 -0.07 0.00 0.21 0.00 0.00 66.02 63.38 3d23 s SER 8 CO 0.21 -1.37 1.24 -2.65 0.41 0.00 0.00 173.24 171.07 3d23 n PRO 9 N -1.37 1.59 -0.00 12.44 -0.02 -1.26 -4.96 135.00 141.41 3d23 n PRO 9 Ca 0.12 0.58 0.11 0.00 -2.02 0.00 0.00 63.50 62.29 3d23 n PRO 9 Cb 0.50 -2.41 0.09 0.00 -0.02 0.00 0.00 33.50 31.67 3d23 n PRO 9 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3d23 n THR 10 N -0.89 0.01 -0.04 3.45 -2.24 -1.26 -4.64 114.28 108.67 3d23 n THR 10 Ca 0.10 -0.51 -0.01 0.00 -2.27 0.00 0.00 64.05 61.36 3d23 n THR 10 Cb 0.43 1.45 0.27 0.00 -2.10 0.00 0.00 70.33 70.38 3d23 n THR 10 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3d23 h SER 11 N 4.31 0.57 0.86 3.42 4.64 -2.01 0.34 113.55 125.68 3d23 h SER 11 Ca 0.00 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 3d23 h SER 11 Cb 0.92 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 3d23 h SER 11 CO 0.00 0.62 0.00 0.11 -0.87 0.00 0.00 176.83 176.69 3d23 h LYS 12 N 0.59 0.00 0.00 4.77 1.57 -1.98 -3.34 116.57 118.18 3d23 h LYS 12 Ca 0.13 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.69 3d23 h LYS 12 Cb 0.32 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 3d23 h LYS 12 CO 0.01 0.00 -1.83 -0.89 -0.57 0.00 0.00 179.45 176.16 3d23 n ILE 13 N -2.47 0.84 -0.29 1.86 -0.00 0.94 -4.53 119.36 115.71 3d23 n ILE 13 Ca 0.02 -0.32 0.01 0.00 -0.00 0.00 0.00 62.75 62.46 3d23 n ILE 13 Cb 0.26 -1.04 0.07 0.00 -0.00 0.00 0.00 39.64 38.93 3d23 n ILE 13 CO 0.00 0.00 0.00 -0.33 -0.00 0.00 0.00 176.55 176.22 3d23 h GLU 14 N -0.02 -0.03 0.00 0.38 5.08 -0.96 0.49 114.58 119.52 3d23 h GLU 14 Ca -0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 3d23 h GLU 14 Cb 1.50 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.76 3d23 h GLU 14 CO -0.06 -0.02 0.00 -0.35 -1.00 0.00 0.00 179.01 177.58 3d23 n PRO 15 N -5.51 0.00 0.00 2.33 -0.04 -1.26 -0.71 135.00 129.82 3d23 n PRO 15 Ca 0.10 0.37 0.14 0.00 -0.04 0.00 0.00 63.50 64.07 3d23 n PRO 15 Cb 0.41 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 32.90 3d23 n PRO 15 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d23 s ILE 17 N -2.13 5.00 0.26 0.00 -1.09 0.12 -0.92 121.20 122.43 3d23 s ILE 17 Ca 0.36 1.08 0.12 0.00 -2.23 0.00 0.00 60.65 59.97 3d23 s ILE 17 Cb 0.21 -3.91 -0.05 0.00 -1.58 0.00 0.00 42.46 37.13 3d23 s ILE 17 CO 0.38 0.04 -0.21 0.68 -1.23 0.00 0.00 174.94 174.61 3d23 s VAL 18 N 2.46 2.40 0.10 2.92 -7.23 -0.73 -4.74 120.40 115.58 3d23 s VAL 18 Ca 0.25 -2.31 -0.09 0.00 -1.81 0.00 0.00 61.98 58.02 3d23 s VAL 18 Cb -0.16 -2.24 -0.06 0.00 0.56 0.00 0.00 36.38 34.49 3d23 s VAL 18 CO 0.09 -0.35 0.41 -0.94 -0.31 0.00 0.00 175.10 174.00 3d23 s SER 19 N -3.30 6.62 -0.05 4.85 1.04 -0.14 -1.00 113.70 121.72 3d23 s SER 19 Ca 0.27 0.77 0.03 0.00 0.48 0.00 0.00 55.95 57.51 3d23 s SER 19 Cb -0.05 -2.17 0.01 0.00 0.10 0.00 0.00 66.02 63.90 3d23 s SER 19 CO 0.13 0.14 -0.14 -0.69 0.98 0.00 0.00 173.24 173.67 3d23 s VAL 20 N -1.46 1.19 0.04 5.02 1.01 -0.23 -2.25 120.40 123.72 3d23 s VAL 20 Ca 0.35 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.83 3d23 s VAL 20 Cb -0.14 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 3d23 s VAL 20 CO 0.19 0.36 -0.14 -0.89 0.00 0.00 0.00 175.10 174.62 3d23 s THR 21 N 0.37 1.10 -0.27 3.92 2.01 -0.62 -0.92 115.64 121.22 3d23 s THR 21 Ca -0.09 -0.97 -0.00 0.00 0.31 0.00 0.00 61.69 60.93 3d23 s THR 21 Cb -0.13 -0.99 0.16 0.00 0.01 0.00 0.00 72.50 71.54 3d23 s THR 21 CO 0.03 0.02 0.45 -0.47 -0.69 0.00 0.00 174.62 173.96 3d23 s TYR 22 N -0.82 -1.13 0.00 4.92 5.04 -0.96 -2.74 117.35 121.66 3d23 s TYR 22 Ca 0.02 0.92 0.00 0.00 -2.44 0.00 0.00 57.07 55.56 3d23 s TYR 22 Cb -0.08 0.12 0.00 0.00 0.35 0.00 0.00 41.96 42.35 3d23 s TYR 22 CO 0.01 -0.85 0.00 0.41 -1.34 0.00 0.00 175.55 173.78 3d23 n GLY 23 N 5.38 2.17 0.13 8.97 0.00 -1.26 -3.46 105.19 117.11 3d23 n GLY 23 Ca -0.01 -0.28 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 3d23 n GLY 23 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d23 n SER 24 N 9.57 2.04 -4.67 1.61 3.41 -1.26 -4.93 113.62 119.39 3d23 n SER 24 Ca 0.00 0.27 -0.43 0.00 -0.26 0.00 0.00 58.87 58.45 3d23 n SER 24 Cb 0.00 -0.88 -0.02 0.00 -0.26 0.00 0.00 64.21 63.05 3d23 n SER 24 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 3d23 s MET 25 N -2.50 4.27 -0.33 4.33 0.00 -1.23 -5.03 119.30 118.83 3d23 s MET 25 Ca -0.25 1.60 -0.10 0.00 0.00 0.00 0.00 55.69 56.94 3d23 s MET 25 Cb 0.07 -3.68 -0.00 0.00 0.00 0.00 0.00 34.83 31.21 3d23 s MET 25 CO 0.70 -0.61 0.17 0.99 0.00 0.00 0.00 175.02 176.27 3d23 s THR 26 N 3.07 4.67 0.00 10.11 2.01 -1.26 -2.26 115.64 131.98 3d23 s THR 26 Ca 0.53 -0.49 0.00 0.00 0.31 0.00 0.00 61.69 62.04 3d23 s THR 26 Cb -0.21 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 68.87 3d23 s THR 26 CO 0.15 -0.00 0.00 0.00 -0.69 0.00 0.00 174.62 174.08 3d23 n LEU 27 N 5.00 0.00 -4.51 4.42 -0.00 -0.10 -4.78 117.00 117.02 3d23 n LEU 27 Ca -0.13 0.00 -0.29 0.00 -0.00 0.00 0.00 56.01 55.58 3d23 n LEU 27 Cb 0.49 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.80 3d23 n LEU 27 CO 0.35 0.00 -0.47 0.20 -0.00 0.00 0.00 177.39 177.47 3d23 s ASN 28 N 1.00 4.02 0.22 1.45 0.01 -0.46 -1.07 114.94 120.11 3d23 s ASN 28 Ca 0.00 -0.52 -0.00 0.00 -0.71 0.00 0.00 52.86 51.63 3d23 s ASN 28 Cb 0.00 -0.62 -0.04 0.00 0.41 0.00 0.00 41.25 41.00 3d23 s ASN 28 CO 0.00 0.17 0.13 -0.83 -1.51 0.00 0.00 177.10 175.07 3d23 s GLY 29 N -2.20 1.56 -0.16 0.66 0.00 -0.17 -4.18 107.32 102.84 3d23 s GLY 29 Ca 0.19 -1.75 0.00 0.00 0.00 0.00 0.00 44.72 43.16 3d23 s GLY 29 CO 0.11 -1.45 -0.16 -2.27 0.00 0.00 0.00 173.10 169.33 3d23 s LEU 30 N -3.21 2.42 -0.33 0.66 2.96 -0.03 -1.77 118.68 119.39 3d23 s LEU 30 Ca 0.39 -0.50 -0.08 0.00 -0.22 0.00 0.00 54.13 53.72 3d23 s LEU 30 Cb 0.07 -1.55 0.03 0.00 0.50 0.00 0.00 46.19 45.23 3d23 s LEU 30 CO 0.13 0.07 0.12 0.86 -1.32 0.00 0.00 176.35 176.22 3d23 s TRP 31 N 0.88 3.22 -0.03 5.38 -0.00 -0.10 -0.18 118.94 128.11 3d23 s TRP 31 Ca -0.04 -1.14 0.01 0.00 -0.00 0.00 0.00 56.10 54.93 3d23 s TRP 31 Cb -0.15 -2.31 0.01 0.00 -0.00 0.00 0.00 33.47 31.02 3d23 s TRP 31 CO -0.01 -0.65 -0.05 -0.51 -0.00 0.00 0.00 176.95 175.72 3d23 s LEU 32 N 1.48 1.60 0.00 5.86 1.43 0.73 -4.68 118.68 125.09 3d23 s LEU 32 Ca 0.01 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 3d23 s LEU 32 Cb -0.19 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.63 3d23 s LEU 32 CO 0.04 0.00 0.00 0.47 0.23 0.00 0.00 176.35 177.09 3d23 n ASP 33 N 3.59 0.00 -1.57 2.29 8.00 -1.26 -0.90 116.55 126.70 3d23 n ASP 33 Ca -0.21 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.34 3d23 n ASP 33 Cb 0.53 0.00 0.33 0.00 -0.02 0.00 0.00 41.12 41.97 3d23 n ASP 33 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3d23 n ASP 34 N 2.17 4.85 -4.51 -2.24 3.85 -1.26 -1.10 116.55 118.30 3d23 n ASP 34 Ca 0.00 -3.06 -0.33 0.00 -0.71 0.00 0.00 54.79 50.69 3d23 n ASP 34 Cb 0.00 -0.65 -0.12 0.00 -1.35 0.00 0.00 41.12 38.99 3d23 n ASP 34 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3d23 s LYS 35 N -2.86 2.91 -0.20 0.11 -0.14 -0.08 0.58 119.74 120.06 3d23 s LYS 35 Ca 0.51 -0.60 -0.03 0.00 -1.36 0.00 0.00 55.97 54.48 3d23 s LYS 35 Cb 0.40 -2.59 -0.01 0.00 -1.68 0.00 0.00 37.83 33.96 3d23 s LYS 35 CO 0.13 0.52 -0.08 0.08 -0.76 0.00 0.00 175.35 175.24 3d23 s VAL 36 N -0.44 3.15 -0.12 3.17 1.01 -0.18 -0.20 120.40 126.79 3d23 s VAL 36 Ca 0.06 -0.58 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 3d23 s VAL 36 Cb -0.12 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 3d23 s VAL 36 CO 0.02 0.46 0.16 -0.31 0.00 0.00 0.00 175.10 175.42 3d23 s TYR 37 N 1.27 3.60 0.23 5.22 2.02 0.75 -1.69 117.35 128.75 3d23 s TYR 37 Ca 0.03 0.55 -0.20 0.00 -0.37 0.00 0.00 57.07 57.08 3d23 s TYR 37 Cb -0.14 -1.97 0.03 0.00 -0.40 0.00 0.00 41.96 39.48 3d23 s TYR 37 CO -0.03 0.71 0.63 0.00 -1.57 0.00 0.00 175.55 175.29 3d23 s PRO 39 N -3.87 3.98 0.49 0.00 0.02 -1.26 -0.87 135.00 133.49 3d23 s PRO 39 Ca 0.08 2.15 0.22 0.00 0.02 0.00 0.00 61.00 63.48 3d23 s PRO 39 Cb -0.03 -2.76 1.25 0.00 0.02 0.00 0.00 34.50 32.97 3d23 s PRO 39 CO -0.01 -0.48 2.02 0.07 -0.33 0.00 0.00 177.00 178.27 3d23 h ARG 40 N 2.70 0.00 0.00 5.54 0.11 -0.93 -2.71 114.38 119.09 3d23 h ARG 40 Ca -0.50 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.58 3d23 h ARG 40 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 3d23 h ARG 40 CO 0.63 0.16 0.00 -2.39 0.10 0.00 0.00 179.97 178.47 3d23 n HIS 41 N -3.86 0.00 0.32 4.08 1.44 -1.26 -2.28 115.22 113.66 3d23 n HIS 41 Ca -0.02 0.00 0.20 0.00 -2.01 0.00 0.00 57.72 55.89 3d23 n HIS 41 Cb 0.26 0.00 1.04 0.00 0.12 0.00 0.00 29.99 31.41 3d23 n HIS 41 CO 0.00 0.00 0.00 -0.24 -2.81 0.00 0.00 176.34 173.29 3d23 h VAL 42 N 0.00 0.08 -0.01 0.61 3.04 -1.86 -2.24 116.25 115.87 3d23 h VAL 42 Ca 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.53 3d23 h VAL 42 Cb 0.00 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 3d23 h VAL 42 CO 0.00 0.01 -0.07 2.30 -1.01 0.00 0.00 177.57 178.80 3d23 n ILE 43 N -3.18 0.00 -3.07 3.17 -5.35 -0.97 -4.31 119.36 105.66 3d23 n ILE 43 Ca -0.02 -0.18 -0.33 0.00 -0.27 0.00 0.00 62.75 61.95 3d23 n ILE 43 Cb 0.14 0.32 -0.06 0.00 -1.74 0.00 0.00 39.64 38.29 3d23 n ILE 43 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3d23 s SER 45 N -2.15 6.15 -0.61 0.00 1.04 -1.26 -4.42 113.70 112.46 3d23 s SER 45 Ca 0.54 -0.04 -0.26 0.00 0.48 0.00 0.00 55.95 56.67 3d23 s SER 45 Cb -0.11 -1.61 -0.09 0.00 0.10 0.00 0.00 66.02 64.31 3d23 s SER 45 CO 0.17 -0.20 2.35 -0.94 0.98 0.00 0.00 173.24 175.60 3d23 s SER 46 N -4.04 4.34 0.00 7.02 1.04 -1.26 -1.24 113.70 119.57 3d23 s SER 46 Ca 0.38 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.43 3d23 s SER 46 Cb -0.09 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.51 3d23 s SER 46 CO 0.30 -3.16 0.00 -0.24 0.98 0.00 0.00 173.24 171.11 3d23 n SER 47 N 16.50 0.00 0.07 7.02 2.88 -1.26 -4.72 113.62 134.12 3d23 n SER 47 Ca 0.39 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.94 3d23 n SER 47 Cb 0.51 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.92 3d23 n SER 47 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 3d23 h ASN 48 N 0.00 0.00 -1.35 -3.46 2.35 -1.80 -3.44 115.58 107.88 3d23 h ASN 48 Ca 0.00 0.00 0.39 0.00 -0.55 0.00 0.00 56.30 56.14 3d23 h ASN 48 Cb 0.00 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.32 3d23 h ASN 48 CO 0.00 0.55 1.02 -0.03 -1.65 0.00 0.00 177.43 177.32 3d23 h MET 49 N 0.00 0.00 0.00 0.81 4.05 -1.46 -1.86 114.93 116.48 3d23 h MET 49 Ca -0.10 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 3d23 h MET 49 Cb 1.51 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.31 3d23 h MET 49 CO 0.05 0.00 0.00 0.09 0.23 0.00 0.00 176.91 177.28 3d23 n ASN 50 N -4.00 0.00 -4.26 1.39 3.02 -1.26 -4.41 115.26 105.74 3d23 n ASN 50 Ca 0.30 0.40 -0.43 0.00 -0.03 0.00 0.00 54.58 54.81 3d23 n ASN 50 Cb 1.45 -0.20 -0.07 0.00 -0.61 0.00 0.00 39.78 40.35 3d23 n ASN 50 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3d23 s GLU 51 N -0.95 2.70 0.33 3.52 8.01 -1.00 -1.98 118.70 129.34 3d23 s GLU 51 Ca 0.00 -1.72 -0.21 0.00 0.01 0.00 0.00 54.97 53.05 3d23 s GLU 51 Cb 0.00 -4.08 -0.10 0.00 -4.31 0.00 0.00 34.13 25.65 3d23 s GLU 51 CO 0.00 -1.24 0.85 -2.14 0.01 0.00 0.00 175.26 172.74 3d23 s PRO 52 N 1.47 4.28 -0.47 0.39 0.02 -0.73 -4.78 135.00 135.17 3d23 s PRO 52 Ca 0.04 1.02 -0.17 0.00 0.02 0.00 0.00 61.00 61.91 3d23 s PRO 52 Cb -0.28 -2.56 0.05 0.00 0.02 0.00 0.00 34.50 31.73 3d23 s PRO 52 CO 0.01 0.19 0.49 0.34 -0.33 0.00 0.00 177.00 177.70 3d23 s ASP 53 N -1.93 6.19 -0.07 2.53 -1.08 -1.26 -5.00 116.67 116.06 3d23 s ASP 53 Ca 0.53 -0.99 -0.02 0.00 -0.52 0.00 0.00 52.55 51.56 3d23 s ASP 53 Cb -0.14 -2.23 -0.01 0.00 -1.46 0.00 0.00 42.92 39.08 3d23 s ASP 53 CO 0.19 -0.72 0.08 1.88 0.52 0.00 0.00 175.17 177.12 3d23 h TYR 54 N 8.83 -0.05 -1.17 -5.34 0.05 -1.99 0.15 116.97 117.46 3d23 h TYR 54 Ca -0.27 -0.00 0.35 0.00 0.05 0.00 0.00 58.73 58.85 3d23 h TYR 54 Cb 1.10 0.02 -0.11 0.00 1.01 0.00 0.00 36.73 38.75 3d23 h TYR 54 CO 0.67 -0.03 0.75 0.66 -1.05 0.00 0.00 178.16 179.16 3d23 h SER 55 N -0.76 0.35 0.69 3.88 4.64 -2.01 0.12 113.55 120.46 3d23 h SER 55 Ca -0.01 0.11 -0.26 0.00 -0.47 0.00 0.00 61.79 61.16 3d23 h SER 55 Cb 0.04 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.21 3d23 h SER 55 CO 0.01 -0.06 -1.21 0.00 -0.87 0.00 0.00 176.83 174.70 3d23 h ALA 56 N 1.62 0.14 -0.62 5.18 0.00 -1.99 -3.29 119.26 120.30 3d23 h ALA 56 Ca 0.71 -0.90 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 3d23 h ALA 56 Cb 2.03 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.78 3d23 h ALA 56 CO -0.37 1.03 0.19 -0.07 0.00 0.00 0.00 179.25 180.02 3d23 h LEU 57 N 0.06 0.87 -0.98 0.00 -0.00 0.13 -3.08 115.31 112.31 3d23 h LEU 57 Ca -0.12 -0.15 0.21 0.00 -0.00 0.00 0.00 57.88 57.82 3d23 h LEU 57 Cb 1.94 -0.23 -0.11 0.00 -0.00 0.00 0.00 40.66 42.26 3d23 h LEU 57 CO 0.19 0.82 0.57 -0.07 -0.00 0.00 0.00 178.44 179.96 3d23 h LEU 58 N 0.91 0.69 -0.91 1.67 3.38 -1.39 -2.77 115.31 116.89 3d23 h LEU 58 Ca 0.20 0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.21 3d23 h LEU 58 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3d23 h LEU 58 CO -0.01 0.19 -0.04 0.00 0.09 0.00 0.00 178.44 178.67 3d23 n ARG 60 N -4.20 0.06 -1.71 0.00 1.74 -1.04 -4.85 116.66 106.66 3d23 n ARG 60 Ca 0.02 0.05 -0.43 0.00 -0.77 0.00 0.00 57.85 56.73 3d23 n ARG 60 Cb 0.32 -1.57 -0.03 0.00 -1.02 0.00 0.00 32.46 30.16 3d23 n ARG 60 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3d23 s VAL 61 N -3.02 3.12 -0.17 1.55 1.01 -0.92 -5.00 120.40 116.96 3d23 s VAL 61 Ca 0.13 0.13 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 3d23 s VAL 61 Cb 0.17 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 3d23 s VAL 61 CO 0.54 -0.06 -0.04 0.42 0.00 0.00 0.00 175.10 175.96 3d23 s THR 62 N 6.56 3.71 0.14 3.92 -4.23 -1.26 -5.04 115.64 119.44 3d23 s THR 62 Ca 0.92 -0.41 -0.22 0.00 -1.18 0.00 0.00 61.69 60.80 3d23 s THR 62 Cb -0.35 -2.64 0.02 0.00 1.34 0.00 0.00 72.50 70.87 3d23 s THR 62 CO 0.36 0.47 1.23 0.18 -0.54 0.00 0.00 174.62 176.33 3d23 n LEU 63 N 3.87 -0.75 0.31 4.79 4.32 -1.26 -1.63 117.00 126.66 3d23 n LEU 63 Ca -0.18 1.41 0.14 0.00 -0.02 0.00 0.00 56.01 57.36 3d23 n LEU 63 Cb 0.52 -0.22 0.72 0.00 -1.62 0.00 0.00 43.42 42.82 3d23 n LEU 63 CO 0.32 -1.18 1.12 1.23 -1.22 0.00 0.00 177.39 177.65 3d23 h GLY 64 N 0.00 0.00 2.00 -0.72 0.00 -1.96 0.63 103.07 103.02 3d23 h GLY 64 Ca 0.17 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 3d23 h GLY 64 CO -0.76 0.00 -0.28 -0.55 0.00 0.00 0.00 176.54 174.95 3d23 h ASP 65 N 0.00 0.00 -4.00 0.19 3.32 -1.71 -3.43 116.42 110.79 3d23 h ASP 65 Ca 0.02 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.54 3d23 h ASP 65 Cb 0.86 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.50 3d23 h ASP 65 CO -0.00 0.28 0.57 -0.36 -1.72 0.00 0.00 179.24 178.01 3d23 s PHE 66 N -3.53 2.66 -0.22 4.55 0.08 0.22 -4.27 117.98 117.47 3d23 s PHE 66 Ca 0.01 1.44 -0.04 0.00 0.12 0.00 0.00 56.93 58.46 3d23 s PHE 66 Cb 0.10 -3.62 0.11 0.00 -0.57 0.00 0.00 43.02 39.04 3d23 s PHE 66 CO 0.66 -2.17 0.33 0.99 -0.10 0.00 0.00 175.22 174.93 3d23 s THR 67 N -1.37 -0.52 -0.22 0.64 2.01 -1.11 -4.95 115.64 110.12 3d23 s THR 67 Ca 0.64 -0.02 -0.01 0.00 0.31 0.00 0.00 61.69 62.61 3d23 s THR 67 Cb -0.36 -0.73 0.06 0.00 0.01 0.00 0.00 72.50 71.49 3d23 s THR 67 CO 0.44 -0.10 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.63 3d23 s ILE 68 N 2.49 1.09 -0.19 1.82 1.01 -1.26 -1.59 121.20 124.57 3d23 s ILE 68 Ca 0.09 -0.97 -0.09 0.00 0.00 0.00 0.00 60.65 59.68 3d23 s ILE 68 Cb -0.15 -1.48 -0.05 0.00 0.01 0.00 0.00 42.46 40.79 3d23 s ILE 68 CO -0.14 -0.17 0.12 -0.04 0.00 0.00 0.00 174.94 174.71 3d23 s MET 69 N 1.59 4.08 -0.46 2.79 -1.94 -0.95 -0.82 119.30 123.59 3d23 s MET 69 Ca -0.03 -0.23 -0.01 0.00 -1.71 0.00 0.00 55.69 53.71 3d23 s MET 69 Cb -0.18 -3.37 0.12 0.00 2.01 0.00 0.00 34.83 33.41 3d23 s MET 69 CO -0.08 0.35 0.24 0.45 -0.01 0.00 0.00 175.02 175.97 3d23 s SER 70 N 0.21 5.08 1.56 3.03 0.15 -0.81 -0.97 113.70 121.95 3d23 s SER 70 Ca 0.08 -2.33 0.00 0.00 0.70 0.00 0.00 55.95 54.40 3d23 s SER 70 Cb -0.11 -1.78 0.00 0.00 -1.71 0.00 0.00 66.02 62.42 3d23 s SER 70 CO -0.01 -0.45 0.00 0.61 1.20 0.00 0.00 173.24 174.59 3d23 n GLY 71 N 4.14 2.86 0.09 9.45 0.00 -1.26 -1.94 105.19 118.54 3d23 n GLY 71 Ca 0.02 -0.28 0.13 0.00 0.00 0.00 0.00 46.02 45.89 3d23 n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d23 n ARG 72 N 13.62 0.20 -1.51 1.61 3.00 -1.26 -4.90 116.66 127.42 3d23 n ARG 72 Ca 0.00 0.22 -0.31 0.00 -0.01 0.00 0.00 57.85 57.74 3d23 n ARG 72 Cb 0.00 -1.76 0.06 0.00 0.00 0.00 0.00 32.46 30.76 3d23 n ARG 72 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.63 179.04 3d23 s MET 73 N -3.12 2.72 -0.31 5.56 1.75 -0.82 -5.04 119.30 120.05 3d23 s MET 73 Ca 0.10 1.08 -0.03 0.00 -1.25 0.00 0.00 55.69 55.59 3d23 s MET 73 Cb 0.13 -1.96 0.11 0.00 2.84 0.00 0.00 34.83 35.95 3d23 s MET 73 CO 0.54 -1.28 0.15 0.45 -0.65 0.00 0.00 175.02 174.24 3d23 s SER 74 N -3.50 3.42 0.53 1.11 0.15 -1.26 -1.93 113.70 112.22 3d23 s SER 74 Ca 0.60 -1.58 -0.19 0.00 0.70 0.00 0.00 55.95 55.48 3d23 s SER 74 Cb -0.16 -0.41 -0.06 0.00 -1.71 0.00 0.00 66.02 63.68 3d23 s SER 74 CO 0.53 -0.40 1.07 -0.76 1.20 0.00 0.00 173.24 174.88 3d23 s LEU 75 N 1.76 3.71 -0.16 3.45 1.43 -0.00 -4.98 118.68 123.89 3d23 s LEU 75 Ca 0.12 1.96 -0.03 0.00 -1.03 0.00 0.00 54.13 55.14 3d23 s LEU 75 Cb -0.18 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.46 3d23 s LEU 75 CO -0.25 -1.02 -0.06 0.42 0.23 0.00 0.00 176.35 175.68 3d23 s THR 76 N -2.08 3.62 -0.29 5.49 -4.23 -1.26 -4.42 115.64 112.47 3d23 s THR 76 Ca 0.67 -0.45 -0.24 0.00 -1.18 0.00 0.00 61.69 60.50 3d23 s THR 76 Cb -0.18 -2.59 -0.00 0.00 1.34 0.00 0.00 72.50 71.07 3d23 s THR 76 CO 0.27 0.48 0.80 0.54 -0.54 0.00 0.00 174.62 176.17 3d23 s VAL 77 N 0.58 4.79 -0.00 2.29 0.11 -1.26 -1.86 120.40 125.04 3d23 s VAL 77 Ca -0.04 1.27 -0.04 0.00 -2.93 0.00 0.00 61.98 60.25 3d23 s VAL 77 Cb -0.15 -4.15 -0.02 0.00 -1.53 0.00 0.00 36.38 30.54 3d23 s VAL 77 CO 0.03 -0.22 0.54 0.58 -3.33 0.00 0.00 175.10 172.70 3d23 h VAL 78 N 5.57 0.00 -4.23 2.04 2.07 -1.00 -3.48 116.25 117.22 3d23 h VAL 78 Ca -0.24 -0.10 -0.38 0.00 0.82 0.00 0.00 66.70 66.80 3d23 h VAL 78 Cb 1.09 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.77 3d23 h VAL 78 CO 0.88 0.00 -0.35 -1.54 0.02 0.00 0.00 177.57 176.58 3d23 n SER 79 N -2.62 -0.00 -3.67 0.57 3.41 -1.20 -5.01 113.62 105.10 3d23 n SER 79 Ca -0.02 -2.64 -0.14 0.00 -0.26 0.00 0.00 58.87 55.81 3d23 n SER 79 Cb 0.05 1.10 -0.08 0.00 -0.26 0.00 0.00 64.21 65.02 3d23 n SER 79 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 3d23 s TYR 80 N -2.92 -0.61 0.05 7.33 1.13 -1.26 -0.32 117.35 120.75 3d23 s TYR 80 Ca 0.25 1.45 0.03 0.00 -1.41 0.00 0.00 57.07 57.40 3d23 s TYR 80 Cb 0.01 0.22 -0.03 0.00 -1.10 0.00 0.00 41.96 41.07 3d23 s TYR 80 CO 0.18 -0.33 -0.09 1.14 -2.51 0.00 0.00 175.55 173.94 3d23 s GLN 81 N 0.12 0.61 -0.23 -3.49 -2.07 0.83 -4.97 119.66 110.46 3d23 s GLN 81 Ca -0.01 -0.85 -0.17 0.00 -1.82 0.00 0.00 55.36 52.50 3d23 s GLN 81 Cb -0.04 -0.39 -0.03 0.00 -1.09 0.00 0.00 33.01 31.46 3d23 s GLN 81 CO 0.02 0.07 0.49 1.41 -1.32 0.00 0.00 175.29 175.95 3d23 s MET 82 N -1.81 4.12 -0.18 9.60 -2.45 -1.26 0.42 119.30 127.73 3d23 s MET 82 Ca -0.06 0.31 0.00 0.00 -1.25 0.00 0.00 55.69 54.68 3d23 s MET 82 Cb -0.09 -3.61 0.04 0.00 1.25 0.00 0.00 34.83 32.43 3d23 s MET 82 CO 0.00 -0.23 -0.07 -1.14 1.05 0.00 0.00 175.02 174.63 3d23 s GLN 83 N 1.93 1.65 1.82 4.11 0.74 0.06 -4.97 119.66 125.00 3d23 s GLN 83 Ca 0.21 -0.67 0.00 0.00 0.05 0.00 0.00 55.36 54.95 3d23 s GLN 83 Cb -0.15 -2.21 0.00 0.00 1.10 0.00 0.00 33.01 31.75 3d23 s GLN 83 CO 0.09 -0.45 0.00 0.41 -0.55 0.00 0.00 175.29 174.79 3d23 n GLY 84 N 4.79 2.30 1.45 2.59 0.00 -1.26 -1.19 105.19 113.86 3d23 n GLY 84 Ca -0.13 0.39 0.11 0.00 0.00 0.00 0.00 46.02 46.39 3d23 n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d23 s GLN 86 N -1.29 2.08 -0.05 0.00 -2.07 -0.33 -0.36 119.66 117.63 3d23 s GLN 86 Ca 0.50 -1.46 -0.12 0.00 -1.82 0.00 0.00 55.36 52.46 3d23 s GLN 86 Cb 0.28 -2.07 -0.05 0.00 -1.09 0.00 0.00 33.01 30.08 3d23 s GLN 86 CO 0.31 0.38 0.31 -0.51 -1.32 0.00 0.00 175.29 174.46 3d23 s LEU 87 N -3.38 4.42 -0.35 2.60 1.43 -0.05 -0.76 118.68 122.60 3d23 s LEU 87 Ca 0.29 0.76 0.01 0.00 -1.03 0.00 0.00 54.13 54.17 3d23 s LEU 87 Cb -0.07 -2.40 0.09 0.00 0.03 0.00 0.00 46.19 43.84 3d23 s LEU 87 CO 0.17 0.33 0.07 -0.69 0.23 0.00 0.00 176.35 176.46 3d23 s VAL 88 N -0.90 2.65 -0.20 -1.59 1.01 0.17 -1.87 120.40 119.68 3d23 s VAL 88 Ca 0.20 -2.08 -0.12 0.00 0.00 0.00 0.00 61.98 59.98 3d23 s VAL 88 Cb -0.15 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.36 3d23 s VAL 88 CO 0.09 -0.52 0.23 -0.76 0.00 0.00 0.00 175.10 174.15 3d23 s LEU 89 N 1.03 4.19 -0.00 3.92 1.43 -0.68 -0.12 118.68 128.45 3d23 s LEU 89 Ca 0.06 0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 53.21 3d23 s LEU 89 Cb -0.20 -2.25 -0.03 0.00 0.03 0.00 0.00 46.19 43.73 3d23 s LEU 89 CO -0.06 0.09 0.92 -0.89 0.23 0.00 0.00 176.35 176.64 3d23 s THR 90 N 0.71 4.87 0.35 5.49 2.01 0.56 -1.01 115.64 128.63 3d23 s THR 90 Ca 0.12 1.94 0.08 0.00 0.31 0.00 0.00 61.69 64.14 3d23 s THR 90 Cb -0.13 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 3d23 s THR 90 CO 0.03 0.19 0.19 0.68 -0.69 0.00 0.00 174.62 175.02 3d23 s VAL 91 N 0.87 3.01 0.09 3.82 -7.23 0.19 -0.38 120.40 120.78 3d23 s VAL 91 Ca 0.49 -1.61 -0.13 0.00 -1.81 0.00 0.00 61.98 58.91 3d23 s VAL 91 Cb -0.21 -3.02 -0.20 0.00 0.56 0.00 0.00 36.38 33.52 3d23 s VAL 91 CO 0.26 -0.15 1.24 0.77 -0.31 0.00 0.00 175.10 176.91 3d23 h SER 92 N 1.45 0.93 -3.68 4.85 4.64 -1.67 -3.43 113.55 116.63 3d23 h SER 92 Ca -0.44 -0.69 -0.58 0.00 -0.47 0.00 0.00 61.79 59.62 3d23 h SER 92 Cb 1.25 -0.28 -0.09 0.00 -0.31 0.00 0.00 62.40 62.98 3d23 h SER 92 CO 0.63 1.49 0.75 -0.22 -0.87 0.00 0.00 176.83 178.61 3d23 s LEU 93 N -8.23 3.83 0.21 5.97 2.96 -1.26 -5.03 118.68 117.13 3d23 s LEU 93 Ca -0.10 0.31 -0.32 0.00 -0.22 0.00 0.00 54.13 53.80 3d23 s LEU 93 Cb 0.08 -3.37 -0.13 0.00 0.50 0.00 0.00 46.19 43.27 3d23 s LEU 93 CO 0.92 -1.14 1.66 1.67 -1.32 0.00 0.00 176.35 178.13 3d23 n GLN 94 N 7.48 2.58 -2.45 1.98 -0.06 -1.26 -4.68 117.38 120.97 3d23 n GLN 94 Ca 0.09 0.93 -0.43 0.00 -2.00 0.00 0.00 57.00 55.59 3d23 n GLN 94 Cb 0.49 -2.74 -0.02 0.00 -4.06 0.00 0.00 30.24 23.91 3d23 n GLN 94 CO 0.00 0.00 0.00 1.21 -0.20 0.00 0.00 177.06 178.07 3d23 s ASN 95 N 0.98 6.60 0.55 1.69 3.04 -0.26 -4.91 114.94 122.62 3d23 s ASN 95 Ca 0.74 0.99 0.25 0.00 0.04 0.00 0.00 52.86 54.87 3d23 s ASN 95 Cb -0.55 -2.54 1.45 0.00 -1.54 0.00 0.00 41.25 38.07 3d23 s ASN 95 CO 0.37 -1.18 2.05 1.55 -3.04 0.00 0.00 177.10 176.85 3d23 h PRO 96 N 9.56 0.00 -0.63 0.43 0.13 -1.92 -2.12 132.00 137.45 3d23 h PRO 96 Ca -0.26 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.66 3d23 h PRO 96 Cb 1.09 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.09 3d23 h PRO 96 CO 1.06 0.00 0.22 0.66 -0.23 0.00 0.00 178.00 179.71 3d23 n TYR 97 N -4.22 2.08 -1.57 1.56 4.01 -1.26 -4.97 117.16 112.78 3d23 n TYR 97 Ca 0.05 -1.31 -0.43 0.00 -0.16 0.00 0.00 57.90 56.05 3d23 n TYR 97 Cb 0.42 -0.63 -0.04 0.00 -0.31 0.00 0.00 39.34 38.78 3d23 n TYR 97 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 3d23 n THR 98 N -0.52 0.25 -0.76 -0.72 -1.04 -0.80 -4.84 114.28 105.86 3d23 n THR 98 Ca 0.39 -0.49 -0.30 0.00 -2.04 0.00 0.00 64.05 61.61 3d23 n THR 98 Cb 1.29 -2.48 0.20 0.00 -1.82 0.00 0.00 70.33 67.52 3d23 n THR 98 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 3d23 s PRO 99 N 6.70 0.24 0.19 -2.82 0.04 -1.26 -4.95 135.00 133.14 3d23 s PRO 99 Ca 1.02 1.06 -0.30 0.00 0.04 0.00 0.00 61.00 62.81 3d23 s PRO 99 Cb -0.38 -1.67 -0.09 0.00 0.04 0.00 0.00 34.50 32.40 3d23 s PRO 99 CO 0.35 -3.00 1.39 0.21 0.04 0.00 0.00 177.00 175.99 3d23 s LYS 100 N -4.64 4.32 0.10 4.56 2.20 -1.26 -4.99 119.74 120.02 3d23 s LYS 100 Ca 0.67 2.16 -0.15 0.00 -0.36 0.00 0.00 55.97 58.28 3d23 s LYS 100 Cb -0.22 -3.18 0.03 0.00 -1.51 0.00 0.00 37.83 32.95 3d23 s LYS 100 CO 0.60 -0.37 0.37 1.52 -0.36 0.00 0.00 175.35 177.11 3d23 s TYR 101 N 0.38 -0.17 0.43 4.03 1.13 -1.26 -2.17 117.35 119.73 3d23 s TYR 101 Ca 0.60 -0.09 0.03 0.00 -1.41 0.00 0.00 57.07 56.20 3d23 s TYR 101 Cb -0.39 0.20 -0.02 0.00 -1.10 0.00 0.00 41.96 40.65 3d23 s TYR 101 CO 0.37 -0.64 0.09 0.95 -2.51 0.00 0.00 175.55 173.82 3d23 s THR 102 N -3.43 0.78 -0.10 -3.49 -4.23 0.32 -4.92 115.64 100.58 3d23 s THR 102 Ca 0.01 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.51 3d23 s THR 102 Cb 0.01 -2.34 -0.03 0.00 1.34 0.00 0.00 72.50 71.48 3d23 s THR 102 CO -0.09 0.00 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.58 3d23 s PHE 103 N -3.13 3.01 0.00 3.99 0.08 -1.26 -1.60 117.98 119.07 3d23 s PHE 103 Ca 0.21 -0.06 0.00 0.00 0.12 0.00 0.00 56.93 57.19 3d23 s PHE 103 Cb 0.03 -1.81 0.00 0.00 -0.57 0.00 0.00 43.02 40.67 3d23 s PHE 103 CO 0.12 0.23 0.00 0.41 -0.10 0.00 0.00 175.22 175.88 3d23 n GLY 104 N 2.66 3.65 3.05 4.36 0.00 0.42 -4.94 105.19 114.39 3d23 n GLY 104 Ca -0.18 -1.20 -0.12 0.00 0.00 0.00 0.00 46.02 44.52 3d23 n GLY 104 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3d23 s ASN 105 N 0.43 -0.26 -0.01 1.61 3.84 -1.26 -4.18 114.94 115.11 3d23 s ASN 105 Ca 0.00 0.52 -0.01 0.00 0.21 0.00 0.00 52.86 53.58 3d23 s ASN 105 Cb 0.00 0.41 -0.04 0.00 -0.55 0.00 0.00 41.25 41.07 3d23 s ASN 105 CO 0.00 -0.16 0.09 0.54 -2.79 0.00 0.00 177.10 174.78 3d23 s VAL 106 N 1.23 4.82 0.25 -5.21 0.11 -1.26 -5.11 120.40 115.23 3d23 s VAL 106 Ca -0.09 -0.35 0.08 0.00 -2.93 0.00 0.00 61.98 58.69 3d23 s VAL 106 Cb -0.10 -3.20 -0.04 0.00 -1.53 0.00 0.00 36.38 31.51 3d23 s VAL 106 CO -0.08 0.37 0.13 -0.54 -3.33 0.00 0.00 175.10 171.65 3d23 s LYS 107 N -1.69 2.72 0.01 1.54 -0.14 -1.26 -5.04 119.74 115.89 3d23 s LYS 107 Ca 0.22 -1.16 -0.38 0.00 -1.36 0.00 0.00 55.97 53.30 3d23 s LYS 107 Cb -0.12 -2.44 -0.17 0.00 -1.68 0.00 0.00 37.83 33.42 3d23 s LYS 107 CO 0.13 0.39 1.37 -2.30 -0.76 0.00 0.00 175.35 174.19 3d23 n PRO 108 N -1.05 0.97 0.00 -1.68 -0.02 -1.26 -1.58 135.00 130.38 3d23 n PRO 108 Ca -0.07 0.35 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3d23 n PRO 108 Cb 0.58 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 3d23 n PRO 108 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d23 n GLY 109 N 2.66 3.02 3.77 -1.23 0.00 0.26 -4.98 105.19 108.68 3d23 n GLY 109 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 3d23 n GLY 109 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d23 s GLU 110 N -0.04 3.89 0.33 1.61 2.02 -0.61 -4.53 118.70 121.36 3d23 s GLU 110 Ca 0.00 2.06 0.09 0.00 0.02 0.00 0.00 54.97 57.13 3d23 s GLU 110 Cb 0.00 -2.66 -0.05 0.00 0.10 0.00 0.00 34.13 31.52 3d23 s GLU 110 CO 0.00 -0.53 0.06 0.95 0.02 0.00 0.00 175.26 175.77 3d23 s THR 111 N -1.33 2.89 0.19 3.63 -4.23 -1.26 -1.54 115.64 113.98 3d23 s THR 111 Ca 0.59 -1.85 -0.24 0.00 -1.18 0.00 0.00 61.69 59.01 3d23 s THR 111 Cb -0.36 -2.88 0.05 0.00 1.34 0.00 0.00 72.50 70.66 3d23 s THR 111 CO 0.45 -0.21 0.91 0.72 -0.54 0.00 0.00 174.62 175.94 3d23 s PHE 112 N -2.46 -0.14 0.01 3.99 -0.12 0.26 -4.92 117.98 114.61 3d23 s PHE 112 Ca 0.36 -0.21 -0.10 0.00 -0.05 0.00 0.00 56.93 56.93 3d23 s PHE 112 Cb -0.02 0.66 -0.05 0.00 -0.63 0.00 0.00 43.02 42.98 3d23 s PHE 112 CO 0.21 -0.93 0.32 0.99 -0.05 0.00 0.00 175.22 175.76 3d23 s THR 113 N -3.40 5.20 -0.08 -4.49 2.01 -0.15 -1.10 115.64 113.63 3d23 s THR 113 Ca 0.12 0.43 0.01 0.00 0.31 0.00 0.00 61.69 62.56 3d23 s THR 113 Cb -0.02 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 3d23 s THR 113 CO 0.04 0.43 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.60 3d23 s VAL 114 N -1.23 3.36 -0.36 3.82 1.01 0.40 -0.52 120.40 126.87 3d23 s VAL 114 Ca 0.26 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 3d23 s VAL 114 Cb -0.14 -2.37 0.06 0.00 0.00 0.00 0.00 36.38 33.93 3d23 s VAL 114 CO 0.14 0.57 0.13 -0.22 0.00 0.00 0.00 175.10 175.73 3d23 s LEU 115 N -0.45 4.57 -0.01 3.92 2.96 -0.19 -1.65 118.68 127.83 3d23 s LEU 115 Ca 0.06 -1.40 -0.27 0.00 -0.22 0.00 0.00 54.13 52.30 3d23 s LEU 115 Cb -0.12 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 3d23 s LEU 115 CO 0.02 -0.40 0.85 0.00 -1.32 0.00 0.00 176.35 175.50 3d23 s ALA 116 N 1.33 3.26 0.16 5.97 0.00 0.10 -3.07 121.76 129.51 3d23 s ALA 116 Ca 0.00 0.36 0.03 0.00 0.00 0.00 0.00 51.96 52.36 3d23 s ALA 116 Cb -0.21 -3.15 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 3d23 s ALA 116 CO 0.01 -0.13 -0.05 0.00 0.00 0.00 0.00 175.76 175.59 3d23 s ALA 117 N 0.71 1.40 -0.13 0.00 0.00 -1.26 -0.15 121.76 122.33 3d23 s ALA 117 Ca 0.45 -1.54 -0.05 0.00 0.00 0.00 0.00 51.96 50.81 3d23 s ALA 117 Cb -0.20 0.27 0.06 0.00 0.00 0.00 0.00 23.12 23.26 3d23 s ALA 117 CO 0.24 -0.21 0.28 0.71 0.00 0.00 0.00 175.76 176.79 3d23 s TYR 118 N -3.48 -0.46 -1.43 0.00 2.02 -1.17 -4.24 117.35 108.60 3d23 s TYR 118 Ca 0.20 1.01 0.00 0.00 -0.37 0.00 0.00 57.07 57.91 3d23 s TYR 118 Cb 0.04 0.02 0.00 0.00 -0.40 0.00 0.00 41.96 41.63 3d23 s TYR 118 CO 0.02 -0.35 0.00 -1.71 -1.57 0.00 0.00 175.55 171.94 3d23 n ASN 119 N 5.13 -4.79 0.00 2.29 2.85 -1.26 -1.94 115.26 117.54 3d23 n ASN 119 Ca -0.10 0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 3d23 n ASN 119 Cb 0.50 -3.87 0.00 0.00 1.24 0.00 0.00 39.78 37.65 3d23 n ASN 119 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3d23 n GLY 120 N -1.02 1.12 3.17 8.20 0.00 -1.26 -4.62 105.19 110.79 3d23 n GLY 120 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.49 3d23 n GLY 120 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3d23 s ARG 121 N -0.32 2.39 0.38 1.61 3.52 -0.82 -4.26 118.95 121.45 3d23 s ARG 121 Ca 0.00 -1.31 -0.27 0.00 -0.13 0.00 0.00 55.73 54.02 3d23 s ARG 121 Cb 0.00 -3.20 -0.11 0.00 -1.56 0.00 0.00 34.95 30.07 3d23 s ARG 121 CO 0.00 -0.65 1.30 -2.30 -0.81 0.00 0.00 175.30 172.84 3d23 n PRO 122 N 4.62 2.09 0.00 5.12 -0.02 -1.26 -3.03 135.00 142.52 3d23 n PRO 122 Ca -0.12 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 3d23 n PRO 122 Cb 0.43 -2.37 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 3d23 n PRO 122 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 3d23 n GLN 123 N 0.35 0.00 -2.49 -0.52 -0.06 0.79 -4.94 117.38 110.51 3d23 n GLN 123 Ca 0.05 0.00 -0.00 0.00 -2.00 0.00 0.00 57.00 55.05 3d23 n GLN 123 Cb 0.38 -0.96 0.01 0.00 -4.06 0.00 0.00 30.24 25.60 3d23 n GLN 123 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3d23 n GLY 124 N 3.42 0.76 3.12 1.69 0.00 -1.12 -5.03 105.19 108.03 3d23 n GLY 124 Ca 0.00 -0.96 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 3d23 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d23 s ALA 125 N -1.38 0.12 0.10 4.61 0.00 -1.26 -0.72 121.76 123.24 3d23 s ALA 125 Ca 0.10 -0.81 -0.14 0.00 0.00 0.00 0.00 51.96 51.10 3d23 s ALA 125 Cb -0.01 0.30 0.03 0.00 0.00 0.00 0.00 23.12 23.44 3d23 s ALA 125 CO 0.01 -0.37 0.34 -0.59 0.00 0.00 0.00 175.76 175.15 3d23 s PHE 126 N -3.31 -0.12 -0.18 0.00 -0.71 -0.66 -4.96 117.98 108.05 3d23 s PHE 126 Ca 0.01 -0.18 -0.09 0.00 -1.04 0.00 0.00 56.93 55.62 3d23 s PHE 126 Cb 0.03 0.16 -0.05 0.00 -1.21 0.00 0.00 43.02 41.96 3d23 s PHE 126 CO -0.08 -0.63 0.14 -1.58 -1.34 0.00 0.00 175.22 171.72 3d23 s HIS 127 N -3.57 3.47 0.16 3.49 5.65 -1.26 -0.46 115.29 122.77 3d23 s HIS 127 Ca 0.02 0.39 0.02 0.00 0.25 0.00 0.00 55.06 55.75 3d23 s HIS 127 Cb 0.02 -2.10 -0.05 0.00 -1.18 0.00 0.00 32.58 29.28 3d23 s HIS 127 CO -0.10 0.42 -0.03 0.14 -0.65 0.00 0.00 174.74 174.52 3d23 s VAL 128 N -0.05 0.82 -0.10 0.89 -7.23 -0.26 -4.98 120.40 109.48 3d23 s VAL 128 Ca 0.10 -1.99 0.04 0.00 -1.81 0.00 0.00 61.98 58.32 3d23 s VAL 128 Cb -0.11 -1.99 -0.00 0.00 0.56 0.00 0.00 36.38 34.84 3d23 s VAL 128 CO -0.00 -0.60 -0.23 -0.89 -0.31 0.00 0.00 175.10 173.06 3d23 s THR 129 N -3.56 2.12 0.05 5.32 2.01 -1.26 -0.57 115.64 119.74 3d23 s THR 129 Ca 0.20 -1.00 -0.31 0.00 0.31 0.00 0.00 61.69 60.90 3d23 s THR 129 Cb 0.05 -1.81 -0.06 0.00 0.01 0.00 0.00 72.50 70.69 3d23 s THR 129 CO 0.02 0.56 1.36 -0.32 -0.69 0.00 0.00 174.62 175.55 3d23 s MET 130 N 0.36 4.32 0.44 4.92 1.75 -0.59 -4.57 119.30 125.92 3d23 s MET 130 Ca -0.18 1.97 0.01 0.00 -1.25 0.00 0.00 55.69 56.23 3d23 s MET 130 Cb -0.18 -3.43 -0.00 0.00 2.84 0.00 0.00 34.83 34.06 3d23 s MET 130 CO 0.08 -0.48 0.66 1.03 -0.65 0.00 0.00 175.02 175.66 3d23 s ARG 131 N 1.77 3.07 0.36 4.11 0.52 -0.57 -0.57 118.95 127.64 3d23 s ARG 131 Ca 0.63 -0.53 0.18 0.00 -0.52 0.00 0.00 55.73 55.49 3d23 s ARG 131 Cb -0.33 -2.58 1.21 0.00 0.52 0.00 0.00 34.95 33.78 3d23 s ARG 131 CO 0.28 -0.25 1.63 0.77 0.02 0.00 0.00 175.30 177.75 3d23 h SER 132 N 0.44 0.42 0.00 0.23 0.02 -1.88 0.20 113.55 112.98 3d23 h SER 132 Ca -0.46 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 3d23 h SER 132 Cb 1.25 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.98 3d23 h SER 132 CO 0.57 -0.25 0.00 -1.54 -1.14 0.00 0.00 176.83 174.47 3d23 n SER 133 N -5.09 0.00 -3.53 3.07 3.41 -1.26 -4.89 113.62 105.32 3d23 n SER 133 Ca 0.34 -1.16 -0.21 0.00 -0.26 0.00 0.00 58.87 57.59 3d23 n SER 133 Cb 1.13 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 65.17 3d23 n SER 133 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3d23 n TYR 134 N -0.89 -2.59 -4.24 7.33 4.02 0.71 -4.75 117.16 116.75 3d23 n TYR 134 Ca 0.18 0.98 -0.13 0.00 -0.01 0.00 0.00 57.90 58.92 3d23 n TYR 134 Cb 0.08 -5.06 -0.10 0.00 -0.02 0.00 0.00 39.34 34.24 3d23 n TYR 134 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3d23 s THR 135 N -3.34 0.78 0.22 -0.72 -4.23 -1.26 -4.59 115.64 102.50 3d23 s THR 135 Ca 0.34 -1.99 0.07 0.00 -1.18 0.00 0.00 61.69 58.93 3d23 s THR 135 Cb -0.15 -2.04 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 3d23 s THR 135 CO 0.73 -0.56 -0.11 0.27 -0.54 0.00 0.00 174.62 174.42 3d23 s ILE 136 N -3.59 1.62 -0.93 2.99 -4.36 0.28 -1.51 121.20 115.71 3d23 s ILE 136 Ca 0.22 -2.16 -0.14 0.00 -0.26 0.00 0.00 60.65 58.30 3d23 s ILE 136 Cb 0.05 -2.17 0.20 0.00 1.25 0.00 0.00 42.46 41.80 3d23 s ILE 136 CO 0.03 -0.50 0.96 -0.54 0.24 0.00 0.00 174.94 175.12 3d23 s LYS 137 N -3.69 3.74 0.00 0.37 1.02 -1.26 0.14 119.74 120.05 3d23 s LYS 137 Ca 0.25 -2.43 0.00 0.00 0.02 0.00 0.00 55.97 53.81 3d23 s LYS 137 Cb 0.01 -4.61 0.00 0.00 -0.52 0.00 0.00 37.83 32.71 3d23 s LYS 137 CO 0.08 -1.43 0.00 0.41 -0.92 0.00 0.00 175.35 173.49 3d23 n GLY 138 N 4.14 3.97 2.73 -3.33 0.00 -1.26 -4.96 105.19 106.48 3d23 n GLY 138 Ca 0.20 -2.14 -0.29 0.00 0.00 0.00 0.00 46.02 43.79 3d23 n GLY 138 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d23 s SER 139 N -0.64 3.71 -0.04 1.61 0.15 -1.26 -4.96 113.70 112.27 3d23 s SER 139 Ca 0.00 -1.38 -0.00 0.00 0.70 0.00 0.00 55.95 55.26 3d23 s SER 139 Cb 0.00 -0.78 0.03 0.00 -1.71 0.00 0.00 66.02 63.55 3d23 s SER 139 CO 0.00 -0.38 0.02 -0.36 1.20 0.00 0.00 173.24 173.72 3d23 s PHE 140 N 1.69 0.27 0.46 3.44 0.08 -1.26 -5.03 117.98 117.64 3d23 s PHE 140 Ca 0.06 0.05 0.07 0.00 0.12 0.00 0.00 56.93 57.24 3d23 s PHE 140 Cb -0.17 -0.46 0.00 0.00 -0.57 0.00 0.00 43.02 41.82 3d23 s PHE 140 CO -0.21 -0.17 0.43 -0.51 -0.10 0.00 0.00 175.22 174.67 3d23 s LEU 141 N 1.44 3.21 0.23 -0.37 1.43 -1.26 -5.02 118.68 118.34 3d23 s LEU 141 Ca -0.04 -0.87 -0.31 0.00 -1.03 0.00 0.00 54.13 51.88 3d23 s LEU 141 Cb -0.13 -1.82 -0.14 0.00 0.03 0.00 0.00 46.19 44.13 3d23 s LEU 141 CO -0.03 -0.83 1.24 0.00 0.23 0.00 0.00 176.35 176.97 3d23 n GLY 143 N 1.82 0.66 0.05 0.00 0.00 -1.26 -4.93 105.19 101.53 3d23 n GLY 143 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 3d23 n GLY 143 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d23 n SER 144 N 0.00 0.53 -4.76 1.61 3.41 -0.31 -4.22 113.62 109.89 3d23 n SER 144 Ca 0.00 0.32 -0.39 0.00 -0.26 0.00 0.00 58.87 58.54 3d23 n SER 144 Cb 0.00 -0.33 0.02 0.00 -0.26 0.00 0.00 64.21 63.64 3d23 n SER 144 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d23 n GLY 146 N 0.63 1.03 3.71 0.00 0.00 0.88 -1.36 105.19 110.08 3d23 n GLY 146 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3d23 n GLY 146 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d23 n SER 147 N 0.00 2.55 -4.68 1.61 7.64 -0.53 -4.34 113.62 115.87 3d23 n SER 147 Ca 0.00 1.07 -0.33 0.00 1.01 0.00 0.00 58.87 60.63 3d23 n SER 147 Cb 0.00 -1.52 -0.09 0.00 -1.01 0.00 0.00 64.21 61.60 3d23 n SER 147 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3d23 s VAL 148 N -1.23 4.14 0.07 0.44 -7.23 -1.18 0.83 120.40 116.25 3d23 s VAL 148 Ca 0.63 -0.57 0.04 0.00 -1.81 0.00 0.00 61.98 60.26 3d23 s VAL 148 Cb -0.48 -2.83 -0.04 0.00 0.56 0.00 0.00 36.38 33.58 3d23 s VAL 148 CO 0.56 0.40 0.03 -0.83 -0.31 0.00 0.00 175.10 174.95 3d23 s GLY 149 N -1.48 1.95 -0.00 2.32 0.00 0.37 -1.02 107.32 109.46 3d23 s GLY 149 Ca 0.19 -1.05 -0.29 0.00 0.00 0.00 0.00 44.72 43.57 3d23 s GLY 149 CO 0.09 -1.01 0.66 -2.52 0.00 0.00 0.00 173.10 170.32 3d23 s TYR 150 N -1.30 -0.63 0.05 1.90 1.13 0.32 -1.87 117.35 116.95 3d23 s TYR 150 Ca 0.26 0.94 0.07 0.00 -1.41 0.00 0.00 57.07 56.93 3d23 s TYR 150 Cb -0.12 0.44 -0.03 0.00 -1.10 0.00 0.00 41.96 41.16 3d23 s TYR 150 CO 0.18 -0.67 -0.20 0.54 -2.51 0.00 0.00 175.55 172.90 3d23 s VAL 151 N -1.80 1.58 -0.36 -3.49 0.11 -0.22 -0.98 120.40 115.25 3d23 s VAL 151 Ca -0.08 -1.22 -0.17 0.00 -2.93 0.00 0.00 61.98 57.58 3d23 s VAL 151 Cb -0.00 -1.40 -0.00 0.00 -1.53 0.00 0.00 36.38 33.45 3d23 s VAL 151 CO 0.05 0.13 0.44 -0.76 -3.33 0.00 0.00 175.10 171.63 3d23 s LEU 152 N -1.29 4.46 -0.44 2.54 1.43 -1.26 -1.04 118.68 123.08 3d23 s LEU 152 Ca 0.06 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 52.99 3d23 s LEU 152 Cb -0.09 -2.46 0.12 0.00 0.03 0.00 0.00 46.19 43.79 3d23 s LEU 152 CO 0.02 -0.45 0.17 -0.89 0.23 0.00 0.00 176.35 175.44 3d23 s THR 153 N 2.22 2.40 0.00 5.49 2.01 -0.01 -5.00 115.64 122.75 3d23 s THR 153 Ca 0.15 -2.88 0.00 0.00 0.31 0.00 0.00 61.69 59.27 3d23 s THR 153 Cb -0.16 -2.72 0.00 0.00 0.01 0.00 0.00 72.50 69.63 3d23 s THR 153 CO 0.13 -0.72 0.00 0.61 -0.69 0.00 0.00 174.62 173.95 3d23 n GLY 154 N 3.60 0.56 0.66 4.40 0.00 -1.26 -2.28 105.19 110.87 3d23 n GLY 154 Ca 0.05 -0.65 0.04 0.00 0.00 0.00 0.00 46.02 45.45 3d23 n GLY 154 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3d23 n ASP 155 N 6.99 1.86 -4.19 1.61 5.68 -1.26 -4.90 116.55 122.34 3d23 n ASP 155 Ca 0.00 -2.09 -0.20 0.00 -0.50 0.00 0.00 54.79 52.01 3d23 n ASP 155 Cb 0.00 -0.28 -0.12 0.00 -1.14 0.00 0.00 41.12 39.57 3d23 n ASP 155 CO 0.00 0.00 0.00 -0.55 -1.33 0.00 0.00 177.20 175.32 3d23 s SER 156 N -0.83 1.83 -0.28 -1.12 0.15 -0.97 -4.60 113.70 107.88 3d23 s SER 156 Ca 0.20 -0.60 -0.10 0.00 0.70 0.00 0.00 55.95 56.15 3d23 s SER 156 Cb 0.12 -0.07 -0.03 0.00 -1.71 0.00 0.00 66.02 64.32 3d23 s SER 156 CO 0.12 -0.04 0.14 -0.69 1.20 0.00 0.00 173.24 173.97 3d23 s VAL 157 N -1.19 4.81 -0.51 4.45 1.01 -0.92 -0.83 120.40 127.23 3d23 s VAL 157 Ca 0.00 -0.10 -0.16 0.00 0.00 0.00 0.00 61.98 61.72 3d23 s VAL 157 Cb -0.10 -3.33 0.09 0.00 0.00 0.00 0.00 36.38 33.05 3d23 s VAL 157 CO 0.02 0.22 0.47 -0.75 0.00 0.00 0.00 175.10 175.07 3d23 s LYS 158 N 1.68 3.00 0.27 2.72 2.20 -0.21 -0.52 119.74 128.88 3d23 s LYS 158 Ca 0.06 -1.44 -0.30 0.00 -0.36 0.00 0.00 55.97 53.94 3d23 s LYS 158 Cb -0.16 -4.20 -0.09 0.00 -1.51 0.00 0.00 37.83 31.87 3d23 s LYS 158 CO 0.07 -1.18 1.06 -0.06 -0.36 0.00 0.00 175.35 174.88 3d23 s PHE 159 N 1.78 3.67 0.00 4.03 0.08 -0.63 -1.06 117.98 125.86 3d23 s PHE 159 Ca 0.05 1.75 0.00 0.00 0.12 0.00 0.00 56.93 58.85 3d23 s PHE 159 Cb -0.26 -3.22 0.00 0.00 -0.57 0.00 0.00 43.02 38.98 3d23 s PHE 159 CO 0.06 -0.32 0.00 0.28 -0.10 0.00 0.00 175.22 175.14 3d23 n VAL 160 N 1.26 0.00 -3.81 -0.44 0.31 -0.78 -0.43 118.33 114.43 3d23 n VAL 160 Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.19 3d23 n VAL 160 Cb 0.45 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.28 3d23 n VAL 160 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 3d23 s TYR 161 N -0.60 -0.17 -0.07 3.52 5.04 -1.06 -4.38 117.35 119.64 3d23 s TYR 161 Ca 0.00 0.37 -0.00 0.00 -2.44 0.00 0.00 57.07 55.00 3d23 s TYR 161 Cb 0.00 0.05 0.02 0.00 0.35 0.00 0.00 41.96 42.39 3d23 s TYR 161 CO 0.00 -0.21 -0.03 1.41 -1.34 0.00 0.00 175.55 175.38 3d23 s MET 162 N -0.50 0.87 0.11 4.97 -2.45 -0.08 -0.48 119.30 121.74 3d23 s MET 162 Ca -0.06 -0.05 -0.30 0.00 -1.25 0.00 0.00 55.69 54.02 3d23 s MET 162 Cb -0.04 -1.02 -0.07 0.00 1.25 0.00 0.00 34.83 34.95 3d23 s MET 162 CO 0.01 -0.19 1.20 -1.58 1.05 0.00 0.00 175.02 175.51 3d23 s HIS 163 N 1.45 3.44 0.00 4.11 2.46 0.24 -2.54 115.29 124.46 3d23 s HIS 163 Ca -0.02 1.35 0.00 0.00 0.47 0.00 0.00 55.06 56.85 3d23 s HIS 163 Cb -0.13 -3.42 0.00 0.00 -0.13 0.00 0.00 32.58 28.89 3d23 s HIS 163 CO -0.03 -1.26 0.00 1.04 -2.47 0.00 0.00 174.74 172.02 3d23 n GLN 164 N 3.34 1.30 -3.85 2.88 6.02 -1.13 -0.09 117.38 125.86 3d23 n GLN 164 Ca 0.07 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.93 3d23 n GLN 164 Cb 0.46 -0.67 -0.15 0.00 1.02 0.00 0.00 30.24 30.90 3d23 n GLN 164 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 3d23 s LEU 165 N -2.10 1.75 -0.23 1.08 2.96 -0.40 -4.94 118.68 116.80 3d23 s LEU 165 Ca 0.00 0.01 -0.05 0.00 -0.22 0.00 0.00 54.13 53.87 3d23 s LEU 165 Cb 0.00 -0.02 -0.02 0.00 0.50 0.00 0.00 46.19 46.65 3d23 s LEU 165 CO 0.00 -0.03 0.01 -0.70 -1.32 0.00 0.00 176.35 174.30 3d23 s GLU 166 N 0.29 3.50 0.59 1.98 2.12 -1.26 -1.61 118.70 124.31 3d23 s GLU 166 Ca -0.02 -0.56 -0.16 0.00 0.36 0.00 0.00 54.97 54.59 3d23 s GLU 166 Cb -0.03 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 3d23 s GLU 166 CO -0.01 -0.19 1.06 -0.51 -0.54 0.00 0.00 175.26 175.07 3d23 s LEU 167 N 1.54 3.51 0.61 2.70 2.01 -0.56 -4.95 118.68 123.53 3d23 s LEU 167 Ca 0.06 1.85 0.27 0.00 0.01 0.00 0.00 54.13 56.32 3d23 s LEU 167 Cb -0.15 -4.54 1.15 0.00 0.01 0.00 0.00 46.19 42.67 3d23 s LEU 167 CO -0.00 -1.20 1.56 0.77 1.01 0.00 0.00 176.35 178.49 3d23 h SER 168 N 0.47 0.00 0.26 2.29 4.64 -1.89 0.33 113.55 119.64 3d23 h SER 168 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3d23 h SER 168 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3d23 h SER 168 CO 0.57 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.88 3d23 n THR 169 N -3.38 0.06 -0.51 2.95 -2.24 -1.26 -4.94 114.28 104.96 3d23 n THR 169 Ca 0.15 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 3d23 n THR 169 Cb 1.10 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 3d23 n THR 169 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d23 n GLY 170 N 0.91 1.19 4.01 3.38 0.00 0.10 -5.07 105.19 109.72 3d23 n GLY 170 Ca 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 3d23 n GLY 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d23 s HIS 172 N -2.45 2.20 0.30 0.00 0.09 0.37 -1.50 115.29 114.31 3d23 s HIS 172 Ca 0.56 -0.38 -0.13 0.00 -0.00 0.00 0.00 55.06 55.12 3d23 s HIS 172 Cb -0.08 -1.05 0.02 0.00 -0.00 0.00 0.00 32.58 31.46 3d23 s HIS 172 CO 0.34 0.52 0.60 -0.08 -0.00 0.00 0.00 174.74 176.13 3d23 s THR 173 N -1.98 0.00 0.00 1.30 -1.32 -0.63 0.99 115.64 113.99 3d23 s THR 173 Ca 0.22 -1.26 0.00 0.00 -1.21 0.00 0.00 61.69 59.44 3d23 s THR 173 Cb -0.07 -2.40 0.00 0.00 -1.51 0.00 0.00 72.50 68.52 3d23 s THR 173 CO 0.10 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.12 3d23 n GLY 174 N -0.47 1.50 3.82 6.08 0.00 -1.26 -1.27 105.19 113.60 3d23 n GLY 174 Ca -0.03 -0.78 -0.27 0.00 0.00 0.00 0.00 46.02 44.94 3d23 n GLY 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d23 s THR 175 N -2.48 4.63 0.65 2.61 -4.23 -1.05 -1.94 115.64 113.83 3d23 s THR 175 Ca 0.00 -0.97 -0.08 0.00 -1.18 0.00 0.00 61.69 59.46 3d23 s THR 175 Cb 0.00 -3.35 0.14 0.00 1.34 0.00 0.00 72.50 70.63 3d23 s THR 175 CO 0.00 -0.07 0.88 -0.90 -0.54 0.00 0.00 174.62 173.99 3d23 n ASP 176 N -0.27 0.35 -0.38 3.99 5.68 0.96 -0.90 116.55 125.99 3d23 n ASP 176 Ca -0.08 -1.49 0.08 0.00 -0.50 0.00 0.00 54.79 52.80 3d23 n ASP 176 Cb 0.54 -0.65 0.32 0.00 -1.14 0.00 0.00 41.12 40.19 3d23 n ASP 176 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3d23 n PHE 177 N -3.05 0.19 0.30 2.11 3.72 -1.26 -1.93 117.46 117.54 3d23 n PHE 177 Ca 0.12 -0.10 0.08 0.00 -0.05 0.00 0.00 57.45 57.50 3d23 n PHE 177 Cb 0.42 0.00 0.23 0.00 -0.94 0.00 0.00 39.48 39.19 3d23 n PHE 177 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 3d23 n THR 178 N 0.01 0.78 -0.86 4.37 -2.24 -1.26 -4.90 114.28 110.17 3d23 n THR 178 Ca 0.13 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 3d23 n THR 178 Cb 0.22 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3d23 n THR 178 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d23 n GLY 179 N 1.27 0.59 3.82 3.38 0.00 -0.81 -4.42 105.19 109.02 3d23 n GLY 179 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.83 3d23 n GLY 179 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3d23 s ASN 180 N -2.04 6.37 0.22 1.61 3.84 -1.24 -0.21 114.94 123.49 3d23 s ASN 180 Ca 0.00 0.43 -0.30 0.00 0.21 0.00 0.00 52.86 53.21 3d23 s ASN 180 Cb 0.00 -2.10 -0.08 0.00 -0.55 0.00 0.00 41.25 38.52 3d23 s ASN 180 CO 0.00 0.31 0.97 -0.36 -2.79 0.00 0.00 177.10 175.24 3d23 s PHE 181 N -0.51 3.89 0.56 0.43 0.40 -1.26 -0.03 117.98 121.46 3d23 s PHE 181 Ca 0.14 1.86 -0.21 0.00 -0.60 0.00 0.00 56.93 58.11 3d23 s PHE 181 Cb -0.12 -3.05 -0.04 0.00 0.51 0.00 0.00 43.02 40.32 3d23 s PHE 181 CO 0.03 0.24 1.34 0.71 0.70 0.00 0.00 175.22 178.24 3d23 s TYR 182 N -0.95 2.27 0.00 0.36 2.02 -0.82 -4.78 117.35 115.46 3d23 s TYR 182 Ca 0.43 1.39 0.00 0.00 -0.37 0.00 0.00 57.07 58.52 3d23 s TYR 182 Cb -0.27 -3.77 0.00 0.00 -0.40 0.00 0.00 41.96 37.52 3d23 s TYR 182 CO 0.33 -2.86 0.00 0.41 -1.57 0.00 0.00 175.55 171.86 3d23 n GLY 183 N 0.73 0.94 0.94 0.71 0.00 -1.26 -3.84 105.19 103.41 3d23 n GLY 183 Ca 0.11 -0.71 0.11 0.00 0.00 0.00 0.00 46.02 45.52 3d23 n GLY 183 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d23 n PRO 184 N 0.00 2.22 -1.51 1.61 -0.04 -1.26 -5.01 135.00 131.02 3d23 n PRO 184 Ca 0.00 -1.85 -0.30 0.00 -0.04 0.00 0.00 63.50 61.30 3d23 n PRO 184 Cb 0.00 -1.46 0.08 0.00 -0.04 0.00 0.00 33.50 32.08 3d23 n PRO 184 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3d23 s TYR 185 N -1.54 2.85 0.07 0.54 2.02 -1.25 -5.08 117.35 114.96 3d23 s TYR 185 Ca 0.36 1.26 -0.06 0.00 -0.37 0.00 0.00 57.07 58.27 3d23 s TYR 185 Cb 0.20 -3.05 -0.02 0.00 -0.40 0.00 0.00 41.96 38.70 3d23 s TYR 185 CO 0.29 -1.67 0.11 -0.98 -1.57 0.00 0.00 175.55 171.72 3d23 s ARG 186 N -5.09 0.75 -1.51 -0.62 1.70 -1.26 -4.79 118.95 108.12 3d23 s ARG 186 Ca 0.60 -1.05 -0.12 0.00 -0.47 0.00 0.00 55.73 54.70 3d23 s ARG 186 Cb -0.15 0.29 -0.00 0.00 -0.57 0.00 0.00 34.95 34.52 3d23 s ARG 186 CO 0.55 -0.20 2.51 -0.40 -1.08 0.00 0.00 175.30 176.67 3d23 n ASP 187 N 0.03 6.07 -3.82 -2.89 5.75 -1.26 -4.83 116.55 115.61 3d23 n ASP 187 Ca -0.15 -2.76 -0.12 0.00 -0.01 0.00 0.00 54.79 51.75 3d23 n ASP 187 Cb 0.62 -1.60 -0.10 0.00 -1.03 0.00 0.00 41.12 39.01 3d23 n ASP 187 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d23 s ALA 188 N 2.45 -0.51 -0.85 2.12 0.00 -1.26 -4.81 121.76 118.90 3d23 s ALA 188 Ca 0.56 0.20 -0.06 0.00 0.00 0.00 0.00 51.96 52.65 3d23 s ALA 188 Cb 0.16 -0.03 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 3d23 s ALA 188 CO -0.07 -0.20 2.98 1.04 0.00 0.00 0.00 175.76 179.51 3d23 n GLN 189 N 1.80 3.15 -4.39 0.00 6.02 -0.84 -4.88 117.38 118.26 3d23 n GLN 189 Ca -0.20 -2.19 -0.24 0.00 -0.01 0.00 0.00 57.00 54.36 3d23 n GLN 189 Cb 0.56 -2.39 -0.09 0.00 1.02 0.00 0.00 30.24 29.34 3d23 n GLN 189 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3d23 s VAL 190 N 0.10 2.84 -0.05 5.09 -7.23 -1.26 -4.89 120.40 114.99 3d23 s VAL 190 Ca 0.63 -2.15 -0.38 0.00 -1.81 0.00 0.00 61.98 58.28 3d23 s VAL 190 Cb 0.27 -2.60 -0.16 0.00 0.56 0.00 0.00 36.38 34.44 3d23 s VAL 190 CO -0.09 -0.35 1.50 0.52 -0.31 0.00 0.00 175.10 176.38 3d23 n VAL 191 N -0.79 0.12 -3.43 1.32 0.31 -1.26 -4.96 118.33 109.64 3d23 n VAL 191 Ca -0.05 -0.02 -0.20 0.00 -0.01 0.00 0.00 64.34 64.05 3d23 n VAL 191 Cb 0.60 -0.99 -0.11 0.00 -0.91 0.00 0.00 33.84 32.44 3d23 n VAL 191 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3d23 s GLN 192 N 1.69 0.34 -0.07 5.55 -0.21 -1.26 -5.12 119.66 120.57 3d23 s GLN 192 Ca 0.90 -0.37 -0.30 0.00 0.02 0.00 0.00 55.36 55.61 3d23 s GLN 192 Cb -1.00 -0.81 -0.02 0.00 1.00 0.00 0.00 33.01 32.19 3d23 s GLN 192 CO 0.54 -1.06 1.01 -0.51 -2.12 0.00 0.00 175.29 173.16 3d23 s LEU 193 N 2.13 4.28 0.43 2.90 1.43 -1.26 -4.68 118.68 123.91 3d23 s LEU 193 Ca 0.11 1.59 -0.24 0.00 -1.03 0.00 0.00 54.13 54.55 3d23 s LEU 193 Cb -0.15 -3.56 -0.08 0.00 0.03 0.00 0.00 46.19 42.43 3d23 s LEU 193 CO -0.29 -0.41 1.17 -2.16 0.23 0.00 0.00 176.35 174.90 3d23 s PRO 194 N 1.75 3.91 0.98 1.29 0.04 -1.26 -5.03 135.00 136.67 3d23 s PRO 194 Ca 0.50 1.81 -0.11 0.00 0.04 0.00 0.00 61.00 63.23 3d23 s PRO 194 Cb -0.19 -2.54 0.18 0.00 0.04 0.00 0.00 34.50 31.98 3d23 s PRO 194 CO 0.21 -0.44 1.09 0.14 0.04 0.00 0.00 177.00 178.04 3d23 s VAL 195 N -1.48 2.33 0.71 -0.36 -7.23 -1.26 -4.99 120.40 108.12 3d23 s VAL 195 Ca 0.60 0.11 -0.16 0.00 -1.81 0.00 0.00 61.98 60.72 3d23 s VAL 195 Cb -0.30 -2.35 -0.05 0.00 0.56 0.00 0.00 36.38 34.25 3d23 s VAL 195 CO 0.37 -0.14 0.44 2.29 -0.31 0.00 0.00 175.10 177.74 3d23 n LYS 196 N -4.28 0.27 -4.56 4.82 2.85 -1.26 -4.66 118.16 111.35 3d23 n LYS 196 Ca 0.07 0.13 -0.34 0.00 -1.05 0.00 0.00 58.31 57.12 3d23 n LYS 196 Cb 0.54 -1.74 -0.11 0.00 -0.65 0.00 0.00 35.03 33.07 3d23 n LYS 196 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 3d23 s ASP 197 N -1.41 4.78 -0.03 -5.58 3.68 -1.26 -4.31 116.67 112.54 3d23 s ASP 197 Ca 0.64 0.01 -0.03 0.00 2.13 0.00 0.00 52.55 55.31 3d23 s ASP 197 Cb -0.36 -1.25 -0.04 0.00 -1.45 0.00 0.00 42.92 39.82 3d23 s ASP 197 CO 0.59 0.36 0.14 -0.31 0.13 0.00 0.00 175.17 176.08 3d23 s TYR 198 N -0.79 3.47 0.26 -5.34 2.02 -1.26 -4.92 117.35 110.78 3d23 s TYR 198 Ca 0.12 0.34 -0.30 0.00 -0.37 0.00 0.00 57.07 56.85 3d23 s TYR 198 Cb -0.11 -1.82 -0.11 0.00 -0.40 0.00 0.00 41.96 39.52 3d23 s TYR 198 CO 0.02 0.63 1.54 0.08 -1.57 0.00 0.00 175.55 176.25 3d23 s VAL 199 N -1.22 2.33 -0.77 0.71 1.01 0.43 -4.64 120.40 118.26 3d23 s VAL 199 Ca 0.23 0.27 -0.20 0.00 0.00 0.00 0.00 61.98 62.29 3d23 s VAL 199 Cb -0.12 -3.17 0.11 0.00 0.00 0.00 0.00 36.38 33.19 3d23 s VAL 199 CO 0.14 0.04 0.97 -1.10 0.00 0.00 0.00 175.10 175.15 3d23 s GLN 200 N -0.20 3.32 0.21 2.72 -1.52 -1.26 -0.64 119.66 122.28 3d23 s GLN 200 Ca 0.63 -1.38 -0.10 0.00 -1.95 0.00 0.00 55.36 52.56 3d23 s GLN 200 Cb -0.45 -4.53 0.19 0.00 -0.22 0.00 0.00 33.01 27.99 3d23 s GLN 200 CO 0.44 -1.72 1.85 1.15 -0.25 0.00 0.00 175.29 176.75 3d23 h THR 201 N 5.86 1.09 0.00 -0.19 2.02 -1.87 -0.16 112.91 119.66 3d23 h THR 201 Ca -0.09 -0.29 -0.03 0.00 0.77 0.00 0.00 66.41 66.77 3d23 h THR 201 Cb 1.05 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 3d23 h THR 201 CO 1.12 0.16 -0.14 -0.37 0.37 0.00 0.00 175.52 176.66 3d23 h VAL 202 N 0.85 0.44 -0.27 3.16 -1.51 -1.90 -0.87 116.25 116.16 3d23 h VAL 202 Ca 0.28 -0.73 -0.06 0.00 -1.23 0.00 0.00 66.70 64.96 3d23 h VAL 202 Cb 0.02 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 30.69 3d23 h VAL 202 CO -0.11 0.13 -0.06 0.78 -1.23 0.00 0.00 177.57 177.09 3d23 h ASN 203 N 0.00 0.52 -0.71 4.19 4.21 -1.28 -1.24 115.58 121.27 3d23 h ASN 203 Ca -0.00 -0.36 0.01 0.00 1.21 0.00 0.00 56.30 57.15 3d23 h ASN 203 Cb 0.51 -0.14 -0.04 0.00 -1.12 0.00 0.00 38.32 37.53 3d23 h ASN 203 CO 0.02 0.76 0.47 0.58 -1.29 0.00 0.00 177.43 177.97 3d23 h VAL 204 N 0.27 1.19 -0.76 2.81 2.07 -0.64 -1.09 116.25 120.09 3d23 h VAL 204 Ca 0.07 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.27 3d23 h VAL 204 Cb 0.53 0.14 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 3d23 h VAL 204 CO 0.03 0.18 0.48 0.40 0.02 0.00 0.00 177.57 178.68 3d23 h ILE 205 N 0.97 1.11 -0.57 4.57 2.04 -1.01 -0.56 117.51 124.06 3d23 h ILE 205 Ca 0.26 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 3d23 h ILE 205 Cb -0.10 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.04 3d23 h ILE 205 CO -0.06 0.17 0.30 0.00 0.00 0.00 0.00 178.15 178.56 3d23 h ALA 206 N 1.32 0.73 -0.01 1.87 0.00 -0.66 0.11 119.26 122.61 3d23 h ALA 206 Ca 0.30 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 3d23 h ALA 206 Cb 0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3d23 h ALA 206 CO -0.11 0.27 -0.39 2.35 0.00 0.00 0.00 179.25 181.37 3d23 h TRP 207 N 0.77 0.03 -0.39 0.00 7.01 -0.54 0.11 115.95 122.94 3d23 h TRP 207 Ca 0.20 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 61.11 3d23 h TRP 207 Cb 0.08 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.12 3d23 h TRP 207 CO -0.01 0.41 -0.08 -0.07 -2.79 0.00 0.00 178.44 175.90 3d23 h LEU 208 N 0.02 0.74 -0.71 0.65 4.07 -0.05 0.14 115.31 120.17 3d23 h LEU 208 Ca -0.00 -0.36 -0.02 0.00 0.08 0.00 0.00 57.88 57.59 3d23 h LEU 208 Cb 0.70 -0.20 -0.03 0.00 1.08 0.00 0.00 40.66 42.20 3d23 h LEU 208 CO 0.05 0.93 0.38 1.88 -1.08 0.00 0.00 178.44 180.60 3d23 h TYR 209 N 0.55 0.99 -0.49 1.13 0.05 -0.36 0.00 116.97 118.85 3d23 h TYR 209 Ca 0.10 -0.03 0.09 0.00 0.05 0.00 0.00 58.73 58.94 3d23 h TYR 209 Cb 0.59 -0.31 -0.07 0.00 1.01 0.00 0.00 36.73 37.95 3d23 h TYR 209 CO 0.05 0.71 0.06 0.00 -1.05 0.00 0.00 178.16 177.92 3d23 h ALA 210 N 1.19 0.51 -0.10 3.88 0.00 -0.41 -0.29 119.26 124.04 3d23 h ALA 210 Ca 0.25 0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.31 3d23 h ALA 210 Cb 0.06 0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 3d23 h ALA 210 CO -0.04 -0.35 -0.12 0.00 0.00 0.00 0.00 179.25 178.75 3d23 h ALA 211 N 1.40 -0.05 -0.15 0.00 0.00 -0.13 -1.18 119.26 119.15 3d23 h ALA 211 Ca 0.24 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.24 3d23 h ALA 211 Cb 0.35 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 3d23 h ALA 211 CO -0.36 -0.58 -0.18 0.82 0.00 0.00 0.00 179.25 178.95 3d23 h ILE 212 N -0.15 0.52 0.00 0.00 2.04 -0.43 0.22 117.51 119.71 3d23 h ILE 212 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.94 3d23 h ILE 212 Cb 0.27 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3d23 h ILE 212 CO -0.19 0.00 0.17 -0.07 0.00 0.00 0.00 178.15 178.05 3d23 h LEU 213 N -0.23 0.00 -3.26 1.44 -0.00 -0.52 0.42 115.31 113.16 3d23 h LEU 213 Ca 0.10 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.85 3d23 h LEU 213 Cb 0.38 0.00 -0.08 0.00 -0.00 0.00 0.00 40.66 40.96 3d23 h LEU 213 CO -0.28 0.00 -0.19 0.59 -0.00 0.00 0.00 178.44 178.56 3d23 n ASN 214 N -2.62 2.26 -3.48 -0.43 4.13 0.71 -4.95 115.26 110.88 3d23 n ASN 214 Ca -0.02 -3.82 -0.20 0.00 1.68 0.00 0.00 54.58 52.21 3d23 n ASN 214 Cb 0.21 -0.61 0.06 0.00 -1.54 0.00 0.00 39.78 37.90 3d23 n ASN 214 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3d23 n ASN 215 N -1.13 -4.24 -3.23 6.41 5.03 0.15 -4.98 115.26 113.28 3d23 n ASN 215 Ca 0.30 -0.79 -0.16 0.00 0.87 0.00 0.00 54.58 54.80 3d23 n ASN 215 Cb 0.95 -4.52 -0.06 0.00 -1.02 0.00 0.00 39.78 35.13 3d23 n ASN 215 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3d23 n ALA 217 N 3.56 2.37 -0.22 0.00 0.00 -1.26 -3.65 120.51 121.30 3d23 n ALA 217 Ca 0.18 -2.51 0.20 0.00 0.00 0.00 0.00 53.44 51.31 3d23 n ALA 217 Cb 0.49 -0.40 0.54 0.00 0.00 0.00 0.00 19.45 20.09 3d23 n ALA 217 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 3d23 h TRP 218 N 0.11 0.45 0.00 0.00 5.08 -1.97 0.31 115.95 119.93 3d23 h TRP 218 Ca -0.00 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.98 3d23 h TRP 218 Cb 1.06 -0.14 0.00 0.00 -3.00 0.00 0.00 29.16 27.08 3d23 h TRP 218 CO 0.09 0.12 0.00 1.97 -1.28 0.00 0.00 178.44 179.34 3d23 n PHE 219 N -4.47 0.00 -3.10 0.12 -1.74 -1.26 -4.78 117.46 102.23 3d23 n PHE 219 Ca 0.19 0.00 -0.41 0.00 -0.56 0.00 0.00 57.45 56.67 3d23 n PHE 219 Cb 0.72 -0.14 -0.06 0.00 1.52 0.00 0.00 39.48 41.52 3d23 n PHE 219 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 3d23 s VAL 220 N -2.28 4.98 0.00 1.97 1.01 0.11 -4.73 120.40 121.45 3d23 s VAL 220 Ca 0.29 1.16 0.00 0.00 0.00 0.00 0.00 61.98 63.42 3d23 s VAL 220 Cb 0.16 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.60 3d23 s VAL 220 CO 0.31 0.03 0.00 0.00 0.00 0.00 0.00 175.10 175.44 3d23 n GLN 221 N 5.71 3.26 -0.17 2.72 6.02 -1.26 -5.05 117.38 128.61 3d23 n GLN 221 Ca -0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.06 3d23 n GLN 221 Cb 0.49 0.00 0.16 0.00 1.02 0.00 0.00 30.24 31.91 3d23 n GLN 221 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3d23 n ASN 222 N 0.00 2.95 -4.87 1.08 5.03 -1.26 -4.95 115.26 113.24 3d23 n ASN 222 Ca 0.00 -1.89 -0.31 0.00 0.87 0.00 0.00 54.58 53.26 3d23 n ASN 222 Cb 0.00 -0.22 -0.02 0.00 -1.02 0.00 0.00 39.78 38.52 3d23 n ASN 222 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 3d23 s ASP 223 N -1.08 6.45 0.03 6.41 3.84 -1.26 -5.08 116.67 125.99 3d23 s ASP 223 Ca 0.27 1.29 0.02 0.00 -0.00 0.00 0.00 52.55 54.13 3d23 s ASP 223 Cb 0.15 -2.40 -0.02 0.00 -1.38 0.00 0.00 42.92 39.27 3d23 s ASP 223 CO 0.21 -0.58 -0.07 0.54 -0.00 0.00 0.00 175.17 175.27 3d23 s VAL 224 N -2.67 0.45 -0.04 2.11 0.11 -1.26 -4.50 120.40 114.61 3d23 s VAL 224 Ca 0.54 -0.93 -0.01 0.00 -2.93 0.00 0.00 61.98 58.64 3d23 s VAL 224 Cb -0.10 -0.51 0.03 0.00 -1.53 0.00 0.00 36.38 34.26 3d23 s VAL 224 CO 0.38 -0.33 0.07 0.00 -3.33 0.00 0.00 175.10 171.89 3d23 s SER 226 N 1.59 4.84 0.29 0.00 1.04 -1.26 -4.41 113.70 115.79 3d23 s SER 226 Ca -0.03 2.14 0.06 0.00 0.48 0.00 0.00 55.95 58.60 3d23 s SER 226 Cb -0.12 -2.57 0.45 0.00 0.10 0.00 0.00 66.02 63.88 3d23 s SER 226 CO -0.04 -1.81 1.69 0.71 0.98 0.00 0.00 173.24 174.78 3d23 h THR 227 N 0.01 1.31 0.10 2.02 1.35 -1.98 -0.20 112.91 115.54 3d23 h THR 227 Ca -0.47 -1.54 0.01 0.00 -0.55 0.00 0.00 66.41 63.86 3d23 h THR 227 Cb 1.26 1.70 -0.02 0.00 -1.73 0.00 0.00 68.15 69.37 3d23 h THR 227 CO 0.53 0.46 -0.14 -0.33 -0.25 0.00 0.00 175.52 175.79 3d23 h GLU 228 N 0.20 -0.28 -0.22 4.72 5.08 -1.96 -0.43 114.58 121.69 3d23 h GLU 228 Ca 0.02 0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 3d23 h GLU 228 Cb 0.83 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 3d23 h GLU 228 CO 0.06 -0.18 -0.41 -0.44 -1.00 0.00 0.00 179.01 177.04 3d23 h ASP 229 N -0.29 0.55 -0.66 1.42 3.45 -1.87 -2.66 116.42 116.36 3d23 h ASP 229 Ca 0.01 -0.24 -0.01 0.00 0.43 0.00 0.00 57.03 57.23 3d23 h ASP 229 Cb 0.29 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 3d23 h ASP 229 CO -0.06 0.89 0.38 0.15 -1.57 0.00 0.00 179.24 179.03 3d23 h PHE 230 N 0.43 0.89 0.43 4.55 3.57 -0.93 -2.23 116.94 123.64 3d23 h PHE 230 Ca 0.04 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 3d23 h PHE 230 Cb 0.89 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.35 3d23 h PHE 230 CO 0.03 0.62 -0.21 -0.91 -2.23 0.00 0.00 178.31 175.62 3d23 h ASN 231 N 0.90 -0.49 -0.65 0.41 -0.26 -0.72 0.25 115.58 115.02 3d23 h ASN 231 Ca 0.23 -0.06 0.12 0.00 -0.56 0.00 0.00 56.30 56.03 3d23 h ASN 231 Cb 0.01 0.13 -0.12 0.00 -1.06 0.00 0.00 38.32 37.28 3d23 h ASN 231 CO -0.04 -0.23 -0.20 0.52 -1.06 0.00 0.00 177.43 176.42 3d23 n VAL 232 N -5.28 -0.30 -0.03 2.81 0.31 -1.14 -0.39 118.33 114.31 3d23 n VAL 232 Ca -0.11 1.50 -0.06 0.00 -0.01 0.00 0.00 64.34 65.67 3d23 n VAL 232 Cb 0.28 -2.05 0.14 0.00 -0.91 0.00 0.00 33.84 31.31 3d23 n VAL 232 CO 0.00 0.00 0.00 -0.25 -1.32 0.00 0.00 176.83 175.26 3d23 h TRP 233 N 0.00 0.69 0.12 3.52 7.01 -0.65 -3.37 115.95 123.27 3d23 h TRP 233 Ca 0.28 -0.16 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 3d23 h TRP 233 Cb 0.44 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 27.34 3d23 h TRP 233 CO -0.53 0.81 -0.06 0.00 -2.79 0.00 0.00 178.44 175.88 3d23 h ALA 234 N 1.18 -0.16 -0.13 2.65 0.00 0.23 -2.57 119.26 120.47 3d23 h ALA 234 Ca 0.07 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3d23 h ALA 234 Cb 0.73 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3d23 h ALA 234 CO 0.06 -0.47 -0.08 -1.33 0.00 0.00 0.00 179.25 177.43 3d23 n MET 235 N -5.05 -0.06 0.09 0.00 2.81 -1.10 -1.03 117.12 112.78 3d23 n MET 235 Ca -0.09 0.80 0.20 0.00 -1.81 0.00 0.00 57.70 56.81 3d23 n MET 235 Cb 0.18 -1.20 0.75 0.00 -0.71 0.00 0.00 33.22 32.24 3d23 n MET 235 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3d23 h ALA 236 N -0.54 2.14 -0.16 3.04 0.00 -1.69 -3.25 119.26 118.80 3d23 h ALA 236 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d23 h ALA 236 Cb 0.05 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3d23 h ALA 236 CO -0.12 -0.65 0.00 0.09 0.00 0.00 0.00 179.25 178.57 3d23 n ASN 237 N -3.76 2.39 0.00 0.00 4.13 -0.20 -5.00 115.26 112.82 3d23 n ASN 237 Ca 0.07 -1.96 0.00 0.00 1.68 0.00 0.00 54.58 54.38 3d23 n ASN 237 Cb 0.61 -0.11 0.00 0.00 -1.54 0.00 0.00 39.78 38.75 3d23 n ASN 237 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3d23 n GLY 238 N 0.01 1.00 3.36 7.41 0.00 -0.89 -5.03 105.19 111.05 3d23 n GLY 238 Ca 0.05 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 3d23 n GLY 238 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d23 s PHE 239 N -2.00 2.53 0.81 1.61 0.40 -0.91 -0.43 117.98 120.00 3d23 s PHE 239 Ca 0.00 -0.46 -0.12 0.00 -0.60 0.00 0.00 56.93 55.76 3d23 s PHE 239 Cb 0.00 -1.61 0.08 0.00 0.51 0.00 0.00 43.02 42.01 3d23 s PHE 239 CO 0.00 -0.04 1.14 -1.54 0.70 0.00 0.00 175.22 175.48 3d23 s SER 240 N -0.41 3.86 0.48 1.36 1.04 0.18 -3.74 113.70 116.47 3d23 s SER 240 Ca 0.04 2.10 -0.24 0.00 0.48 0.00 0.00 55.95 58.33 3d23 s SER 240 Cb -0.12 -2.56 -0.07 0.00 0.10 0.00 0.00 66.02 63.38 3d23 s SER 240 CO 0.02 -2.47 1.30 -1.10 0.98 0.00 0.00 173.24 171.97 3d23 s GLN 241 N -4.52 3.57 -0.01 4.02 -1.52 -1.26 -4.47 119.66 115.48 3d23 s GLN 241 Ca 0.67 2.12 -0.17 0.00 -1.95 0.00 0.00 55.36 56.04 3d23 s GLN 241 Cb -0.22 -2.47 -0.06 0.00 -0.22 0.00 0.00 33.01 30.04 3d23 s GLN 241 CO 0.53 -0.81 0.46 0.08 -0.25 0.00 0.00 175.29 175.30 3d23 s VAL 242 N -1.34 4.99 0.10 1.09 1.01 -1.26 -4.79 120.40 120.19 3d23 s VAL 242 Ca 0.64 0.95 0.08 0.00 0.00 0.00 0.00 61.98 63.66 3d23 s VAL 242 Cb -0.37 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 3d23 s VAL 242 CO 0.46 0.52 -0.21 -0.54 0.00 0.00 0.00 175.10 175.33 3d23 s LYS 243 N -0.73 1.17 0.38 2.72 1.02 -1.26 -5.01 119.74 118.04 3d23 s LYS 243 Ca 0.25 -1.14 -0.24 0.00 0.02 0.00 0.00 55.97 54.86 3d23 s LYS 243 Cb -0.17 -1.43 -0.12 0.00 -0.52 0.00 0.00 37.83 35.59 3d23 s LYS 243 CO 0.14 0.34 0.77 0.00 -0.92 0.00 0.00 175.35 175.67 3d23 n ALA 244 N 1.18 -0.86 -3.24 5.17 0.00 -1.26 -4.97 120.51 116.53 3d23 n ALA 244 Ca -0.19 0.24 -0.02 0.00 0.00 0.00 0.00 53.44 53.47 3d23 n ALA 244 Cb 0.53 -1.90 -0.04 0.00 0.00 0.00 0.00 19.45 18.04 3d23 n ALA 244 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3d23 s ASP 245 N -0.83 -0.68 0.36 0.00 -1.08 -1.26 -5.04 116.67 108.15 3d23 s ASP 245 Ca 0.63 0.57 0.05 0.00 -0.52 0.00 0.00 52.55 53.28 3d23 s ASP 245 Cb -0.63 1.71 0.69 0.00 -1.46 0.00 0.00 42.92 43.23 3d23 s ASP 245 CO 0.58 -0.28 1.96 -0.07 0.52 0.00 0.00 175.17 177.88 3d23 h LEU 246 N 8.08 0.53 -0.24 -1.34 3.38 -1.99 -1.51 115.31 122.23 3d23 h LEU 246 Ca -0.21 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 3d23 h LEU 246 Cb 1.16 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.76 3d23 h LEU 246 CO 0.26 0.49 0.03 0.58 0.09 0.00 0.00 178.44 179.89 3d23 h VAL 247 N 0.59 1.23 -0.37 1.22 2.07 -1.96 -0.01 116.25 119.02 3d23 h VAL 247 Ca 0.15 -0.78 0.05 0.00 0.82 0.00 0.00 66.70 66.93 3d23 h VAL 247 Cb 0.12 1.29 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 3d23 h VAL 247 CO -0.02 0.25 0.11 -0.07 0.02 0.00 0.00 177.57 177.87 3d23 h LEU 248 N 0.19 0.10 -0.89 2.57 3.38 -1.86 0.88 115.31 119.69 3d23 h LEU 248 Ca 0.07 0.05 0.23 0.00 0.09 0.00 0.00 57.88 58.32 3d23 h LEU 248 Cb 0.34 0.04 -0.13 0.00 0.09 0.00 0.00 40.66 41.00 3d23 h LEU 248 CO 0.01 0.09 0.35 0.44 0.09 0.00 0.00 178.44 179.42 3d23 h ASP 249 N 0.26 0.23 -0.27 -0.43 3.32 -0.94 0.92 116.42 119.51 3d23 h ASP 249 Ca 0.17 0.17 -0.17 0.00 0.02 0.00 0.00 57.03 57.22 3d23 h ASP 249 Cb 0.16 0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3d23 h ASP 249 CO -0.19 -0.06 -0.50 0.00 -1.72 0.00 0.00 179.24 176.77 3d23 h ALA 250 N 1.74 0.42 0.00 3.45 0.00 0.12 -0.84 119.26 124.15 3d23 h ALA 250 Ca 0.56 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3d23 h ALA 250 Cb 1.11 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3d23 h ALA 250 CO -0.57 0.61 -0.06 -0.07 0.00 0.00 0.00 179.25 179.15 3d23 h LEU 251 N 0.58 0.00 -0.33 0.00 3.38 0.28 0.04 115.31 119.26 3d23 h LEU 251 Ca 0.01 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.80 3d23 h LEU 251 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3d23 h LEU 251 CO 0.11 0.06 -0.57 0.00 0.09 0.00 0.00 178.44 178.13 3d23 h ALA 252 N 1.94 0.50 0.36 1.53 0.00 0.13 -2.64 119.26 121.08 3d23 h ALA 252 Ca -0.00 -0.52 -0.02 0.00 0.00 0.00 0.00 54.91 54.37 3d23 h ALA 252 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3d23 h ALA 252 CO 0.01 0.68 -0.17 0.77 0.00 0.00 0.00 179.25 180.54 3d23 h SER 253 N 0.61 -0.41 -0.66 0.00 0.02 -0.66 0.26 113.55 112.72 3d23 h SER 253 Ca 0.01 -0.01 0.12 0.00 -0.84 0.00 0.00 61.79 61.07 3d23 h SER 253 Cb 1.17 0.11 -0.09 0.00 0.14 0.00 0.00 62.40 63.73 3d23 h SER 253 CO 0.12 -0.26 0.22 0.24 -1.14 0.00 0.00 176.83 176.01 3d23 h MET 254 N -0.52 0.36 0.00 3.45 2.07 -0.89 -3.19 114.93 116.21 3d23 h MET 254 Ca -0.05 -0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.56 3d23 h MET 254 Cb 0.39 -0.08 0.00 0.00 -1.87 0.00 0.00 31.60 30.04 3d23 h MET 254 CO 0.08 0.24 -1.53 0.25 1.07 0.00 0.00 176.91 177.02 3d23 n THR 255 N -5.04 0.00 -0.29 2.22 -2.24 -1.01 -4.99 114.28 102.93 3d23 n THR 255 Ca 0.11 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.60 3d23 n THR 255 Cb 0.34 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 3d23 n THR 255 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d23 n GLY 256 N 1.39 2.09 3.49 3.38 0.00 0.07 -5.01 105.19 110.60 3d23 n GLY 256 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3d23 n GLY 256 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d23 s VAL 257 N -3.18 4.70 0.71 1.61 1.01 -1.22 -5.02 120.40 119.01 3d23 s VAL 257 Ca 0.00 -0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.75 3d23 s VAL 257 Cb 0.00 -3.26 0.02 0.00 0.00 0.00 0.00 36.38 33.15 3d23 s VAL 257 CO 0.00 0.25 1.07 -0.94 0.00 0.00 0.00 175.10 175.48 3d23 s SER 258 N 1.66 5.08 0.20 3.32 1.04 -1.26 -4.45 113.70 119.28 3d23 s SER 258 Ca 0.06 1.72 -0.11 0.00 0.48 0.00 0.00 55.95 58.10 3d23 s SER 258 Cb -0.16 -2.51 0.23 0.00 0.10 0.00 0.00 66.02 63.68 3d23 s SER 258 CO 0.07 -1.65 1.72 0.40 0.98 0.00 0.00 173.24 174.76 3d23 h ILE 259 N -0.74 0.71 -1.00 -1.02 2.04 -1.96 -2.88 117.51 112.66 3d23 h ILE 259 Ca -0.44 -0.10 0.03 0.00 1.00 0.00 0.00 64.86 65.36 3d23 h ILE 259 Cb 1.22 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 37.65 3d23 h ILE 259 CO 0.55 0.05 0.66 -0.33 0.00 0.00 0.00 178.15 179.07 3d23 h GLU 260 N 0.28 1.24 -0.79 2.37 3.07 -1.92 0.21 114.58 119.03 3d23 h GLU 260 Ca 0.28 -0.07 0.13 0.00 -0.50 0.00 0.00 59.36 59.19 3d23 h GLU 260 Cb 0.37 -0.28 -0.06 0.00 -0.84 0.00 0.00 28.75 27.95 3d23 h GLU 260 CO -0.34 0.82 0.52 1.15 -1.40 0.00 0.00 179.01 179.76 3d23 h THR 261 N 1.27 0.86 0.00 1.13 2.02 -1.74 -1.63 112.91 114.84 3d23 h THR 261 Ca 0.39 -0.20 -0.24 0.00 0.77 0.00 0.00 66.41 67.13 3d23 h THR 261 Cb -0.01 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.58 3d23 h THR 261 CO -0.12 0.11 -1.22 -0.07 0.37 0.00 0.00 175.52 174.59 3d23 h LEU 262 N 0.59 0.01 -0.72 2.58 3.38 -0.61 -2.17 115.31 118.38 3d23 h LEU 262 Ca 0.38 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.36 3d23 h LEU 262 Cb 0.66 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 3d23 h LEU 262 CO -0.15 1.01 0.46 -0.07 0.09 0.00 0.00 178.44 179.79 3d23 h LEU 263 N 0.00 0.77 -0.08 1.67 3.38 -0.85 -0.36 115.31 119.84 3d23 h LEU 263 Ca -0.10 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.87 3d23 h LEU 263 Cb 1.85 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 42.42 3d23 h LEU 263 CO 0.12 0.54 0.05 0.00 0.09 0.00 0.00 178.44 179.24 3d23 h ALA 264 N 1.30 0.11 -0.89 1.53 0.00 -1.32 -1.65 119.26 118.32 3d23 h ALA 264 Ca 0.28 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.26 3d23 h ALA 264 Cb -0.02 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.67 3d23 h ALA 264 CO -0.09 -0.39 0.55 0.00 0.00 0.00 0.00 179.25 179.32 3d23 h ALA 265 N 1.02 1.26 0.05 0.00 0.00 -1.20 -0.78 119.26 119.61 3d23 h ALA 265 Ca 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3d23 h ALA 265 Cb 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 3d23 h ALA 265 CO -0.01 0.26 -0.03 0.82 0.00 0.00 0.00 179.25 180.30 3d23 h ILE 266 N 0.97 0.96 -0.40 0.00 2.04 -0.66 0.20 117.51 120.63 3d23 h ILE 266 Ca 0.40 -0.04 0.06 0.00 1.00 0.00 0.00 64.86 66.28 3d23 h ILE 266 Cb 0.25 0.99 -0.05 0.00 -0.74 0.00 0.00 36.82 37.26 3d23 h ILE 266 CO -0.20 0.01 0.07 0.11 0.00 0.00 0.00 178.15 178.15 3d23 h LYS 267 N -0.09 0.19 0.45 2.37 1.57 -0.40 -0.28 116.57 120.38 3d23 h LYS 267 Ca -0.01 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3d23 h LYS 267 Cb 0.07 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 3d23 h LYS 267 CO 0.01 0.13 -0.46 0.00 -0.57 0.00 0.00 179.45 178.57 3d23 h ARG 268 N 0.20 -0.89 -0.08 3.15 3.08 -1.00 -3.11 114.38 115.73 3d23 h ARG 268 Ca 0.19 0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.33 3d23 h ARG 268 Cb 0.23 0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 3d23 h ARG 268 CO -0.26 -0.59 0.11 -0.07 -1.07 0.00 0.00 179.97 178.10 3d23 h LEU 269 N -0.92 0.00 -2.56 3.04 3.38 0.01 0.28 115.31 118.54 3d23 h LEU 269 Ca -0.05 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 3d23 h LEU 269 Cb 0.81 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 3d23 h LEU 269 CO -0.06 0.00 -0.02 0.22 0.09 0.00 0.00 178.44 178.67 3d23 h TYR 270 N 0.00 0.00 0.00 1.13 3.20 -0.99 -0.87 116.97 119.44 3d23 h TYR 270 Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3d23 h TYR 270 Cb 0.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.53 3d23 h TYR 270 CO 0.00 0.02 0.00 -1.33 -1.64 0.00 0.00 178.16 175.21 3d23 n MET 271 N -3.29 0.87 0.00 1.82 2.81 0.98 -5.00 117.12 115.31 3d23 n MET 271 Ca -0.02 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.87 3d23 n MET 271 Cb 0.13 -1.18 0.00 0.00 -0.71 0.00 0.00 33.22 31.46 3d23 n MET 271 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3d23 n GLY 272 N 0.50 2.36 0.12 3.03 0.00 -0.33 -4.94 105.19 105.93 3d23 n GLY 272 Ca 0.07 -1.92 0.11 0.00 0.00 0.00 0.00 46.02 44.28 3d23 n GLY 272 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3d23 n PHE 273 N 1.54 0.00 -3.62 1.61 0.99 -1.26 -4.65 117.46 112.08 3d23 n PHE 273 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.45 57.21 3d23 n PHE 273 Cb 0.00 -0.04 0.07 0.00 -1.00 0.00 0.00 39.48 38.52 3d23 n PHE 273 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 3d23 n GLN 274 N -1.15 -7.41 -0.76 -1.08 3.00 -1.26 -1.93 117.38 106.78 3d23 n GLN 274 Ca 0.06 0.80 -0.03 0.00 -0.01 0.00 0.00 57.00 57.81 3d23 n GLN 274 Cb 0.36 -5.81 -0.01 0.00 0.00 0.00 0.00 30.24 24.77 3d23 n GLN 274 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3d23 n GLY 275 N -1.84 0.30 3.77 1.08 0.00 -1.26 -4.94 105.19 102.29 3d23 n GLY 275 Ca -0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 3d23 n GLY 275 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d23 s ARG 276 N -1.61 4.00 0.10 1.61 0.52 -0.82 -5.05 118.95 117.70 3d23 s ARG 276 Ca 0.00 1.81 0.03 0.00 -0.52 0.00 0.00 55.73 57.04 3d23 s ARG 276 Cb 0.00 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.82 3d23 s ARG 276 CO 0.00 -0.36 0.16 -0.65 0.02 0.00 0.00 175.30 174.47 3d23 s GLN 277 N -2.40 3.13 -0.20 3.54 -0.21 -1.26 -4.79 119.66 117.46 3d23 s GLN 277 Ca 0.59 -0.65 0.01 0.00 0.02 0.00 0.00 55.36 55.33 3d23 s GLN 277 Cb -0.30 -2.83 0.03 0.00 1.00 0.00 0.00 33.01 30.91 3d23 s GLN 277 CO 0.37 0.55 -0.17 0.42 -2.12 0.00 0.00 175.29 174.34 3d23 s ILE 278 N -1.56 2.13 -1.24 1.08 1.01 -0.51 -4.78 121.20 117.34 3d23 s ILE 278 Ca 0.32 -1.11 -0.11 0.00 0.00 0.00 0.00 60.65 59.75 3d23 s ILE 278 Cb -0.12 -2.00 -0.01 0.00 0.01 0.00 0.00 42.46 40.35 3d23 s ILE 278 CO 0.25 0.38 0.68 0.18 0.00 0.00 0.00 174.94 176.43 3d23 n LEU 279 N 4.58 -2.82 -2.55 2.97 4.77 -1.26 -2.16 117.00 120.52 3d23 n LEU 279 Ca -0.19 -0.97 -0.17 0.00 -0.03 0.00 0.00 56.01 54.65 3d23 n LEU 279 Cb 0.48 -2.43 -0.00 0.00 -2.33 0.00 0.00 43.42 39.14 3d23 n LEU 279 CO 0.25 0.44 -0.17 0.61 -1.33 0.00 0.00 177.39 177.18 3d23 n GLY 280 N -1.73 -0.50 3.12 -0.72 0.00 -1.26 -4.97 105.19 99.12 3d23 n GLY 280 Ca -0.19 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.75 3d23 n GLY 280 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3d23 s SER 281 N -2.15 0.88 0.00 1.61 0.15 -0.92 -5.07 113.70 108.21 3d23 s SER 281 Ca 0.06 -0.88 0.01 0.00 0.70 0.00 0.00 55.95 55.84 3d23 s SER 281 Cb -0.03 0.11 -0.01 0.00 -1.71 0.00 0.00 66.02 64.38 3d23 s SER 281 CO 0.07 -0.43 0.04 0.00 1.20 0.00 0.00 173.24 174.12 3d23 s THR 283 N -1.07 2.13 0.33 0.00 -4.23 -1.26 -4.70 115.64 106.85 3d23 s THR 283 Ca 0.00 -1.76 -0.29 0.00 -1.18 0.00 0.00 61.69 58.46 3d23 s THR 283 Cb 0.01 -2.89 -0.11 0.00 1.34 0.00 0.00 72.50 70.85 3d23 s THR 283 CO 0.03 0.00 1.40 -0.36 -0.54 0.00 0.00 174.62 175.15 3d23 s PHE 284 N -2.65 2.87 -0.20 3.99 2.99 -1.26 -4.97 117.98 118.75 3d23 s PHE 284 Ca 0.37 1.25 -0.06 0.00 0.00 0.00 0.00 56.93 58.50 3d23 s PHE 284 Cb 0.05 -3.83 -0.03 0.00 0.00 0.00 0.00 43.02 39.21 3d23 s PHE 284 CO 0.20 -2.43 0.02 -2.00 -0.00 0.00 0.00 175.22 171.01 3d23 s GLU 285 N -1.65 3.66 -0.02 0.44 2.56 -1.26 -4.97 118.70 117.46 3d23 s GLU 285 Ca 0.52 -0.49 0.04 0.00 0.00 0.00 0.00 54.97 55.03 3d23 s GLU 285 Cb -0.43 -3.13 0.06 0.00 2.00 0.00 0.00 34.13 32.63 3d23 s GLU 285 CO 0.55 0.02 0.95 -0.40 -0.56 0.00 0.00 175.26 175.81 3d23 n ASP 286 N 4.25 0.56 0.01 -1.70 5.75 -1.26 -4.01 116.55 120.15 3d23 n ASP 286 Ca -0.17 -2.04 0.13 0.00 -0.01 0.00 0.00 54.79 52.70 3d23 n ASP 286 Cb 0.52 -0.20 0.40 0.00 -1.03 0.00 0.00 41.12 40.81 3d23 n ASP 286 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3d23 n GLU 287 N -0.30 0.03 -3.73 0.11 1.02 -1.26 -4.76 120.64 111.75 3d23 n GLU 287 Ca 0.03 0.01 -0.36 0.00 -0.02 0.00 0.00 57.16 56.82 3d23 n GLU 287 Cb 0.63 -1.52 -0.10 0.00 -0.02 0.00 0.00 31.44 30.43 3d23 n GLU 287 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d23 s LEU 288 N -3.12 3.98 0.72 -4.62 1.43 -1.26 -4.58 118.68 111.23 3d23 s LEU 288 Ca 0.12 0.06 -0.11 0.00 -1.03 0.00 0.00 54.13 53.17 3d23 s LEU 288 Cb 0.18 -2.06 0.02 0.00 0.03 0.00 0.00 46.19 44.36 3d23 s LEU 288 CO 0.63 0.07 1.07 0.00 0.23 0.00 0.00 176.35 178.35 3d23 s ALA 289 N 1.03 2.56 0.21 4.21 0.00 -1.26 -4.52 121.76 123.99 3d23 s ALA 289 Ca 0.07 0.02 -0.15 0.00 0.00 0.00 0.00 51.96 51.89 3d23 s ALA 289 Cb -0.14 -3.16 0.22 0.00 0.00 0.00 0.00 23.12 20.04 3d23 s ALA 289 CO 0.04 -1.37 1.61 -1.35 0.00 0.00 0.00 175.76 174.70 3d23 h PRO 290 N -0.82 -0.05 -0.01 0.00 0.11 -1.89 -1.98 132.00 127.36 3d23 h PRO 290 Ca -0.45 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.63 3d23 h PRO 290 Cb 1.23 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3d23 h PRO 290 CO 0.57 -0.03 -0.17 0.66 -0.21 0.00 0.00 178.00 178.81 3d23 h SER 291 N -0.05 0.02 0.59 -2.05 4.64 -1.96 -0.21 113.55 114.53 3d23 h SER 291 Ca 0.29 -0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.58 3d23 h SER 291 Cb 0.50 -0.01 0.01 0.00 -0.31 0.00 0.00 62.40 62.59 3d23 h SER 291 CO -0.67 0.20 -0.29 0.44 -0.87 0.00 0.00 176.83 175.64 3d23 h ASP 292 N 0.02 -0.67 -1.00 4.97 3.32 -1.73 -1.01 116.42 120.31 3d23 h ASP 292 Ca 0.00 -0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.10 3d23 h ASP 292 Cb 0.32 0.17 -0.07 0.00 0.22 0.00 0.00 39.33 39.98 3d23 h ASP 292 CO 0.02 -0.39 0.65 0.58 -1.72 0.00 0.00 179.24 178.38 3d23 h VAL 293 N -0.93 1.08 0.61 -1.35 2.07 -1.05 -2.49 116.25 114.19 3d23 h VAL 293 Ca -0.08 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 67.01 3d23 h VAL 293 Cb 0.65 -0.19 0.01 0.00 -1.52 0.00 0.00 31.29 30.24 3d23 h VAL 293 CO 0.13 0.21 -0.29 0.22 0.02 0.00 0.00 177.57 177.87 3d23 h TYR 294 N 1.17 -0.76 -1.00 1.57 3.20 -0.99 0.09 116.97 120.25 3d23 h TYR 294 Ca 0.43 -0.02 0.30 0.00 3.14 0.00 0.00 58.73 62.59 3d23 h TYR 294 Cb 0.18 0.25 -0.18 0.00 1.54 0.00 0.00 36.73 38.51 3d23 h TYR 294 CO -0.00 -0.43 0.13 0.37 -1.64 0.00 0.00 178.16 176.59 3d23 h GLN 295 N -1.13 0.00 0.02 1.82 4.15 -1.10 -0.32 115.11 118.56 3d23 h GLN 295 Ca -0.08 -0.00 -0.25 0.00 0.77 0.00 0.00 58.65 59.09 3d23 h GLN 295 Cb 0.67 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.33 3d23 h GLN 295 CO 0.14 0.00 -1.27 1.96 -1.93 0.00 0.00 178.83 177.73 3d23 h GLN 296 N 0.00 0.03 0.00 1.69 4.20 -1.16 -0.85 115.11 119.03 3d23 h GLN 296 Ca 0.66 -0.06 -0.35 0.00 0.06 0.00 0.00 58.65 58.96 3d23 h GLN 296 Cb 1.45 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 29.19 3d23 h GLN 296 CO -0.90 0.87 -2.30 1.28 -0.67 0.00 0.00 178.83 177.11 3d23 n LEU 297 N -3.28 0.84 -0.11 1.46 4.77 -0.01 -4.62 117.00 116.06 3d23 n LEU 297 Ca -0.07 -0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.75 3d23 n LEU 297 Cb 0.99 0.09 -0.13 0.00 -2.33 0.00 0.00 43.42 42.04 3d23 n LEU 297 CO 0.47 0.59 -1.19 0.00 -1.33 0.00 0.00 177.39 175.92 3d23 n ALA 298 N -2.84 1.51 0.00 -1.18 0.00 -0.19 -5.08 120.51 112.73 3d23 n ALA 298 Ca -0.34 -1.16 0.00 0.00 0.00 0.00 0.00 53.44 51.94 3d23 n ALA 298 Cb 1.06 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 20.40 3d23 n ALA 298 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91