#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3im9 n SER -6 N 0.00 0.46 0.10 4.39 3.41 -1.26 -1.34 113.62 119.38 3im9 n SER -6 Ca 0.00 0.71 0.13 0.00 -0.26 0.00 0.00 58.87 59.45 3im9 n SER -6 Cb 0.00 -0.76 0.43 0.00 -0.26 0.00 0.00 64.21 63.62 3im9 n SER -6 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3im9 n SER -5 N -2.12 0.74 0.00 4.04 3.41 -1.26 -4.91 113.62 113.53 3im9 n SER -5 Ca -0.01 0.58 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 3im9 n SER -5 Cb 0.04 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.21 3im9 n SER -5 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3im9 n GLY -4 N 1.13 0.60 3.31 5.00 0.00 -0.45 -5.00 105.19 109.79 3im9 n GLY -4 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 3im9 n GLY -4 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3im9 s LEU -3 N 0.00 5.07 -0.36 0.99 1.43 -1.26 -4.89 118.68 119.66 3im9 s LEU -3 Ca 0.00 -1.33 -0.16 0.00 -1.03 0.00 0.00 54.13 51.61 3im9 s LEU -3 Cb 0.00 -2.02 -0.00 0.00 0.03 0.00 0.00 46.19 44.20 3im9 s LEU -3 CO 0.00 -0.50 0.41 -0.69 0.23 0.00 0.00 176.35 175.80 3im9 s VAL -2 N 1.49 5.11 0.48 -1.59 1.01 -1.26 -3.43 120.40 122.21 3im9 s VAL -2 Ca 0.03 0.06 -0.23 0.00 0.00 0.00 0.00 61.98 61.84 3im9 s VAL -2 Cb -0.22 -3.90 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 3im9 s VAL -2 CO 0.04 -0.18 1.23 -2.16 0.00 0.00 0.00 175.10 174.02 3im9 s PRO -1 N 2.14 3.58 0.12 2.72 0.04 -1.26 -4.93 135.00 137.41 3im9 s PRO -1 Ca 0.14 1.92 -0.32 0.00 0.04 0.00 0.00 61.00 62.78 3im9 s PRO -1 Cb -0.16 -2.37 -0.11 0.00 0.04 0.00 0.00 34.50 31.89 3im9 s PRO -1 CO 0.12 -0.74 1.82 -2.13 0.04 0.00 0.00 177.00 176.12 3im9 n ARG 0 N -0.63 2.75 -2.43 4.56 0.63 -1.26 -4.73 116.66 115.55 3im9 n ARG 0 Ca 0.08 1.00 0.00 0.00 -0.92 0.00 0.00 57.85 58.01 3im9 n ARG 0 Cb 0.47 -2.88 0.00 0.00 0.45 0.00 0.00 32.46 30.50 3im9 n ARG 0 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3im9 n GLY 1 N 4.19 -1.08 2.46 5.14 0.00 -1.23 -4.87 105.19 109.80 3im9 n GLY 1 Ca 0.18 -1.55 -0.17 0.00 0.00 0.00 0.00 46.02 44.48 3im9 n GLY 1 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3im9 n SER 2 N 3.00 -5.03 -4.89 1.61 7.64 -1.20 -4.89 113.62 109.86 3im9 n SER 2 Ca 0.00 0.35 -0.29 0.00 1.01 0.00 0.00 58.87 59.94 3im9 n SER 2 Cb 0.00 -4.03 -0.04 0.00 -1.01 0.00 0.00 64.21 59.13 3im9 n SER 2 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 3im9 s HIS 3 N -2.66 3.42 -0.01 1.43 3.76 -0.93 -4.94 115.29 115.35 3im9 s HIS 3 Ca 0.00 0.15 0.05 0.00 -0.15 0.00 0.00 55.06 55.10 3im9 s HIS 3 Cb 0.00 -1.68 -0.01 0.00 1.11 0.00 0.00 32.58 32.00 3im9 s HIS 3 CO 0.00 0.55 -0.15 1.41 -0.85 0.00 0.00 174.74 175.69 3im9 s MET 4 N -2.82 1.25 -0.04 1.40 1.75 -1.26 -1.72 119.30 117.86 3im9 s MET 4 Ca 0.34 -0.56 0.05 0.00 -1.25 0.00 0.00 55.69 54.26 3im9 s MET 4 Cb -0.12 -1.21 -0.01 0.00 2.84 0.00 0.00 34.83 36.34 3im9 s MET 4 CO 0.27 0.33 -0.18 0.00 -0.65 0.00 0.00 175.02 174.79 3im9 s ALA 5 N -0.38 1.60 -0.08 4.11 0.00 -0.39 -0.90 121.76 125.72 3im9 s ALA 5 Ca 0.06 -0.75 -0.12 0.00 0.00 0.00 0.00 51.96 51.15 3im9 s ALA 5 Cb -0.06 -0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.50 3im9 s ALA 5 CO -0.01 0.31 0.30 0.96 0.00 0.00 0.00 175.76 177.32 3im9 s ILE 6 N -0.05 5.24 0.06 0.00 -4.36 -0.90 -0.91 121.20 120.29 3im9 s ILE 6 Ca -0.02 0.59 0.03 0.00 -0.26 0.00 0.00 60.65 60.98 3im9 s ILE 6 Cb -0.11 -3.61 -0.03 0.00 1.25 0.00 0.00 42.46 39.96 3im9 s ILE 6 CO 0.02 0.53 -0.09 0.27 0.24 0.00 0.00 174.94 175.91 3im9 s ILE 7 N -0.61 0.73 -0.05 8.37 -4.36 0.55 -2.64 121.20 123.19 3im9 s ILE 7 Ca 0.19 -1.30 0.02 0.00 -0.26 0.00 0.00 60.65 59.30 3im9 s ILE 7 Cb -0.14 -0.93 0.01 0.00 1.25 0.00 0.00 42.46 42.65 3im9 s ILE 7 CO 0.08 -0.43 -0.09 -0.36 0.24 0.00 0.00 174.94 174.37 3im9 s PHE 8 N -1.77 1.15 0.74 1.37 0.40 -0.74 -1.40 117.98 117.73 3im9 s PHE 8 Ca -0.04 -0.38 -0.11 0.00 -0.60 0.00 0.00 56.93 55.80 3im9 s PHE 8 Cb -0.07 -0.88 0.03 0.00 0.51 0.00 0.00 43.02 42.61 3im9 s PHE 8 CO 0.00 -0.22 1.10 -1.25 0.70 0.00 0.00 175.22 175.55 3im9 s PRO 9 N 0.65 2.61 0.00 0.24 0.04 -1.26 -0.99 135.00 136.29 3im9 s PRO 9 Ca -0.12 0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.45 3im9 s PRO 9 Cb -0.14 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.41 3im9 s PRO 9 CO 0.02 -1.23 0.00 0.41 0.04 0.00 0.00 177.00 176.25 3im9 n GLY 10 N -2.70 7.37 3.56 0.56 0.00 -1.22 -3.75 105.19 109.03 3im9 n GLY 10 Ca 0.07 -1.96 -0.50 0.00 0.00 0.00 0.00 46.02 43.62 3im9 n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3im9 n GLN 11 N 0.00 0.99 0.00 1.61 -0.06 -1.26 -1.66 117.38 117.00 3im9 n GLN 11 Ca 0.00 0.35 0.00 0.00 -2.00 0.00 0.00 57.00 55.35 3im9 n GLN 11 Cb 0.00 -1.85 0.00 0.00 -4.06 0.00 0.00 30.24 24.33 3im9 n GLN 11 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3im9 n GLY 12 N 2.06 2.91 0.23 1.69 0.00 -1.26 -4.93 105.19 105.89 3im9 n GLY 12 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 3im9 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3im9 n ALA 13 N -1.12 3.46 -0.95 4.61 0.00 -0.66 -4.97 120.51 120.88 3im9 n ALA 13 Ca 0.00 -0.47 -0.31 0.00 0.00 0.00 0.00 53.44 52.67 3im9 n ALA 13 Cb 0.00 -1.02 0.14 0.00 0.00 0.00 0.00 19.45 18.58 3im9 n ALA 13 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 3im9 s GLN 14 N -2.65 1.29 -0.25 0.00 0.00 -1.26 -4.30 119.66 112.49 3im9 s GLN 14 Ca 0.19 1.24 -0.24 0.00 -0.00 0.00 0.00 55.36 56.55 3im9 s GLN 14 Cb 0.18 -1.78 0.07 0.00 0.00 0.00 0.00 33.01 31.48 3im9 s GLN 14 CO 0.60 -2.34 0.67 -1.59 0.00 0.00 0.00 175.29 172.63 3im9 s LYS 15 N -4.76 0.79 0.20 9.60 -2.85 -1.26 -5.04 119.74 116.41 3im9 s LYS 15 Ca 0.64 0.91 -0.32 0.00 -1.00 0.00 0.00 55.97 56.21 3im9 s LYS 15 Cb -0.20 0.39 -0.12 0.00 -2.06 0.00 0.00 37.83 35.84 3im9 s LYS 15 CO 0.58 -0.10 1.72 0.08 0.10 0.00 0.00 175.35 177.73 3im9 s VAL 16 N 0.31 2.13 0.00 1.79 1.01 -1.26 -1.59 120.40 122.78 3im9 s VAL 16 Ca -0.00 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.03 3im9 s VAL 16 Cb -0.05 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.30 3im9 s VAL 16 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.73 3im9 n GLY 17 N 3.99 0.66 3.68 4.51 0.00 0.81 -4.99 105.19 113.85 3im9 n GLY 17 Ca 0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.73 3im9 n GLY 17 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3im9 n MET 18 N -1.12 2.33 -0.92 1.61 0.00 -0.62 -1.27 117.12 117.13 3im9 n MET 18 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 57.70 58.54 3im9 n MET 18 Cb 0.00 -2.65 0.00 0.00 0.00 0.00 0.00 33.22 30.57 3im9 n MET 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3im9 n ALA 19 N 4.34 0.00 0.25 3.17 0.00 -1.26 -4.44 120.51 122.57 3im9 n ALA 19 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.73 3im9 n ALA 19 Cb 0.31 -0.18 0.67 0.00 0.00 0.00 0.00 19.45 20.25 3im9 n ALA 19 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 3im9 h GLN 20 N 2.34 0.00 0.00 0.00 3.07 -1.54 -1.10 115.11 117.87 3im9 h GLN 20 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 58.65 58.70 3im9 h GLN 20 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.57 3im9 h GLN 20 CO 0.00 0.14 -0.18 0.38 0.09 0.00 0.00 178.83 179.27 3im9 h ASP 21 N 0.00 0.00 0.43 0.06 -0.00 -1.91 -3.20 116.42 111.80 3im9 h ASP 21 Ca -0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.03 56.73 3im9 h ASP 21 Cb 0.35 0.00 0.02 0.00 -0.00 0.00 0.00 39.33 39.70 3im9 h ASP 21 CO 0.02 0.18 -1.33 -0.07 -0.00 0.00 0.00 179.24 178.04 3im9 h LEU 22 N 0.00 0.64 -9.49 0.15 3.38 -1.60 -3.42 115.31 104.96 3im9 h LEU 22 Ca -0.00 -0.67 -0.53 0.00 0.09 0.00 0.00 57.88 56.77 3im9 h LEU 22 Cb 0.86 -0.21 0.03 0.00 0.09 0.00 0.00 40.66 41.43 3im9 h LEU 22 CO 0.02 1.52 0.99 0.12 0.09 0.00 0.00 178.44 181.18 3im9 s PHE 23 N -2.69 2.53 -0.79 1.13 5.99 -1.14 -1.12 117.98 121.89 3im9 s PHE 23 Ca -0.07 0.34 0.00 0.00 0.00 0.00 0.00 56.93 57.21 3im9 s PHE 23 Cb 0.06 -3.99 0.00 0.00 0.00 0.00 0.00 43.02 39.09 3im9 s PHE 23 CO 0.91 -3.90 0.00 0.09 -0.00 0.00 0.00 175.22 172.32 3im9 n ASN 24 N 5.23 -5.51 -0.05 6.13 3.02 -1.26 -4.81 115.26 118.02 3im9 n ASN 24 Ca 0.16 0.19 0.01 0.00 -0.03 0.00 0.00 54.58 54.90 3im9 n ASN 24 Cb 0.40 -3.67 -0.00 0.00 -0.61 0.00 0.00 39.78 35.90 3im9 n ASN 24 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3im9 n ASN 25 N -0.94 0.59 -3.67 6.41 3.02 -0.27 -4.98 115.26 115.41 3im9 n ASN 25 Ca -0.07 -0.80 -0.11 0.00 -0.03 0.00 0.00 54.58 53.57 3im9 n ASN 25 Cb 0.51 0.59 -0.11 0.00 -0.61 0.00 0.00 39.78 40.16 3im9 n ASN 25 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3im9 s ASN 26 N -0.84 -0.04 0.25 6.41 3.84 -1.04 -5.03 114.94 118.49 3im9 s ASN 26 Ca 0.02 0.79 -0.05 0.00 0.21 0.00 0.00 52.86 53.84 3im9 s ASN 26 Cb 0.02 0.97 0.28 0.00 -0.55 0.00 0.00 41.25 41.97 3im9 s ASN 26 CO 0.08 -0.23 1.83 0.44 -2.79 0.00 0.00 177.10 176.43 3im9 h ASP 27 N 8.05 0.99 -0.11 -4.21 3.32 -1.94 -0.39 116.42 122.13 3im9 h ASP 27 Ca -0.19 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 56.65 3im9 h ASP 27 Cb 1.12 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.42 3im9 h ASP 27 CO 0.16 0.86 -0.24 1.56 -1.72 0.00 0.00 179.24 179.86 3im9 h GLN 28 N 1.07 0.37 -0.93 3.56 7.50 -1.94 -0.69 115.11 124.05 3im9 h GLN 28 Ca 0.25 -0.24 -0.01 0.00 0.50 0.00 0.00 58.65 59.15 3im9 h GLN 28 Cb 0.16 0.03 -0.04 0.00 0.05 0.00 0.00 27.48 27.68 3im9 h GLN 28 CO -0.03 0.84 0.54 0.00 -1.50 0.00 0.00 178.83 178.69 3im9 h ALA 29 N 0.52 1.19 -0.04 3.87 0.00 -1.67 -2.86 119.26 120.27 3im9 h ALA 29 Ca 0.00 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 3im9 h ALA 29 Cb 0.84 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3im9 h ALA 29 CO 0.05 0.67 -0.41 1.15 0.00 0.00 0.00 179.25 180.71 3im9 h THR 30 N 1.29 1.31 -0.90 0.00 2.02 -0.82 -1.38 112.91 114.43 3im9 h THR 30 Ca 0.33 -1.47 0.05 0.00 0.77 0.00 0.00 66.41 66.09 3im9 h THR 30 Cb -0.02 1.74 -0.06 0.00 -1.74 0.00 0.00 68.15 68.07 3im9 h THR 30 CO -0.06 0.43 0.57 -0.08 0.37 0.00 0.00 175.52 176.75 3im9 h GLU 31 N 0.08 1.05 -0.09 6.66 4.81 -0.90 0.90 114.58 127.09 3im9 h GLU 31 Ca 0.01 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3im9 h GLU 31 Cb 0.77 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 3im9 h GLU 31 CO 0.06 0.70 -0.05 0.82 -0.73 0.00 0.00 179.01 179.81 3im9 h ILE 32 N 1.09 1.33 -0.85 2.32 1.08 -1.31 0.11 117.51 121.28 3im9 h ILE 32 Ca 0.37 -1.09 -0.01 0.00 -0.39 0.00 0.00 64.86 63.73 3im9 h ILE 32 Cb 0.07 1.87 -0.04 0.00 -3.07 0.00 0.00 36.82 35.65 3im9 h ILE 32 CO -0.14 0.31 0.48 -0.07 -0.69 0.00 0.00 178.15 178.04 3im9 h LEU 33 N -0.19 1.05 -0.82 1.44 3.38 -0.96 -1.09 115.31 118.12 3im9 h LEU 33 Ca 0.02 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 3im9 h LEU 33 Cb 0.51 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 3im9 h LEU 33 CO 0.01 0.83 -0.57 0.74 0.09 0.00 0.00 178.44 179.55 3im9 h THR 34 N 1.18 1.36 -0.37 0.22 2.02 -0.83 -1.67 112.91 114.82 3im9 h THR 34 Ca 0.30 -1.99 -0.02 0.00 0.77 0.00 0.00 66.41 65.47 3im9 h THR 34 Cb 0.01 2.09 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 3im9 h THR 34 CO -0.05 0.56 0.16 -1.28 0.37 0.00 0.00 175.52 175.28 3im9 h SER 35 N 0.00 0.50 -0.42 4.18 0.87 -0.10 0.56 113.55 119.14 3im9 h SER 35 Ca -0.01 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.39 3im9 h SER 35 Cb 1.04 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.85 3im9 h SER 35 CO 0.07 0.52 0.20 0.00 -0.53 0.00 0.00 176.83 177.09 3im9 h ALA 36 N 1.01 0.54 -0.82 6.23 0.00 -1.06 -1.38 119.26 123.78 3im9 h ALA 36 Ca 0.13 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3im9 h ALA 36 Cb 0.16 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3im9 h ALA 36 CO -0.01 0.09 0.52 0.00 0.00 0.00 0.00 179.25 179.85 3im9 h ALA 37 N 1.05 1.09 0.00 0.00 0.00 -0.92 -1.45 119.26 119.03 3im9 h ALA 37 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3im9 h ALA 37 Cb 0.11 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 3im9 h ALA 37 CO -0.02 0.33 -0.08 0.87 0.00 0.00 0.00 179.25 180.35 3im9 h LYS 38 N 1.00 0.00 0.11 0.00 1.79 -0.58 -3.35 116.57 115.55 3im9 h LYS 38 Ca 0.33 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.46 3im9 h LYS 38 Cb 0.04 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 3im9 h LYS 38 CO -0.13 0.08 -1.87 1.15 -1.08 0.00 0.00 179.45 177.61 3im9 h THR 39 N 0.00 0.69 -4.00 -0.16 2.02 -0.70 -3.49 112.91 107.29 3im9 h THR 39 Ca -0.00 -2.33 -0.47 0.00 0.77 0.00 0.00 66.41 64.38 3im9 h THR 39 Cb 0.87 2.49 -0.00 0.00 -1.74 0.00 0.00 68.15 69.77 3im9 h THR 39 CO 0.01 0.82 0.27 -0.76 0.37 0.00 0.00 175.52 176.23 3im9 s LEU 40 N -7.19 3.80 -0.01 2.58 1.43 -0.60 -4.98 118.68 113.72 3im9 s LEU 40 Ca -0.23 1.47 0.10 0.00 -1.03 0.00 0.00 54.13 54.44 3im9 s LEU 40 Cb 0.06 -4.35 0.29 0.00 0.03 0.00 0.00 46.19 42.22 3im9 s LEU 40 CO 0.75 -0.44 1.22 -0.90 0.23 0.00 0.00 176.35 177.21 3im9 n ASP 41 N -1.13 1.83 -4.12 2.29 5.75 -1.26 -4.82 116.55 115.10 3im9 n ASP 41 Ca 0.05 -2.03 -0.17 0.00 -0.01 0.00 0.00 54.79 52.63 3im9 n ASP 41 Cb 0.54 -0.25 -0.10 0.00 -1.03 0.00 0.00 41.12 40.29 3im9 n ASP 41 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3im9 s PHE 42 N -1.59 1.53 -1.15 2.11 -0.71 -1.26 -5.06 117.98 111.85 3im9 s PHE 42 Ca 0.22 -1.31 -0.18 0.00 -1.04 0.00 0.00 56.93 54.62 3im9 s PHE 42 Cb 0.12 -0.84 0.10 0.00 -1.21 0.00 0.00 43.02 41.19 3im9 s PHE 42 CO 0.14 -0.47 1.50 0.34 -1.34 0.00 0.00 175.22 175.39 3im9 s ASP 43 N -3.33 6.78 0.24 1.98 -1.08 -1.26 -4.80 116.67 115.20 3im9 s ASP 43 Ca 0.37 -2.27 -0.06 0.00 -0.52 0.00 0.00 52.55 50.07 3im9 s ASP 43 Cb 0.06 -2.51 0.25 0.00 -1.46 0.00 0.00 42.92 39.27 3im9 s ASP 43 CO 0.16 -1.14 1.85 -0.29 0.52 0.00 0.00 175.17 176.27 3im9 h ILE 44 N 5.70 1.25 -0.27 4.11 6.09 -1.91 -0.97 117.51 131.51 3im9 h ILE 44 Ca 0.31 -0.68 -0.14 0.00 -1.37 0.00 0.00 64.86 62.98 3im9 h ILE 44 Cb 0.93 0.17 -0.01 0.00 0.47 0.00 0.00 36.82 38.38 3im9 h ILE 44 CO 1.35 0.29 -0.42 -0.07 -3.07 0.00 0.00 178.15 176.23 3im9 h LEU 45 N 1.17 0.71 -0.90 2.19 3.38 -1.92 0.28 115.31 120.22 3im9 h LEU 45 Ca 0.29 -0.33 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3im9 h LEU 45 Cb 0.08 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3im9 h LEU 45 CO -0.04 1.04 0.33 -0.08 0.09 0.00 0.00 178.44 179.78 3im9 h GLU 46 N 0.54 1.13 -0.51 1.13 4.22 -1.91 0.36 114.58 119.54 3im9 h GLU 46 Ca 0.04 -0.19 -0.10 0.00 0.08 0.00 0.00 59.36 59.20 3im9 h GLU 46 Cb 0.95 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 3im9 h GLU 46 CO 0.09 0.90 -0.06 1.15 -2.18 0.00 0.00 179.01 178.91 3im9 h THR 47 N 1.11 1.26 -0.17 0.32 2.02 -0.69 0.10 112.91 116.87 3im9 h THR 47 Ca 0.26 -1.16 -0.09 0.00 0.77 0.00 0.00 66.41 66.19 3im9 h THR 47 Cb 0.17 0.93 -0.00 0.00 -1.74 0.00 0.00 68.15 67.51 3im9 h THR 47 CO -0.03 0.41 -0.23 0.24 0.37 0.00 0.00 175.52 176.28 3im9 h MET 48 N 0.83 0.45 0.09 6.66 2.86 -0.60 -3.24 114.93 121.99 3im9 h MET 48 Ca 0.14 -0.26 -0.33 0.00 -2.06 0.00 0.00 59.70 57.19 3im9 h MET 48 Cb 0.58 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 3im9 h MET 48 CO 0.04 0.85 -1.82 0.74 1.06 0.00 0.00 176.91 177.77 3im9 h PHE 49 N 0.09 0.36 0.00 -0.22 0.04 -0.60 0.23 116.94 116.85 3im9 h PHE 49 Ca 0.02 -0.27 0.00 0.00 2.80 0.00 0.00 57.97 60.52 3im9 h PHE 49 Cb 0.79 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.93 3im9 h PHE 49 CO 0.09 1.50 -0.47 0.25 -0.60 0.00 0.00 178.31 179.07 3im9 n THR 50 N -3.37 0.00 -3.85 -1.55 -2.24 -0.21 -2.98 114.28 100.09 3im9 n THR 50 Ca -0.25 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.16 3im9 n THR 50 Cb 1.05 -0.26 0.03 0.00 -2.10 0.00 0.00 70.33 69.06 3im9 n THR 50 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3im9 n ASP 51 N -1.05 -4.85 0.25 3.42 4.64 0.19 -4.87 116.55 114.28 3im9 n ASP 51 Ca 0.00 -1.13 0.13 0.00 -1.38 0.00 0.00 54.79 52.41 3im9 n ASP 51 Cb 0.16 -2.61 0.62 0.00 -1.04 0.00 0.00 41.12 38.26 3im9 n ASP 51 CO 0.00 0.00 0.00 1.05 -0.82 0.00 0.00 177.20 177.43 3im9 h GLU 52 N -2.14 0.00 -0.03 -0.67 4.11 -1.90 -1.43 114.58 112.52 3im9 h GLU 52 Ca -0.68 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.75 3im9 h GLU 52 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 3im9 h GLU 52 CO 0.49 0.13 0.00 0.39 0.07 0.00 0.00 179.01 180.09 3im9 n GLU 53 N -3.35 1.40 -3.96 1.06 1.02 -1.26 -4.96 120.64 110.58 3im9 n GLU 53 Ca -0.00 -0.58 -0.32 0.00 -0.02 0.00 0.00 57.16 56.24 3im9 n GLU 53 Cb 0.33 -1.45 0.01 0.00 -0.02 0.00 0.00 31.44 30.31 3im9 n GLU 53 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3im9 n GLY 54 N 1.07 -0.49 0.46 0.62 0.00 -0.54 -4.90 105.19 101.42 3im9 n GLY 54 Ca 0.20 0.17 0.05 0.00 0.00 0.00 0.00 46.02 46.43 3im9 n GLY 54 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3im9 n LYS 55 N -4.54 1.69 0.02 1.61 2.85 -1.26 -4.66 118.16 113.87 3im9 n LYS 55 Ca 0.05 -1.54 0.04 0.00 -1.05 0.00 0.00 58.31 55.81 3im9 n LYS 55 Cb 0.52 -1.20 0.42 0.00 -0.65 0.00 0.00 35.03 34.11 3im9 n LYS 55 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 3im9 h LEU 56 N 1.74 0.44 -0.61 -5.58 5.85 -1.90 -2.01 115.31 113.23 3im9 h LEU 56 Ca 0.00 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3im9 h LEU 56 Cb 0.55 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3im9 h LEU 56 CO 0.00 0.35 0.00 0.61 -0.34 0.00 0.00 178.44 179.06 3im9 n GLY 57 N -1.39 -0.30 3.64 3.75 0.00 -1.26 -3.16 105.19 106.47 3im9 n GLY 57 Ca 0.02 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 3im9 n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3im9 s GLU 58 N -1.90 4.18 0.57 1.61 2.02 -0.76 -4.87 118.70 119.55 3im9 s GLU 58 Ca 0.32 0.74 0.27 0.00 0.02 0.00 0.00 54.97 56.32 3im9 s GLU 58 Cb 0.16 -3.62 1.51 0.00 0.10 0.00 0.00 34.13 32.28 3im9 s GLU 58 CO 0.26 -0.40 2.01 0.00 0.02 0.00 0.00 175.26 177.15 3im9 h THR 59 N 5.34 0.54 0.00 3.63 1.03 -1.87 0.26 112.91 121.84 3im9 h THR 59 Ca -0.27 0.00 -0.03 0.00 -0.01 0.00 0.00 66.41 66.11 3im9 h THR 59 Cb 1.12 0.74 -0.00 0.00 -1.07 0.00 0.00 68.15 68.94 3im9 h THR 59 CO 0.81 0.00 -0.12 1.05 -0.01 0.00 0.00 175.52 177.25 3im9 h GLU 60 N 0.00 0.00 0.07 0.00 9.09 -1.91 -1.06 114.58 120.77 3im9 h GLU 60 Ca 0.18 0.00 -0.37 0.00 0.05 0.00 0.00 59.36 59.22 3im9 h GLU 60 Cb 0.86 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.92 3im9 h GLU 60 CO -0.00 0.12 -2.15 0.09 0.05 0.00 0.00 179.01 177.12 3im9 n ASN 61 N -4.16 1.88 -0.06 3.06 3.02 0.80 -4.51 115.26 115.30 3im9 n ASN 61 Ca -0.02 0.11 -0.06 0.00 -0.03 0.00 0.00 54.58 54.57 3im9 n ASN 61 Cb 0.20 -0.57 0.12 0.00 -0.61 0.00 0.00 39.78 38.92 3im9 n ASN 61 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3im9 h THR 62 N 0.04 1.27 0.46 3.41 2.02 -0.95 -2.06 112.91 117.09 3im9 h THR 62 Ca -0.47 -1.31 -0.02 0.00 0.77 0.00 0.00 66.41 65.38 3im9 h THR 62 Cb 2.00 1.24 0.00 0.00 -1.74 0.00 0.00 68.15 69.66 3im9 h THR 62 CO 0.03 0.43 -0.24 1.56 0.37 0.00 0.00 175.52 177.67 3im9 h GLN 63 N 0.61 -0.62 0.00 6.66 4.20 -1.43 0.04 115.11 124.56 3im9 h GLN 63 Ca 0.09 0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.78 3im9 h GLN 63 Cb 0.71 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.62 3im9 h GLN 63 CO 0.05 -0.42 -0.26 -1.00 -0.67 0.00 0.00 178.83 176.54 3im9 h PRO 64 N -0.65 0.00 -0.54 1.46 0.13 -1.78 -1.60 132.00 129.02 3im9 h PRO 64 Ca -0.06 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.02 3im9 h PRO 64 Cb 0.51 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.62 3im9 h PRO 64 CO 0.09 0.26 0.12 0.00 -0.23 0.00 0.00 178.00 178.24 3im9 h ALA 65 N 1.74 0.72 -0.13 -0.56 0.00 -0.87 -0.08 119.26 120.08 3im9 h ALA 65 Ca -0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.63 3im9 h ALA 65 Cb 0.54 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3im9 h ALA 65 CO 0.03 0.43 -0.13 -0.07 0.00 0.00 0.00 179.25 179.52 3im9 h LEU 66 N 0.78 0.33 -0.75 0.00 3.38 -0.78 -1.04 115.31 117.23 3im9 h LEU 66 Ca 0.17 -0.48 0.09 0.00 0.09 0.00 0.00 57.88 57.75 3im9 h LEU 66 Cb 0.36 -0.09 -0.07 0.00 0.09 0.00 0.00 40.66 40.94 3im9 h LEU 66 CO 0.00 0.74 0.39 0.25 0.09 0.00 0.00 178.44 179.92 3im9 h LEU 67 N -0.07 0.53 -0.42 1.67 5.85 -1.23 -1.24 115.31 120.40 3im9 h LEU 67 Ca 0.02 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 3im9 h LEU 67 Cb 0.65 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.63 3im9 h LEU 67 CO 0.03 0.30 0.04 0.74 -0.34 0.00 0.00 178.44 179.21 3im9 h THR 68 N 0.66 1.25 -0.12 1.05 2.02 -0.79 0.44 112.91 117.42 3im9 h THR 68 Ca 0.37 -0.94 -0.02 0.00 0.77 0.00 0.00 66.41 66.58 3im9 h THR 68 Cb 0.37 1.04 -0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3im9 h THR 68 CO -0.26 0.32 0.00 -0.74 0.37 0.00 0.00 175.52 175.22 3im9 h HIS 69 N 0.56 0.24 -0.78 3.16 -0.00 -0.93 0.48 115.15 117.88 3im9 h HIS 69 Ca 0.12 -0.04 -0.05 0.00 -0.00 0.00 0.00 60.37 60.40 3im9 h HIS 69 Cb 0.42 -0.06 -0.03 0.00 -0.00 0.00 0.00 27.41 27.74 3im9 h HIS 69 CO 0.03 0.44 0.29 0.77 -0.00 0.00 0.00 177.93 179.46 3im9 h SER 70 N -0.04 1.10 0.34 3.26 0.02 -1.21 -1.58 113.55 115.44 3im9 h SER 70 Ca 0.04 -0.18 -0.15 0.00 -0.84 0.00 0.00 61.79 60.66 3im9 h SER 70 Cb 0.35 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.59 3im9 h SER 70 CO 0.01 0.99 -0.60 0.28 -1.14 0.00 0.00 176.83 176.37 3im9 h SER 71 N 1.15 0.29 -0.35 3.07 0.02 -0.72 -0.34 113.55 116.67 3im9 h SER 71 Ca 0.26 -0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 60.95 3im9 h SER 71 Cb 0.25 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 3im9 h SER 71 CO -0.02 0.82 -0.13 0.00 -1.14 0.00 0.00 176.83 176.37 3im9 h ALA 72 N 1.18 0.49 -0.14 3.77 0.00 -0.52 -0.74 119.26 123.30 3im9 h ALA 72 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.58 3im9 h ALA 72 Cb 1.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 3im9 h ALA 72 CO 0.09 0.38 0.09 -0.07 0.00 0.00 0.00 179.25 179.74 3im9 h LEU 73 N 0.49 0.17 -0.85 0.00 3.38 -1.19 -2.75 115.31 114.56 3im9 h LEU 73 Ca 0.08 -0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.10 3im9 h LEU 73 Cb 0.65 -0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.29 3im9 h LEU 73 CO 0.04 0.15 0.51 0.25 0.09 0.00 0.00 178.44 179.48 3im9 h LEU 74 N 0.18 0.77 -1.39 1.67 5.85 -0.91 -1.93 115.31 119.55 3im9 h LEU 74 Ca 0.05 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 3im9 h LEU 74 Cb 0.01 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 3im9 h LEU 74 CO -0.01 0.47 -0.29 0.00 -0.34 0.00 0.00 178.44 178.27 3im9 h ALA 75 N 1.43 1.29 0.00 1.25 0.00 -0.88 -2.66 119.26 119.69 3im9 h ALA 75 Ca 0.39 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3im9 h ALA 75 Cb 0.26 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3im9 h ALA 75 CO -0.21 0.37 -0.54 0.00 0.00 0.00 0.00 179.25 178.87 3im9 h ALA 76 N 1.71 0.75 -2.50 0.00 0.00 -1.08 -3.44 119.26 114.69 3im9 h ALA 76 Ca -0.00 -0.11 -0.53 0.00 0.00 0.00 0.00 54.91 54.27 3im9 h ALA 76 Cb 0.60 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 3im9 h ALA 76 CO 0.04 0.14 0.40 -0.51 0.00 0.00 0.00 179.25 179.31 3im9 s LEU 77 N -5.88 4.43 -0.06 0.00 1.43 -0.99 -5.00 118.68 112.61 3im9 s LEU 77 Ca 0.03 1.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.81 3im9 s LEU 77 Cb 0.07 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.66 3im9 s LEU 77 CO 0.73 -0.20 0.28 -0.54 0.23 0.00 0.00 176.35 176.85 3im9 s LYS 78 N 0.51 3.69 -1.34 1.70 1.02 -1.26 -4.53 119.74 119.52 3im9 s LYS 78 Ca 0.51 0.15 -0.11 0.00 0.02 0.00 0.00 55.97 56.54 3im9 s LYS 78 Cb -0.23 -3.21 0.01 0.00 -0.52 0.00 0.00 37.83 33.88 3im9 s LYS 78 CO 0.29 0.73 0.46 0.09 -0.92 0.00 0.00 175.35 176.01 3im9 n ASN 79 N 1.90 -1.80 -4.66 2.83 3.02 -1.26 -4.83 115.26 110.46 3im9 n ASN 79 Ca -0.17 -1.12 -0.38 0.00 -0.03 0.00 0.00 54.58 52.87 3im9 n ASN 79 Cb 0.54 -2.55 -0.08 0.00 -0.61 0.00 0.00 39.78 37.08 3im9 n ASN 79 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3im9 s LEU 80 N -7.05 4.14 -0.54 3.41 2.96 -1.26 -4.98 118.68 115.35 3im9 s LEU 80 Ca 0.19 0.51 0.07 0.00 -0.22 0.00 0.00 54.13 54.68 3im9 s LEU 80 Cb -0.09 -2.54 0.32 0.00 0.50 0.00 0.00 46.19 44.38 3im9 s LEU 80 CO 0.92 -0.11 0.84 0.59 -1.32 0.00 0.00 176.35 177.27 3im9 n ASN 81 N 4.66 3.39 -4.77 3.68 5.03 -1.26 -5.10 115.26 120.88 3im9 n ASN 81 Ca -0.08 -3.45 -0.37 0.00 0.87 0.00 0.00 54.58 51.56 3im9 n ASN 81 Cb 0.51 -0.60 -0.01 0.00 -1.02 0.00 0.00 39.78 38.66 3im9 n ASN 81 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 3im9 s PRO 82 N -2.92 3.70 0.09 3.52 0.04 -1.26 -4.81 135.00 133.36 3im9 s PRO 82 Ca 0.44 1.74 0.16 0.00 0.04 0.00 0.00 61.00 63.38 3im9 s PRO 82 Cb 0.26 -2.34 -0.11 0.00 0.04 0.00 0.00 34.50 32.35 3im9 s PRO 82 CO -0.10 -0.59 0.94 -0.44 0.04 0.00 0.00 177.00 176.85 3im9 h ASP 83 N 1.91 0.00 -5.11 6.66 3.32 -1.41 -3.49 116.42 118.30 3im9 h ASP 83 Ca -0.49 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.55 3im9 h ASP 83 Cb 1.25 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.74 3im9 h ASP 83 CO 0.60 0.62 0.10 -0.36 -1.72 0.00 0.00 179.24 178.47 3im9 s PHE 84 N -2.89 0.10 0.10 4.55 0.40 -1.14 -4.07 117.98 115.03 3im9 s PHE 84 Ca -0.02 -0.55 -0.13 0.00 -0.60 0.00 0.00 56.93 55.64 3im9 s PHE 84 Cb 0.08 0.51 0.02 0.00 0.51 0.00 0.00 43.02 44.15 3im9 s PHE 84 CO 0.80 -1.20 0.30 -0.08 0.70 0.00 0.00 175.22 175.74 3im9 s THR 85 N -3.68 0.10 0.14 0.64 -1.32 -0.67 -2.11 115.64 108.74 3im9 s THR 85 Ca 0.16 -0.85 -0.21 0.00 -1.21 0.00 0.00 61.69 59.58 3im9 s THR 85 Cb -0.04 -1.21 0.06 0.00 -1.51 0.00 0.00 72.50 69.80 3im9 s THR 85 CO 0.09 -0.47 0.53 0.00 -2.21 0.00 0.00 174.62 172.56 3im9 s MET 86 N -3.67 1.20 0.06 7.08 0.23 -1.08 -0.42 119.30 122.71 3im9 s MET 86 Ca 0.03 -0.53 -0.13 0.00 -1.03 0.00 0.00 55.69 54.02 3im9 s MET 86 Cb 0.03 0.55 0.02 0.00 -1.53 0.00 0.00 34.83 33.89 3im9 s MET 86 CO -0.10 -0.51 0.29 0.20 -2.03 0.00 0.00 175.02 172.87 3im9 s GLY 87 N -2.73 -0.10 -0.50 3.16 0.00 -1.26 -1.80 107.32 104.09 3im9 s GLY 87 Ca 0.01 -0.13 -0.21 0.00 0.00 0.00 0.00 44.72 44.40 3im9 s GLY 87 CO -0.12 -0.35 0.72 -1.58 0.00 0.00 0.00 173.10 171.77 3im9 s HIS 88 N -3.00 2.98 0.00 1.90 2.46 -0.16 -3.04 115.29 116.43 3im9 s HIS 88 Ca -0.02 -0.28 0.00 0.00 0.47 0.00 0.00 55.06 55.23 3im9 s HIS 88 Cb 0.01 -3.64 0.00 0.00 -0.13 0.00 0.00 32.58 28.82 3im9 s HIS 88 CO -0.06 -1.08 0.00 0.45 -2.47 0.00 0.00 174.74 171.58 3im9 n SER 89 N 6.54 0.00 -0.29 9.88 2.88 -1.26 -1.05 113.62 130.32 3im9 n SER 89 Ca -0.03 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 57.57 3im9 n SER 89 Cb 0.47 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 64.14 3im9 n SER 89 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3im9 h LEU 90 N 0.00 0.49 -1.91 2.46 7.12 -1.89 -2.01 115.31 119.57 3im9 h LEU 90 Ca 0.00 0.09 0.13 0.00 0.13 0.00 0.00 57.88 58.23 3im9 h LEU 90 Cb 0.00 0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 40.13 3im9 h LEU 90 CO 0.00 0.21 0.50 1.23 -0.13 0.00 0.00 178.44 180.26 3im9 h GLY 91 N 0.60 0.00 1.92 3.75 0.00 -1.18 1.00 103.07 109.16 3im9 h GLY 91 Ca 0.45 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.75 3im9 h GLY 91 CO -0.36 0.00 -0.07 -2.09 0.00 0.00 0.00 176.54 174.02 3im9 h GLU 92 N 0.00 0.10 -0.41 4.80 4.81 -1.27 -1.54 114.58 121.06 3im9 h GLU 92 Ca 0.22 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.34 3im9 h GLU 92 Cb 1.23 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 3im9 h GLU 92 CO -0.00 0.18 -0.13 1.88 -0.73 0.00 0.00 179.01 180.20 3im9 h TYR 93 N 0.10 0.83 -0.66 0.92 -1.99 -0.96 -1.15 116.97 114.06 3im9 h TYR 93 Ca 0.02 -0.16 -0.03 0.00 2.00 0.00 0.00 58.73 60.56 3im9 h TYR 93 Cb 0.19 -0.21 -0.03 0.00 2.00 0.00 0.00 36.73 38.68 3im9 h TYR 93 CO 0.00 0.84 0.29 0.77 -0.00 0.00 0.00 178.16 180.06 3im9 h SER 94 N 0.68 0.86 -0.89 3.88 0.02 -1.37 -1.02 113.55 115.70 3im9 h SER 94 Ca 0.11 -0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 3im9 h SER 94 Cb 0.61 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.89 3im9 h SER 94 CO 0.04 0.76 0.48 0.28 -1.14 0.00 0.00 176.83 177.25 3im9 h SER 95 N 0.94 1.13 -0.53 3.07 0.02 -0.70 -0.69 113.55 116.78 3im9 h SER 95 Ca 0.23 -0.10 -0.08 0.00 -0.84 0.00 0.00 61.79 60.99 3im9 h SER 95 Cb 0.14 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.38 3im9 h SER 95 CO -0.02 0.91 0.01 -0.07 -1.14 0.00 0.00 176.83 176.52 3im9 h LEU 96 N 1.26 0.93 -0.33 5.07 3.38 -0.52 -0.12 115.31 124.97 3im9 h LEU 96 Ca 0.31 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 3im9 h LEU 96 Cb 0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3im9 h LEU 96 CO -0.05 0.98 -0.20 0.58 0.09 0.00 0.00 178.44 179.84 3im9 h VAL 97 N 0.89 1.29 -0.82 1.22 2.07 -0.95 0.21 116.25 120.15 3im9 h VAL 97 Ca 0.17 -1.34 0.01 0.00 0.82 0.00 0.00 66.70 66.36 3im9 h VAL 97 Cb 0.50 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.66 3im9 h VAL 97 CO 0.02 0.43 0.54 0.00 0.02 0.00 0.00 177.57 178.59 3im9 h ALA 98 N 0.76 1.43 -0.42 1.67 0.00 -0.66 -2.12 119.26 119.93 3im9 h ALA 98 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3im9 h ALA 98 Cb 0.75 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3im9 h ALA 98 CO 0.06 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.83 3im9 n ALA 99 N -2.41 2.44 -1.88 0.00 0.00 -0.10 -4.93 120.51 113.63 3im9 n ALA 99 Ca 0.10 -0.86 -0.19 0.00 0.00 0.00 0.00 53.44 52.48 3im9 n ALA 99 Cb 0.04 -0.97 -0.05 0.00 0.00 0.00 0.00 19.45 18.47 3im9 n ALA 99 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3im9 n ASP 100 N 1.01 -5.41 -0.17 0.00 8.00 -0.80 -1.03 116.55 118.16 3im9 n ASP 100 Ca 0.18 0.28 -0.09 0.00 0.71 0.00 0.00 54.79 55.87 3im9 n ASP 100 Cb 0.46 -4.54 0.01 0.00 -0.02 0.00 0.00 41.12 37.03 3im9 n ASP 100 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3im9 h VAL 101 N 0.00 1.24 -4.01 2.53 2.07 -1.14 -3.41 116.25 113.52 3im9 h VAL 101 Ca -0.42 -0.86 -0.43 0.00 0.82 0.00 0.00 66.70 65.81 3im9 h VAL 101 Cb 1.29 0.86 -0.24 0.00 -1.52 0.00 0.00 31.29 31.68 3im9 h VAL 101 CO 0.56 0.31 -0.79 -0.76 0.02 0.00 0.00 177.57 176.91 3im9 s LEU 102 N -9.59 2.20 0.71 2.57 1.43 -1.08 -1.20 118.68 113.72 3im9 s LEU 102 Ca -0.13 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.37 3im9 s LEU 102 Cb 0.11 -0.57 0.01 0.00 0.03 0.00 0.00 46.19 45.77 3im9 s LEU 102 CO 0.79 0.00 1.06 -0.94 0.23 0.00 0.00 176.35 177.50 3im9 s SER 103 N -1.27 5.28 0.17 2.29 1.04 -1.26 -4.07 113.70 115.88 3im9 s SER 103 Ca 0.01 1.61 -0.13 0.00 0.48 0.00 0.00 55.95 57.91 3im9 s SER 103 Cb -0.08 -2.47 0.07 0.00 0.10 0.00 0.00 66.02 63.64 3im9 s SER 103 CO 0.01 -1.51 1.79 0.15 0.98 0.00 0.00 173.24 174.67 3im9 h PHE 104 N -0.76 0.75 -0.40 5.02 3.57 -1.97 0.62 116.94 123.76 3im9 h PHE 104 Ca -0.44 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 60.98 3im9 h PHE 104 Cb 1.21 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 3im9 h PHE 104 CO 0.61 0.53 -0.05 0.93 -2.23 0.00 0.00 178.31 178.10 3im9 h GLU 105 N 0.74 0.66 -0.04 1.11 5.08 -1.97 0.73 114.58 120.89 3im9 h GLU 105 Ca 0.20 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 3im9 h GLU 105 Cb 0.02 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.20 3im9 h GLU 105 CO -0.03 0.71 -0.02 -0.44 -1.00 0.00 0.00 179.01 178.23 3im9 h ASP 106 N 0.61 0.09 -0.28 1.42 3.32 -1.85 -2.91 116.42 116.82 3im9 h ASP 106 Ca 0.12 -0.40 -0.02 0.00 0.02 0.00 0.00 57.03 56.74 3im9 h ASP 106 Cb 0.46 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3im9 h ASP 106 CO 0.02 0.47 0.11 0.00 -1.72 0.00 0.00 179.24 178.13 3im9 h ALA 107 N 0.62 1.57 -0.10 3.45 0.00 -0.52 -0.19 119.26 124.09 3im9 h ALA 107 Ca 0.01 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 3im9 h ALA 107 Cb 0.44 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3im9 h ALA 107 CO 0.01 0.34 -0.56 -0.24 0.00 0.00 0.00 179.25 178.79 3im9 h VAL 108 N 0.48 1.36 -0.22 0.00 3.04 -0.83 0.56 116.25 120.64 3im9 h VAL 108 Ca 0.12 -1.87 -0.19 0.00 -1.01 0.00 0.00 66.70 63.74 3im9 h VAL 108 Cb 0.14 1.91 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 3im9 h VAL 108 CO -0.01 0.56 -0.61 0.11 -1.01 0.00 0.00 177.57 176.61 3im9 h LYS 109 N 0.23 0.80 -0.54 4.17 1.57 -1.27 -1.61 116.57 119.91 3im9 h LYS 109 Ca 0.00 -0.57 -0.02 0.00 -1.87 0.00 0.00 60.65 58.19 3im9 h LYS 109 Cb 1.06 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.43 3im9 h LYS 109 CO 0.09 1.19 0.24 0.82 -0.57 0.00 0.00 179.45 181.22 3im9 h ILE 110 N 0.54 1.21 0.00 1.86 2.04 -0.59 -1.40 117.51 121.17 3im9 h ILE 110 Ca -0.01 -0.62 -0.10 0.00 1.00 0.00 0.00 64.86 65.13 3im9 h ILE 110 Cb 1.23 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 3im9 h ILE 110 CO 0.13 0.24 -0.49 -0.37 0.00 0.00 0.00 178.15 177.66 3im9 h VAL 111 N 0.73 0.88 -0.39 1.67 -1.51 -0.88 0.89 116.25 117.64 3im9 h VAL 111 Ca 0.18 -2.13 -0.00 0.00 -1.23 0.00 0.00 66.70 63.52 3im9 h VAL 111 Cb 0.15 2.35 -0.02 0.00 -2.13 0.00 0.00 31.29 31.65 3im9 h VAL 111 CO -0.02 0.48 0.22 -0.09 -1.23 0.00 0.00 177.57 176.94 3im9 h ARG 112 N 0.00 0.54 -0.69 5.19 9.65 -1.07 0.23 114.38 128.22 3im9 h ARG 112 Ca -0.00 -0.06 -0.07 0.00 -1.10 0.00 0.00 59.98 58.75 3im9 h ARG 112 Cb 1.32 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 29.76 3im9 h ARG 112 CO 0.06 0.42 0.17 -0.22 2.80 0.00 0.00 179.97 183.20 3im9 h LYS 113 N 0.50 1.10 -0.59 0.20 1.63 -0.88 -1.25 116.57 117.28 3im9 h LYS 113 Ca 0.14 -0.26 0.06 0.00 -0.85 0.00 0.00 60.65 59.73 3im9 h LYS 113 Cb 0.03 -0.15 -0.05 0.00 -0.60 0.00 0.00 32.23 31.46 3im9 h LYS 113 CO -0.02 0.97 0.30 -0.09 -3.45 0.00 0.00 179.45 177.16 3im9 h ARG 114 N 1.05 0.56 -0.51 1.90 2.43 -0.60 0.49 114.38 119.69 3im9 h ARG 114 Ca 0.22 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.29 3im9 h ARG 114 Cb 0.37 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 3im9 h ARG 114 CO 0.00 0.37 0.08 0.78 -1.51 0.00 0.00 179.97 179.69 3im9 h GLY 115 N 0.57 0.91 1.35 2.80 0.00 -0.75 0.09 103.07 108.04 3im9 h GLY 115 Ca 0.27 -0.61 -0.13 0.00 0.00 0.00 0.00 47.33 46.85 3im9 h GLY 115 CO -0.18 0.56 -0.34 1.46 0.00 0.00 0.00 176.54 178.04 3im9 h GLN 116 N 0.72 0.73 -0.35 4.80 4.20 -0.68 0.64 115.11 125.17 3im9 h GLN 116 Ca 0.15 -0.35 -0.13 0.00 0.06 0.00 0.00 58.65 58.38 3im9 h GLN 116 Cb 0.41 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 3im9 h GLN 116 CO 0.01 0.96 -0.31 -0.07 -0.67 0.00 0.00 178.83 178.75 3im9 h LEU 117 N 0.61 0.88 -0.27 1.46 4.07 -0.71 -1.76 115.31 119.58 3im9 h LEU 117 Ca 0.06 -0.46 -0.02 0.00 0.08 0.00 0.00 57.88 57.54 3im9 h LEU 117 Cb 0.87 -0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.35 3im9 h LEU 117 CO 0.08 1.15 0.07 0.24 -1.08 0.00 0.00 178.44 178.90 3im9 h MET 118 N 0.61 0.43 -0.35 1.13 2.86 -0.83 -1.73 114.93 117.05 3im9 h MET 118 Ca 0.06 -0.10 0.04 0.00 -2.06 0.00 0.00 59.70 57.64 3im9 h MET 118 Cb 0.89 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.47 3im9 h MET 118 CO 0.08 0.51 0.24 0.00 1.06 0.00 0.00 176.91 178.80 3im9 h ALA 119 N 0.90 1.93 -0.26 6.32 0.00 -0.70 -2.78 119.26 124.67 3im9 h ALA 119 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3im9 h ALA 119 Cb 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3im9 h ALA 119 CO -0.00 0.02 0.00 1.04 0.00 0.00 0.00 179.25 180.31 3im9 n GLN 120 N -4.48 2.41 -0.17 0.00 6.02 -0.68 -4.61 117.38 115.87 3im9 n GLN 120 Ca 0.04 -2.10 -0.09 0.00 -0.01 0.00 0.00 57.00 54.83 3im9 n GLN 120 Cb 0.19 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.96 3im9 n GLN 120 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3im9 h ALA 121 N 4.57 0.65 -3.53 -1.58 0.00 -1.02 -3.43 119.26 114.90 3im9 h ALA 121 Ca 0.00 -0.23 -0.34 0.00 0.00 0.00 0.00 54.91 54.33 3im9 h ALA 121 Cb 0.96 -0.18 -0.24 0.00 0.00 0.00 0.00 17.79 18.33 3im9 h ALA 121 CO 0.00 0.38 -0.76 -0.06 0.00 0.00 0.00 179.25 178.81 3im9 s PHE 122 N -5.19 0.82 0.82 0.00 0.40 -1.26 -5.04 117.98 108.52 3im9 s PHE 122 Ca -0.13 -0.35 -0.13 0.00 -0.60 0.00 0.00 56.93 55.72 3im9 s PHE 122 Cb 0.11 -0.49 0.09 0.00 0.51 0.00 0.00 43.02 43.24 3im9 s PHE 122 CO 0.80 -0.02 1.19 -2.14 0.70 0.00 0.00 175.22 175.75 3im9 s PRO 123 N -1.10 1.57 0.17 0.24 0.02 -1.26 -4.89 135.00 129.74 3im9 s PRO 123 Ca -0.03 1.71 -0.34 0.00 0.02 0.00 0.00 61.00 62.36 3im9 s PRO 123 Cb -0.07 -1.77 -0.15 0.00 0.02 0.00 0.00 34.50 32.53 3im9 s PRO 123 CO 0.01 -2.25 1.39 2.41 -0.33 0.00 0.00 177.00 178.22 3im9 n THR 124 N -3.42 0.43 0.00 0.99 -1.04 -1.26 -2.27 114.28 107.70 3im9 n THR 124 Ca 0.13 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 3im9 n THR 124 Cb 0.51 -1.20 0.00 0.00 -1.82 0.00 0.00 70.33 67.82 3im9 n THR 124 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3im9 n GLY 125 N 2.58 0.87 0.10 3.41 0.00 -1.26 -4.94 105.19 105.94 3im9 n GLY 125 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 3im9 n GLY 125 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3im9 h VAL 126 N 0.00 1.37 -3.79 1.61 2.07 -1.80 -3.41 116.25 112.29 3im9 h VAL 126 Ca 0.00 -2.34 -0.39 0.00 0.82 0.00 0.00 66.70 64.80 3im9 h VAL 126 Cb 0.00 2.92 -0.20 0.00 -1.52 0.00 0.00 31.29 32.49 3im9 h VAL 126 CO 0.00 0.56 -0.76 -0.83 0.02 0.00 0.00 177.57 176.56 3im9 s GLY 127 N -4.57 0.91 0.05 2.17 0.00 -1.26 -0.47 107.32 104.15 3im9 s GLY 127 Ca -0.21 -1.12 -0.01 0.00 0.00 0.00 0.00 44.72 43.38 3im9 s GLY 127 CO 0.70 -1.16 0.09 -1.26 0.00 0.00 0.00 173.10 171.46 3im9 n SER 128 N 0.91 -0.27 -3.95 1.64 2.88 -0.24 -3.95 113.62 110.65 3im9 n SER 128 Ca -0.18 -1.25 -0.09 0.00 -1.33 0.00 0.00 58.87 56.02 3im9 n SER 128 Cb 0.56 0.46 -0.10 0.00 -0.75 0.00 0.00 64.21 64.38 3im9 n SER 128 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3im9 s MET 129 N -2.06 0.57 -0.05 -1.46 -1.94 -1.26 -1.80 119.30 111.30 3im9 s MET 129 Ca 0.03 -0.78 -0.10 0.00 -1.71 0.00 0.00 55.69 53.13 3im9 s MET 129 Cb -0.00 0.22 0.02 0.00 2.01 0.00 0.00 34.83 37.07 3im9 s MET 129 CO 0.02 -0.14 0.24 0.00 -0.01 0.00 0.00 175.02 175.14 3im9 s ALA 130 N -2.61 -0.60 -0.17 3.03 0.00 -0.33 -1.53 121.76 119.54 3im9 s ALA 130 Ca -0.05 0.38 -0.20 0.00 0.00 0.00 0.00 51.96 52.09 3im9 s ALA 130 Cb -0.01 -0.13 -0.03 0.00 0.00 0.00 0.00 23.12 22.94 3im9 s ALA 130 CO -0.05 -0.19 0.60 0.00 0.00 0.00 0.00 175.76 176.13 3im9 s ALA 131 N -0.70 3.51 -0.28 0.00 0.00 0.64 -0.58 121.76 124.34 3im9 s ALA 131 Ca -0.08 -0.23 -0.11 0.00 0.00 0.00 0.00 51.96 51.54 3im9 s ALA 131 Cb -0.04 -2.91 -0.05 0.00 0.00 0.00 0.00 23.12 20.12 3im9 s ALA 131 CO 0.02 -0.42 0.18 0.08 0.00 0.00 0.00 175.76 175.62 3im9 s VAL 132 N 1.58 5.24 -0.02 0.00 1.01 0.54 -0.95 120.40 127.81 3im9 s VAL 132 Ca 0.29 0.15 0.02 0.00 0.00 0.00 0.00 61.98 62.44 3im9 s VAL 132 Cb -0.16 -3.49 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 3im9 s VAL 132 CO 0.11 0.26 -0.06 -0.76 0.00 0.00 0.00 175.10 174.65 3im9 s LEU 133 N 1.73 3.21 0.00 3.92 1.43 -0.34 -1.66 118.68 126.98 3im9 s LEU 133 Ca 0.07 -0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 3im9 s LEU 133 Cb -0.16 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.26 3im9 s LEU 133 CO 0.10 0.30 0.00 0.61 0.23 0.00 0.00 176.35 177.60 3im9 n GLY 134 N 1.72 0.76 3.31 -3.19 0.00 0.02 -0.93 105.19 106.88 3im9 n GLY 134 Ca -0.16 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 3im9 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3im9 s LEU 135 N 0.00 2.19 0.68 0.99 1.43 -1.26 -4.63 118.68 118.07 3im9 s LEU 135 Ca 0.00 -0.58 -0.16 0.00 -1.03 0.00 0.00 54.13 52.36 3im9 s LEU 135 Cb 0.00 -1.14 0.01 0.00 0.03 0.00 0.00 46.19 45.09 3im9 s LEU 135 CO 0.00 0.20 1.19 -1.81 0.23 0.00 0.00 176.35 176.17 3im9 s ASP 136 N -1.31 4.64 0.25 2.29 1.01 -1.26 -4.10 116.67 118.19 3im9 s ASP 136 Ca 0.10 2.31 -0.03 0.00 0.71 0.00 0.00 52.55 55.64 3im9 s ASP 136 Cb -0.09 -2.59 0.46 0.00 1.01 0.00 0.00 42.92 41.71 3im9 s ASP 136 CO 0.02 -1.96 1.77 0.15 0.21 0.00 0.00 175.17 175.36 3im9 h PHE 137 N 0.11 0.73 -0.35 4.23 3.04 -1.99 -1.52 116.94 121.18 3im9 h PHE 137 Ca -0.48 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.45 3im9 h PHE 137 Cb 1.29 -0.21 -0.02 0.00 2.56 0.00 0.00 35.95 39.58 3im9 h PHE 137 CO 0.48 0.21 0.03 0.38 -2.02 0.00 0.00 178.31 177.39 3im9 h ASP 138 N 0.63 0.50 -0.18 0.41 -0.00 -1.99 0.13 116.42 115.93 3im9 h ASP 138 Ca 0.42 -0.09 -0.21 0.00 -0.00 0.00 0.00 57.03 57.16 3im9 h ASP 138 Cb 0.54 -0.13 0.01 0.00 -0.00 0.00 0.00 39.33 39.74 3im9 h ASP 138 CO -0.33 0.55 -0.69 0.50 -0.00 0.00 0.00 179.24 179.28 3im9 h LYS 139 N 0.52 0.81 -0.62 4.15 1.63 -1.73 -0.93 116.57 120.39 3im9 h LYS 139 Ca 0.12 -0.60 -0.04 0.00 -0.85 0.00 0.00 60.65 59.27 3im9 h LYS 139 Cb 0.30 0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 32.00 3im9 h LYS 139 CO 0.01 1.22 0.23 0.28 -3.45 0.00 0.00 179.45 177.73 3im9 h VAL 140 N 0.58 1.24 -0.51 2.00 2.07 -0.79 -0.97 116.25 119.86 3im9 h VAL 140 Ca -0.03 -0.78 -0.12 0.00 0.82 0.00 0.00 66.70 66.59 3im9 h VAL 140 Cb 1.31 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 3im9 h VAL 140 CO 0.14 0.30 -0.15 -0.78 0.02 0.00 0.00 177.57 177.11 3im9 h ASP 141 N 0.88 1.00 -0.28 0.57 3.58 -0.68 -0.37 116.42 121.12 3im9 h ASP 141 Ca 0.20 -0.35 0.02 0.00 0.42 0.00 0.00 57.03 57.33 3im9 h ASP 141 Cb 0.24 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 3im9 h ASP 141 CO -0.01 1.14 0.12 -0.08 -2.88 0.00 0.00 179.24 177.53 3im9 h GLU 142 N 0.87 0.26 -0.56 0.28 4.81 -0.91 -0.26 114.58 119.07 3im9 h GLU 142 Ca 0.13 -0.02 0.07 0.00 -0.13 0.00 0.00 59.36 59.41 3im9 h GLU 142 Cb 0.71 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.98 3im9 h GLU 142 CO 0.05 0.17 0.25 0.82 -0.73 0.00 0.00 179.01 179.57 3im9 h ILE 143 N 0.27 0.87 -0.90 2.32 2.04 -0.93 0.16 117.51 121.34 3im9 h ILE 143 Ca 0.12 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 65.86 3im9 h ILE 143 Cb 0.05 0.36 -0.05 0.00 -0.74 0.00 0.00 36.82 36.44 3im9 h ILE 143 CO -0.09 0.08 0.59 0.00 0.00 0.00 0.00 178.15 178.73 3im9 h LYS 145 N 1.10 0.34 -0.34 0.00 1.79 -0.29 -0.68 116.57 118.49 3im9 h LYS 145 Ca 0.36 -0.17 -0.03 0.00 -2.18 0.00 0.00 60.65 58.62 3im9 h LYS 145 Cb 0.05 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 3im9 h LYS 145 CO -0.11 0.72 0.08 0.77 -1.08 0.00 0.00 179.45 179.82 3im9 h SER 146 N 0.28 0.52 1.16 0.86 0.02 -0.46 -3.23 113.55 112.70 3im9 h SER 146 Ca 0.02 -0.24 -0.15 0.00 -0.84 0.00 0.00 61.79 60.58 3im9 h SER 146 Cb 0.89 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.28 3im9 h SER 146 CO 0.07 0.63 -0.70 -0.07 -1.14 0.00 0.00 176.83 175.62 3im9 h LEU 147 N 0.39 0.00 -9.30 5.07 4.07 -0.96 -3.44 115.31 111.15 3im9 h LEU 147 Ca 0.11 0.00 -0.54 0.00 0.08 0.00 0.00 57.88 57.52 3im9 h LEU 147 Cb 0.31 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.05 3im9 h LEU 147 CO 0.00 0.70 1.12 -0.44 -1.08 0.00 0.00 178.44 178.74 3im9 s SER 148 N -6.59 6.61 -0.17 -0.43 0.01 -0.28 -4.89 113.70 107.96 3im9 s SER 148 Ca 0.02 2.36 -0.35 0.00 1.31 0.00 0.00 55.95 59.29 3im9 s SER 148 Cb 0.09 -2.53 0.14 0.00 0.21 0.00 0.00 66.02 63.93 3im9 s SER 148 CO 0.77 -0.95 1.30 -0.94 0.41 0.00 0.00 173.24 173.83 3im9 s SER 149 N 3.54 -0.07 -1.49 2.44 1.04 -0.65 -4.95 113.70 113.57 3im9 s SER 149 Ca 0.77 -0.03 -0.07 0.00 0.48 0.00 0.00 55.95 57.11 3im9 s SER 149 Cb -0.36 0.10 0.02 0.00 0.10 0.00 0.00 66.02 65.88 3im9 s SER 149 CO 0.33 -0.16 0.67 -0.67 0.98 0.00 0.00 173.24 174.38 3im9 n ASP 150 N -0.19 -5.63 -1.10 7.02 2.03 -1.26 -0.91 116.55 116.51 3im9 n ASP 150 Ca -0.01 -0.36 -0.14 0.00 0.52 0.00 0.00 54.79 54.80 3im9 n ASP 150 Cb 0.59 -4.55 -0.06 0.00 -0.72 0.00 0.00 41.12 36.38 3im9 n ASP 150 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3im9 n ASP 151 N -2.55 -4.80 -4.51 1.67 8.00 -1.26 -5.00 116.55 108.11 3im9 n ASP 151 Ca -0.07 0.35 -0.29 0.00 0.71 0.00 0.00 54.79 55.49 3im9 n ASP 151 Cb 0.59 -3.55 -0.11 0.00 -0.02 0.00 0.00 41.12 38.03 3im9 n ASP 151 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3im9 s LYS 152 N -3.19 1.87 0.05 -1.24 1.02 -0.09 -5.11 119.74 113.05 3im9 s LYS 152 Ca 0.00 -1.15 0.03 0.00 0.02 0.00 0.00 55.97 54.87 3im9 s LYS 152 Cb 0.00 -2.16 -0.02 0.00 -0.52 0.00 0.00 37.83 35.13 3im9 s LYS 152 CO 0.00 0.49 -0.09 0.96 -0.92 0.00 0.00 175.35 175.79 3im9 s ILE 153 N -1.17 0.64 -0.01 2.17 -4.36 -1.26 -1.63 121.20 115.57 3im9 s ILE 153 Ca 0.19 -1.11 0.01 0.00 -0.26 0.00 0.00 60.65 59.48 3im9 s ILE 153 Cb -0.11 -0.68 0.01 0.00 1.25 0.00 0.00 42.46 42.92 3im9 s ILE 153 CO 0.11 -0.35 -0.02 -0.51 0.24 0.00 0.00 174.94 174.41 3im9 s ILE 154 N -1.35 0.20 0.03 8.37 2.07 -1.26 -0.59 121.20 128.67 3im9 s ILE 154 Ca -0.08 -0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.08 3im9 s ILE 154 Cb -0.10 -0.20 -0.02 0.00 0.13 0.00 0.00 42.46 42.27 3im9 s ILE 154 CO 0.01 0.08 0.01 -1.61 -1.91 0.00 0.00 174.94 171.51 3im9 s GLU 155 N 0.20 0.43 0.26 3.50 2.02 0.18 -4.67 118.70 120.62 3im9 s GLU 155 Ca -0.02 -0.73 -0.30 0.00 0.02 0.00 0.00 54.97 53.94 3im9 s GLU 155 Cb -0.04 0.16 -0.11 0.00 0.10 0.00 0.00 34.13 34.24 3im9 s GLU 155 CO -0.01 -0.08 1.52 -2.14 0.02 0.00 0.00 175.26 174.57 3im9 s PRO 156 N -2.11 4.20 0.05 0.39 0.02 -1.26 -0.64 135.00 135.64 3im9 s PRO 156 Ca -0.10 2.42 -0.01 0.00 0.02 0.00 0.00 61.00 63.34 3im9 s PRO 156 Cb -0.05 -3.08 -0.01 0.00 0.02 0.00 0.00 34.50 31.39 3im9 s PRO 156 CO -0.03 -0.52 -0.02 0.00 -0.33 0.00 0.00 177.00 176.09 3im9 n ALA 157 N 2.41 2.87 -3.86 -1.55 0.00 0.96 -4.56 120.51 116.79 3im9 n ALA 157 Ca 0.08 -0.06 -0.34 0.00 0.00 0.00 0.00 53.44 53.12 3im9 n ALA 157 Cb 0.39 0.32 -0.15 0.00 0.00 0.00 0.00 19.45 20.02 3im9 n ALA 157 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3im9 s ASN 158 N -5.69 4.36 -0.86 0.00 0.02 -0.55 0.95 114.94 113.16 3im9 s ASN 158 Ca -0.02 -1.11 -0.15 0.00 -1.02 0.00 0.00 52.86 50.56 3im9 s ASN 158 Cb 0.01 -1.62 0.20 0.00 0.02 0.00 0.00 41.25 39.86 3im9 s ASN 158 CO 0.03 -0.16 0.86 -0.63 0.02 0.00 0.00 177.10 177.22 3im9 s ILE 159 N 1.23 5.43 -0.18 0.60 -1.09 -0.34 -0.88 121.20 125.97 3im9 s ILE 159 Ca -0.03 -2.31 -0.16 0.00 -2.23 0.00 0.00 60.65 55.92 3im9 s ILE 159 Cb -0.18 -4.54 -0.11 0.00 -1.58 0.00 0.00 42.46 36.05 3im9 s ILE 159 CO -0.05 -1.14 -0.03 0.59 -1.23 0.00 0.00 174.94 173.08 3im9 n ASN 160 N 4.50 1.85 -3.72 3.58 3.02 -1.00 -2.00 115.26 121.49 3im9 n ASN 160 Ca 0.17 0.50 -0.08 0.00 -0.03 0.00 0.00 54.58 55.14 3im9 n ASN 160 Cb 0.47 -0.90 -0.02 0.00 -0.61 0.00 0.00 39.78 38.72 3im9 n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3im9 n PRO 162 N -0.43 1.74 -0.71 0.00 -0.02 -1.26 -0.90 135.00 133.41 3im9 n PRO 162 Ca -0.08 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3im9 n PRO 162 Cb 0.61 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 3im9 n PRO 162 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3im9 n GLY 163 N 3.68 0.77 2.59 -1.23 0.00 -1.26 -4.93 105.19 104.81 3im9 n GLY 163 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 3im9 n GLY 163 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3im9 s GLN 164 N -0.29 0.18 -0.13 1.61 0.74 -0.08 -0.80 119.66 120.90 3im9 s GLN 164 Ca 0.00 -0.37 -0.00 0.00 0.05 0.00 0.00 55.36 55.04 3im9 s GLN 164 Cb 0.00 -1.52 0.03 0.00 1.10 0.00 0.00 33.01 32.62 3im9 s GLN 164 CO 0.00 -0.86 -0.08 0.42 -0.55 0.00 0.00 175.29 174.22 3im9 s ILE 165 N 2.08 1.15 -0.04 -2.34 -1.09 -0.66 -2.38 121.20 117.91 3im9 s ILE 165 Ca 0.06 -0.43 -0.18 0.00 -2.23 0.00 0.00 60.65 57.86 3im9 s ILE 165 Cb -0.16 -1.18 -0.05 0.00 -1.58 0.00 0.00 42.46 39.49 3im9 s ILE 165 CO -0.24 0.33 0.51 -0.69 -1.23 0.00 0.00 174.94 173.63 3im9 s VAL 166 N 1.65 5.03 0.25 2.92 1.01 -0.06 -0.34 120.40 130.86 3im9 s VAL 166 Ca 0.04 1.06 0.08 0.00 0.00 0.00 0.00 61.98 63.16 3im9 s VAL 166 Cb -0.13 -3.85 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 3im9 s VAL 166 CO -0.09 0.42 0.07 0.68 0.00 0.00 0.00 175.10 176.18 3im9 s VAL 167 N -0.09 3.84 -0.02 2.92 -7.23 0.25 -0.03 120.40 120.04 3im9 s VAL 167 Ca 0.28 -1.68 -0.13 0.00 -1.81 0.00 0.00 61.98 58.64 3im9 s VAL 167 Cb -0.17 -3.05 0.02 0.00 0.56 0.00 0.00 36.38 33.74 3im9 s VAL 167 CO 0.14 -0.34 0.27 -0.55 -0.31 0.00 0.00 175.10 174.31 3im9 s SER 168 N -3.65 -0.15 0.00 4.85 0.15 0.18 -1.18 113.70 113.89 3im9 s SER 168 Ca 0.32 0.07 0.00 0.00 0.70 0.00 0.00 55.95 57.03 3im9 s SER 168 Cb -0.07 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 3im9 s SER 168 CO 0.22 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.87 3im9 n GLY 169 N 1.48 -0.28 3.77 9.45 0.00 -0.75 -0.65 105.19 118.22 3im9 n GLY 169 Ca -0.21 -1.00 -0.41 0.00 0.00 0.00 0.00 46.02 44.39 3im9 n GLY 169 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3im9 s HIS 170 N -3.72 2.65 0.35 1.61 3.76 0.24 -1.08 115.29 119.11 3im9 s HIS 170 Ca 0.00 1.01 0.05 0.00 -0.15 0.00 0.00 55.06 55.97 3im9 s HIS 170 Cb 0.00 -4.04 0.66 0.00 1.11 0.00 0.00 32.58 30.31 3im9 s HIS 170 CO 0.00 -3.23 1.92 -0.22 -0.85 0.00 0.00 174.74 172.36 3im9 h LYS 171 N 3.74 0.54 -0.89 1.40 3.64 -1.01 -1.43 116.57 122.55 3im9 h LYS 171 Ca -0.49 -0.09 0.07 0.00 -1.27 0.00 0.00 60.65 58.87 3im9 h LYS 171 Cb 1.23 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 32.90 3im9 h LYS 171 CO 0.70 0.51 0.58 0.00 -2.27 0.00 0.00 179.45 178.97 3im9 h ALA 172 N 1.56 1.55 0.11 5.00 0.00 -1.85 0.12 119.26 125.75 3im9 h ALA 172 Ca 0.12 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.75 3im9 h ALA 172 Cb 0.22 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3im9 h ALA 172 CO -0.00 0.30 -1.20 -0.07 0.00 0.00 0.00 179.25 178.28 3im9 h LEU 173 N 0.98 0.39 -0.90 0.00 3.38 -1.65 -2.04 115.31 115.47 3im9 h LEU 173 Ca 0.39 -0.41 0.02 0.00 0.09 0.00 0.00 57.88 57.97 3im9 h LEU 173 Cb 0.26 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3im9 h LEU 173 CO -0.15 1.31 0.59 0.40 0.09 0.00 0.00 178.44 180.68 3im9 h ILE 174 N 0.08 1.20 -0.05 1.22 1.08 -0.81 -1.02 117.51 119.22 3im9 h ILE 174 Ca -0.12 -0.41 -0.16 0.00 -0.39 0.00 0.00 64.86 63.78 3im9 h ILE 174 Cb 1.92 -0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.57 3im9 h ILE 174 CO 0.19 0.22 -0.70 0.44 -0.69 0.00 0.00 178.15 177.62 3im9 h ASP 175 N 1.19 0.27 -0.61 1.72 3.32 -0.74 -0.07 116.42 121.50 3im9 h ASP 175 Ca 0.34 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 57.16 3im9 h ASP 175 Cb -0.09 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 3im9 h ASP 175 CO -0.09 0.88 0.17 -0.08 -1.72 0.00 0.00 179.24 178.40 3im9 h GLU 176 N 0.16 0.97 -0.38 3.56 4.81 -0.92 -0.60 114.58 122.17 3im9 h GLU 176 Ca -0.02 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 58.97 3im9 h GLU 176 Cb 1.24 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 3im9 h GLU 176 CO 0.11 0.88 0.17 1.25 -0.73 0.00 0.00 179.01 180.68 3im9 h LEU 177 N 0.89 0.51 -0.50 1.64 5.85 -0.70 -0.24 115.31 122.76 3im9 h LEU 177 Ca 0.20 -0.14 0.09 0.00 0.84 0.00 0.00 57.88 58.86 3im9 h LEU 177 Cb 0.33 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.15 3im9 h LEU 177 CO -0.00 0.51 0.07 0.58 -0.34 0.00 0.00 178.44 179.26 3im9 h VAL 178 N 0.48 0.68 -0.31 1.05 2.07 -0.80 0.45 116.25 119.87 3im9 h VAL 178 Ca 0.13 -0.07 -0.09 0.00 0.82 0.00 0.00 66.70 67.49 3im9 h VAL 178 Cb 0.15 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 3im9 h VAL 178 CO -0.01 0.04 -0.15 -0.33 0.02 0.00 0.00 177.57 177.13 3im9 h GLU 179 N 0.19 0.65 -0.01 1.57 5.08 -0.77 -3.26 114.58 118.04 3im9 h GLU 179 Ca 0.25 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3im9 h GLU 179 Cb 0.36 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3im9 h GLU 179 CO -0.36 0.88 -0.44 1.63 -1.00 0.00 0.00 179.01 179.72 3im9 n LYS 180 N -4.38 0.57 -0.18 2.33 5.02 -0.13 -4.62 118.16 116.78 3im9 n LYS 180 Ca -0.03 -0.38 -0.01 0.00 -2.02 0.00 0.00 58.31 55.87 3im9 n LYS 180 Cb 0.38 -1.49 0.09 0.00 -0.02 0.00 0.00 35.03 33.99 3im9 n LYS 180 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 3im9 h GLY 181 N 4.94 0.70 0.98 0.72 0.00 -0.14 -1.41 103.07 108.85 3im9 h GLY 181 Ca 0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.30 3im9 h GLY 181 CO 0.00 -0.09 0.23 1.70 0.00 0.00 0.00 176.54 178.38 3im9 h LYS 182 N 0.25 0.54 -0.11 4.80 1.63 -1.82 -1.47 116.57 120.39 3im9 h LYS 182 Ca 0.28 -0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 60.02 3im9 h LYS 182 Cb 0.40 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 31.92 3im9 h LYS 182 CO -0.36 0.42 0.05 0.66 -3.45 0.00 0.00 179.45 176.76 3im9 h SER 183 N 0.51 0.13 0.16 4.20 4.64 -1.68 -0.34 113.55 121.17 3im9 h SER 183 Ca 0.14 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3im9 h SER 183 Cb 0.03 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3im9 h SER 183 CO -0.02 0.12 -0.02 0.18 -0.87 0.00 0.00 176.83 176.22 3im9 n LEU 184 N -4.49 0.26 0.00 5.97 4.77 -0.61 -4.93 117.00 117.97 3im9 n LEU 184 Ca -0.01 -0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3im9 n LEU 184 Cb 0.10 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3im9 n LEU 184 CO 0.35 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 3im9 n GLY 185 N 1.12 0.74 3.77 -0.72 0.00 -0.14 -5.08 105.19 104.88 3im9 n GLY 185 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 3im9 n GLY 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3im9 s ALA 186 N -2.03 3.23 0.20 4.61 0.00 -0.61 -4.81 121.76 122.35 3im9 s ALA 186 Ca 0.00 0.88 -0.08 0.00 0.00 0.00 0.00 51.96 52.75 3im9 s ALA 186 Cb 0.00 -3.33 0.14 0.00 0.00 0.00 0.00 23.12 19.92 3im9 s ALA 186 CO 0.00 -0.31 1.76 -0.22 0.00 0.00 0.00 175.76 176.98 3im9 h LYS 187 N 3.02 1.14 -1.66 0.00 1.63 -1.29 -3.37 116.57 116.04 3im9 h LYS 187 Ca -0.48 -0.23 0.08 0.00 -0.85 0.00 0.00 60.65 59.18 3im9 h LYS 187 Cb 1.22 -0.18 -0.25 0.00 -0.60 0.00 0.00 32.23 32.42 3im9 h LYS 187 CO 0.64 0.95 0.30 0.50 -3.45 0.00 0.00 179.45 178.40 3im9 s ARG 188 N -5.49 0.49 -0.36 1.90 6.06 -1.19 -4.94 118.95 115.42 3im9 s ARG 188 Ca -0.12 0.79 -0.05 0.00 -2.50 0.00 0.00 55.73 53.84 3im9 s ARG 188 Cb 0.15 0.12 0.06 0.00 0.06 0.00 0.00 34.95 35.35 3im9 s ARG 188 CO 0.84 -0.09 0.13 0.08 -2.50 0.00 0.00 175.30 173.75 3im9 s VAL 189 N 1.23 3.60 -0.35 7.11 1.01 -1.26 -1.20 120.40 130.54 3im9 s VAL 189 Ca -0.07 -1.42 -0.13 0.00 0.00 0.00 0.00 61.98 60.36 3im9 s VAL 189 Cb -0.04 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.17 3im9 s VAL 189 CO -0.14 -0.33 0.23 -0.32 0.00 0.00 0.00 175.10 174.54 3im9 s MET 190 N 1.32 3.38 0.49 2.72 1.75 -0.12 -4.80 119.30 124.04 3im9 s MET 190 Ca 0.00 -0.72 -0.22 0.00 -1.25 0.00 0.00 55.69 53.50 3im9 s MET 190 Cb -0.21 -3.79 -0.07 0.00 2.84 0.00 0.00 34.83 33.61 3im9 s MET 190 CO 0.00 -0.49 1.22 -1.25 -0.65 0.00 0.00 175.02 173.86 3im9 s PRO 191 N 1.70 3.56 0.17 4.11 0.04 -1.26 -0.26 135.00 143.05 3im9 s PRO 191 Ca 0.06 1.90 0.07 0.00 0.04 0.00 0.00 61.00 63.06 3im9 s PRO 191 Cb -0.18 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.98 3im9 s PRO 191 CO 0.10 -0.75 0.05 -0.51 0.04 0.00 0.00 177.00 175.93 3im9 s LEU 192 N -3.20 3.48 -0.99 -3.56 1.43 -0.58 -4.88 118.68 110.38 3im9 s LEU 192 Ca 0.66 -0.31 -0.23 0.00 -1.03 0.00 0.00 54.13 53.22 3im9 s LEU 192 Cb -0.32 -2.11 0.05 0.00 0.03 0.00 0.00 46.19 43.84 3im9 s LEU 192 CO 0.38 0.08 1.42 0.00 0.23 0.00 0.00 176.35 178.46 3im9 s ALA 193 N -1.75 2.75 0.05 4.21 0.00 -1.26 -4.68 121.76 121.08 3im9 s ALA 193 Ca 0.29 -2.21 0.01 0.00 0.00 0.00 0.00 51.96 50.04 3im9 s ALA 193 Cb -0.09 -4.48 -0.03 0.00 0.00 0.00 0.00 23.12 18.51 3im9 s ALA 193 CO 0.20 -3.56 -0.06 0.14 0.00 0.00 0.00 175.76 172.49 3im9 s VAL 194 N 4.92 0.43 -1.31 0.00 -7.23 -1.26 -5.05 120.40 110.89 3im9 s VAL 194 Ca 0.44 -1.35 0.25 0.00 -1.81 0.00 0.00 61.98 59.52 3im9 s VAL 194 Cb -0.01 -0.91 0.07 0.00 0.56 0.00 0.00 36.38 36.09 3im9 s VAL 194 CO -0.08 -0.61 1.39 -1.54 -0.31 0.00 0.00 175.10 173.95 3im9 n SER 195 N 0.95 0.82 -1.00 4.85 3.41 -1.26 -4.90 113.62 116.49 3im9 n SER 195 Ca -0.19 -0.62 0.00 0.00 -0.26 0.00 0.00 58.87 57.80 3im9 n SER 195 Cb 0.57 0.31 0.00 0.00 -0.26 0.00 0.00 64.21 64.83 3im9 n SER 195 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3im9 n GLY 196 N 1.44 1.71 2.79 5.00 0.00 -1.25 -4.74 105.19 110.14 3im9 n GLY 196 Ca 0.08 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 3im9 n GLY 196 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3im9 n PRO 197 N 0.00 4.34 -2.15 1.61 -0.04 -1.26 -4.03 135.00 133.47 3im9 n PRO 197 Ca 0.00 -3.98 -0.36 0.00 -0.04 0.00 0.00 63.50 59.12 3im9 n PRO 197 Cb 0.00 -2.68 0.01 0.00 -0.04 0.00 0.00 33.50 30.79 3im9 n PRO 197 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3im9 s PHE 198 N -1.55 2.63 -1.57 0.54 0.08 -1.26 -2.75 117.98 114.09 3im9 s PHE 198 Ca 0.40 1.52 0.00 0.00 0.12 0.00 0.00 56.93 58.96 3im9 s PHE 198 Cb 0.11 -3.42 0.00 0.00 -0.57 0.00 0.00 43.02 39.14 3im9 s PHE 198 CO -0.00 -1.85 0.00 0.72 -0.10 0.00 0.00 175.22 173.99 3im9 n HIS 199 N -1.07 -1.02 -4.35 0.36 8.25 -1.16 -4.75 115.22 111.47 3im9 n HIS 199 Ca 0.11 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.32 3im9 n HIS 199 Cb 0.49 -3.48 -0.09 0.00 1.12 0.00 0.00 29.99 28.04 3im9 n HIS 199 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3im9 s SER 200 N -2.10 4.15 0.67 0.41 1.04 -1.11 -3.90 113.70 112.85 3im9 s SER 200 Ca 0.00 -0.93 0.40 0.00 0.48 0.00 0.00 55.95 55.90 3im9 s SER 200 Cb 0.00 -0.56 2.16 0.00 0.10 0.00 0.00 66.02 67.72 3im9 s SER 200 CO 0.00 -0.14 2.22 0.77 0.98 0.00 0.00 173.24 177.07 3im9 h SER 201 N 1.90 0.00 0.15 7.02 4.64 -1.87 -0.38 113.55 125.02 3im9 h SER 201 Ca -0.43 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.89 3im9 h SER 201 Cb 1.25 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3im9 h SER 201 CO 0.64 0.00 -0.04 -0.07 -0.87 0.00 0.00 176.83 176.50 3im9 h LEU 202 N 0.00 0.00 0.00 5.97 3.38 -1.89 -2.14 115.31 120.63 3im9 h LEU 202 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3im9 h LEU 202 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3im9 h LEU 202 CO -0.00 0.04 0.00 0.23 0.09 0.00 0.00 178.44 178.80 3im9 n MET 203 N -3.63 0.75 0.33 1.13 2.81 -0.15 -2.83 117.12 115.52 3im9 n MET 203 Ca -0.03 0.00 0.19 0.00 -1.81 0.00 0.00 57.70 56.05 3im9 n MET 203 Cb 0.14 -1.50 1.01 0.00 -0.71 0.00 0.00 33.22 32.15 3im9 n MET 203 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 3im9 h LYS 204 N 0.00 0.00 -0.01 0.03 1.57 -1.58 -2.07 116.57 114.51 3im9 h LYS 204 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3im9 h LYS 204 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 3im9 h LYS 204 CO 0.00 0.00 0.02 -0.39 -0.57 0.00 0.00 179.45 178.51 3im9 h VAL 205 N 0.00 0.25 -0.19 0.50 -1.51 -1.80 -1.96 116.25 111.55 3im9 h VAL 205 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.47 3im9 h VAL 205 Cb 0.33 0.98 0.00 0.00 -2.13 0.00 0.00 31.29 30.48 3im9 h VAL 205 CO 0.00 0.00 0.00 2.30 -1.23 0.00 0.00 177.57 178.64 3im9 n ILE 206 N -3.44 0.40 -0.04 7.19 -5.35 -0.78 -4.66 119.36 112.69 3im9 n ILE 206 Ca -0.03 -0.70 -0.08 0.00 -0.27 0.00 0.00 62.75 61.67 3im9 n ILE 206 Cb 0.09 0.97 -0.03 0.00 -1.74 0.00 0.00 39.64 38.94 3im9 n ILE 206 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3im9 h GLU 207 N 2.65 0.03 -0.39 6.28 4.81 -1.45 -1.50 114.58 125.01 3im9 h GLU 207 Ca 0.00 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.16 3im9 h GLU 207 Cb 0.66 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 3im9 h GLU 207 CO 0.00 0.02 -0.02 0.93 -0.73 0.00 0.00 179.01 179.22 3im9 h GLU 208 N 0.03 0.70 -0.76 1.92 5.08 -1.83 0.21 114.58 119.93 3im9 h GLU 208 Ca 0.10 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 3im9 h GLU 208 Cb 0.13 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3im9 h GLU 208 CO -0.18 0.80 0.29 -0.44 -1.00 0.00 0.00 179.01 178.48 3im9 h ASP 209 N 0.52 1.07 -0.17 1.42 3.32 -1.84 -0.79 116.42 119.94 3im9 h ASP 209 Ca 0.11 -0.18 -0.07 0.00 0.02 0.00 0.00 57.03 56.91 3im9 h ASP 209 Cb 0.50 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.76 3im9 h ASP 209 CO 0.02 0.96 -0.16 0.15 -1.72 0.00 0.00 179.24 178.49 3im9 h PHE 210 N 1.11 0.49 -0.98 4.55 3.04 -1.06 -2.00 116.94 122.10 3im9 h PHE 210 Ca 0.25 -0.15 0.07 0.00 3.98 0.00 0.00 57.97 62.12 3im9 h PHE 210 Cb 0.24 -0.10 -0.07 0.00 2.56 0.00 0.00 35.95 38.58 3im9 h PHE 210 CO 0.02 0.78 0.63 0.77 -2.02 0.00 0.00 178.31 178.49 3im9 h SER 211 N 0.05 1.00 -0.25 0.41 0.02 -0.84 -1.38 113.55 112.56 3im9 h SER 211 Ca 0.03 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 3im9 h SER 211 Cb 0.70 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 3im9 h SER 211 CO 0.04 0.64 0.08 -1.28 -1.14 0.00 0.00 176.83 175.17 3im9 h SER 212 N 1.13 0.37 -0.42 3.07 0.87 -0.98 -3.04 113.55 114.55 3im9 h SER 212 Ca 0.42 -0.20 -0.03 0.00 -1.23 0.00 0.00 61.79 60.75 3im9 h SER 212 Cb 0.18 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 3im9 h SER 212 CO -0.17 0.48 0.14 0.22 -0.53 0.00 0.00 176.83 176.97 3im9 h TYR 213 N 0.24 0.67 0.00 2.24 3.20 -1.03 -2.87 116.97 119.44 3im9 h TYR 213 Ca 0.08 -0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3im9 h TYR 213 Cb 0.24 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.31 3im9 h TYR 213 CO 0.00 0.61 0.00 -0.84 -1.64 0.00 0.00 178.16 176.30 3im9 h ILE 214 N 0.54 0.00 0.00 1.81 3.07 -1.21 -0.53 117.51 121.19 3im9 h ILE 214 Ca 0.14 -0.16 0.00 0.00 1.55 0.00 0.00 64.86 66.39 3im9 h ILE 214 Cb 0.25 0.89 0.00 0.00 -0.27 0.00 0.00 36.82 37.69 3im9 h ILE 214 CO -0.01 0.00 0.00 0.59 -1.05 0.00 0.00 178.15 177.68 3im9 n ASN 215 N -2.52 0.17 0.00 2.16 3.02 -1.08 -2.64 115.26 114.38 3im9 n ASN 215 Ca -0.00 0.53 0.13 0.00 -0.03 0.00 0.00 54.58 55.21 3im9 n ASN 215 Cb 0.15 -0.57 0.74 0.00 -0.61 0.00 0.00 39.78 39.49 3im9 n ASN 215 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3im9 n GLN 216 N -1.68 0.73 -4.33 3.52 6.02 -0.21 -4.85 117.38 116.58 3im9 n GLN 216 Ca 0.05 0.01 -0.18 0.00 -0.01 0.00 0.00 57.00 56.87 3im9 n GLN 216 Cb 0.26 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 29.92 3im9 n GLN 216 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 3im9 s PHE 217 N -2.10 1.63 -0.20 1.08 0.40 -1.08 -5.12 117.98 112.59 3im9 s PHE 217 Ca 0.36 -0.65 -0.17 0.00 -0.60 0.00 0.00 56.93 55.87 3im9 s PHE 217 Cb 0.18 -0.80 -0.03 0.00 0.51 0.00 0.00 43.02 42.87 3im9 s PHE 217 CO 0.31 0.26 0.46 -2.00 0.70 0.00 0.00 175.22 174.96 3im9 s GLU 218 N -3.69 4.17 -0.15 0.44 2.12 -1.26 -5.05 118.70 115.28 3im9 s GLU 218 Ca 0.22 0.31 -0.08 0.00 0.36 0.00 0.00 54.97 55.79 3im9 s GLU 218 Cb 0.01 -3.56 -0.04 0.00 0.26 0.00 0.00 34.13 30.80 3im9 s GLU 218 CO 0.06 -0.11 0.12 -1.58 -0.54 0.00 0.00 175.26 173.21 3im9 s TRP 219 N 1.54 3.47 0.30 5.30 0.52 -1.26 -4.78 118.94 124.03 3im9 s TRP 219 Ca 0.22 0.39 0.09 0.00 0.02 0.00 0.00 56.10 56.82 3im9 s TRP 219 Cb -0.15 -2.02 -0.04 0.00 -1.15 0.00 0.00 33.47 30.11 3im9 s TRP 219 CO 0.09 0.51 0.08 1.03 0.02 0.00 0.00 176.95 178.68 3im9 s ARG 220 N -0.42 2.38 0.77 4.98 0.52 -0.34 -4.93 118.95 121.90 3im9 s ARG 220 Ca 0.11 -1.46 -0.14 0.00 -0.52 0.00 0.00 55.73 53.73 3im9 s ARG 220 Cb -0.12 -2.19 0.06 0.00 0.52 0.00 0.00 34.95 33.22 3im9 s ARG 220 CO 0.01 0.24 1.20 -0.51 0.02 0.00 0.00 175.30 176.27 3im9 s ASP 221 N -3.77 3.91 0.23 0.23 1.01 -1.26 -4.35 116.67 112.67 3im9 s ASP 221 Ca 0.35 2.34 -0.23 0.00 0.71 0.00 0.00 52.55 55.71 3im9 s ASP 221 Cb -0.04 -2.59 -0.09 0.00 1.01 0.00 0.00 42.92 41.21 3im9 s ASP 221 CO 0.22 -2.45 0.80 0.00 0.21 0.00 0.00 175.17 173.94 3im9 s ALA 222 N -2.10 3.37 -0.60 5.23 0.00 -0.05 -4.21 121.76 123.40 3im9 s ALA 222 Ca 0.73 0.31 0.26 0.00 0.00 0.00 0.00 51.96 53.26 3im9 s ALA 222 Cb -0.28 -2.95 0.85 0.00 0.00 0.00 0.00 23.12 20.73 3im9 s ALA 222 CO 0.48 0.28 1.76 0.87 0.00 0.00 0.00 175.76 179.15 3im9 h LYS 223 N 3.62 0.00 -3.21 0.00 1.57 -1.42 -3.45 116.57 113.69 3im9 h LYS 223 Ca -0.47 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.25 3im9 h LYS 223 Cb 1.20 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.37 3im9 h LYS 223 CO 0.65 0.00 -0.04 -0.59 -0.57 0.00 0.00 179.45 178.90 3im9 s PHE 224 N -3.20 -0.27 0.32 -1.35 -0.71 -1.26 -5.13 117.98 106.38 3im9 s PHE 224 Ca 0.08 0.06 -0.29 0.00 -1.04 0.00 0.00 56.93 55.75 3im9 s PHE 224 Cb 0.11 0.28 -0.10 0.00 -1.21 0.00 0.00 43.02 42.10 3im9 s PHE 224 CO 0.54 -0.68 1.33 -2.14 -1.34 0.00 0.00 175.22 172.93 3im9 s PRO 225 N -3.35 4.34 -0.29 1.99 0.02 -1.26 -4.85 135.00 131.60 3im9 s PRO 225 Ca 0.00 2.24 -0.10 0.00 0.02 0.00 0.00 61.00 63.15 3im9 s PRO 225 Cb 0.01 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.42 3im9 s PRO 225 CO -0.09 -0.23 0.17 0.08 -0.33 0.00 0.00 177.00 176.60 3im9 s VAL 226 N -1.00 4.99 -0.49 3.83 1.01 -0.66 -1.67 120.40 126.40 3im9 s VAL 226 Ca 0.50 -0.05 -0.27 0.00 0.00 0.00 0.00 61.98 62.16 3im9 s VAL 226 Cb -0.40 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 32.59 3im9 s VAL 226 CO 0.52 0.20 1.03 -0.69 0.00 0.00 0.00 175.10 176.17 3im9 s VAL 227 N 1.70 4.32 0.29 2.92 1.01 0.44 -0.69 120.40 130.39 3im9 s VAL 227 Ca 0.06 0.88 -0.21 0.00 0.00 0.00 0.00 61.98 62.72 3im9 s VAL 227 Cb -0.16 -4.54 -0.09 0.00 0.00 0.00 0.00 36.38 31.59 3im9 s VAL 227 CO 0.09 -0.98 0.82 -1.10 0.00 0.00 0.00 175.10 173.92 3im9 s GLN 228 N 4.16 4.32 0.42 2.72 -0.21 -0.96 -4.57 119.66 125.54 3im9 s GLN 228 Ca 0.41 1.01 0.10 0.00 0.02 0.00 0.00 55.36 56.90 3im9 s GLN 228 Cb -0.09 -2.73 0.89 0.00 1.00 0.00 0.00 33.01 32.08 3im9 s GLN 228 CO 0.28 0.29 2.00 -0.91 -2.12 0.00 0.00 175.29 174.82 3im9 h ASN 229 N 3.05 0.27 -0.42 5.90 2.35 -1.91 0.18 115.58 124.99 3im9 h ASN 229 Ca -0.48 -0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 55.11 3im9 h ASN 229 Cb 1.19 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.48 3im9 h ASN 229 CO 0.65 0.31 -0.24 -0.37 -1.65 0.00 0.00 177.43 176.13 3im9 h VAL 230 N 0.30 1.28 0.00 2.81 -1.51 -1.87 -0.78 116.25 116.47 3im9 h VAL 230 Ca 0.07 -1.39 0.00 0.00 -1.23 0.00 0.00 66.70 64.15 3im9 h VAL 230 Cb 0.17 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.59 3im9 h VAL 230 CO 0.00 0.47 0.00 -0.46 -1.23 0.00 0.00 177.57 176.35 3im9 n ASN 231 N -4.16 0.56 -3.40 4.19 6.94 -1.17 -4.83 115.26 113.39 3im9 n ASN 231 Ca -0.01 -0.87 -0.24 0.00 -0.02 0.00 0.00 54.58 53.44 3im9 n ASN 231 Cb 0.46 0.14 0.05 0.00 -2.36 0.00 0.00 39.78 38.07 3im9 n ASN 231 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3im9 n ALA 232 N -0.14 -1.16 -2.59 -2.53 0.00 0.61 -4.99 120.51 109.72 3im9 n ALA 232 Ca 0.00 0.31 -0.10 0.00 0.00 0.00 0.00 53.44 53.65 3im9 n ALA 232 Cb 0.06 -4.56 -0.11 0.00 0.00 0.00 0.00 19.45 14.85 3im9 n ALA 232 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3im9 s GLN 233 N -6.10 0.52 0.23 0.00 -0.21 -1.26 -4.48 119.66 108.37 3im9 s GLN 233 Ca 0.48 -0.92 -0.30 0.00 0.02 0.00 0.00 55.36 54.63 3im9 s GLN 233 Cb -0.22 -0.00 -0.10 0.00 1.00 0.00 0.00 33.01 33.68 3im9 s GLN 233 CO 0.59 -0.04 1.50 0.20 -2.12 0.00 0.00 175.29 175.42 3im9 s GLY 234 N -2.13 2.09 0.04 3.09 0.00 -1.26 -2.26 107.32 106.89 3im9 s GLY 234 Ca -0.04 1.38 0.04 0.00 0.00 0.00 0.00 44.72 46.10 3im9 s GLY 234 CO -0.04 2.42 -0.13 -0.54 0.00 0.00 0.00 173.10 174.81 3im9 s GLU 235 N 0.00 0.86 0.00 2.90 0.41 0.13 -4.89 118.70 118.12 3im9 s GLU 235 Ca 0.63 -0.72 0.00 0.00 -0.41 0.00 0.00 54.97 54.46 3im9 s GLU 235 Cb -0.43 -0.85 0.00 0.00 -1.78 0.00 0.00 34.13 31.07 3im9 s GLU 235 CO 0.41 0.21 0.00 0.25 -0.49 0.00 0.00 175.26 175.64 3im9 n THR 236 N 1.92 0.00 -2.11 3.63 -2.24 -1.26 -1.65 114.28 112.57 3im9 n THR 236 Ca -0.18 -0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.12 3im9 n THR 236 Cb 0.55 0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 3im9 n THR 236 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3im9 s ASP 237 N -1.05 6.76 0.23 3.42 -1.08 -1.26 -0.87 116.67 122.83 3im9 s ASP 237 Ca 0.00 2.49 -0.07 0.00 -0.52 0.00 0.00 52.55 54.45 3im9 s ASP 237 Cb 0.00 -2.61 0.22 0.00 -1.46 0.00 0.00 42.92 39.07 3im9 s ASP 237 CO 0.00 -0.65 1.89 0.07 0.52 0.00 0.00 175.17 177.00 3im9 h LYS 238 N 5.79 1.23 0.04 4.34 2.10 -1.92 -0.29 116.57 127.87 3im9 h LYS 238 Ca -0.44 -0.10 -0.23 0.00 -2.00 0.00 0.00 60.65 57.88 3im9 h LYS 238 Cb 1.21 -0.26 -0.01 0.00 -0.90 0.00 0.00 32.23 32.27 3im9 h LYS 238 CO 0.81 0.85 -1.03 0.93 -2.00 0.00 0.00 179.45 179.02 3im9 h GLU 239 N 1.26 0.18 -0.18 0.07 4.39 -1.92 -1.22 114.58 117.15 3im9 h GLU 239 Ca 0.33 -0.25 -0.09 0.00 0.34 0.00 0.00 59.36 59.69 3im9 h GLU 239 Cb -0.08 0.09 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3im9 h GLU 239 CO -0.06 1.05 -0.23 0.28 -1.16 0.00 0.00 179.01 178.89 3im9 h VAL 240 N 0.07 1.34 -0.38 3.13 2.07 -1.94 -1.75 116.25 118.79 3im9 h VAL 240 Ca -0.07 -1.43 -0.01 0.00 0.82 0.00 0.00 66.70 66.01 3im9 h VAL 240 Cb 1.72 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 33.31 3im9 h VAL 240 CO 0.16 0.43 0.19 0.40 0.02 0.00 0.00 177.57 178.77 3im9 h ILE 241 N 0.14 1.16 -0.42 4.57 2.04 -1.04 -1.17 117.51 122.79 3im9 h ILE 241 Ca 0.02 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.43 3im9 h ILE 241 Cb 0.80 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 3im9 h ILE 241 CO 0.06 0.17 0.23 0.50 0.00 0.00 0.00 178.15 179.11 3im9 h LYS 242 N 0.48 0.59 -0.55 2.37 3.64 -1.21 -0.25 116.57 121.65 3im9 h LYS 242 Ca 0.13 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3im9 h LYS 242 Cb 0.10 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.77 3im9 h LYS 242 CO -0.02 0.48 0.18 1.03 -2.27 0.00 0.00 179.45 178.85 3im9 h SER 243 N 0.55 0.75 1.26 4.20 0.87 -1.13 -1.48 113.55 118.57 3im9 h SER 243 Ca 0.15 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 3im9 h SER 243 Cb 0.06 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 61.82 3im9 h SER 243 CO -0.02 0.70 -0.01 0.78 -0.53 0.00 0.00 176.83 177.75 3im9 h ASN 244 N 0.80 0.00 0.43 6.23 2.35 -0.44 -1.62 115.58 123.32 3im9 h ASN 244 Ca 0.18 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.74 3im9 h ASN 244 Cb 0.21 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 3im9 h ASN 244 CO -0.01 0.01 -0.81 0.24 -1.65 0.00 0.00 177.43 175.20 3im9 h MET 245 N 0.00 0.29 -0.31 0.81 2.86 0.01 -0.20 114.93 118.39 3im9 h MET 245 Ca -0.00 -0.28 -0.11 0.00 -2.06 0.00 0.00 59.70 57.25 3im9 h MET 245 Cb 0.64 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.37 3im9 h MET 245 CO 0.00 0.96 -0.23 0.28 1.06 0.00 0.00 176.91 178.98 3im9 h VAL 246 N 0.18 1.30 0.00 -2.22 2.07 -1.11 -3.19 116.25 113.28 3im9 h VAL 246 Ca -0.04 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.07 3im9 h VAL 246 Cb 1.41 1.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.69 3im9 h VAL 246 CO 0.13 0.44 -0.14 0.11 0.02 0.00 0.00 177.57 178.13 3im9 h LYS 247 N 0.45 0.00 -0.44 1.57 1.57 -1.25 -2.27 116.57 116.20 3im9 h LYS 247 Ca 0.06 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.91 3im9 h LYS 247 Cb 0.79 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 3im9 h LYS 247 CO 0.06 0.14 0.30 0.37 -0.57 0.00 0.00 179.45 179.75 3im9 h GLN 248 N 0.00 0.30 -0.98 3.15 4.15 -1.01 -1.90 115.11 118.81 3im9 h GLN 248 Ca -0.00 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.46 3im9 h GLN 248 Cb 0.26 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 27.82 3im9 h GLN 248 CO 0.02 0.20 0.64 -0.07 -1.93 0.00 0.00 178.83 177.68 3im9 h LEU 249 N 0.30 1.03 -3.01 -2.39 3.38 -1.50 -3.05 115.31 110.07 3im9 h LEU 249 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3im9 h LEU 249 Cb 0.39 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3im9 h LEU 249 CO -0.04 0.67 0.00 0.00 0.09 0.00 0.00 178.44 179.15 3im9 n TYR 250 N -4.48 0.16 -4.40 1.13 4.11 -0.75 -2.97 117.16 109.95 3im9 n TYR 250 Ca 0.15 -0.71 -0.27 0.00 -0.00 0.00 0.00 57.90 57.06 3im9 n TYR 250 Cb 0.16 -0.11 -0.12 0.00 -0.00 0.00 0.00 39.34 39.28 3im9 n TYR 250 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.86 175.74 3im9 s SER 251 N -1.74 3.53 0.52 9.48 0.01 -0.99 -3.39 113.70 121.13 3im9 s SER 251 Ca 0.18 -0.81 -0.21 0.00 1.31 0.00 0.00 55.95 56.42 3im9 s SER 251 Cb 0.15 -0.31 -0.06 0.00 0.21 0.00 0.00 66.02 66.01 3im9 s SER 251 CO 0.04 0.13 1.25 -2.84 0.41 0.00 0.00 173.24 172.22 3im9 s PRO 252 N -2.60 3.34 -0.45 12.44 0.02 -1.25 -4.70 135.00 141.80 3im9 s PRO 252 Ca 0.20 1.95 -0.28 0.00 0.02 0.00 0.00 61.00 62.90 3im9 s PRO 252 Cb -0.08 -2.23 0.03 0.00 0.02 0.00 0.00 34.50 32.23 3im9 s PRO 252 CO 0.10 -0.94 1.08 0.08 -0.33 0.00 0.00 177.00 176.99 3im9 s VAL 253 N -1.47 4.31 -1.48 3.83 1.01 0.27 -4.46 120.40 122.41 3im9 s VAL 253 Ca 0.70 1.20 -0.09 0.00 0.00 0.00 0.00 61.98 63.78 3im9 s VAL 253 Cb -0.33 -4.54 0.02 0.00 0.00 0.00 0.00 36.38 31.53 3im9 s VAL 253 CO 0.39 -0.90 2.56 0.00 0.00 0.00 0.00 175.10 177.15 3im9 n GLN 254 N 7.56 3.82 -0.12 2.72 1.13 -0.30 -1.20 117.38 130.99 3im9 n GLN 254 Ca 0.11 -2.77 -0.12 0.00 -1.94 0.00 0.00 57.00 52.27 3im9 n GLN 254 Cb 0.49 -2.84 -0.00 0.00 0.11 0.00 0.00 30.24 27.99 3im9 n GLN 254 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 3im9 h PHE 255 N 5.13 1.09 -0.04 1.08 3.04 -1.70 -1.33 116.94 124.21 3im9 h PHE 255 Ca 0.73 -0.31 -0.00 0.00 3.98 0.00 0.00 57.97 62.37 3im9 h PHE 255 Cb 0.38 -0.24 -0.00 0.00 2.56 0.00 0.00 35.95 38.65 3im9 h PHE 255 CO 1.67 1.13 0.02 0.82 -2.02 0.00 0.00 178.31 179.93 3im9 h ILE 256 N 0.77 1.07 -0.13 1.41 2.04 -1.57 -0.92 117.51 120.18 3im9 h ILE 256 Ca 0.07 -0.19 -0.11 0.00 1.00 0.00 0.00 64.86 65.63 3im9 h ILE 256 Cb 0.92 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 3im9 h ILE 256 CO 0.09 0.06 -0.41 0.78 0.00 0.00 0.00 178.15 178.66 3im9 h ASN 257 N -0.01 0.29 -0.41 1.72 -0.26 -1.85 -0.29 115.58 114.77 3im9 h ASN 257 Ca 0.01 -0.12 -0.07 0.00 -0.56 0.00 0.00 56.30 55.56 3im9 h ASN 257 Cb 0.07 -0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.23 3im9 h ASN 257 CO -0.00 0.68 -0.03 0.28 -1.06 0.00 0.00 177.43 177.29 3im9 h SER 258 N 0.24 0.73 -0.46 5.81 0.02 -1.12 -0.35 113.55 118.42 3im9 h SER 258 Ca 0.02 -0.32 0.02 0.00 -0.84 0.00 0.00 61.79 60.66 3im9 h SER 258 Cb 0.82 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 3im9 h SER 258 CO 0.07 0.88 0.28 0.74 -1.14 0.00 0.00 176.83 177.65 3im9 h THR 259 N 0.56 1.07 -0.53 -2.27 2.02 -0.66 -2.07 112.91 111.03 3im9 h THR 259 Ca 0.11 -0.19 -0.07 0.00 0.77 0.00 0.00 66.41 67.03 3im9 h THR 259 Cb 0.52 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 3im9 h THR 259 CO 0.03 0.10 0.06 -0.33 0.37 0.00 0.00 175.52 175.75 3im9 h GLU 260 N 0.56 0.85 -0.45 6.66 5.08 -0.91 -0.75 114.58 125.63 3im9 h GLU 260 Ca 0.18 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.23 3im9 h GLU 260 Cb -0.01 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 3im9 h GLU 260 CO -0.07 0.81 -0.11 2.35 -1.00 0.00 0.00 179.01 180.99 3im9 h TRP 261 N 0.81 0.90 -0.19 4.33 7.01 -0.86 0.63 115.95 128.58 3im9 h TRP 261 Ca 0.17 -0.17 -0.21 0.00 2.11 0.00 0.00 58.89 60.79 3im9 h TRP 261 Cb 0.39 -0.23 0.01 0.00 -2.10 0.00 0.00 29.16 27.23 3im9 h TRP 261 CO 0.02 0.88 -0.69 -0.07 -2.79 0.00 0.00 178.44 175.79 3im9 h LEU 262 N 0.74 0.91 -0.92 0.65 3.38 -0.82 -2.22 115.31 117.03 3im9 h LEU 262 Ca 0.12 -0.56 -0.08 0.00 0.09 0.00 0.00 57.88 57.45 3im9 h LEU 262 Cb 0.61 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3im9 h LEU 262 CO 0.04 1.35 -0.08 0.40 0.09 0.00 0.00 178.44 180.24 3im9 h ILE 263 N 0.56 1.25 0.00 1.22 2.04 -0.70 -1.19 117.51 120.68 3im9 h ILE 263 Ca -0.03 -1.08 0.00 0.00 1.00 0.00 0.00 64.86 64.76 3im9 h ILE 263 Cb 1.31 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 3im9 h ILE 263 CO 0.14 0.37 0.00 0.47 0.00 0.00 0.00 178.15 179.13 3im9 n ASP 264 N -4.19 0.62 -0.74 1.72 8.00 0.18 -0.99 116.55 121.14 3im9 n ASP 264 Ca 0.02 0.66 0.12 0.00 0.71 0.00 0.00 54.79 56.30 3im9 n ASP 264 Cb 0.33 -0.79 0.33 0.00 -0.02 0.00 0.00 41.12 40.97 3im9 n ASP 264 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3im9 n GLN 265 N -2.19 1.99 -0.13 -1.24 1.13 -0.53 -4.93 117.38 111.47 3im9 n GLN 265 Ca 0.02 -1.47 0.00 0.00 -1.94 0.00 0.00 57.00 53.61 3im9 n GLN 265 Cb 0.20 -1.45 0.00 0.00 0.11 0.00 0.00 30.24 29.10 3im9 n GLN 265 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3im9 n GLY 266 N 1.26 0.93 3.66 1.08 0.00 -0.16 -4.73 105.19 107.23 3im9 n GLY 266 Ca 0.17 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 3im9 n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3im9 s VAL 267 N -2.00 3.62 -0.01 1.61 1.01 -0.73 -2.19 120.40 121.71 3im9 s VAL 267 Ca 0.00 0.79 0.02 0.00 0.00 0.00 0.00 61.98 62.79 3im9 s VAL 267 Cb 0.00 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.89 3im9 s VAL 267 CO 0.00 -0.06 0.90 -0.90 0.00 0.00 0.00 175.10 175.04 3im9 n ASP 268 N 6.90 1.54 -3.67 3.32 3.85 -0.70 -4.30 116.55 123.48 3im9 n ASP 268 Ca 0.17 -1.87 -0.13 0.00 -0.71 0.00 0.00 54.79 52.24 3im9 n ASP 268 Cb 0.43 -0.04 -0.13 0.00 -1.35 0.00 0.00 41.12 40.03 3im9 n ASP 268 CO 0.00 0.00 0.00 -2.28 -1.01 0.00 0.00 177.20 173.91 3im9 s HIS 269 N -0.91 -0.41 -0.10 2.11 2.46 -1.20 -0.57 115.29 116.68 3im9 s HIS 269 Ca 0.03 0.95 0.01 0.00 0.47 0.00 0.00 55.06 56.51 3im9 s HIS 269 Cb 0.02 -0.03 -0.02 0.00 -0.13 0.00 0.00 32.58 32.42 3im9 s HIS 269 CO 0.00 -0.34 -0.12 -0.06 -2.47 0.00 0.00 174.74 171.75 3im9 s PHE 270 N 2.28 2.81 -0.26 3.88 0.40 -0.36 -1.26 117.98 125.47 3im9 s PHE 270 Ca 0.00 -0.37 0.01 0.00 -0.60 0.00 0.00 56.93 55.97 3im9 s PHE 270 Cb -0.12 -1.76 0.05 0.00 0.51 0.00 0.00 43.02 41.70 3im9 s PHE 270 CO -0.08 0.00 -0.09 0.42 0.70 0.00 0.00 175.22 176.17 3im9 s ILE 271 N -0.15 2.44 -0.02 0.64 1.01 -0.08 -1.32 121.20 123.71 3im9 s ILE 271 Ca -0.00 -1.44 -0.23 0.00 0.00 0.00 0.00 60.65 58.98 3im9 s ILE 271 Cb -0.13 -2.37 -0.05 0.00 0.01 0.00 0.00 42.46 39.92 3im9 s ILE 271 CO 0.03 0.03 0.69 -0.70 0.00 0.00 0.00 174.94 174.99 3im9 s GLU 272 N 1.18 4.42 -0.18 2.79 2.12 0.32 -0.33 118.70 129.02 3im9 s GLU 272 Ca -0.06 0.89 -0.01 0.00 0.36 0.00 0.00 54.97 56.15 3im9 s GLU 272 Cb -0.19 -3.39 0.05 0.00 0.26 0.00 0.00 34.13 30.86 3im9 s GLU 272 CO -0.05 0.21 -0.01 0.42 -0.54 0.00 0.00 175.26 175.29 3im9 s ILE 273 N 0.29 0.87 -5.00 -3.70 1.01 -0.49 -0.10 121.20 114.08 3im9 s ILE 273 Ca 0.36 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.38 3im9 s ILE 273 Cb -0.19 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.09 3im9 s ILE 273 CO 0.19 -0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.71 3im9 n GLY 274 N 4.94 -0.96 3.79 6.18 0.00 -0.56 -4.43 105.19 114.15 3im9 n GLY 274 Ca -0.10 -1.58 -0.36 0.00 0.00 0.00 0.00 46.02 43.98 3im9 n GLY 274 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3im9 s PRO 275 N -1.69 4.25 0.07 1.61 0.04 -1.26 -4.11 135.00 133.91 3im9 s PRO 275 Ca 0.00 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.46 3im9 s PRO 275 Cb 0.00 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 32.01 3im9 s PRO 275 CO 0.00 -0.05 0.00 0.41 0.04 0.00 0.00 177.00 177.40 3im9 n GLY 276 N 0.23 -1.45 2.60 0.56 0.00 -1.26 -4.72 105.19 101.15 3im9 n GLY 276 Ca 0.05 -1.45 -0.04 0.00 0.00 0.00 0.00 46.02 44.57 3im9 n GLY 276 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3im9 n LYS 277 N -1.78 2.00 -0.22 1.61 2.85 -1.26 -4.88 118.16 116.48 3im9 n LYS 277 Ca 0.00 -3.56 -0.09 0.00 -1.05 0.00 0.00 58.31 53.61 3im9 n LYS 277 Cb 0.14 -1.66 0.03 0.00 -0.65 0.00 0.00 35.03 32.89 3im9 n LYS 277 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 3im9 h VAL 278 N 4.98 1.26 -0.11 0.58 2.07 -1.98 -2.15 116.25 120.90 3im9 h VAL 278 Ca -0.05 -1.05 -0.13 0.00 0.82 0.00 0.00 66.70 66.29 3im9 h VAL 278 Cb 1.35 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 3im9 h VAL 278 CO 0.28 0.39 -0.51 -0.07 0.02 0.00 0.00 177.57 177.68 3im9 h LEU 279 N 0.96 0.31 -1.15 2.57 3.38 -1.95 -1.88 115.31 117.54 3im9 h LEU 279 Ca 0.19 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3im9 h LEU 279 Cb 0.47 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 3im9 h LEU 279 CO 0.02 0.77 0.42 0.28 0.09 0.00 0.00 178.44 180.01 3im9 h SER 280 N 0.23 0.89 -0.52 -0.43 0.02 -1.89 0.14 113.55 111.98 3im9 h SER 280 Ca 0.01 -0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 60.81 3im9 h SER 280 Cb 0.97 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 3im9 h SER 280 CO 0.08 0.70 -0.00 1.23 -1.14 0.00 0.00 176.83 177.70 3im9 h GLY 281 N 1.05 1.04 0.85 -3.77 0.00 -0.71 -0.79 103.07 100.75 3im9 h GLY 281 Ca 0.26 -0.74 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 3im9 h GLY 281 CO -0.05 0.68 -0.16 1.41 0.00 0.00 0.00 176.54 178.43 3im9 h LEU 282 N 0.89 0.54 -0.99 3.11 3.38 -0.73 -3.05 115.31 118.46 3im9 h LEU 282 Ca 0.16 -0.44 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 3im9 h LEU 282 Cb 0.52 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3im9 h LEU 282 CO 0.03 0.87 0.21 0.40 0.09 0.00 0.00 178.44 180.03 3im9 h ILE 283 N 0.22 1.23 -0.72 1.22 2.04 -0.47 -2.31 117.51 118.73 3im9 h ILE 283 Ca 0.05 -0.78 0.09 0.00 1.00 0.00 0.00 64.86 65.21 3im9 h ILE 283 Cb 0.69 0.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.25 3im9 h ILE 283 CO 0.04 0.30 0.48 0.50 0.00 0.00 0.00 178.15 179.47 3im9 h LYS 284 N 0.91 0.64 0.00 2.37 1.63 -1.10 0.26 116.57 121.28 3im9 h LYS 284 Ca 0.21 -0.04 -0.05 0.00 -0.85 0.00 0.00 60.65 59.92 3im9 h LYS 284 Cb 0.24 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.72 3im9 h LYS 284 CO -0.01 0.42 -0.24 0.87 -3.45 0.00 0.00 179.45 177.04 3im9 h LYS 285 N 0.66 0.00 0.05 1.90 1.57 -1.33 -3.28 116.57 116.14 3im9 h LYS 285 Ca 0.33 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.02 3im9 h LYS 285 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.72 3im9 h LYS 285 CO -0.11 0.24 -0.42 0.82 -0.57 0.00 0.00 179.45 179.41 3im9 h ILE 286 N 0.00 1.61 -2.62 1.86 2.04 -0.57 -3.43 117.51 116.40 3im9 h ILE 286 Ca -0.00 -2.40 -0.23 0.00 1.00 0.00 0.00 64.86 63.22 3im9 h ILE 286 Cb 1.07 3.22 -0.33 0.00 -0.74 0.00 0.00 36.82 40.04 3im9 h ILE 286 CO 0.03 0.63 -0.55 0.21 0.00 0.00 0.00 178.15 178.47 3im9 s ASN 287 N -6.54 0.62 0.00 1.72 3.84 0.73 -5.04 114.94 110.27 3im9 s ASN 287 Ca -0.18 0.32 0.28 0.00 0.21 0.00 0.00 52.86 53.49 3im9 s ASN 287 Cb -0.01 0.68 1.44 0.00 -0.55 0.00 0.00 41.25 42.82 3im9 s ASN 287 CO 0.73 -0.27 1.96 -2.11 -2.79 0.00 0.00 177.10 174.62 3im9 n ARG 288 N 5.34 1.29 -0.01 0.43 1.85 -1.24 -3.92 116.66 120.41 3im9 n ARG 288 Ca -0.06 -0.43 0.08 0.00 -1.00 0.00 0.00 57.85 56.45 3im9 n ARG 288 Cb 0.50 -1.47 -0.15 0.00 -1.05 0.00 0.00 32.46 30.29 3im9 n ARG 288 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 3im9 n ASP 289 N -0.46 0.57 -4.81 2.89 8.00 -1.26 -4.98 116.55 116.50 3im9 n ASP 289 Ca 0.21 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.38 3im9 n ASP 289 Cb 0.21 1.82 0.00 0.00 -0.02 0.00 0.00 41.12 43.14 3im9 n ASP 289 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3im9 s VAL 290 N -3.29 3.89 0.18 2.53 -7.23 -1.25 -5.03 120.40 110.20 3im9 s VAL 290 Ca -0.07 0.91 -0.26 0.00 -1.81 0.00 0.00 61.98 60.75 3im9 s VAL 290 Cb 0.12 -3.42 -0.08 0.00 0.56 0.00 0.00 36.38 33.55 3im9 s VAL 290 CO 0.80 -0.51 0.80 -0.75 -0.31 0.00 0.00 175.10 175.13 3im9 s LYS 291 N -4.02 4.60 -0.11 4.82 2.20 0.26 -4.97 119.74 122.52 3im9 s LYS 291 Ca 0.63 1.19 0.02 0.00 -0.36 0.00 0.00 55.97 57.46 3im9 s LYS 291 Cb -0.15 -3.26 0.01 0.00 -1.51 0.00 0.00 37.83 32.92 3im9 s LYS 291 CO 0.35 0.56 -0.17 -0.51 -0.36 0.00 0.00 175.35 175.23 3im9 s LEU 292 N -1.17 1.81 -0.04 5.43 1.43 -1.26 -1.22 118.68 123.65 3im9 s LEU 292 Ca 0.36 -0.46 0.06 0.00 -1.03 0.00 0.00 54.13 53.06 3im9 s LEU 292 Cb -0.23 -1.16 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 3im9 s LEU 292 CO 0.27 0.04 -0.23 -0.89 0.23 0.00 0.00 176.35 175.77 3im9 s THR 293 N 0.90 2.28 -0.11 5.49 2.01 -0.43 -4.99 115.64 120.79 3im9 s THR 293 Ca -0.08 -1.00 0.02 0.00 0.31 0.00 0.00 61.69 60.94 3im9 s THR 293 Cb -0.15 -1.83 -0.01 0.00 0.01 0.00 0.00 72.50 70.52 3im9 s THR 293 CO -0.01 0.58 -0.19 -0.55 -0.69 0.00 0.00 174.62 173.75 3im9 s SER 294 N -0.42 3.49 -0.34 3.53 0.15 -1.26 -0.52 113.70 118.32 3im9 s SER 294 Ca 0.04 -0.46 -0.04 0.00 0.70 0.00 0.00 55.95 56.20 3im9 s SER 294 Cb -0.12 -1.49 0.06 0.00 -1.71 0.00 0.00 66.02 62.77 3im9 s SER 294 CO 0.01 0.16 0.09 -0.63 1.20 0.00 0.00 173.24 174.08 3im9 s ILE 295 N 0.33 3.37 -0.01 6.45 -1.09 0.86 -4.94 121.20 126.17 3im9 s ILE 295 Ca -0.15 -1.45 0.01 0.00 -2.23 0.00 0.00 60.65 56.82 3im9 s ILE 295 Cb -0.17 -3.02 -0.01 0.00 -1.58 0.00 0.00 42.46 37.68 3im9 s ILE 295 CO 0.08 -0.28 -0.00 0.00 -1.23 0.00 0.00 174.94 173.51 3im9 n GLN 296 N 4.69 2.73 -4.52 2.79 6.02 -1.26 -1.49 117.38 126.34 3im9 n GLN 296 Ca -0.10 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.65 3im9 n GLN 296 Cb 0.43 -1.03 -0.10 0.00 1.02 0.00 0.00 30.24 30.56 3im9 n GLN 296 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 3im9 s THR 297 N -2.03 1.36 0.31 5.09 -4.23 -1.26 -4.75 115.64 110.12 3im9 s THR 297 Ca -0.01 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 3im9 s THR 297 Cb 0.00 -2.78 0.25 0.00 1.34 0.00 0.00 72.50 71.32 3im9 s THR 297 CO 0.05 0.00 1.97 0.25 -0.54 0.00 0.00 174.62 176.34 3im9 h LEU 298 N 1.95 0.89 -1.09 4.79 5.85 -1.99 -1.26 115.31 124.45 3im9 h LEU 298 Ca -0.41 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.23 3im9 h LEU 298 Cb 1.25 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 3im9 h LEU 298 CO 0.72 0.66 0.12 -0.33 -0.34 0.00 0.00 178.44 179.27 3im9 h GLU 299 N 1.05 0.76 -0.55 1.25 4.39 -1.95 0.38 114.58 119.91 3im9 h GLU 299 Ca 0.28 -0.15 -0.09 0.00 0.34 0.00 0.00 59.36 59.74 3im9 h GLU 299 Cb -0.09 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 3im9 h GLU 299 CO -0.06 0.69 -0.01 -0.44 -1.16 0.00 0.00 179.01 178.04 3im9 h ASP 300 N 0.74 0.95 -0.30 1.42 3.32 -1.72 -0.08 116.42 120.75 3im9 h ASP 300 Ca 0.16 -0.31 0.03 0.00 0.02 0.00 0.00 57.03 56.93 3im9 h ASP 300 Cb 0.28 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 3im9 h ASP 300 CO -0.00 1.03 0.11 0.58 -1.72 0.00 0.00 179.24 179.24 3im9 h VAL 301 N 0.85 0.92 -0.70 -1.35 2.07 -0.74 -1.12 116.25 116.20 3im9 h VAL 301 Ca 0.15 -0.08 -0.03 0.00 0.82 0.00 0.00 66.70 67.56 3im9 h VAL 301 Cb 0.55 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 3im9 h VAL 301 CO 0.03 0.04 0.32 0.11 0.02 0.00 0.00 177.57 178.09 3im9 h LYS 302 N 0.24 1.01 -0.51 1.57 1.57 -0.71 0.56 116.57 120.30 3im9 h LYS 302 Ca 0.13 -0.16 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 3im9 h LYS 302 Cb 0.10 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.21 3im9 h LYS 302 CO -0.13 0.81 0.20 0.78 -0.57 0.00 0.00 179.45 180.54 3im9 h GLY 303 N 0.98 0.83 0.94 3.86 0.00 -0.77 -2.67 103.07 106.22 3im9 h GLY 303 Ca 0.24 -0.46 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 3im9 h GLY 303 CO -0.03 0.43 0.16 -0.25 0.00 0.00 0.00 176.54 176.85 3im9 h TRP 304 N 0.69 0.56 0.00 5.60 2.91 -0.87 -3.51 115.95 121.32 3im9 h TRP 304 Ca 0.17 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.15 3im9 h TRP 304 Cb 0.21 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 28.69 3im9 h TRP 304 CO 0.01 0.49 0.00 0.09 -1.03 0.00 0.00 178.44 178.00