#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r9b n SER 2 N 0.00 1.63 -4.53 6.43 3.41 -1.26 -4.84 113.62 114.46 2r9b n SER 2 Ca 0.00 -2.04 -0.25 0.00 -0.26 0.00 0.00 58.87 56.31 2r9b n SER 2 Cb 0.00 -0.23 -0.11 0.00 -0.26 0.00 0.00 64.21 63.61 2r9b n SER 2 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2r9b s ASN 3 N -0.91 3.51 -0.27 4.04 0.01 -1.26 -4.80 114.94 115.26 2r9b s ASN 3 Ca 0.19 -1.25 -0.21 0.00 -0.71 0.00 0.00 52.86 50.88 2r9b s ASN 3 Cb 0.10 -0.31 -0.01 0.00 0.41 0.00 0.00 41.25 41.44 2r9b s ASN 3 CO 0.12 -0.31 0.65 -0.62 -1.51 0.00 0.00 177.10 175.43 2r9b s ASP 4 N -3.59 6.58 -0.17 -1.22 3.68 -0.93 -4.92 116.67 116.10 2r9b s ASP 4 Ca 0.33 0.66 -0.01 0.00 2.13 0.00 0.00 52.55 55.66 2r9b s ASP 4 Cb 0.05 -2.35 -0.01 0.00 -1.45 0.00 0.00 42.92 39.16 2r9b s ASP 4 CO 0.16 -0.42 -0.12 0.20 0.13 0.00 0.00 175.17 175.12 2r9b s ASN 5 N 1.51 3.93 -0.16 -0.34 0.01 -1.26 -0.14 114.94 118.49 2r9b s ASN 5 Ca 0.27 -0.41 -0.04 0.00 -0.71 0.00 0.00 52.86 51.98 2r9b s ASN 5 Cb -0.15 -1.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.86 2r9b s ASN 5 CO 0.09 0.08 -0.04 -0.63 -1.51 0.00 0.00 177.10 175.10 2r9b s ILE 6 N 0.86 3.84 0.27 0.60 1.09 0.64 -4.79 121.20 123.71 2r9b s ILE 6 Ca -0.03 -0.37 -0.30 0.00 -1.10 0.00 0.00 60.65 58.85 2r9b s ILE 6 Cb -0.15 -2.69 -0.09 0.00 -1.06 0.00 0.00 42.46 38.47 2r9b s ILE 6 CO 0.00 0.49 1.08 -0.70 -0.10 0.00 0.00 174.94 175.71 2r9b s GLU 7 N 0.46 4.67 -0.09 2.79 2.12 -1.26 -0.85 118.70 126.54 2r9b s GLU 7 Ca -0.04 1.77 0.02 0.00 0.36 0.00 0.00 54.97 57.09 2r9b s GLU 7 Cb -0.14 -3.20 -0.02 0.00 0.26 0.00 0.00 34.13 31.03 2r9b s GLU 7 CO 0.03 0.25 -0.17 -0.51 -0.54 0.00 0.00 175.26 174.32 2r9b s LEU 8 N -1.40 2.54 0.00 2.70 1.43 -0.02 -4.51 118.68 119.43 2r9b s LEU 8 Ca 0.44 -0.35 0.08 0.00 -1.03 0.00 0.00 54.13 53.27 2r9b s LEU 8 Cb -0.31 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 2r9b s LEU 8 CO 0.40 0.23 -0.24 -0.69 0.23 0.00 0.00 176.35 176.28 2r9b s VAL 9 N -0.03 1.90 -0.26 -1.59 1.01 -1.20 -0.46 120.40 119.77 2r9b s VAL 9 Ca -0.05 -1.12 0.02 0.00 0.00 0.00 0.00 61.98 60.84 2r9b s VAL 9 Cb -0.14 -1.60 0.06 0.00 0.00 0.00 0.00 36.38 34.70 2r9b s VAL 9 CO 0.04 0.45 -0.08 -0.62 0.00 0.00 0.00 175.10 174.90 2r9b s ASP 10 N -0.78 4.26 0.00 3.32 -1.08 -1.26 -2.95 116.67 118.17 2r9b s ASP 10 Ca 0.09 -1.37 0.00 0.00 -0.52 0.00 0.00 52.55 50.75 2r9b s ASP 10 Cb -0.09 -1.42 0.00 0.00 -1.46 0.00 0.00 42.92 39.95 2r9b s ASP 10 CO 0.00 -0.22 0.00 0.49 0.52 0.00 0.00 175.17 175.96 2r9b n PHE 11 N 4.51 0.00 -0.61 -5.34 0.99 -1.26 -4.37 117.46 111.37 2r9b n PHE 11 Ca -0.12 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.03 2r9b n PHE 11 Cb 0.43 0.00 0.20 0.00 -1.00 0.00 0.00 39.48 39.10 2r9b n PHE 11 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2r9b n GLN 12 N 0.00 -1.18 -0.74 -1.08 0.00 -1.26 -4.85 117.38 108.27 2r9b n GLN 12 Ca 0.00 -0.29 -0.13 0.00 0.00 0.00 0.00 57.00 56.57 2r9b n GLN 12 Cb 0.00 -2.24 0.12 0.00 0.00 0.00 0.00 30.24 28.12 2r9b n GLN 12 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2r9b n ASN 13 N -4.17 3.49 0.02 2.61 2.85 -1.26 -4.29 115.26 114.50 2r9b n ASN 13 Ca 0.08 -2.95 -0.20 0.00 -0.11 0.00 0.00 54.58 51.40 2r9b n ASN 13 Cb 0.53 -0.70 -0.14 0.00 1.24 0.00 0.00 39.78 40.71 2r9b n ASN 13 CO 0.00 0.00 0.00 -0.29 -2.11 0.00 0.00 177.26 174.86 2r9b h ILE 14 N 0.74 0.73 -0.91 -1.44 6.09 -1.98 -3.48 117.51 117.26 2r9b h ILE 14 Ca 0.36 -2.44 0.19 0.00 -1.37 0.00 0.00 64.86 61.61 2r9b h ILE 14 Cb 2.09 2.56 -0.28 0.00 0.47 0.00 0.00 36.82 41.66 2r9b h ILE 14 CO 0.65 0.85 0.50 -0.32 -3.07 0.00 0.00 178.15 176.76 2r9b s MET 15 N -2.57 0.17 0.55 2.19 0.00 -1.26 -4.58 119.30 113.79 2r9b s MET 15 Ca -0.18 0.35 -0.06 0.00 0.00 0.00 0.00 55.69 55.79 2r9b s MET 15 Cb 0.07 0.13 -0.02 0.00 0.00 0.00 0.00 34.83 35.00 2r9b s MET 15 CO 0.80 -0.05 0.87 -0.59 0.00 0.00 0.00 175.02 176.05 2r9b s PHE 16 N 1.68 3.46 0.36 4.11 -0.12 -1.26 -4.81 117.98 121.40 2r9b s PHE 16 Ca -0.05 0.84 0.04 0.00 -0.05 0.00 0.00 56.93 57.70 2r9b s PHE 16 Cb -0.03 -2.53 -0.04 0.00 -0.63 0.00 0.00 43.02 39.79 2r9b s PHE 16 CO -0.14 -0.55 0.13 0.71 -0.05 0.00 0.00 175.22 175.31 2r9b s TYR 17 N -2.91 1.76 0.09 3.49 2.02 -1.15 -4.67 117.35 115.98 2r9b s TYR 17 Ca 0.51 -1.25 -0.04 0.00 -0.37 0.00 0.00 57.07 55.91 2r9b s TYR 17 Cb -0.10 -1.08 -0.02 0.00 -0.40 0.00 0.00 41.96 40.35 2r9b s TYR 17 CO 0.47 -0.31 0.09 0.20 -1.57 0.00 0.00 175.55 174.42 2r9b s GLY 18 N -3.51 0.44 0.14 0.71 0.00 0.03 -3.27 107.32 101.86 2r9b s GLY 18 Ca 0.30 -1.03 0.06 0.00 0.00 0.00 0.00 44.72 44.05 2r9b s GLY 18 CO 0.16 -1.11 0.00 0.99 0.00 0.00 0.00 173.10 173.14 2r9b s ASP 19 N -2.93 4.89 0.11 1.64 1.01 -1.26 0.37 116.67 120.50 2r9b s ASP 19 Ca 0.11 -0.30 -0.25 0.00 0.71 0.00 0.00 52.55 52.82 2r9b s ASP 19 Cb 0.06 -1.10 0.07 0.00 1.01 0.00 0.00 42.92 42.97 2r9b s ASP 19 CO -0.07 0.12 0.82 0.00 0.21 0.00 0.00 175.17 176.25 2r9b s ALA 20 N -1.54 -1.65 0.11 5.23 0.00 -1.11 -4.61 121.76 118.20 2r9b s ALA 20 Ca 0.27 0.48 0.07 0.00 0.00 0.00 0.00 51.96 52.78 2r9b s ALA 20 Cb -0.10 0.64 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 2r9b s ALA 20 CO 0.18 -0.85 -0.17 -1.83 0.00 0.00 0.00 175.76 173.10 2r9b s GLU 21 N -3.41 1.06 -0.05 0.00 1.03 -0.22 -1.84 118.70 115.27 2r9b s GLU 21 Ca 0.07 -1.19 0.04 0.00 0.03 0.00 0.00 54.97 53.92 2r9b s GLU 21 Cb -0.02 -1.12 -0.00 0.00 -0.80 0.00 0.00 34.13 32.19 2r9b s GLU 21 CO -0.05 0.24 -0.19 0.08 -1.33 0.00 0.00 175.26 174.01 2r9b s VAL 22 N -1.66 1.58 0.00 1.83 1.01 -0.58 0.14 120.40 122.72 2r9b s VAL 22 Ca 0.07 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.26 2r9b s VAL 22 Cb -0.08 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.95 2r9b s VAL 22 CO 0.04 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2r9b n GLY 23 N 3.18 2.42 0.24 4.51 0.00 0.74 -2.52 105.19 113.76 2r9b n GLY 23 Ca -0.18 -1.65 0.16 0.00 0.00 0.00 0.00 46.02 44.35 2r9b n GLY 23 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2r9b h ASP 24 N 0.00 0.00 -0.64 1.61 1.82 -1.88 -0.71 116.42 116.61 2r9b h ASP 24 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2r9b h ASP 24 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2r9b h ASP 24 CO 0.00 0.00 0.00 -0.46 -1.61 0.00 0.00 179.24 177.17 2r9b n ASN 25 N -2.60 3.55 -2.56 2.28 6.94 -1.26 -4.95 115.26 116.65 2r9b n ASN 25 Ca -0.02 -1.99 -0.16 0.00 -0.02 0.00 0.00 54.58 52.38 2r9b n ASN 25 Cb 0.05 -0.43 0.05 0.00 -2.36 0.00 0.00 39.78 37.10 2r9b n ASN 25 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2r9b n GLN 26 N 1.45 -5.29 -1.68 -3.83 1.13 -0.27 -4.94 117.38 103.95 2r9b n GLN 26 Ca 0.22 0.56 -0.46 0.00 -1.94 0.00 0.00 57.00 55.38 2r9b n GLN 26 Cb 0.57 -4.77 -0.04 0.00 0.11 0.00 0.00 30.24 26.11 2r9b n GLN 26 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 2r9b n GLN 27 N -3.50 2.26 -3.39 -1.09 6.02 -1.05 -4.79 117.38 111.85 2r9b n GLN 27 Ca 0.00 0.82 -0.38 0.00 -0.01 0.00 0.00 57.00 57.43 2r9b n GLN 27 Cb 0.54 -2.62 -0.06 0.00 1.02 0.00 0.00 30.24 29.12 2r9b n GLN 27 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2r9b s PRO 28 N 1.54 4.14 0.07 -1.09 0.04 -1.26 -1.53 135.00 136.92 2r9b s PRO 28 Ca 0.81 0.47 0.02 0.00 0.04 0.00 0.00 61.00 62.33 2r9b s PRO 28 Cb -0.65 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 30.54 2r9b s PRO 28 CO 0.39 0.45 -0.07 -0.06 0.04 0.00 0.00 177.00 177.76 2r9b s PHE 29 N -0.35 0.79 -0.24 0.56 0.40 -0.77 -4.88 117.98 113.49 2r9b s PHE 29 Ca 0.25 -0.75 -0.08 0.00 -0.60 0.00 0.00 56.93 55.75 2r9b s PHE 29 Cb -0.16 -0.47 -0.04 0.00 0.51 0.00 0.00 43.02 42.86 2r9b s PHE 29 CO 0.13 -0.13 0.10 0.99 0.70 0.00 0.00 175.22 177.01 2r9b s THR 30 N -2.71 4.73 0.11 0.64 2.01 -1.26 -2.74 115.64 116.42 2r9b s THR 30 Ca 0.03 -0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.07 2r9b s THR 30 Cb -0.01 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.26 2r9b s THR 30 CO -0.03 0.35 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.74 2r9b s PHE 31 N 1.31 2.62 -0.23 4.92 0.40 0.16 -1.37 117.98 125.79 2r9b s PHE 31 Ca 0.06 -0.22 -0.17 0.00 -0.60 0.00 0.00 56.93 56.00 2r9b s PHE 31 Cb -0.15 -1.38 -0.03 0.00 0.51 0.00 0.00 43.02 41.97 2r9b s PHE 31 CO 0.05 0.41 0.45 0.42 0.70 0.00 0.00 175.22 177.25 2r9b s ILE 32 N -1.19 5.14 -0.77 0.64 1.01 -0.94 -0.79 121.20 124.30 2r9b s ILE 32 Ca 0.20 0.79 -0.19 0.00 0.00 0.00 0.00 60.65 61.44 2r9b s ILE 32 Cb -0.11 -3.78 0.11 0.00 0.01 0.00 0.00 42.46 38.70 2r9b s ILE 32 CO 0.12 0.18 0.96 -0.76 0.00 0.00 0.00 174.94 175.43 2r9b s LEU 33 N 1.75 5.08 -0.33 2.97 1.43 -1.26 -0.44 118.68 127.87 2r9b s LEU 33 Ca 0.20 -1.66 -0.11 0.00 -1.03 0.00 0.00 54.13 51.54 2r9b s LEU 33 Cb -0.15 -2.37 -0.00 0.00 0.03 0.00 0.00 46.19 43.70 2r9b s LEU 33 CO 0.09 -1.14 0.19 -0.62 0.23 0.00 0.00 176.35 175.09 2r9b s ASP 34 N 3.54 5.71 0.00 2.29 2.15 -0.59 -4.52 116.67 125.24 2r9b s ASP 34 Ca 0.24 -0.60 0.30 0.00 0.43 0.00 0.00 52.55 52.92 2r9b s ASP 34 Cb -0.13 -2.04 1.53 0.00 -0.30 0.00 0.00 42.92 41.98 2r9b s ASP 34 CO -0.00 -0.24 2.06 0.35 -0.17 0.00 0.00 175.17 177.16 2r9b n THR 35 N 5.02 0.00 1.26 1.71 -2.24 -1.26 0.78 114.28 119.54 2r9b n THR 35 Ca -0.13 -0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.77 2r9b n THR 35 Cb 0.49 -0.48 0.34 0.00 -2.10 0.00 0.00 70.33 68.57 2r9b n THR 35 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2r9b n GLY 36 N 1.27 -0.21 3.32 3.38 0.00 -1.26 -4.20 105.19 107.49 2r9b n GLY 36 Ca 0.15 -0.48 -0.16 0.00 0.00 0.00 0.00 46.02 45.53 2r9b n GLY 36 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2r9b s SER 37 N -2.32 1.19 -0.19 1.61 1.04 -1.22 -4.99 113.70 108.82 2r9b s SER 37 Ca 0.27 -1.39 0.18 0.00 0.48 0.00 0.00 55.95 55.50 2r9b s SER 37 Cb 0.20 0.16 0.46 0.00 0.10 0.00 0.00 66.02 66.94 2r9b s SER 37 CO 0.46 -0.73 1.16 0.00 0.98 0.00 0.00 173.24 175.11 2r9b n ALA 38 N -0.47 3.23 -2.36 5.32 0.00 -1.26 -1.49 120.51 123.48 2r9b n ALA 38 Ca 0.00 -2.96 -0.08 0.00 0.00 0.00 0.00 53.44 50.40 2r9b n ALA 38 Cb 0.66 -0.63 -0.10 0.00 0.00 0.00 0.00 19.45 19.39 2r9b n ALA 38 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 2r9b s ASN 39 N -3.16 0.36 -0.21 0.00 -0.87 -1.26 -4.41 114.94 105.38 2r9b s ASN 39 Ca 0.36 -0.82 0.02 0.00 -1.57 0.00 0.00 52.86 50.85 2r9b s ASN 39 Cb 0.37 0.21 0.04 0.00 -0.02 0.00 0.00 41.25 41.85 2r9b s ASN 39 CO -0.06 -0.57 -0.12 -0.22 -2.57 0.00 0.00 177.10 173.55 2r9b s LEU 40 N -2.62 2.61 0.16 0.60 2.96 -1.26 -0.41 118.68 120.72 2r9b s LEU 40 Ca 0.02 -1.00 0.07 0.00 -0.22 0.00 0.00 54.13 53.00 2r9b s LEU 40 Cb 0.04 -1.38 -0.04 0.00 0.50 0.00 0.00 46.19 45.31 2r9b s LEU 40 CO -0.08 -0.13 -0.16 -1.66 -1.32 0.00 0.00 176.35 173.00 2r9b s TRP 41 N 1.29 1.64 0.04 5.38 1.48 -0.80 -1.77 118.94 126.20 2r9b s TRP 41 Ca -0.02 -0.54 0.01 0.00 -1.06 0.00 0.00 56.10 54.49 2r9b s TRP 41 Cb -0.17 -0.81 -0.02 0.00 -1.16 0.00 0.00 33.47 31.31 2r9b s TRP 41 CO -0.08 0.27 -0.06 0.14 -4.06 0.00 0.00 176.95 173.16 2r9b s VAL 42 N -2.38 0.39 0.10 -0.66 -7.23 -0.64 -3.00 120.40 106.97 2r9b s VAL 42 Ca 0.16 -1.09 -0.31 0.00 -1.81 0.00 0.00 61.98 58.93 2r9b s VAL 42 Cb -0.04 -0.58 -0.07 0.00 0.56 0.00 0.00 36.38 36.26 2r9b s VAL 42 CO 0.05 -0.47 1.23 -2.16 -0.31 0.00 0.00 175.10 173.44 2r9b s PRO 43 N -1.75 4.43 0.54 4.82 0.04 -1.26 -0.55 135.00 141.27 2r9b s PRO 43 Ca -0.10 1.85 -0.05 0.00 0.04 0.00 0.00 61.00 62.74 2r9b s PRO 43 Cb -0.09 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.15 2r9b s PRO 43 CO -0.01 -0.24 0.84 0.45 0.04 0.00 0.00 177.00 178.08 2r9b s SER 44 N 0.82 5.78 0.00 6.66 0.15 -0.14 -1.50 113.70 125.47 2r9b s SER 44 Ca 0.58 0.69 0.18 0.00 0.70 0.00 0.00 55.95 58.10 2r9b s SER 44 Cb -0.31 -1.80 1.02 0.00 -1.71 0.00 0.00 66.02 63.22 2r9b s SER 44 CO 0.31 -0.90 1.66 1.33 1.20 0.00 0.00 173.24 176.85 2r9b n VAL 45 N -2.43 0.02 1.02 4.45 0.24 -1.01 -1.59 118.33 119.02 2r9b n VAL 45 Ca 0.03 -0.03 0.11 0.00 -2.04 0.00 0.00 64.34 62.41 2r9b n VAL 45 Cb 0.57 -0.21 -0.00 0.00 -1.47 0.00 0.00 33.84 32.73 2r9b n VAL 45 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2r9b n LYS 46 N -0.67 0.36 -1.90 7.34 4.76 -1.26 -4.93 118.16 121.85 2r9b n LYS 46 Ca 0.13 -0.28 -0.42 0.00 -2.87 0.00 0.00 58.31 54.87 2r9b n LYS 46 Cb 0.09 -1.49 -0.03 0.00 -1.84 0.00 0.00 35.03 31.75 2r9b n LYS 46 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2r9b n THR 48 N 4.67 0.06 -2.17 0.00 -2.24 -0.90 -4.98 114.28 108.73 2r9b n THR 48 Ca 0.16 -0.29 -0.29 0.00 -2.27 0.00 0.00 64.05 61.35 2r9b n THR 48 Cb 0.40 0.33 0.01 0.00 -2.10 0.00 0.00 70.33 68.97 2r9b n THR 48 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2r9b s THR 49 N -3.28 4.64 0.35 4.28 -4.23 -1.25 -4.99 115.64 111.15 2r9b s THR 49 Ca -0.00 0.57 0.13 0.00 -1.18 0.00 0.00 61.69 61.21 2r9b s THR 49 Cb 0.14 -3.82 0.08 0.00 1.34 0.00 0.00 72.50 70.25 2r9b s THR 49 CO 0.87 -0.97 1.79 0.00 -0.54 0.00 0.00 174.62 175.77 2r9b h ALA 50 N -0.14 1.29 -0.35 3.99 0.00 -1.97 -2.93 119.26 119.16 2r9b h ALA 50 Ca -0.45 -0.37 0.10 0.00 0.00 0.00 0.00 54.91 54.19 2r9b h ALA 50 Cb 1.20 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2r9b h ALA 50 CO 0.62 0.51 0.25 0.78 0.00 0.00 0.00 179.25 181.41 2r9b h GLY 51 N 1.28 0.00 2.00 0.00 0.00 -1.94 -1.32 103.07 103.09 2r9b h GLY 51 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2r9b h GLY 51 CO 0.05 0.00 -0.08 0.00 0.00 0.00 0.00 176.54 176.52 2r9b h LEU 53 N 0.00 0.00 -3.01 0.00 3.38 -1.39 -1.32 115.31 112.97 2r9b h LEU 53 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2r9b h LEU 53 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2r9b h LEU 53 CO 0.01 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.89 2r9b n THR 54 N -3.75 1.42 -3.72 0.22 -2.24 -1.25 -5.04 114.28 99.91 2r9b n THR 54 Ca 0.11 -1.48 -0.21 0.00 -2.27 0.00 0.00 64.05 60.20 2r9b n THR 54 Cb 0.79 0.19 -0.03 0.00 -2.10 0.00 0.00 70.33 69.18 2r9b n THR 54 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2r9b s LYS 55 N -1.77 2.82 -0.28 -0.78 -0.14 -0.50 -5.07 119.74 114.01 2r9b s LYS 55 Ca 0.18 -1.23 -0.29 0.00 -1.36 0.00 0.00 55.97 53.27 2r9b s LYS 55 Cb 0.14 -2.56 0.01 0.00 -1.68 0.00 0.00 37.83 33.74 2r9b s LYS 55 CO 0.04 0.08 1.14 -1.01 -0.76 0.00 0.00 175.35 174.85 2r9b s HIS 56 N -2.28 3.04 -0.09 3.18 3.76 -1.26 -5.02 115.29 116.62 2r9b s HIS 56 Ca 0.42 1.14 -0.10 0.00 -0.15 0.00 0.00 55.06 56.38 2r9b s HIS 56 Cb -0.07 -3.65 -0.05 0.00 1.11 0.00 0.00 32.58 29.93 2r9b s HIS 56 CO 0.28 -1.05 0.22 -0.51 -0.85 0.00 0.00 174.74 172.82 2r9b s LEU 57 N 3.72 4.40 -0.02 0.89 1.43 -1.26 -4.48 118.68 123.36 2r9b s LEU 57 Ca 0.49 0.59 -0.25 0.00 -1.03 0.00 0.00 54.13 53.93 2r9b s LEU 57 Cb -0.15 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.81 2r9b s LEU 57 CO 0.15 0.36 0.78 -0.47 0.23 0.00 0.00 176.35 177.40 2r9b s TYR 58 N -0.89 3.65 -0.38 0.29 5.04 -0.56 -4.82 117.35 119.67 2r9b s TYR 58 Ca 0.17 1.41 0.03 0.00 -2.44 0.00 0.00 57.07 56.24 2r9b s TYR 58 Cb -0.13 -2.87 0.11 0.00 0.35 0.00 0.00 41.96 39.42 2r9b s TYR 58 CO 0.06 0.13 0.11 0.34 -1.34 0.00 0.00 175.55 174.86 2r9b s ASP 59 N 0.54 4.51 0.63 4.32 -1.08 -1.26 -2.41 116.67 121.92 2r9b s ASP 59 Ca 0.41 -2.29 0.34 0.00 -0.52 0.00 0.00 52.55 50.49 2r9b s ASP 59 Cb -0.19 -1.49 1.90 0.00 -1.46 0.00 0.00 42.92 41.68 2r9b s ASP 59 CO 0.22 -0.35 2.16 0.77 0.52 0.00 0.00 175.17 178.48 2r9b h SER 60 N 7.40 0.00 0.00 -0.34 4.64 -1.95 -1.50 113.55 121.80 2r9b h SER 60 Ca -0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 2r9b h SER 60 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2r9b h SER 60 CO 0.55 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.97 2r9b n SER 61 N -3.39 0.00 -0.28 4.97 3.41 -1.26 -2.94 113.62 114.13 2r9b n SER 61 Ca -0.01 -0.76 0.03 0.00 -0.26 0.00 0.00 58.87 57.88 2r9b n SER 61 Cb 0.24 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.23 2r9b n SER 61 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r9b n LYS 62 N -0.96 0.43 -4.10 4.33 4.76 -0.56 -4.96 118.16 117.09 2r9b n LYS 62 Ca 0.16 -1.05 -0.33 0.00 -2.87 0.00 0.00 58.31 54.21 2r9b n LYS 62 Cb 0.07 -1.13 -0.16 0.00 -1.84 0.00 0.00 35.03 31.97 2r9b n LYS 62 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2r9b s SER 63 N -0.62 3.35 0.27 4.39 0.15 -1.15 -4.64 113.70 115.44 2r9b s SER 63 Ca 0.09 -0.71 0.01 0.00 0.70 0.00 0.00 55.95 56.04 2r9b s SER 63 Cb 0.06 -1.51 0.58 0.00 -1.71 0.00 0.00 66.02 63.44 2r9b s SER 63 CO 0.08 -0.02 1.77 0.03 1.20 0.00 0.00 173.24 176.30 2r9b h ARG 64 N 7.94 0.66 0.00 5.44 3.08 -1.92 -2.64 114.38 126.94 2r9b h ARG 64 Ca -0.43 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.58 2r9b h ARG 64 Cb 1.13 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.03 2r9b h ARG 64 CO 0.62 0.44 0.00 0.25 -1.07 0.00 0.00 179.97 180.21 2r9b n THR 65 N -4.83 0.72 -1.47 2.04 -2.24 -1.26 -4.90 114.28 102.34 2r9b n THR 65 Ca 0.18 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.54 2r9b n THR 65 Cb 0.45 -0.90 0.02 0.00 -2.10 0.00 0.00 70.33 67.80 2r9b n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2r9b n TYR 66 N -2.28 -0.36 -3.47 4.78 9.36 -1.00 -4.67 117.16 119.52 2r9b n TYR 66 Ca 0.04 0.56 -0.14 0.00 3.32 0.00 0.00 57.90 61.67 2r9b n TYR 66 Cb 0.33 -2.01 -0.11 0.00 -0.63 0.00 0.00 39.34 36.92 2r9b n TYR 66 CO 0.00 0.00 0.00 -2.00 0.22 0.00 0.00 176.86 175.08 2r9b s GLU 67 N -1.75 0.24 0.31 2.98 2.12 0.37 -4.98 118.70 118.00 2r9b s GLU 67 Ca 0.64 0.40 -0.30 0.00 0.36 0.00 0.00 54.97 56.08 2r9b s GLU 67 Cb -0.56 -0.79 -0.12 0.00 0.26 0.00 0.00 34.13 32.92 2r9b s GLU 67 CO 0.57 -0.60 1.52 1.17 -0.54 0.00 0.00 175.26 177.38 2r9b n LYS 68 N 5.34 2.55 0.00 4.30 4.81 -1.26 -1.53 118.16 132.37 2r9b n LYS 68 Ca -0.05 0.90 0.00 0.00 -0.87 0.00 0.00 58.31 58.29 2r9b n LYS 68 Cb 0.50 -2.64 0.00 0.00 0.02 0.00 0.00 35.03 32.91 2r9b n LYS 68 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2r9b n ASP 69 N 1.62 0.00 0.00 3.14 -0.08 -1.25 -4.87 116.55 115.11 2r9b n ASP 69 Ca 0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.35 2r9b n ASP 69 Cb 0.36 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.82 2r9b n ASP 69 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2r9b n GLY 70 N 3.43 3.25 3.74 0.27 0.00 -0.37 -4.99 105.19 110.53 2r9b n GLY 70 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 2r9b n GLY 70 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2r9b s THR 71 N -2.17 2.14 0.33 2.61 -4.23 -1.26 -4.58 115.64 108.48 2r9b s THR 71 Ca 0.00 0.11 -0.28 0.00 -1.18 0.00 0.00 61.69 60.34 2r9b s THR 71 Cb 0.00 -3.07 -0.09 0.00 1.34 0.00 0.00 72.50 70.67 2r9b s THR 71 CO 0.00 0.02 1.17 -0.54 -0.54 0.00 0.00 174.62 174.72 2r9b s LYS 72 N -0.19 4.39 0.03 3.99 1.02 -1.26 -1.35 119.74 126.37 2r9b s LYS 72 Ca 0.65 1.90 -0.04 0.00 0.02 0.00 0.00 55.97 58.50 2r9b s LYS 72 Cb -0.47 -2.99 -0.02 0.00 -0.52 0.00 0.00 37.83 33.83 2r9b s LYS 72 CO 0.45 -0.05 0.06 0.54 -0.92 0.00 0.00 175.35 175.43 2r9b s VAL 73 N -1.25 0.13 0.04 3.17 0.11 -1.01 -4.91 120.40 116.68 2r9b s VAL 73 Ca 0.50 -1.10 0.05 0.00 -2.93 0.00 0.00 61.98 58.49 2r9b s VAL 73 Cb -0.33 -0.79 -0.02 0.00 -1.53 0.00 0.00 36.38 33.71 2r9b s VAL 73 CO 0.43 -0.61 -0.13 -0.70 -3.33 0.00 0.00 175.10 170.76 2r9b s GLU 74 N -2.41 0.89 -0.12 1.54 2.12 -1.26 -2.45 118.70 117.01 2r9b s GLU 74 Ca -0.07 -0.72 0.03 0.00 0.36 0.00 0.00 54.97 54.56 2r9b s GLU 74 Cb -0.03 -0.88 0.01 0.00 0.26 0.00 0.00 34.13 33.49 2r9b s GLU 74 CO -0.04 0.22 -0.20 -1.64 -0.54 0.00 0.00 175.26 173.06 2r9b s MET 75 N -1.09 2.77 -0.19 4.30 -1.94 0.21 -5.00 119.30 118.36 2r9b s MET 75 Ca 0.01 -0.77 -0.01 0.00 -1.71 0.00 0.00 55.69 53.21 2r9b s MET 75 Cb -0.08 -2.23 0.00 0.00 2.01 0.00 0.00 34.83 34.53 2r9b s MET 75 CO 0.01 0.01 -0.12 -0.80 -0.01 0.00 0.00 175.02 174.11 2r9b s ASN 76 N 0.77 3.79 0.41 3.03 -0.87 -1.26 -1.63 114.94 119.18 2r9b s ASN 76 Ca -0.09 -0.48 0.07 0.00 -1.57 0.00 0.00 52.86 50.79 2r9b s ASN 76 Cb -0.16 -1.62 -0.05 0.00 -0.02 0.00 0.00 41.25 39.41 2r9b s ASN 76 CO 0.00 0.02 0.20 -0.31 -2.57 0.00 0.00 177.10 174.44 2r9b s TYR 77 N 1.22 2.62 0.34 2.20 2.02 0.33 -4.99 117.35 121.09 2r9b s TYR 77 Ca 0.02 -0.57 0.03 0.00 -0.37 0.00 0.00 57.07 56.18 2r9b s TYR 77 Cb -0.14 -1.98 0.59 0.00 -0.40 0.00 0.00 41.96 40.04 2r9b s TYR 77 CO -0.05 0.16 1.93 0.28 -1.57 0.00 0.00 175.55 176.29 2r9b h VAL 78 N 1.39 1.18 0.00 0.71 2.07 -2.01 -2.98 116.25 116.62 2r9b h VAL 78 Ca -0.43 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.53 2r9b h VAL 78 Cb 1.25 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 2r9b h VAL 78 CO 0.68 0.22 -0.67 -1.20 0.02 0.00 0.00 177.57 176.62 2r9b n SER 79 N -4.35 0.67 0.00 0.57 7.64 -1.26 -5.05 113.62 111.84 2r9b n SER 79 Ca 0.04 -0.51 0.00 0.00 1.01 0.00 0.00 58.87 59.41 2r9b n SER 79 Cb 0.15 0.51 0.00 0.00 -1.01 0.00 0.00 64.21 63.86 2r9b n SER 79 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2r9b n GLY 80 N 1.50 -1.48 2.98 0.23 0.00 -1.13 -4.90 105.19 102.40 2r9b n GLY 80 Ca 0.05 -1.02 -0.15 0.00 0.00 0.00 0.00 46.02 44.90 2r9b n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2r9b s THR 81 N -2.55 0.42 0.05 2.61 -1.32 -0.10 0.12 115.64 114.88 2r9b s THR 81 Ca 0.00 -0.47 0.01 0.00 -1.21 0.00 0.00 61.69 60.02 2r9b s THR 81 Cb 0.00 -0.40 -0.03 0.00 -1.51 0.00 0.00 72.50 70.56 2r9b s THR 81 CO 0.00 -0.05 -0.05 0.68 -2.21 0.00 0.00 174.62 172.99 2r9b s VAL 82 N -0.50 0.40 0.05 5.08 -7.23 -0.65 -2.88 120.40 114.67 2r9b s VAL 82 Ca -0.02 -1.37 -0.00 0.00 -1.81 0.00 0.00 61.98 58.78 2r9b s VAL 82 Cb -0.04 -0.93 -0.04 0.00 0.56 0.00 0.00 36.38 35.93 2r9b s VAL 82 CO -0.00 -0.64 -0.04 -0.94 -0.31 0.00 0.00 175.10 173.17 2r9b s SER 83 N -2.13 0.58 0.00 4.85 1.04 -0.88 -0.62 113.70 116.53 2r9b s SER 83 Ca -0.03 -0.90 0.00 0.00 0.48 0.00 0.00 55.95 55.50 2r9b s SER 83 Cb -0.03 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2r9b s SER 83 CO -0.03 -0.51 0.00 0.61 0.98 0.00 0.00 173.24 174.29 2r9b n GLY 84 N 0.39 0.89 3.14 7.32 0.00 -1.03 -1.27 105.19 114.63 2r9b n GLY 84 Ca -0.16 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 2r9b n GLY 84 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2r9b s PHE 85 N 0.91 0.11 0.63 1.61 -0.12 -0.44 -2.39 117.98 118.29 2r9b s PHE 85 Ca 0.00 -0.34 -0.15 0.00 -0.05 0.00 0.00 56.93 56.39 2r9b s PHE 85 Cb 0.00 -0.08 -0.02 0.00 -0.63 0.00 0.00 43.02 42.29 2r9b s PHE 85 CO 0.00 -0.37 1.09 -0.06 -0.05 0.00 0.00 175.22 175.83 2r9b s PHE 86 N -2.32 2.78 0.26 3.49 0.08 -0.46 0.28 117.98 122.09 2r9b s PHE 86 Ca -0.07 1.53 -0.13 0.00 0.12 0.00 0.00 56.93 58.38 2r9b s PHE 86 Cb -0.03 -3.10 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 2r9b s PHE 86 CO -0.03 -1.45 0.52 -1.12 -0.10 0.00 0.00 175.22 173.04 2r9b s SER 87 N -2.66 -0.02 -0.04 1.36 0.01 0.13 -1.24 113.70 111.24 2r9b s SER 87 Ca 0.66 -0.95 0.02 0.00 1.31 0.00 0.00 55.95 56.98 2r9b s SER 87 Cb -0.19 0.62 0.01 0.00 0.21 0.00 0.00 66.02 66.67 2r9b s SER 87 CO 0.39 -1.20 -0.07 -0.75 0.41 0.00 0.00 173.24 172.03 2r9b s LYS 88 N -3.85 0.90 0.15 12.44 2.20 -0.58 -0.62 119.74 130.38 2r9b s LYS 88 Ca 0.22 -0.20 -0.24 0.00 -0.36 0.00 0.00 55.97 55.38 2r9b s LYS 88 Cb -0.01 -0.86 0.07 0.00 -1.51 0.00 0.00 37.83 35.52 2r9b s LYS 88 CO 0.10 0.01 1.01 0.34 -0.36 0.00 0.00 175.35 176.45 2r9b s ASP 89 N 0.55 -0.10 -0.31 1.43 -1.08 -0.53 -0.48 116.67 116.15 2r9b s ASP 89 Ca -0.08 -0.48 -0.29 0.00 -0.52 0.00 0.00 52.55 51.18 2r9b s ASP 89 Cb -0.12 0.47 0.00 0.00 -1.46 0.00 0.00 42.92 41.81 2r9b s ASP 89 CO 0.01 -0.89 1.32 -0.22 0.52 0.00 0.00 175.17 175.91 2r9b s LEU 90 N -3.10 3.85 -0.13 -1.34 2.96 -1.26 -0.82 118.68 118.84 2r9b s LEU 90 Ca 0.16 1.17 -0.10 0.00 -0.22 0.00 0.00 54.13 55.13 2r9b s LEU 90 Cb -0.01 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.09 2r9b s LEU 90 CO 0.03 -1.12 0.20 -0.69 -1.32 0.00 0.00 176.35 173.45 2r9b s VAL 91 N 4.50 5.38 -0.20 1.68 1.01 -0.06 -0.19 120.40 132.52 2r9b s VAL 91 Ca 0.57 0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.92 2r9b s VAL 91 Cb -0.16 -3.50 0.05 0.00 0.00 0.00 0.00 36.38 32.76 2r9b s VAL 91 CO 0.24 0.54 -0.09 -0.89 0.00 0.00 0.00 175.10 174.90 2r9b s THR 92 N -0.49 1.62 -0.23 3.92 2.01 0.12 -1.35 115.64 121.23 2r9b s THR 92 Ca 0.15 -1.03 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 2r9b s THR 92 Cb -0.13 -1.72 0.02 0.00 0.01 0.00 0.00 72.50 70.68 2r9b s THR 92 CO 0.04 0.13 -0.07 0.68 -0.69 0.00 0.00 174.62 174.70 2r9b s VAL 93 N 1.40 2.87 0.00 3.82 -7.23 -0.86 -1.06 120.40 119.35 2r9b s VAL 93 Ca -0.02 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.24 2r9b s VAL 93 Cb -0.17 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.37 2r9b s VAL 93 CO -0.08 0.28 0.00 0.61 -0.31 0.00 0.00 175.10 175.61 2r9b n GLY 94 N 4.69 2.83 1.19 2.32 0.00 -1.26 -2.73 105.19 112.23 2r9b n GLY 94 Ca -0.17 -0.23 0.03 0.00 0.00 0.00 0.00 46.02 45.64 2r9b n GLY 94 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2r9b n ASN 95 N 7.42 3.78 -4.22 1.61 6.94 -1.26 -4.96 115.26 124.57 2r9b n ASN 95 Ca 0.00 -3.23 -0.22 0.00 -0.02 0.00 0.00 54.58 51.11 2r9b n ASN 95 Cb 0.00 -0.61 -0.13 0.00 -2.36 0.00 0.00 39.78 36.68 2r9b n ASN 95 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2r9b s LEU 96 N -2.96 2.24 0.21 -4.53 1.43 -1.10 -5.12 118.68 108.85 2r9b s LEU 96 Ca 0.46 -0.59 0.05 0.00 -1.03 0.00 0.00 54.13 53.02 2r9b s LEU 96 Cb 0.38 -0.73 -0.05 0.00 0.03 0.00 0.00 46.19 45.82 2r9b s LEU 96 CO 0.08 0.03 -0.07 -0.44 0.23 0.00 0.00 176.35 176.18 2r9b s SER 97 N -1.57 2.11 -0.23 2.29 0.01 -1.26 -2.02 113.70 113.02 2r9b s SER 97 Ca 0.03 -1.11 -0.30 0.00 1.31 0.00 0.00 55.95 55.88 2r9b s SER 97 Cb -0.09 -0.05 0.17 0.00 0.21 0.00 0.00 66.02 66.25 2r9b s SER 97 CO 0.03 -0.37 1.21 -1.48 0.41 0.00 0.00 173.24 173.04 2r9b s LEU 98 N -3.29 -0.18 0.19 2.44 2.34 -0.46 -4.99 118.68 114.74 2r9b s LEU 98 Ca 0.24 0.19 -0.30 0.00 0.06 0.00 0.00 54.13 54.32 2r9b s LEU 98 Cb 0.03 1.41 -0.08 0.00 -0.56 0.00 0.00 46.19 46.99 2r9b s LEU 98 CO 0.06 -0.16 1.27 -2.84 -1.06 0.00 0.00 176.35 173.61 2r9b s PRO 99 N -1.05 4.43 0.06 1.48 0.02 -1.26 -0.88 135.00 137.80 2r9b s PRO 99 Ca 0.04 1.98 -0.10 0.00 0.02 0.00 0.00 61.00 62.95 2r9b s PRO 99 Cb -0.01 -3.21 0.00 0.00 0.02 0.00 0.00 34.50 31.30 2r9b s PRO 99 CO -0.04 -0.19 0.21 -0.47 -0.33 0.00 0.00 177.00 176.18 2r9b s TYR 100 N 0.04 0.07 -0.34 6.54 5.04 -0.00 -4.88 117.35 123.82 2r9b s TYR 100 Ca 0.55 -0.38 -0.12 0.00 -2.44 0.00 0.00 57.07 54.69 2r9b s TYR 100 Cb -0.35 -0.02 -0.00 0.00 0.35 0.00 0.00 41.96 41.93 2r9b s TYR 100 CO 0.38 -0.49 0.21 0.21 -1.34 0.00 0.00 175.55 174.51 2r9b s LYS 101 N -3.14 3.30 0.48 4.97 2.20 -1.26 -1.45 119.74 124.84 2r9b s LYS 101 Ca -0.01 -0.76 0.02 0.00 -0.36 0.00 0.00 55.97 54.87 2r9b s LYS 101 Cb 0.02 -3.72 -0.01 0.00 -1.51 0.00 0.00 37.83 32.60 2r9b s LYS 101 CO -0.07 -0.49 0.07 -0.59 -0.36 0.00 0.00 175.35 173.91 2r9b s PHE 102 N 1.66 1.78 -0.16 4.03 -0.12 0.21 -4.76 117.98 120.61 2r9b s PHE 102 Ca 0.05 -1.17 -0.01 0.00 -0.05 0.00 0.00 56.93 55.75 2r9b s PHE 102 Cb -0.18 -1.37 -0.01 0.00 -0.63 0.00 0.00 43.02 40.84 2r9b s PHE 102 CO 0.08 -0.08 -0.11 0.42 -0.05 0.00 0.00 175.22 175.49 2r9b s ILE 103 N -3.04 3.11 -0.47 -4.49 1.01 -0.73 0.18 121.20 116.78 2r9b s ILE 103 Ca 0.12 -0.62 -0.20 0.00 0.00 0.00 0.00 60.65 59.94 2r9b s ILE 103 Cb 0.01 -2.34 0.04 0.00 0.01 0.00 0.00 42.46 40.17 2r9b s ILE 103 CO 0.08 0.50 0.66 -1.61 0.00 0.00 0.00 174.94 174.56 2r9b s GLU 104 N 0.70 3.23 -0.21 2.79 2.02 0.14 -1.62 118.70 125.75 2r9b s GLU 104 Ca -0.05 -0.54 -0.28 0.00 0.02 0.00 0.00 54.97 54.11 2r9b s GLU 104 Cb -0.15 -4.01 0.00 0.00 0.10 0.00 0.00 34.13 30.07 2r9b s GLU 104 CO 0.02 -1.11 0.99 0.08 0.02 0.00 0.00 175.26 175.26 2r9b s VAL 105 N 2.84 4.73 -0.39 2.63 1.01 0.29 -1.33 120.40 130.17 2r9b s VAL 105 Ca 0.20 1.95 0.08 0.00 0.00 0.00 0.00 61.98 64.21 2r9b s VAL 105 Cb -0.16 -4.27 -0.09 0.00 0.00 0.00 0.00 36.38 31.86 2r9b s VAL 105 CO 0.17 -0.13 0.35 2.30 0.00 0.00 0.00 175.10 177.79 2r9b n ILE 106 N 5.16 0.00 -3.89 2.22 -5.35 -0.40 -0.96 119.36 116.13 2r9b n ILE 106 Ca 0.10 -0.31 -0.29 0.00 -0.27 0.00 0.00 62.75 61.99 2r9b n ILE 106 Cb 0.47 1.00 -0.16 0.00 -1.74 0.00 0.00 39.64 39.21 2r9b n ILE 106 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2r9b s ASP 107 N -1.76 3.02 0.00 7.28 -1.08 -0.77 -2.11 116.67 121.25 2r9b s ASP 107 Ca 0.03 -0.76 0.10 0.00 -0.52 0.00 0.00 52.55 51.40 2r9b s ASP 107 Cb 0.06 -0.94 -0.07 0.00 -1.46 0.00 0.00 42.92 40.51 2r9b s ASP 107 CO 0.33 -0.20 0.51 0.35 0.52 0.00 0.00 175.17 176.68 2r9b n THR 108 N 4.85 0.00 -0.51 1.71 -2.24 -1.26 -2.08 114.28 114.75 2r9b n THR 108 Ca -0.12 -0.31 0.43 0.00 -2.27 0.00 0.00 64.05 61.78 2r9b n THR 108 Cb 0.47 1.05 0.75 0.00 -2.10 0.00 0.00 70.33 70.50 2r9b n THR 108 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2r9b h ASN 109 N 0.45 0.07 -0.20 3.42 2.35 -1.94 0.53 115.58 120.26 2r9b h ASN 109 Ca 0.00 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2r9b h ASN 109 Cb 0.28 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.68 2r9b h ASN 109 CO 0.00 -0.03 0.00 0.61 -1.65 0.00 0.00 177.43 176.36 2r9b n GLY 110 N -1.77 0.52 0.44 2.83 0.00 -1.25 -3.62 105.19 102.33 2r9b n GLY 110 Ca 0.36 -0.24 0.06 0.00 0.00 0.00 0.00 46.02 46.20 2r9b n GLY 110 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2r9b n PHE 111 N 0.13 0.00 -3.69 1.61 7.35 0.19 -0.92 117.46 122.13 2r9b n PHE 111 Ca 0.07 -0.77 -0.20 0.00 -0.76 0.00 0.00 57.45 55.80 2r9b n PHE 111 Cb 0.27 -0.14 -0.02 0.00 0.35 0.00 0.00 39.48 39.94 2r9b n PHE 111 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 2r9b s GLU 112 N -1.85 3.08 0.00 -4.13 0.41 -1.24 -0.20 118.70 114.77 2r9b s GLU 112 Ca 0.25 -1.03 0.27 0.00 -0.41 0.00 0.00 54.97 54.04 2r9b s GLU 112 Cb 0.23 -2.74 1.45 0.00 -1.78 0.00 0.00 34.13 31.29 2r9b s GLU 112 CO -0.02 0.16 1.95 -0.35 -0.49 0.00 0.00 175.26 176.51 2r9b n PRO 113 N -1.50 1.17 -0.01 0.39 -0.04 -1.26 -4.85 135.00 128.89 2r9b n PRO 113 Ca -0.03 -0.24 -0.09 0.00 -0.04 0.00 0.00 63.50 63.10 2r9b n PRO 113 Cb 0.58 -1.43 -0.03 0.00 -0.04 0.00 0.00 33.50 32.59 2r9b n PRO 113 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2r9b h THR 114 N 0.55 0.56 0.31 0.52 2.02 -1.93 -2.17 112.91 112.78 2r9b h THR 114 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2r9b h THR 114 Cb 0.12 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 2r9b h THR 114 CO 0.00 0.00 -0.46 0.22 0.37 0.00 0.00 175.52 175.65 2r9b h TYR 115 N -0.20 -1.29 -0.95 3.16 3.20 -0.91 0.28 116.97 120.25 2r9b h TYR 115 Ca 0.10 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.03 2r9b h TYR 115 Cb 0.35 0.52 -0.06 0.00 1.54 0.00 0.00 36.73 39.09 2r9b h TYR 115 CO -0.29 -0.59 0.62 1.15 -1.64 0.00 0.00 178.16 177.41 2r9b h THR 116 N -0.82 1.15 0.35 1.81 2.02 -1.81 -2.91 112.91 112.68 2r9b h THR 116 Ca -0.02 -0.40 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 2r9b h THR 116 Cb 0.77 -0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2r9b h THR 116 CO -0.15 0.21 -0.17 0.00 0.37 0.00 0.00 175.52 175.78 2r9b h ALA 117 N 1.45 -0.47 -2.13 6.16 0.00 -0.78 -3.44 119.26 120.04 2r9b h ALA 117 Ca 0.38 -0.17 -0.43 0.00 0.00 0.00 0.00 54.91 54.70 2r9b h ALA 117 Cb 0.05 0.18 0.21 0.00 0.00 0.00 0.00 17.79 18.23 2r9b h ALA 117 CO -0.12 -0.65 -0.01 -1.12 0.00 0.00 0.00 179.25 177.35 2r9b s SER 118 N -4.94 0.68 -0.40 0.00 0.01 0.93 -4.98 113.70 104.99 2r9b s SER 118 Ca -0.15 1.38 0.09 0.00 1.31 0.00 0.00 55.95 58.58 2r9b s SER 118 Cb 0.03 -2.13 0.43 0.00 0.21 0.00 0.00 66.02 64.56 2r9b s SER 118 CO 0.58 -4.37 1.07 0.35 0.41 0.00 0.00 173.24 171.28 2r9b n THR 119 N -5.02 1.99 -4.38 1.44 -2.24 -1.26 -4.93 114.28 99.88 2r9b n THR 119 Ca 0.04 -4.40 -0.24 0.00 -2.27 0.00 0.00 64.05 57.18 2r9b n THR 119 Cb 0.55 -0.72 -0.11 0.00 -2.10 0.00 0.00 70.33 67.95 2r9b n THR 119 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 2r9b s PHE 120 N -3.43 2.06 -0.17 4.78 -0.71 -1.26 -4.99 117.98 114.27 2r9b s PHE 120 Ca 0.42 -0.41 -0.18 0.00 -1.04 0.00 0.00 56.93 55.72 2r9b s PHE 120 Cb 0.42 -1.02 -0.15 0.00 -1.21 0.00 0.00 43.02 41.05 2r9b s PHE 120 CO -0.12 0.42 0.24 -0.44 -1.34 0.00 0.00 175.22 173.98 2r9b h ASP 121 N 3.21 0.00 -0.13 1.98 3.32 -1.60 -3.49 116.42 119.71 2r9b h ASP 121 Ca -0.44 -0.46 0.00 0.00 0.02 0.00 0.00 57.03 56.15 2r9b h ASP 121 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 2r9b h ASP 121 CO 0.50 1.11 0.00 0.61 -1.72 0.00 0.00 179.24 179.74 2r9b n GLY 122 N 1.55 4.96 3.16 2.75 0.00 -1.01 -4.38 105.19 112.22 2r9b n GLY 122 Ca -0.18 -1.39 -0.18 0.00 0.00 0.00 0.00 46.02 44.26 2r9b n GLY 122 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2r9b s ILE 123 N -1.19 1.07 -0.29 -0.61 1.01 -1.16 -2.20 121.20 117.83 2r9b s ILE 123 Ca 0.00 -1.20 -0.00 0.00 0.00 0.00 0.00 60.65 59.44 2r9b s ILE 123 Cb 0.00 -1.02 0.09 0.00 0.01 0.00 0.00 42.46 41.54 2r9b s ILE 123 CO 0.00 -0.17 0.06 -0.22 0.00 0.00 0.00 174.94 174.61 2r9b s LEU 124 N -1.56 2.50 0.43 2.97 0.20 0.41 -1.90 118.68 121.74 2r9b s LEU 124 Ca -0.01 -1.53 -0.25 0.00 0.69 0.00 0.00 54.13 53.03 2r9b s LEU 124 Cb -0.09 -0.98 -0.08 0.00 -0.43 0.00 0.00 46.19 44.60 2r9b s LEU 124 CO 0.02 -0.37 1.24 -0.83 -0.29 0.00 0.00 176.35 176.12 2r9b s GLY 125 N 1.51 2.88 -0.23 7.98 0.00 0.46 -1.54 107.32 118.38 2r9b s GLY 125 Ca 0.06 1.11 0.17 0.00 0.00 0.00 0.00 44.72 46.06 2r9b s GLY 125 CO -0.18 1.64 1.15 1.04 0.00 0.00 0.00 173.10 176.76 2r9b n LEU 126 N -0.13 2.64 0.00 0.66 4.77 0.23 -4.64 117.00 120.53 2r9b n LEU 126 Ca 0.05 -3.50 0.00 0.00 -0.03 0.00 0.00 56.01 52.53 2r9b n LEU 126 Cb 0.45 0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2r9b n LEU 126 CO 0.52 1.33 0.00 0.61 -1.33 0.00 0.00 177.39 178.52 2r9b n GLY 127 N -0.53 2.52 3.93 -0.72 0.00 -0.56 -4.67 105.19 105.16 2r9b n GLY 127 Ca 0.19 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.97 2r9b n GLY 127 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2r9b s TRP 128 N 2.30 3.48 0.17 1.61 0.52 -1.22 -4.65 118.94 121.15 2r9b s TRP 128 Ca 0.00 0.30 -0.21 0.00 0.02 0.00 0.00 56.10 56.21 2r9b s TRP 128 Cb 0.00 -1.82 0.08 0.00 -1.15 0.00 0.00 33.47 30.57 2r9b s TRP 128 CO 0.00 0.37 1.61 -0.22 0.02 0.00 0.00 176.95 178.73 2r9b h LYS 129 N 1.87 -0.21 -1.02 4.98 3.64 -1.84 -1.52 116.57 122.47 2r9b h LYS 129 Ca -0.48 0.01 0.25 0.00 -1.27 0.00 0.00 60.65 59.16 2r9b h LYS 129 Cb 1.20 0.05 -0.12 0.00 -0.41 0.00 0.00 32.23 32.95 2r9b h LYS 129 CO 0.67 -0.14 0.62 -0.44 -2.27 0.00 0.00 179.45 177.89 2r9b h ASP 130 N -0.21 0.61 0.22 4.20 5.19 -1.91 0.13 116.42 124.64 2r9b h ASP 130 Ca 0.18 0.12 -0.09 0.00 -0.62 0.00 0.00 57.03 56.62 2r9b h ASP 130 Cb 0.50 0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.03 2r9b h ASP 130 CO -0.51 0.10 -0.34 0.25 -3.12 0.00 0.00 179.24 175.62 2r9b h LEU 131 N 0.52 0.18-10.19 1.55 5.85 -1.51 -3.46 115.31 108.26 2r9b h LEU 131 Ca 0.63 -0.06 -0.42 0.00 0.84 0.00 0.00 57.88 58.87 2r9b h LEU 131 Cb 1.32 -0.05 0.20 0.00 0.37 0.00 0.00 40.66 42.50 2r9b h LEU 131 CO -0.42 0.52 0.02 -0.94 -0.34 0.00 0.00 178.44 177.28 2r9b s SER 132 N -6.89 0.49 -0.11 1.25 1.04 0.45 -4.70 113.70 105.24 2r9b s SER 132 Ca -0.04 1.05 0.04 0.00 0.48 0.00 0.00 55.95 57.47 2r9b s SER 132 Cb 0.14 -1.57 0.00 0.00 0.10 0.00 0.00 66.02 64.69 2r9b s SER 132 CO 0.75 -4.44 -0.23 -0.63 0.98 0.00 0.00 173.24 169.67 2r9b s ILE 133 N -2.59 2.01 0.00 -1.02 1.01 -1.26 -4.63 121.20 114.71 2r9b s ILE 133 Ca 0.69 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 60.35 2r9b s ILE 133 Cb -0.17 -1.75 0.00 0.00 0.01 0.00 0.00 42.46 40.55 2r9b s ILE 133 CO 0.60 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.69 2r9b n GLY 134 N 3.64 0.88 2.72 6.18 0.00 -1.26 -4.47 105.19 112.87 2r9b n GLY 134 Ca -0.19 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 2r9b n GLY 134 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2r9b n SER 135 N 1.35 -3.00 -4.24 1.61 7.64 -1.26 -4.93 113.62 110.79 2r9b n SER 135 Ca 0.00 -0.26 -0.33 0.00 1.01 0.00 0.00 58.87 59.29 2r9b n SER 135 Cb 0.35 -0.91 -0.15 0.00 -1.01 0.00 0.00 64.21 62.48 2r9b n SER 135 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2r9b s VAL 136 N -1.42 2.63 0.50 0.44 1.01 -1.26 -5.11 120.40 117.19 2r9b s VAL 136 Ca 0.15 -0.77 -0.22 0.00 0.00 0.00 0.00 61.98 61.14 2r9b s VAL 136 Cb -0.02 -2.12 -0.06 0.00 0.00 0.00 0.00 36.38 34.18 2r9b s VAL 136 CO 0.51 0.51 1.20 -1.81 0.00 0.00 0.00 175.10 175.51 2r9b s ASP 137 N 1.00 5.86 0.54 3.32 -0.00 -1.26 -4.53 116.67 121.60 2r9b s ASP 137 Ca -0.02 2.39 -0.22 0.00 -0.00 0.00 0.00 52.55 54.70 2r9b s ASP 137 Cb -0.15 -2.61 -0.05 0.00 -0.00 0.00 0.00 42.92 40.12 2r9b s ASP 137 CO -0.03 -1.14 1.37 -2.84 -0.00 0.00 0.00 175.17 172.53 2r9b s PRO 138 N -2.86 3.17 0.12 8.23 0.02 -1.26 -4.82 135.00 137.60 2r9b s PRO 138 Ca 0.67 2.26 -0.30 0.00 0.02 0.00 0.00 61.00 63.65 2r9b s PRO 138 Cb -0.30 -2.29 -0.08 0.00 0.02 0.00 0.00 34.50 31.85 2r9b s PRO 138 CO 0.36 -1.17 1.58 0.82 -0.33 0.00 0.00 177.00 178.26 2r9b h ILE 139 N 1.51 0.13 -0.89 2.83 2.04 -1.91 -1.66 117.51 119.55 2r9b h ILE 139 Ca -0.51 0.00 0.17 0.00 1.00 0.00 0.00 64.86 65.52 2r9b h ILE 139 Cb 1.30 0.13 -0.07 0.00 -0.74 0.00 0.00 36.82 37.43 2r9b h ILE 139 CO 0.57 0.00 0.58 0.58 0.00 0.00 0.00 178.15 179.89 2r9b h VAL 140 N -0.55 0.75 0.13 1.67 2.07 -1.96 0.83 116.25 119.20 2r9b h VAL 140 Ca 0.05 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 2r9b h VAL 140 Cb 0.65 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2r9b h VAL 140 CO -0.36 0.10 -0.06 0.58 0.02 0.00 0.00 177.57 177.85 2r9b h VAL 141 N 0.56 1.02 -0.35 2.57 2.07 -1.73 -2.65 116.25 117.73 2r9b h VAL 141 Ca 0.46 -0.74 0.04 0.00 0.82 0.00 0.00 66.70 67.29 2r9b h VAL 141 Cb 0.94 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 32.14 2r9b h VAL 141 CO -0.20 0.17 0.11 -0.33 0.02 0.00 0.00 177.57 177.34 2r9b h GLU 142 N -0.54 0.24 -0.86 1.57 5.08 -0.43 -0.67 114.58 118.98 2r9b h GLU 142 Ca -0.02 -0.01 0.21 0.00 -1.00 0.00 0.00 59.36 58.53 2r9b h GLU 142 Cb 0.42 -0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.56 2r9b h GLU 142 CO 0.03 0.16 0.58 -0.07 -1.00 0.00 0.00 179.01 178.71 2r9b h LEU 143 N 0.25 0.29 0.04 1.33 3.38 -0.86 -0.78 115.31 118.96 2r9b h LEU 143 Ca 0.16 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2r9b h LEU 143 Cb 0.15 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2r9b h LEU 143 CO -0.18 0.12 -0.02 0.50 0.09 0.00 0.00 178.44 178.95 2r9b h LYS 144 N 0.30 -0.05 -0.54 1.13 3.11 -0.79 0.28 116.57 120.00 2r9b h LYS 144 Ca 0.43 0.00 0.09 0.00 -2.81 0.00 0.00 60.65 58.37 2r9b h LYS 144 Cb 1.23 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 32.40 2r9b h LYS 144 CO -0.13 0.60 0.14 -0.91 -2.81 0.00 0.00 179.45 176.34 2r9b h ASN 145 N -0.83 0.07 0.00 4.20 2.35 -0.83 0.32 115.58 120.86 2r9b h ASN 145 Ca -0.01 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2r9b h ASN 145 Cb 0.68 0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.15 2r9b h ASN 145 CO 0.01 0.06 0.00 0.00 -1.65 0.00 0.00 177.43 175.85 2r9b n GLN 146 N -5.08 0.40 -2.88 0.81 6.02 -0.34 -4.77 117.38 111.53 2r9b n GLN 146 Ca 0.07 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.84 2r9b n GLN 146 Cb 0.26 -1.02 0.02 0.00 1.02 0.00 0.00 30.24 30.53 2r9b n GLN 146 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2r9b n ASN 147 N -0.42 -5.93 -0.00 1.08 2.85 0.11 -4.87 115.26 108.09 2r9b n ASN 147 Ca 0.00 -0.22 0.09 0.00 -0.11 0.00 0.00 54.58 54.34 2r9b n ASN 147 Cb 0.01 -4.83 -0.11 0.00 1.24 0.00 0.00 39.78 36.09 2r9b n ASN 147 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2r9b n LYS 148 N -3.76 0.63 -3.87 1.20 5.02 0.96 -4.96 118.16 113.37 2r9b n LYS 148 Ca -0.14 -0.02 -0.11 0.00 -2.02 0.00 0.00 58.31 56.02 2r9b n LYS 148 Cb 0.63 -1.42 -0.10 0.00 -0.02 0.00 0.00 35.03 34.12 2r9b n LYS 148 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2r9b s ILE 149 N -2.87 0.07 0.14 -0.18 -4.36 -1.16 -4.96 121.20 107.88 2r9b s ILE 149 Ca 0.06 -0.58 -0.26 0.00 -0.26 0.00 0.00 60.65 59.61 2r9b s ILE 149 Cb 0.14 -0.37 -0.01 0.00 1.25 0.00 0.00 42.46 43.47 2r9b s ILE 149 CO 0.80 -0.32 1.60 -0.33 0.24 0.00 0.00 174.94 176.93 2r9b h GLU 150 N 4.63 -0.37 -5.27 0.37 4.39 -1.87 -3.43 114.58 113.02 2r9b h GLU 150 Ca -0.30 0.03 -0.38 0.00 0.34 0.00 0.00 59.36 59.04 2r9b h GLU 150 Cb 1.20 0.08 -0.14 0.00 -0.10 0.00 0.00 28.75 29.79 2r9b h GLU 150 CO 0.41 -0.25 -0.71 -0.80 -1.16 0.00 0.00 179.01 176.50 2r9b s ASN 151 N -4.96 2.13 -1.26 1.42 0.01 -1.00 -5.05 114.94 106.22 2r9b s ASN 151 Ca -0.15 -1.05 -0.06 0.00 -0.71 0.00 0.00 52.86 50.89 2r9b s ASN 151 Cb 0.11 -0.06 0.17 0.00 0.41 0.00 0.00 41.25 41.88 2r9b s ASN 151 CO 0.66 -0.29 2.09 0.00 -1.51 0.00 0.00 177.10 178.04 2r9b n ALA 152 N -0.31 6.12 -2.40 0.60 0.00 -1.26 -4.03 120.51 119.24 2r9b n ALA 152 Ca -0.09 -4.27 -0.08 0.00 0.00 0.00 0.00 53.44 49.00 2r9b n ALA 152 Cb 0.61 -2.76 -0.08 0.00 0.00 0.00 0.00 19.45 17.22 2r9b n ALA 152 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 2r9b s LEU 153 N -1.70 1.75 0.00 0.00 0.05 -1.26 -1.59 118.68 115.93 2r9b s LEU 153 Ca 0.46 -0.81 -0.09 0.00 0.05 0.00 0.00 54.13 53.74 2r9b s LEU 153 Cb 0.14 0.74 0.01 0.00 -2.05 0.00 0.00 46.19 45.03 2r9b s LEU 153 CO -0.05 -0.70 0.17 0.72 -0.55 0.00 0.00 176.35 175.95 2r9b s PHE 154 N -3.90 0.00 0.16 3.48 -0.12 -0.70 -0.29 117.98 116.62 2r9b s PHE 154 Ca 0.07 -0.06 0.09 0.00 -0.05 0.00 0.00 56.93 56.98 2r9b s PHE 154 Cb 0.06 -0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.39 2r9b s PHE 154 CO -0.09 -0.31 -0.20 0.95 -0.05 0.00 0.00 175.22 175.52 2r9b s THR 155 N -1.39 1.91 -0.09 -4.49 -4.23 0.02 -0.45 115.64 106.93 2r9b s THR 155 Ca -0.15 -1.90 0.04 0.00 -1.18 0.00 0.00 61.69 58.50 2r9b s THR 155 Cb -0.07 -1.87 0.00 0.00 1.34 0.00 0.00 72.50 71.90 2r9b s THR 155 CO 0.02 -0.25 -0.22 -0.36 -0.54 0.00 0.00 174.62 173.28 2r9b s PHE 156 N -1.88 2.30 -0.43 3.99 0.08 -0.85 -1.50 117.98 119.70 2r9b s PHE 156 Ca 0.16 -0.89 0.02 0.00 0.12 0.00 0.00 56.93 56.34 2r9b s PHE 156 Cb -0.07 -1.55 0.14 0.00 -0.57 0.00 0.00 43.02 40.97 2r9b s PHE 156 CO 0.07 -0.36 0.24 -0.47 -0.10 0.00 0.00 175.22 174.60 2r9b s TYR 157 N 0.32 1.87 0.57 0.36 5.04 -0.82 -2.81 117.35 121.89 2r9b s TYR 157 Ca -0.16 -2.36 -0.20 0.00 -2.44 0.00 0.00 57.07 51.91 2r9b s TYR 157 Cb -0.17 -1.80 -0.04 0.00 0.35 0.00 0.00 41.96 40.31 2r9b s TYR 157 CO 0.07 -0.78 1.26 -0.51 -1.34 0.00 0.00 175.55 174.24 2r9b s LEU 158 N 0.39 3.74 0.69 6.97 1.43 -1.26 -1.29 118.68 129.35 2r9b s LEU 158 Ca 0.18 2.52 -0.11 0.00 -1.03 0.00 0.00 54.13 55.69 2r9b s LEU 158 Cb -0.23 -4.47 0.00 0.00 0.03 0.00 0.00 46.19 41.52 2r9b s LEU 158 CO -0.00 -1.58 1.06 -2.16 0.23 0.00 0.00 176.35 173.90 2r9b s PRO 159 N -3.15 3.02 -0.11 1.29 0.04 -1.26 -4.62 135.00 130.22 2r9b s PRO 159 Ca 0.75 0.72 0.02 0.00 0.04 0.00 0.00 61.00 62.52 2r9b s PRO 159 Cb -0.34 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.19 2r9b s PRO 159 CO 0.38 -0.98 -0.15 0.08 0.04 0.00 0.00 177.00 176.37 2r9b s VAL 160 N -3.19 1.52 -0.04 -0.36 1.01 -0.72 -4.91 120.40 113.71 2r9b s VAL 160 Ca 0.57 -0.65 -0.40 0.00 0.00 0.00 0.00 61.98 61.50 2r9b s VAL 160 Cb -0.12 -1.38 -0.19 0.00 0.00 0.00 0.00 36.38 34.68 2r9b s VAL 160 CO 0.54 0.44 1.22 1.57 0.00 0.00 0.00 175.10 178.88 2r9b n HIS 161 N 4.19 1.04 -3.58 5.22 -0.00 -1.26 -1.49 115.22 119.34 2r9b n HIS 161 Ca -0.19 0.94 -0.27 0.00 0.46 0.00 0.00 57.72 58.66 2r9b n HIS 161 Cb 0.51 -2.18 0.00 0.00 -0.12 0.00 0.00 29.99 28.20 2r9b n HIS 161 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 2r9b n ASP 162 N 2.20 -4.09 0.00 0.26 8.00 -1.26 -4.79 116.55 116.87 2r9b n ASP 162 Ca 0.21 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 55.16 2r9b n ASP 162 Cb 0.10 -3.34 0.00 0.00 -0.02 0.00 0.00 41.12 37.86 2r9b n ASP 162 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2r9b n LYS 163 N -4.05 0.00 -3.92 -1.24 5.02 -0.56 -5.14 118.16 108.27 2r9b n LYS 163 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 2r9b n LYS 163 Cb 0.54 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.44 2r9b n LYS 163 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 2r9b s HIS 164 N -0.72 0.13 1.04 2.13 -3.43 -1.17 -5.02 115.29 108.25 2r9b s HIS 164 Ca 0.00 -0.30 -0.17 0.00 -0.80 0.00 0.00 55.06 53.79 2r9b s HIS 164 Cb 0.00 -0.11 0.24 0.00 -1.43 0.00 0.00 32.58 31.28 2r9b s HIS 164 CO 0.00 -0.24 1.30 0.95 -2.00 0.00 0.00 174.74 174.75 2r9b s THR 165 N -1.38 1.90 0.34 -5.38 -4.23 -1.26 -1.75 115.64 103.89 2r9b s THR 165 Ca -0.15 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.37 2r9b s THR 165 Cb -0.08 -2.90 -0.00 0.00 1.34 0.00 0.00 72.50 70.86 2r9b s THR 165 CO 0.00 0.00 0.02 0.61 -0.54 0.00 0.00 174.62 174.71 2r9b n GLY 166 N -3.27 3.71 3.13 3.99 0.00 0.39 -4.42 105.19 108.72 2r9b n GLY 166 Ca 0.16 -2.28 -0.13 0.00 0.00 0.00 0.00 46.02 43.78 2r9b n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2r9b s PHE 167 N -2.35 -0.30 -0.25 1.61 0.08 -0.41 -0.84 117.98 115.52 2r9b s PHE 167 Ca 0.03 0.72 -0.08 0.00 0.12 0.00 0.00 56.93 57.72 2r9b s PHE 167 Cb 0.00 0.09 -0.03 0.00 -0.57 0.00 0.00 43.02 42.51 2r9b s PHE 167 CO 0.02 -0.16 0.08 -1.17 -0.10 0.00 0.00 175.22 173.89 2r9b s LEU 168 N 0.37 3.50 -0.23 -0.37 2.96 -0.03 -1.95 118.68 122.94 2r9b s LEU 168 Ca -0.02 -0.18 -0.01 0.00 -0.22 0.00 0.00 54.13 53.70 2r9b s LEU 168 Cb -0.04 -1.94 0.03 0.00 0.50 0.00 0.00 46.19 44.74 2r9b s LEU 168 CO -0.02 -0.03 -0.10 -0.89 -1.32 0.00 0.00 176.35 173.99 2r9b s THR 169 N 1.60 2.63 -0.18 3.68 2.01 -0.56 -0.26 115.64 124.57 2r9b s THR 169 Ca 0.06 -1.03 -0.10 0.00 0.31 0.00 0.00 61.69 60.93 2r9b s THR 169 Cb -0.15 -2.29 -0.05 0.00 0.01 0.00 0.00 72.50 70.02 2r9b s THR 169 CO 0.04 0.28 0.17 -0.63 -0.69 0.00 0.00 174.62 173.79 2r9b s ILE 170 N 1.30 5.40 0.00 1.82 1.01 0.80 -0.80 121.20 130.73 2r9b s ILE 170 Ca 0.01 0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.93 2r9b s ILE 170 Cb -0.16 -3.49 0.00 0.00 0.01 0.00 0.00 42.46 38.82 2r9b s ILE 170 CO -0.07 0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2r9b n GLY 171 N 3.27 0.83 3.59 6.18 0.00 0.61 -2.18 105.19 117.49 2r9b n GLY 171 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2r9b n GLY 171 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r9b s GLY 172 N -1.73 -0.28 -0.39 -0.02 0.00 -1.26 -2.39 107.32 101.25 2r9b s GLY 172 Ca 0.00 2.15 -0.18 0.00 0.00 0.00 0.00 44.72 46.68 2r9b s GLY 172 CO 0.00 1.32 0.52 -0.42 0.00 0.00 0.00 173.10 174.52 2r9b s ILE 173 N -0.61 4.99 -0.31 0.90 1.01 -1.26 -4.73 121.20 121.18 2r9b s ILE 173 Ca -0.01 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.58 2r9b s ILE 173 Cb -0.02 -4.05 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 2r9b s ILE 173 CO 0.00 -0.38 0.22 -1.61 0.00 0.00 0.00 174.94 173.18 2r9b s GLU 174 N 2.43 3.72 0.57 2.79 2.02 -1.26 -4.96 118.70 124.02 2r9b s GLU 174 Ca 0.18 -0.47 0.38 0.00 0.02 0.00 0.00 54.97 55.08 2r9b s GLU 174 Cb -0.16 -3.73 2.04 0.00 0.10 0.00 0.00 34.13 32.38 2r9b s GLU 174 CO 0.15 -0.32 2.18 0.93 0.02 0.00 0.00 175.26 178.22 2r9b h GLU 175 N 8.43 0.00 -0.29 1.61 5.08 -1.96 -2.34 114.58 125.11 2r9b h GLU 175 Ca -0.33 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.12 2r9b h GLU 175 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 2r9b h GLU 175 CO 0.60 0.00 0.39 0.07 -1.00 0.00 0.00 179.01 179.06 2r9b h ARG 176 N 0.00 0.00 0.00 2.33 0.11 -2.04 -2.69 114.38 112.09 2r9b h ARG 176 Ca 0.00 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.04 2r9b h ARG 176 Cb 0.06 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.13 2r9b h ARG 176 CO 0.00 0.00 -0.50 0.74 0.10 0.00 0.00 179.97 180.31 2r9b h PHE 177 N 0.00 0.00 -2.28 4.08 0.04 -1.84 -3.46 116.94 113.49 2r9b h PHE 177 Ca 0.14 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 2r9b h PHE 177 Cb 0.91 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.06 2r9b h PHE 177 CO 0.00 0.18 -0.01 2.48 -0.60 0.00 0.00 178.31 180.36 2r9b n TYR 178 N -3.01 -0.01 -3.73 -0.55 4.11 -1.02 -0.53 117.16 112.42 2r9b n TYR 178 Ca 0.01 -0.04 -0.11 0.00 -0.00 0.00 0.00 57.90 57.77 2r9b n TYR 178 Cb 0.61 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.89 2r9b n TYR 178 CO 0.00 0.00 0.00 -1.83 -0.00 0.00 0.00 176.86 175.03 2r9b s GLU 179 N -2.02 0.90 0.28 -3.48 -1.05 -0.87 -4.62 118.70 107.85 2r9b s GLU 179 Ca 0.00 -0.66 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 2r9b s GLU 179 Cb 0.00 0.39 0.00 0.00 -0.44 0.00 0.00 34.13 34.08 2r9b s GLU 179 CO 0.00 -0.31 0.00 0.41 0.95 0.00 0.00 175.26 176.31 2r9b n GLY 180 N 0.19 -2.17 3.80 -3.83 0.00 -1.26 -3.95 105.19 97.97 2r9b n GLY 180 Ca -0.17 -1.47 -0.34 0.00 0.00 0.00 0.00 46.02 44.05 2r9b n GLY 180 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2r9b s PRO 181 N -0.90 3.64 -0.32 1.61 0.04 -1.26 -4.93 135.00 132.88 2r9b s PRO 181 Ca 0.00 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.28 2r9b s PRO 181 Cb 0.00 -2.07 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 2r9b s PRO 181 CO 0.00 -0.56 0.20 -1.17 0.04 0.00 0.00 177.00 175.50 2r9b s LEU 182 N -3.76 4.29 -0.34 -3.56 2.96 -1.26 -4.61 118.68 112.40 2r9b s LEU 182 Ca 0.67 -0.44 -0.11 0.00 -0.22 0.00 0.00 54.13 54.04 2r9b s LEU 182 Cb -0.17 -2.07 0.00 0.00 0.50 0.00 0.00 46.19 44.45 2r9b s LEU 182 CO 0.25 -0.20 0.19 -0.89 -1.32 0.00 0.00 176.35 174.37 2r9b s THR 183 N 1.67 4.70 0.26 3.68 2.01 -0.39 -4.87 115.64 122.71 2r9b s THR 183 Ca 0.05 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.25 2r9b s THR 183 Cb -0.17 -3.48 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 2r9b s THR 183 CO 0.09 -0.05 0.88 -0.31 -0.69 0.00 0.00 174.62 174.54 2r9b s TYR 184 N 1.61 3.81 -0.08 4.92 1.51 -1.26 -1.98 117.35 125.88 2r9b s TYR 184 Ca 0.04 1.75 0.04 0.00 -1.01 0.00 0.00 57.07 57.88 2r9b s TYR 184 Cb -0.18 -2.87 0.00 0.00 -0.11 0.00 0.00 41.96 38.80 2r9b s TYR 184 CO 0.07 0.35 -0.19 -1.21 -1.11 0.00 0.00 175.55 173.46 2r9b s GLU 185 N -1.63 2.37 0.40 -0.62 0.41 0.86 -4.92 118.70 115.57 2r9b s GLU 185 Ca 0.44 -0.68 -0.24 0.00 -0.41 0.00 0.00 54.97 54.07 2r9b s GLU 185 Cb -0.21 -1.88 -0.09 0.00 -1.78 0.00 0.00 34.13 30.18 2r9b s GLU 185 CO 0.26 0.15 1.11 0.15 -0.49 0.00 0.00 175.26 176.44 2r9b s LYS 186 N 0.37 4.09 0.46 1.61 -0.14 -1.26 -0.73 119.74 124.14 2r9b s LYS 186 Ca -0.14 1.67 -0.18 0.00 -1.36 0.00 0.00 55.97 55.97 2r9b s LYS 186 Cb -0.16 -2.60 -0.09 0.00 -1.68 0.00 0.00 37.83 33.30 2r9b s LYS 186 CO 0.06 -0.25 0.93 -0.51 -0.76 0.00 0.00 175.35 174.83 2r9b s LEU 187 N -2.59 3.80 0.00 3.17 1.43 -0.74 -4.34 118.68 119.41 2r9b s LEU 187 Ca 0.58 1.56 0.20 0.00 -1.03 0.00 0.00 54.13 55.44 2r9b s LEU 187 Cb -0.26 -4.45 0.42 0.00 0.03 0.00 0.00 46.19 41.93 2r9b s LEU 187 CO 0.33 -0.45 1.35 -0.46 0.23 0.00 0.00 176.35 177.35 2r9b n ASN 188 N -1.09 3.35 -3.60 2.29 0.23 -0.94 -4.95 115.26 110.55 2r9b n ASN 188 Ca 0.06 -1.95 -0.09 0.00 -0.53 0.00 0.00 54.58 52.07 2r9b n ASN 188 Cb 0.54 -0.27 -0.05 0.00 -2.08 0.00 0.00 39.78 37.91 2r9b n ASN 188 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2r9b s HIS 189 N -1.26 -0.34 -1.07 -2.53 3.76 -1.26 -5.04 115.29 107.54 2r9b s HIS 189 Ca 0.36 0.65 -0.02 0.00 -0.15 0.00 0.00 55.06 55.90 2r9b s HIS 189 Cb 0.20 0.44 0.30 0.00 1.11 0.00 0.00 32.58 34.63 2r9b s HIS 189 CO 0.28 -0.28 1.83 -0.25 -0.85 0.00 0.00 174.74 175.47 2r9b n ASP 190 N 1.01 7.24 0.03 1.40 8.00 -1.26 -4.37 116.55 128.60 2r9b n ASP 190 Ca -0.10 -3.58 0.00 0.00 0.71 0.00 0.00 54.79 51.82 2r9b n ASP 190 Cb 0.58 -1.21 0.00 0.00 -0.02 0.00 0.00 41.12 40.46 2r9b n ASP 190 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2r9b n LEU 191 N 0.41 0.24 -4.78 0.64 7.94 -1.26 -4.42 117.00 115.77 2r9b n LEU 191 Ca 0.45 0.11 -0.22 0.00 -1.11 0.00 0.00 56.01 55.23 2r9b n LEU 191 Cb 0.27 -0.02 -0.05 0.00 0.53 0.00 0.00 43.42 44.15 2r9b n LEU 191 CO 0.58 -0.60 -0.18 -0.31 -1.11 0.00 0.00 177.39 175.77 2r9b s TYR 192 N -1.38 2.89 -1.49 1.96 1.51 -1.26 -3.45 117.35 116.13 2r9b s TYR 192 Ca 0.00 -0.25 -0.13 0.00 -1.01 0.00 0.00 57.07 55.68 2r9b s TYR 192 Cb 0.00 -1.54 0.02 0.00 -0.11 0.00 0.00 41.96 40.33 2r9b s TYR 192 CO 0.00 0.40 2.38 0.91 -1.11 0.00 0.00 175.55 178.13 2r9b n TRP 193 N -1.18 3.24 -4.47 2.71 7.02 -1.26 -4.79 117.44 118.70 2r9b n TRP 193 Ca -0.05 -2.99 -0.34 0.00 -1.02 0.00 0.00 57.50 53.10 2r9b n TRP 193 Cb 0.59 -2.50 -0.14 0.00 -2.42 0.00 0.00 31.31 26.84 2r9b n TRP 193 CO 0.00 0.00 0.00 1.14 -2.02 0.00 0.00 177.69 176.81 2r9b s GLN 194 N 2.75 3.41 0.35 -0.99 -2.07 -1.26 -1.86 119.66 119.99 2r9b s GLN 194 Ca 0.52 -0.65 0.04 0.00 -1.82 0.00 0.00 55.36 53.45 2r9b s GLN 194 Cb 0.15 -2.77 -0.05 0.00 -1.09 0.00 0.00 33.01 29.24 2r9b s GLN 194 CO -0.08 0.09 0.07 0.96 -1.32 0.00 0.00 175.29 175.01 2r9b s ILE 195 N 0.69 1.10 -0.18 3.63 -4.36 0.70 -2.21 121.20 120.57 2r9b s ILE 195 Ca -0.05 -2.00 -0.04 0.00 -0.26 0.00 0.00 60.65 58.31 2r9b s ILE 195 Cb -0.15 -2.69 -0.02 0.00 1.25 0.00 0.00 42.46 40.85 2r9b s ILE 195 CO 0.02 0.00 -0.04 -0.89 0.24 0.00 0.00 174.94 174.27 2r9b s THR 196 N -3.24 3.65 0.12 8.37 2.01 -1.26 -0.28 115.64 125.01 2r9b s THR 196 Ca 0.33 -0.43 -0.02 0.00 0.31 0.00 0.00 61.69 61.88 2r9b s THR 196 Cb 0.07 -2.62 -0.04 0.00 0.01 0.00 0.00 72.50 69.93 2r9b s THR 196 CO 0.15 0.46 0.07 -0.76 -0.69 0.00 0.00 174.62 173.85 2r9b s LEU 197 N 0.80 1.77 -0.08 4.42 1.43 -0.72 -4.85 118.68 121.45 2r9b s LEU 197 Ca -0.01 -1.15 -0.15 0.00 -1.03 0.00 0.00 54.13 51.79 2r9b s LEU 197 Cb -0.15 0.38 -0.05 0.00 0.03 0.00 0.00 46.19 46.41 2r9b s LEU 197 CO 0.02 -0.73 0.37 -1.81 0.23 0.00 0.00 176.35 174.43 2r9b s ASP 198 N -3.02 6.65 -0.35 2.29 1.01 -0.13 0.69 116.67 123.81 2r9b s ASP 198 Ca 0.21 0.77 -0.08 0.00 0.71 0.00 0.00 52.55 54.17 2r9b s ASP 198 Cb 0.07 -2.23 0.04 0.00 1.01 0.00 0.00 42.92 41.81 2r9b s ASP 198 CO 0.00 0.20 0.13 0.00 0.21 0.00 0.00 175.17 175.72 2r9b s ALA 199 N -0.31 3.10 -0.61 5.23 0.00 -0.14 -0.83 121.76 128.21 2r9b s ALA 199 Ca 0.22 -1.74 0.04 0.00 0.00 0.00 0.00 51.96 50.48 2r9b s ALA 199 Cb -0.15 -2.35 0.15 0.00 0.00 0.00 0.00 23.12 20.77 2r9b s ALA 199 CO 0.09 -1.35 0.37 -1.58 0.00 0.00 0.00 175.76 173.30 2r9b s HIS 200 N 1.44 3.31 -0.47 0.00 5.04 0.57 -0.18 115.29 125.01 2r9b s HIS 200 Ca -0.01 -3.23 -0.18 0.00 -1.54 0.00 0.00 55.06 50.10 2r9b s HIS 200 Cb -0.19 -2.72 0.05 0.00 0.04 0.00 0.00 32.58 29.75 2r9b s HIS 200 CO 0.04 -0.65 0.53 0.08 -2.34 0.00 0.00 174.74 172.40 2r9b s VAL 201 N -0.84 5.00 0.00 0.89 1.01 -0.63 -3.08 120.40 122.75 2r9b s VAL 201 Ca 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2r9b s VAL 201 Cb -0.15 -4.18 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2r9b s VAL 201 CO -0.08 -0.63 0.00 0.61 0.00 0.00 0.00 175.10 175.00 2r9b n GLY 202 N 5.15 3.43 0.61 4.51 0.00 -1.26 -1.90 105.19 115.71 2r9b n GLY 202 Ca -0.07 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 45.99 2r9b n GLY 202 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2r9b n ASN 203 N 9.18 2.22 -4.77 1.61 2.85 -1.26 -4.93 115.26 120.17 2r9b n ASN 203 Ca 0.00 -1.61 -0.39 0.00 -0.11 0.00 0.00 54.58 52.47 2r9b n ASN 203 Cb 0.00 0.26 -0.06 0.00 1.24 0.00 0.00 39.78 41.23 2r9b n ASN 203 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2r9b s ILE 204 N -1.98 4.81 -0.05 -1.44 -1.09 -0.80 -5.08 121.20 115.58 2r9b s ILE 204 Ca 0.19 1.35 0.01 0.00 -2.23 0.00 0.00 60.65 59.98 2r9b s ILE 204 Cb 0.16 -3.98 0.02 0.00 -1.58 0.00 0.00 42.46 37.09 2r9b s ILE 204 CO 0.39 0.43 -0.04 -0.04 -1.23 0.00 0.00 174.94 174.45 2r9b s MET 205 N -0.35 0.86 -0.35 2.79 -1.94 -1.26 -1.60 119.30 117.45 2r9b s MET 205 Ca 0.33 -0.09 0.03 0.00 -1.71 0.00 0.00 55.69 54.24 2r9b s MET 205 Cb -0.19 -0.90 0.10 0.00 2.01 0.00 0.00 34.83 35.84 2r9b s MET 205 CO 0.19 -0.11 0.06 -0.51 -0.01 0.00 0.00 175.02 174.64 2r9b s LEU 206 N 1.08 4.74 0.23 -0.03 1.43 0.75 -4.99 118.68 121.88 2r9b s LEU 206 Ca -0.08 -2.06 -0.30 0.00 -1.03 0.00 0.00 54.13 50.66 2r9b s LEU 206 Cb -0.14 -1.66 -0.09 0.00 0.03 0.00 0.00 46.19 44.33 2r9b s LEU 206 CO -0.01 -0.39 1.23 -0.70 0.23 0.00 0.00 176.35 176.70 2r9b s GLU 207 N 0.97 4.47 -1.45 1.70 2.12 -1.26 -0.96 118.70 124.28 2r9b s GLU 207 Ca 0.09 1.96 -0.09 0.00 0.36 0.00 0.00 54.97 57.28 2r9b s GLU 207 Cb -0.20 -3.19 0.04 0.00 0.26 0.00 0.00 34.13 31.04 2r9b s GLU 207 CO -0.07 -0.09 0.94 1.63 -0.54 0.00 0.00 175.26 177.14 2r9b n LYS 208 N 2.02 -6.25 -1.94 4.30 4.76 -1.23 -4.94 118.16 114.88 2r9b n LYS 208 Ca 0.03 0.76 -0.37 0.00 -2.87 0.00 0.00 58.31 55.86 2r9b n LYS 208 Cb 0.44 -5.70 0.03 0.00 -1.84 0.00 0.00 35.03 27.96 2r9b n LYS 208 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2r9b s ALA 209 N -3.25 2.67 -0.25 7.82 0.00 0.22 -4.72 121.76 124.25 2r9b s ALA 209 Ca 0.53 1.13 -0.24 0.00 0.00 0.00 0.00 51.96 53.38 2r9b s ALA 209 Cb -0.25 -3.49 -0.00 0.00 0.00 0.00 0.00 23.12 19.38 2r9b s ALA 209 CO 0.66 -1.21 0.82 1.21 0.00 0.00 0.00 175.76 177.24 2r9b s ASN 210 N -1.33 6.80 -0.10 0.00 2.47 -1.12 -1.76 114.94 119.90 2r9b s ASN 210 Ca 0.74 0.96 0.03 0.00 0.42 0.00 0.00 52.86 55.02 2r9b s ASN 210 Cb -0.34 -2.43 0.01 0.00 -1.45 0.00 0.00 41.25 37.03 2r9b s ASN 210 CO 0.39 -0.53 -0.20 0.00 -3.72 0.00 0.00 177.10 173.03 2r9b s ILE 212 N 0.57 3.32 -0.21 0.00 1.01 -0.75 -0.21 121.20 124.93 2r9b s ILE 212 Ca -0.14 -1.10 -0.29 0.00 0.00 0.00 0.00 60.65 59.11 2r9b s ILE 212 Cb -0.17 -2.81 -0.00 0.00 0.01 0.00 0.00 42.46 39.49 2r9b s ILE 212 CO 0.05 -0.01 1.18 -0.69 0.00 0.00 0.00 174.94 175.47 2r9b s VAL 213 N 1.35 4.41 -0.18 2.92 1.01 -0.78 -0.28 120.40 128.86 2r9b s VAL 213 Ca -0.02 1.69 -0.05 0.00 0.00 0.00 0.00 61.98 63.61 2r9b s VAL 213 Cb -0.18 -4.14 0.07 0.00 0.00 0.00 0.00 36.38 32.13 2r9b s VAL 213 CO -0.00 -0.20 0.13 -0.62 0.00 0.00 0.00 175.10 174.41 2r9b s ASP 214 N 1.78 1.97 0.08 3.32 2.15 -0.99 -4.67 116.67 120.31 2r9b s ASP 214 Ca 0.51 -0.45 0.19 0.00 0.43 0.00 0.00 52.55 53.23 2r9b s ASP 214 Cb -0.19 -0.03 0.78 0.00 -0.30 0.00 0.00 42.92 43.18 2r9b s ASP 214 CO 0.13 -0.34 1.58 -1.54 -0.17 0.00 0.00 175.17 174.83 2r9b n SER 215 N 5.29 0.22 -0.56 -0.34 3.41 -1.26 -2.95 113.62 117.42 2r9b n SER 215 Ca -0.06 0.55 0.11 0.00 -0.26 0.00 0.00 58.87 59.21 2r9b n SER 215 Cb 0.49 -0.60 0.40 0.00 -0.26 0.00 0.00 64.21 64.24 2r9b n SER 215 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2r9b n GLY 216 N 0.16 0.28 3.28 5.00 0.00 -1.26 -4.81 105.19 107.85 2r9b n GLY 216 Ca 0.03 -0.44 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 2r9b n GLY 216 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2r9b s THR 217 N -1.82 2.77 -0.12 2.61 2.01 -1.15 -5.01 115.64 114.92 2r9b s THR 217 Ca 0.33 -0.74 0.21 0.00 0.31 0.00 0.00 61.69 61.81 2r9b s THR 217 Cb 0.18 -2.18 0.21 0.00 0.01 0.00 0.00 72.50 70.72 2r9b s THR 217 CO 0.28 0.51 1.64 0.77 -0.69 0.00 0.00 174.62 177.12 2r9b h SER 218 N 7.26 0.00 -5.27 3.53 4.64 -1.87 0.14 113.55 121.98 2r9b h SER 218 Ca -0.32 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.48 2r9b h SER 218 Cb 1.19 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.22 2r9b h SER 218 CO 0.57 0.26 -0.30 0.00 -0.87 0.00 0.00 176.83 176.49 2r9b n ALA 219 N -2.18 0.61 -2.56 5.18 0.00 -1.26 -4.15 120.51 116.14 2r9b n ALA 219 Ca 0.02 -1.93 -0.39 0.00 0.00 0.00 0.00 53.44 51.14 2r9b n ALA 219 Cb 0.56 0.89 -0.11 0.00 0.00 0.00 0.00 19.45 20.79 2r9b n ALA 219 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2r9b s ILE 220 N -2.43 5.29 0.24 0.00 1.09 -0.80 -3.11 121.20 121.48 2r9b s ILE 220 Ca 0.18 0.03 -0.20 0.00 -1.10 0.00 0.00 60.65 59.56 2r9b s ILE 220 Cb -0.01 -3.62 -0.09 0.00 -1.06 0.00 0.00 42.46 37.68 2r9b s ILE 220 CO 0.11 0.13 0.75 -0.89 -0.10 0.00 0.00 174.94 174.95 2r9b s THR 221 N 1.76 4.54 -0.01 2.92 2.01 -0.82 -1.09 115.64 124.96 2r9b s THR 221 Ca 0.07 1.31 -0.13 0.00 0.31 0.00 0.00 61.69 63.25 2r9b s THR 221 Cb -0.17 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.52 2r9b s THR 221 CO 0.11 0.16 0.28 -0.69 -0.69 0.00 0.00 174.62 173.79 2r9b s VAL 222 N -1.58 0.06 0.06 3.82 1.01 -0.33 -2.70 120.40 120.75 2r9b s VAL 222 Ca 0.45 -0.54 -0.31 0.00 0.00 0.00 0.00 61.98 61.59 2r9b s VAL 222 Cb -0.16 -0.62 -0.08 0.00 0.00 0.00 0.00 36.38 35.52 2r9b s VAL 222 CO 0.21 -0.29 1.61 -2.84 0.00 0.00 0.00 175.10 173.78 2r9b s PRO 223 N -1.47 4.21 0.29 2.72 0.02 -1.25 -1.19 135.00 138.33 2r9b s PRO 223 Ca -0.13 2.28 -0.02 0.00 0.02 0.00 0.00 61.00 63.15 2r9b s PRO 223 Cb -0.05 -3.57 0.64 0.00 0.02 0.00 0.00 34.50 31.54 2r9b s PRO 223 CO 0.03 -0.70 1.57 1.79 -0.33 0.00 0.00 177.00 179.36 2r9b h THR 224 N 4.78 0.03 -0.42 0.99 1.35 -1.91 0.71 112.91 118.45 2r9b h THR 224 Ca -0.42 -0.00 0.08 0.00 -0.55 0.00 0.00 66.41 65.52 2r9b h THR 224 Cb 1.20 0.02 -0.07 0.00 -1.73 0.00 0.00 68.15 67.57 2r9b h THR 224 CO 0.92 0.00 -0.03 -0.78 -0.25 0.00 0.00 175.52 175.39 2r9b h ASP 225 N 0.01 -0.23 -0.34 5.36 3.58 -1.98 -0.74 116.42 122.07 2r9b h ASP 225 Ca 0.55 0.11 -0.04 0.00 0.42 0.00 0.00 57.03 58.06 2r9b h ASP 225 Cb 1.03 0.20 -0.02 0.00 1.72 0.00 0.00 39.33 42.26 2r9b h ASP 225 CO -0.95 -0.08 0.07 0.15 -2.88 0.00 0.00 179.24 175.56 2r9b h PHE 226 N 0.08 0.66 -0.05 0.28 3.04 0.03 -2.43 116.94 118.53 2r9b h PHE 226 Ca 0.21 -0.06 -0.01 0.00 3.98 0.00 0.00 57.97 62.09 2r9b h PHE 226 Cb 0.30 -0.19 -0.00 0.00 2.56 0.00 0.00 35.95 38.62 2r9b h PHE 226 CO -0.30 0.58 -0.01 1.25 -2.02 0.00 0.00 178.31 177.81 2r9b h LEU 227 N 0.62 0.10 -0.25 0.59 5.85 -0.19 -2.77 115.31 119.26 2r9b h LEU 227 Ca 0.14 -0.37 0.06 0.00 0.84 0.00 0.00 57.88 58.55 2r9b h LEU 227 Cb 0.28 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.22 2r9b h LEU 227 CO 0.00 0.45 -0.17 0.78 -0.34 0.00 0.00 178.44 179.16 2r9b h ASN 228 N -0.25 -0.56 -0.63 1.25 2.35 -0.97 0.44 115.58 117.21 2r9b h ASN 228 Ca 0.01 0.12 0.13 0.00 -0.55 0.00 0.00 56.30 56.01 2r9b h ASN 228 Cb 0.41 0.28 -0.04 0.00 0.05 0.00 0.00 38.32 39.02 2r9b h ASN 228 CO 0.01 -0.21 0.43 0.11 -1.65 0.00 0.00 177.43 176.11 2r9b h LYS 229 N -0.16 0.31 -0.73 0.81 1.57 -1.45 1.95 116.57 118.88 2r9b h LYS 229 Ca 0.14 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.92 2r9b h LYS 229 Cb 0.37 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 2r9b h LYS 229 CO -0.35 0.20 0.47 0.52 -0.57 0.00 0.00 179.45 179.72 2r9b h MET 230 N 0.32 0.90 0.00 3.15 2.86 -0.63 -2.15 114.93 119.37 2r9b h MET 230 Ca 0.30 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.70 2r9b h MET 230 Cb 0.75 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 32.17 2r9b h MET 230 CO -0.07 0.59 -1.15 -0.07 1.06 0.00 0.00 176.91 177.27 2r9b h LEU 231 N 0.93 0.00 0.00 1.22 3.38 -0.33 -3.34 115.31 117.16 2r9b h LEU 231 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 2r9b h LEU 231 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 2r9b h LEU 231 CO -0.09 0.76 0.00 1.67 0.09 0.00 0.00 178.44 180.86 2r9b n GLN 232 N -3.12 0.00 -0.42 1.13 7.27 0.64 -2.05 117.38 120.84 2r9b n GLN 232 Ca -0.06 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.00 2r9b n GLN 232 Cb 0.89 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 33.52 2r9b n GLN 232 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2r9b n ASN 233 N -2.36 -0.17 -0.49 1.69 3.02 -1.26 -4.93 115.26 110.76 2r9b n ASN 233 Ca 0.00 -0.59 0.07 0.00 -0.03 0.00 0.00 54.58 54.03 2r9b n ASN 233 Cb 0.00 0.05 0.03 0.00 -0.61 0.00 0.00 39.78 39.26 2r9b n ASN 233 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2r9b n LEU 234 N 0.00 1.94 -3.41 3.41 4.77 -0.87 -4.97 117.00 117.86 2r9b n LEU 234 Ca -0.05 -0.89 0.01 0.00 -0.03 0.00 0.00 56.01 55.05 2r9b n LEU 234 Cb 0.30 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.36 2r9b n LEU 234 CO -0.02 0.36 0.54 -0.62 -1.33 0.00 0.00 177.39 176.32 2r9b s ASP 235 N -1.51 -0.68 0.20 -1.43 -1.08 -1.16 -4.79 116.67 106.22 2r9b s ASP 235 Ca 0.15 0.88 -0.31 0.00 -0.52 0.00 0.00 52.55 52.75 2r9b s ASP 235 Cb 0.12 1.75 -0.10 0.00 -1.46 0.00 0.00 42.92 43.24 2r9b s ASP 235 CO 0.27 -0.13 1.48 -0.69 0.52 0.00 0.00 175.17 176.62 2r9b s VAL 236 N 2.56 2.73 -0.09 1.11 1.01 -1.26 -4.72 120.40 121.73 2r9b s VAL 236 Ca -0.02 0.57 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 2r9b s VAL 236 Cb -0.07 -3.36 0.05 0.00 0.00 0.00 0.00 36.38 32.99 2r9b s VAL 236 CO -0.17 0.07 0.20 -0.63 0.00 0.00 0.00 175.10 174.56 2r9b s ILE 237 N 0.55 -0.11 -0.09 2.22 -1.09 -1.26 -4.64 121.20 116.78 2r9b s ILE 237 Ca 0.64 0.20 0.04 0.00 -2.23 0.00 0.00 60.65 59.30 2r9b s ILE 237 Cb -0.42 -0.32 0.00 0.00 -1.58 0.00 0.00 42.46 40.14 2r9b s ILE 237 CO 0.37 0.08 -0.22 -0.75 -1.23 0.00 0.00 174.94 173.19 2r9b s LYS 238 N 1.48 2.84 0.15 2.79 2.47 -0.44 -4.87 119.74 124.17 2r9b s LYS 238 Ca -0.07 -0.82 -0.11 0.00 -1.56 0.00 0.00 55.97 53.42 2r9b s LYS 238 Cb -0.11 -2.17 -0.07 0.00 -1.46 0.00 0.00 37.83 34.02 2r9b s LYS 238 CO -0.07 0.17 0.49 0.08 0.16 0.00 0.00 175.35 176.17 2r9b s VAL 239 N 0.36 4.98 0.09 4.02 1.01 -1.26 -1.90 120.40 127.69 2r9b s VAL 239 Ca -0.18 0.54 0.02 0.00 0.00 0.00 0.00 61.98 62.36 2r9b s VAL 239 Cb -0.17 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 2r9b s VAL 239 CO 0.08 0.15 0.06 -0.81 0.00 0.00 0.00 175.10 174.58 2r9b n PRO 240 N 0.49 0.33 0.28 2.72 -0.04 -1.26 -5.03 135.00 132.49 2r9b n PRO 240 Ca -0.04 -0.82 0.18 0.00 -0.04 0.00 0.00 63.50 62.78 2r9b n PRO 240 Cb 0.52 0.60 0.95 0.00 -0.04 0.00 0.00 33.50 35.53 2r9b n PRO 240 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2r9b h PHE 241 N 1.23 0.00 -4.04 0.54 3.57 -1.99 -3.43 116.94 112.83 2r9b h PHE 241 Ca -0.06 0.00 -0.45 0.00 3.53 0.00 0.00 57.97 60.99 2r9b h PHE 241 Cb 0.29 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.02 2r9b h PHE 241 CO 0.00 0.00 0.35 -0.51 -2.23 0.00 0.00 178.31 175.92 2r9b s LEU 242 N -6.84 3.99 0.10 0.59 1.43 -1.26 -5.00 118.68 111.69 2r9b s LEU 242 Ca -0.05 1.75 -0.22 0.00 -1.03 0.00 0.00 54.13 54.59 2r9b s LEU 242 Cb 0.13 -4.46 -0.06 0.00 0.03 0.00 0.00 46.19 41.83 2r9b s LEU 242 CO 0.46 -0.38 1.38 1.55 0.23 0.00 0.00 176.35 179.58 2r9b h PRO 243 N 2.04 -0.10 -7.71 1.29 0.13 -2.04 -3.44 132.00 122.18 2r9b h PRO 243 Ca -0.49 0.01 -0.46 0.00 -0.87 0.00 0.00 66.00 64.19 2r9b h PRO 243 Cb 1.19 0.02 0.13 0.00 0.13 0.00 0.00 31.00 32.47 2r9b h PRO 243 CO 0.61 -0.06 0.41 -0.06 -0.23 0.00 0.00 178.00 178.67 2r9b s PHE 244 N -4.79 2.25 0.73 1.56 0.40 -1.26 -4.98 117.98 111.90 2r9b s PHE 244 Ca -0.09 0.55 -0.11 0.00 -0.60 0.00 0.00 56.93 56.67 2r9b s PHE 244 Cb 0.07 -3.79 0.03 0.00 0.51 0.00 0.00 43.02 39.84 2r9b s PHE 244 CO 0.43 -2.25 1.08 0.71 0.70 0.00 0.00 175.22 175.89 2r9b s TYR 245 N -3.70 3.10 0.04 0.36 2.02 -1.26 -4.56 117.35 113.34 2r9b s TYR 245 Ca 0.68 1.23 0.05 0.00 -0.37 0.00 0.00 57.07 58.65 2r9b s TYR 245 Cb -0.08 -3.00 -0.02 0.00 -0.40 0.00 0.00 41.96 38.46 2r9b s TYR 245 CO 0.51 -1.38 -0.14 0.08 -1.57 0.00 0.00 175.55 173.05 2r9b s VAL 246 N -3.16 1.12 0.32 0.71 1.01 -0.80 -2.25 120.40 117.34 2r9b s VAL 246 Ca 0.59 -1.02 -0.19 0.00 0.00 0.00 0.00 61.98 61.36 2r9b s VAL 246 Cb -0.13 -1.02 0.04 0.00 0.00 0.00 0.00 36.38 35.27 2r9b s VAL 246 CO 0.54 -0.00 0.78 0.28 0.00 0.00 0.00 175.10 176.70 2r9b s THR 247 N -0.87 0.00 0.10 3.92 -1.32 -0.22 -1.33 115.64 115.92 2r9b s THR 247 Ca 0.01 -0.96 -0.29 0.00 -1.21 0.00 0.00 61.69 59.25 2r9b s THR 247 Cb -0.08 -2.46 -0.06 0.00 -1.51 0.00 0.00 72.50 68.39 2r9b s THR 247 CO 0.01 0.00 0.91 -0.76 -2.21 0.00 0.00 174.62 172.57 2r9b s LEU 248 N -3.02 4.49 0.40 9.08 1.43 -1.26 -1.02 118.68 128.78 2r9b s LEU 248 Ca 0.14 1.71 0.09 0.00 -1.03 0.00 0.00 54.13 55.04 2r9b s LEU 248 Cb -0.05 -3.49 0.87 0.00 0.03 0.00 0.00 46.19 43.54 2r9b s LEU 248 CO 0.09 -0.03 1.98 0.00 0.23 0.00 0.00 176.35 178.61 2r9b n ASN 250 N -4.48 0.19 -4.35 0.00 0.23 -1.26 -4.89 115.26 100.70 2r9b n ASN 250 Ca 0.09 -0.08 -0.56 0.00 -0.53 0.00 0.00 54.58 53.51 2r9b n ASN 250 Cb 0.26 -0.23 -0.10 0.00 -2.08 0.00 0.00 39.78 37.64 2r9b n ASN 250 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2r9b n ASN 251 N -1.29 1.41 0.00 0.53 2.85 -0.11 -4.79 115.26 113.87 2r9b n ASN 251 Ca 0.11 0.56 0.08 0.00 -0.11 0.00 0.00 54.58 55.22 2r9b n ASN 251 Cb 0.29 -1.07 0.40 0.00 1.24 0.00 0.00 39.78 40.64 2r9b n ASN 251 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 2r9b n SER 252 N 8.54 0.00 -0.61 1.20 3.41 -1.26 -2.60 113.62 122.31 2r9b n SER 252 Ca 0.48 0.10 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 2r9b n SER 252 Cb 0.09 -0.30 0.27 0.00 -0.26 0.00 0.00 64.21 64.00 2r9b n SER 252 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2r9b n LYS 253 N -1.30 1.67 -1.68 4.33 5.02 -1.26 -4.92 118.16 120.02 2r9b n LYS 253 Ca 0.07 -1.22 -0.46 0.00 -2.02 0.00 0.00 58.31 54.68 2r9b n LYS 253 Cb 0.13 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 33.63 2r9b n LYS 253 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 2r9b n LEU 254 N 0.40 3.47 -4.83 -0.35 4.77 -1.07 -4.85 117.00 114.54 2r9b n LEU 254 Ca 0.14 1.01 -0.29 0.00 -0.03 0.00 0.00 56.01 56.85 2r9b n LEU 254 Cb 0.46 -1.43 0.11 0.00 -2.33 0.00 0.00 43.42 40.23 2r9b n LEU 254 CO 0.20 -0.08 0.74 -2.16 -1.33 0.00 0.00 177.39 174.75 2r9b s PRO 255 N 2.64 1.55 -0.17 3.23 0.04 -1.26 -4.87 135.00 136.16 2r9b s PRO 255 Ca 0.85 0.28 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2r9b s PRO 255 Cb -0.63 -1.89 0.03 0.00 0.04 0.00 0.00 34.50 32.05 2r9b s PRO 255 CO 0.43 -1.91 -0.12 0.99 0.04 0.00 0.00 177.00 176.43 2r9b s THR 256 N -3.36 1.56 0.36 1.26 2.01 -1.26 -4.14 115.64 112.07 2r9b s THR 256 Ca 0.63 -0.79 -0.28 0.00 0.31 0.00 0.00 61.69 61.55 2r9b s THR 256 Cb -0.13 -1.56 -0.11 0.00 0.01 0.00 0.00 72.50 70.70 2r9b s THR 256 CO 0.52 0.30 1.50 0.49 -0.69 0.00 0.00 174.62 176.74 2r9b n PHE 257 N 4.74 2.93 -3.66 4.92 3.01 -1.06 -4.33 117.46 124.01 2r9b n PHE 257 Ca -0.15 0.42 -0.27 0.00 1.01 0.00 0.00 57.45 58.45 2r9b n PHE 257 Cb 0.48 -2.54 -0.16 0.00 -0.01 0.00 0.00 39.48 37.25 2r9b n PHE 257 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2r9b s GLU 258 N -1.82 0.36 -0.12 -1.08 2.12 -1.18 -1.55 118.70 115.43 2r9b s GLU 258 Ca 0.55 -0.34 -0.03 0.00 0.36 0.00 0.00 54.97 55.51 2r9b s GLU 258 Cb -0.48 -1.88 -0.03 0.00 0.26 0.00 0.00 34.13 31.99 2r9b s GLU 258 CO 0.61 -0.72 -0.01 -0.06 -0.54 0.00 0.00 175.26 174.55 2r9b s PHE 259 N 1.99 3.12 0.04 5.30 0.40 -0.50 -0.31 117.98 128.01 2r9b s PHE 259 Ca 0.02 0.00 0.04 0.00 -0.60 0.00 0.00 56.93 56.39 2r9b s PHE 259 Cb -0.17 -1.89 -0.02 0.00 0.51 0.00 0.00 43.02 41.46 2r9b s PHE 259 CO -0.13 0.25 -0.11 0.95 0.70 0.00 0.00 175.22 176.88 2r9b s THR 260 N -0.27 0.86 0.24 0.64 -4.23 -0.01 -1.13 115.64 111.74 2r9b s THR 260 Ca 0.06 -0.94 0.03 0.00 -1.18 0.00 0.00 61.69 59.65 2r9b s THR 260 Cb -0.12 -0.82 -0.01 0.00 1.34 0.00 0.00 72.50 72.89 2r9b s THR 260 CO 0.02 -0.11 0.10 -1.54 -0.54 0.00 0.00 174.62 172.56 2r9b n SER 261 N 1.87 0.87 0.06 3.99 3.41 -0.27 -0.96 113.62 122.59 2r9b n SER 261 Ca -0.19 -2.31 -0.02 0.00 -0.26 0.00 0.00 58.87 56.09 2r9b n SER 261 Cb 0.55 0.68 0.23 0.00 -0.26 0.00 0.00 64.21 65.41 2r9b n SER 261 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2r9b h GLU 262 N 0.00 0.34 0.00 4.33 4.39 -1.99 -3.27 114.58 118.37 2r9b h GLU 262 Ca -0.18 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.38 2r9b h GLU 262 Cb 0.73 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 2r9b h GLU 262 CO 0.29 0.63 -1.39 0.09 -1.16 0.00 0.00 179.01 177.47 2r9b n ASN 263 N -4.09 0.47 -3.81 1.42 4.13 -1.26 -5.03 115.26 107.09 2r9b n ASN 263 Ca -0.01 -0.17 -0.07 0.00 1.68 0.00 0.00 54.58 56.01 2r9b n ASN 263 Cb 0.43 1.23 -0.02 0.00 -1.54 0.00 0.00 39.78 39.88 2r9b n ASN 263 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 2r9b s GLY 264 N -3.99 -0.15 -0.08 7.41 0.00 -1.24 -4.92 107.32 104.36 2r9b s GLY 264 Ca -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 44.72 44.52 2r9b s GLY 264 CO 0.85 -0.06 -0.03 1.25 0.00 0.00 0.00 173.10 175.11 2r9b s LYS 265 N -3.83 0.93 -0.12 2.90 2.20 -1.26 -1.11 119.74 119.44 2r9b s LYS 265 Ca 0.10 -0.05 0.03 0.00 -0.36 0.00 0.00 55.97 55.69 2r9b s LYS 265 Cb -0.05 -1.11 0.00 0.00 -1.51 0.00 0.00 37.83 35.16 2r9b s LYS 265 CO 0.05 -0.23 -0.21 0.71 -0.36 0.00 0.00 175.35 175.30 2r9b s TYR 266 N 1.63 2.64 0.12 4.03 2.02 -0.29 -5.01 117.35 122.49 2r9b s TYR 266 Ca 0.01 -1.11 0.11 0.00 -0.37 0.00 0.00 57.07 55.70 2r9b s TYR 266 Cb -0.13 -1.78 -0.04 0.00 -0.40 0.00 0.00 41.96 39.62 2r9b s TYR 266 CO -0.04 -0.47 -0.27 0.95 -1.57 0.00 0.00 175.55 174.14 2r9b s THR 267 N 0.55 2.23 -0.39 -0.71 -4.23 -1.26 -1.41 115.64 110.42 2r9b s THR 267 Ca -0.13 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 58.69 2r9b s THR 267 Cb -0.17 -1.96 0.13 0.00 1.34 0.00 0.00 72.50 71.84 2r9b s THR 267 CO 0.04 0.13 0.19 -0.22 -0.54 0.00 0.00 174.62 174.22 2r9b s LEU 268 N -1.94 2.47 0.81 4.79 2.96 -0.59 -4.97 118.68 122.20 2r9b s LEU 268 Ca 0.13 -2.31 -0.11 0.00 -0.22 0.00 0.00 54.13 51.63 2r9b s LEU 268 Cb -0.10 -0.95 0.08 0.00 0.50 0.00 0.00 46.19 45.72 2r9b s LEU 268 CO 0.05 -0.31 1.11 -1.61 -1.32 0.00 0.00 176.35 174.27 2r9b s GLU 269 N 0.77 1.95 0.28 1.98 8.01 -1.26 -2.57 118.70 127.86 2r9b s GLU 269 Ca 0.15 1.28 0.02 0.00 0.01 0.00 0.00 54.97 56.43 2r9b s GLU 269 Cb -0.22 -1.85 0.67 0.00 -4.31 0.00 0.00 34.13 28.41 2r9b s GLU 269 CO -0.07 -1.89 1.70 -1.35 0.01 0.00 0.00 175.26 173.66 2r9b h PRO 270 N -1.29 0.37 0.00 0.39 0.11 -1.90 -0.81 132.00 128.88 2r9b h PRO 270 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2r9b h PRO 270 Cb 1.24 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2r9b h PRO 270 CO 0.49 0.24 0.31 -0.85 -0.21 0.00 0.00 178.00 177.98 2r9b n GLU 271 N -5.06 0.03 -0.00 1.05 0.28 -1.26 -0.32 120.64 115.36 2r9b n GLU 271 Ca 0.20 0.37 0.09 0.00 -0.16 0.00 0.00 57.16 57.67 2r9b n GLU 271 Cb 0.61 -1.91 -0.12 0.00 1.43 0.00 0.00 31.44 31.44 2r9b n GLU 271 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2r9b n TYR 272 N -1.56 0.00 -1.20 -1.84 4.01 -0.31 -4.53 117.16 111.73 2r9b n TYR 272 Ca -0.00 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.77 2r9b n TYR 272 Cb 0.32 -0.14 0.04 0.00 -0.31 0.00 0.00 39.34 39.25 2r9b n TYR 272 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 2r9b n TYR 273 N -1.67 0.00 -3.84 -0.72 0.18 0.57 -4.68 117.16 106.99 2r9b n TYR 273 Ca 0.01 -0.38 -0.36 0.00 1.88 0.00 0.00 57.90 59.05 2r9b n TYR 273 Cb 0.36 -0.07 -0.07 0.00 -0.38 0.00 0.00 39.34 39.17 2r9b n TYR 273 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2r9b s LEU 274 N -1.03 4.24 -0.32 -3.48 1.43 -0.87 0.10 118.68 118.75 2r9b s LEU 274 Ca 0.10 0.32 0.04 0.00 -1.03 0.00 0.00 54.13 53.56 2r9b s LEU 274 Cb 0.08 -2.06 0.09 0.00 0.03 0.00 0.00 46.19 44.33 2r9b s LEU 274 CO 0.01 0.29 0.01 -1.10 0.23 0.00 0.00 176.35 175.79 2r9b s GLN 275 N -0.30 1.69 0.40 1.70 -1.52 0.66 -4.93 119.66 117.36 2r9b s GLN 275 Ca 0.11 -1.74 -0.26 0.00 -1.95 0.00 0.00 55.36 51.53 2r9b s GLN 275 Cb -0.12 -3.13 -0.11 0.00 -0.22 0.00 0.00 33.01 29.44 2r9b s GLN 275 CO 0.01 -0.84 1.15 0.72 -0.25 0.00 0.00 175.29 176.08 2r9b n HIS 276 N 4.30 1.72 -2.81 0.91 8.25 -1.26 -0.18 115.22 126.14 2r9b n HIS 276 Ca -0.01 0.55 -0.11 0.00 -0.26 0.00 0.00 57.72 57.89 2r9b n HIS 276 Cb 0.42 -2.31 0.04 0.00 1.12 0.00 0.00 29.99 29.25 2r9b n HIS 276 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 2r9b n ILE 277 N -0.21 0.41 -0.35 1.59 -5.35 -0.85 -4.81 119.36 109.79 2r9b n ILE 277 Ca 0.08 -3.00 0.04 0.00 -0.27 0.00 0.00 62.75 59.60 2r9b n ILE 277 Cb 0.38 0.58 0.11 0.00 -1.74 0.00 0.00 39.64 38.97 2r9b n ILE 277 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 2r9b n GLU 278 N -0.03 -0.12 -0.31 6.28 4.07 -1.26 -0.40 120.64 128.88 2r9b n GLU 278 Ca 0.11 1.50 -0.07 0.00 -0.06 0.00 0.00 57.16 58.64 2r9b n GLU 278 Cb 0.77 -2.24 -0.05 0.00 -0.06 0.00 0.00 31.44 29.86 2r9b n GLU 278 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 2r9b n ASP 279 N -5.54 -0.73 -0.23 4.31 10.43 -1.26 0.14 116.55 123.66 2r9b n ASP 279 Ca 0.14 1.32 -0.06 0.00 2.57 0.00 0.00 54.79 58.76 2r9b n ASP 279 Cb 0.46 -0.20 0.04 0.00 1.84 0.00 0.00 41.12 43.27 2r9b n ASP 279 CO 0.00 0.00 0.00 0.58 -1.07 0.00 0.00 177.20 176.71 2r9b h VAL 280 N 0.00 1.21 -1.42 2.53 2.07 -1.15 -3.45 116.25 116.04 2r9b h VAL 280 Ca 0.15 -0.51 0.13 0.00 0.82 0.00 0.00 66.70 67.29 2r9b h VAL 280 Cb 0.34 0.35 -0.29 0.00 -1.52 0.00 0.00 31.29 30.17 2r9b h VAL 280 CO -0.71 0.22 0.49 -0.83 0.02 0.00 0.00 177.57 176.77 2r9b s GLY 281 N -2.98 0.14 -0.27 2.17 0.00 0.36 -5.06 107.32 101.67 2r9b s GLY 281 Ca -0.13 3.26 -0.35 0.00 0.00 0.00 0.00 44.72 47.50 2r9b s GLY 281 CO 0.78 2.51 2.05 -1.55 0.00 0.00 0.00 173.10 176.90 2r9b n PRO 282 N 3.30 1.41 -0.16 2.90 -0.04 -1.19 -0.10 135.00 141.14 2r9b n PRO 282 Ca -0.17 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 2r9b n PRO 282 Cb 0.57 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 2r9b n PRO 282 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2r9b n GLY 283 N 5.64 0.61 3.84 0.55 0.00 -1.26 -5.07 105.19 109.50 2r9b n GLY 283 Ca 0.34 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.04 2r9b n GLY 283 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2r9b s LEU 284 N 0.00 3.55 -0.07 0.99 1.43 0.86 -1.36 118.68 124.09 2r9b s LEU 284 Ca 0.00 1.57 -0.13 0.00 -1.03 0.00 0.00 54.13 54.54 2r9b s LEU 284 Cb 0.00 -4.50 0.03 0.00 0.03 0.00 0.00 46.19 41.74 2r9b s LEU 284 CO 0.00 -0.68 0.31 0.00 0.23 0.00 0.00 176.35 176.21 2r9b s MET 286 N -0.58 3.12 0.04 0.00 0.23 0.74 -1.06 119.30 121.79 2r9b s MET 286 Ca -0.07 -0.37 -0.29 0.00 -1.03 0.00 0.00 55.69 53.93 2r9b s MET 286 Cb -0.04 -2.87 -0.04 0.00 -1.53 0.00 0.00 34.83 30.35 2r9b s MET 286 CO 0.02 0.67 0.94 -0.51 -2.03 0.00 0.00 175.02 174.11 2r9b s LEU 287 N -0.79 4.42 -1.38 0.18 1.43 -0.96 -0.24 118.68 121.34 2r9b s LEU 287 Ca 0.12 1.66 -0.06 0.00 -1.03 0.00 0.00 54.13 54.82 2r9b s LEU 287 Cb -0.12 -3.52 0.08 0.00 0.03 0.00 0.00 46.19 42.67 2r9b s LEU 287 CO 0.02 -0.16 2.49 -3.20 0.23 0.00 0.00 176.35 175.73 2r9b n ASN 288 N 3.41 8.17 -4.02 2.29 2.85 0.29 -4.37 115.26 123.88 2r9b n ASN 288 Ca 0.04 -3.04 -0.18 0.00 -0.11 0.00 0.00 54.58 51.29 2r9b n ASN 288 Cb 0.50 -1.40 -0.14 0.00 1.24 0.00 0.00 39.78 39.98 2r9b n ASN 288 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2r9b s ILE 289 N -0.53 0.67 0.02 -1.44 1.01 -1.26 -1.90 121.20 117.77 2r9b s ILE 289 Ca 0.57 -0.42 -0.09 0.00 0.00 0.00 0.00 60.65 60.71 2r9b s ILE 289 Cb 0.18 -0.58 0.00 0.00 0.01 0.00 0.00 42.46 42.08 2r9b s ILE 289 CO -0.09 0.15 0.17 0.27 0.00 0.00 0.00 174.94 175.44 2r9b s ILE 290 N -0.28 0.09 0.27 2.92 -4.36 -0.25 -4.82 121.20 114.78 2r9b s ILE 290 Ca 0.03 -0.78 -0.28 0.00 -0.26 0.00 0.00 60.65 59.35 2r9b s ILE 290 Cb -0.04 -0.66 -0.09 0.00 1.25 0.00 0.00 42.46 42.92 2r9b s ILE 290 CO -0.00 -0.43 0.94 -0.83 0.24 0.00 0.00 174.94 174.86 2r9b s GLY 291 N -1.69 2.98 -0.30 6.27 0.00 -1.26 -1.18 107.32 112.14 2r9b s GLY 291 Ca -0.10 0.57 -0.09 0.00 0.00 0.00 0.00 44.72 45.10 2r9b s GLY 291 CO -0.00 1.09 0.78 -2.27 0.00 0.00 0.00 173.10 172.69 2r9b s LEU 292 N -1.54 -0.98 -0.15 0.66 2.96 -0.34 -4.85 118.68 114.45 2r9b s LEU 292 Ca 0.45 0.93 -0.08 0.00 -0.22 0.00 0.00 54.13 55.21 2r9b s LEU 292 Cb -0.23 1.95 -0.04 0.00 0.50 0.00 0.00 46.19 48.37 2r9b s LEU 292 CO 0.28 -0.18 0.13 -1.81 -1.32 0.00 0.00 176.35 173.45 2r9b s ASP 293 N 2.79 6.24 0.33 3.68 1.01 -1.26 -4.02 116.67 125.44 2r9b s ASP 293 Ca 0.05 0.35 0.09 0.00 0.71 0.00 0.00 52.55 53.74 2r9b s ASP 293 Cb -0.11 -2.05 -0.04 0.00 1.01 0.00 0.00 42.92 41.72 2r9b s ASP 293 CO -0.18 0.31 0.10 -0.36 0.21 0.00 0.00 175.17 175.25 2r9b s PHE 294 N -0.44 2.68 0.50 4.23 0.40 -1.26 -5.02 117.98 119.08 2r9b s PHE 294 Ca 0.12 -0.37 0.42 0.00 -0.60 0.00 0.00 56.93 56.50 2r9b s PHE 294 Cb -0.12 -1.55 2.15 0.00 0.51 0.00 0.00 43.02 44.02 2r9b s PHE 294 CO 0.01 0.41 2.26 -1.35 0.70 0.00 0.00 175.22 177.25 2r9b h PRO 295 N 1.64 0.00 -5.02 0.24 0.11 -2.01 -3.39 132.00 123.57 2r9b h PRO 295 Ca -0.44 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.15 2r9b h PRO 295 Cb 1.25 0.00 -0.32 0.00 0.11 0.00 0.00 31.00 32.05 2r9b h PRO 295 CO 0.63 0.00 -0.82 0.08 -0.21 0.00 0.00 178.00 177.68 2r9b s VAL 296 N -4.01 1.25 -0.12 3.15 1.01 -1.26 -5.08 120.40 115.33 2r9b s VAL 296 Ca -0.03 -0.60 -0.41 0.00 0.00 0.00 0.00 61.98 60.93 2r9b s VAL 296 Cb 0.12 -1.09 -0.20 0.00 0.00 0.00 0.00 36.38 35.21 2r9b s VAL 296 CO 0.43 0.37 1.24 -2.65 0.00 0.00 0.00 175.10 174.50 2r9b n PRO 297 N 3.29 0.14 -3.77 2.72 -0.02 -1.26 -4.91 135.00 131.19 2r9b n PRO 297 Ca -0.19 0.05 -0.13 0.00 -2.02 0.00 0.00 63.50 61.21 2r9b n PRO 297 Cb 0.53 -1.57 -0.10 0.00 -0.02 0.00 0.00 33.50 32.34 2r9b n PRO 297 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2r9b s THR 298 N 0.89 0.03 0.10 3.45 2.01 -1.26 -2.79 115.64 118.07 2r9b s THR 298 Ca 0.94 -0.25 0.09 0.00 0.31 0.00 0.00 61.69 62.79 2r9b s THR 298 Cb -1.29 -0.51 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 2r9b s THR 298 CO 0.62 -0.14 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.84 2r9b s PHE 299 N -0.56 2.43 -0.37 4.92 0.40 -0.03 -3.84 117.98 120.94 2r9b s PHE 299 Ca -0.07 -0.32 -0.04 0.00 -0.60 0.00 0.00 56.93 55.90 2r9b s PHE 299 Cb -0.04 -1.33 0.08 0.00 0.51 0.00 0.00 43.02 42.24 2r9b s PHE 299 CO 0.02 0.32 0.14 0.42 0.70 0.00 0.00 175.22 176.82 2r9b s ILE 300 N -1.05 3.43 -1.12 0.64 1.01 -1.10 -1.81 121.20 121.21 2r9b s ILE 300 Ca 0.15 -1.60 -0.22 0.00 0.00 0.00 0.00 60.65 58.99 2r9b s ILE 300 Cb -0.10 -3.13 -0.02 0.00 0.01 0.00 0.00 42.46 39.22 2r9b s ILE 300 CO 0.07 -0.40 1.81 -0.76 0.00 0.00 0.00 174.94 175.66 2r9b s LEU 301 N 1.26 3.33 0.00 2.97 1.43 0.62 -1.95 118.68 126.35 2r9b s LEU 301 Ca 0.02 -1.58 0.00 0.00 -1.03 0.00 0.00 54.13 51.54 2r9b s LEU 301 Cb -0.21 -2.58 0.00 0.00 0.03 0.00 0.00 46.19 43.43 2r9b s LEU 301 CO -0.01 -2.30 0.00 0.61 0.23 0.00 0.00 176.35 174.88 2r9b n GLY 302 N 6.14 -1.84 0.28 -3.19 0.00 -1.18 -2.35 105.19 103.05 2r9b n GLY 302 Ca 0.43 -1.49 0.06 0.00 0.00 0.00 0.00 46.02 45.02 2r9b n GLY 302 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2r9b h ASP 303 N -0.30 0.09 -0.97 1.61 3.32 -1.09 -0.16 116.42 118.92 2r9b h ASP 303 Ca 0.00 0.14 0.26 0.00 0.02 0.00 0.00 57.03 57.45 2r9b h ASP 303 Cb 0.00 0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.66 2r9b h ASP 303 CO 0.00 -0.01 0.67 -0.65 -1.72 0.00 0.00 179.24 177.52 2r9b h PRO 304 N 0.31 0.20 0.06 3.56 0.11 -1.84 0.15 132.00 134.54 2r9b h PRO 304 Ca 0.43 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.44 2r9b h PRO 304 Cb 0.73 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 31.81 2r9b h PRO 304 CO -0.50 0.13 -0.39 0.35 -0.21 0.00 0.00 178.00 177.39 2r9b h PHE 305 N 0.20 0.28 0.00 0.65 3.57 -1.33 -3.29 116.94 117.02 2r9b h PHE 305 Ca 0.50 -0.19 0.00 0.00 3.53 0.00 0.00 57.97 61.80 2r9b h PHE 305 Cb 1.59 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 40.32 2r9b h PHE 305 CO -0.00 1.12 0.00 -1.33 -2.23 0.00 0.00 178.31 175.87 2r9b n MET 306 N -4.38 0.07 0.13 1.11 2.81 -0.63 -1.14 117.12 115.08 2r9b n MET 306 Ca -0.12 0.21 0.12 0.00 -1.81 0.00 0.00 57.70 56.10 2r9b n MET 306 Cb 0.63 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.71 2r9b n MET 306 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2r9b h ARG 307 N 0.00 0.00 0.00 0.03 2.43 -0.82 -3.31 114.38 112.71 2r9b h ARG 307 Ca 0.00 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.87 2r9b h ARG 307 Cb 0.23 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 29.72 2r9b h ARG 307 CO 0.00 0.00 -2.20 1.17 -1.51 0.00 0.00 179.97 177.43 2r9b n LYS 308 N -2.69 1.03 -4.01 0.20 4.81 -0.69 -4.91 118.16 111.91 2r9b n LYS 308 Ca 0.02 -0.02 -0.34 0.00 -0.87 0.00 0.00 58.31 57.09 2r9b n LYS 308 Cb 0.53 -1.46 -0.15 0.00 0.02 0.00 0.00 35.03 33.97 2r9b n LYS 308 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2r9b s TYR 309 N -2.51 2.88 0.35 5.64 2.02 -0.29 -1.47 117.35 123.98 2r9b s TYR 309 Ca -0.09 -1.27 -0.28 0.00 -0.37 0.00 0.00 57.07 55.06 2r9b s TYR 309 Cb 0.06 -2.02 -0.11 0.00 -0.40 0.00 0.00 41.96 39.49 2r9b s TYR 309 CO 0.74 -0.67 1.39 0.12 -1.57 0.00 0.00 175.55 175.56 2r9b s PHE 310 N 1.39 2.83 0.02 2.71 5.36 0.43 -4.45 117.98 126.28 2r9b s PHE 310 Ca 0.05 1.31 0.04 0.00 -0.96 0.00 0.00 56.93 57.37 2r9b s PHE 310 Cb -0.14 -3.83 -0.02 0.00 -0.34 0.00 0.00 43.02 38.69 2r9b s PHE 310 CO -0.08 -2.37 -0.13 0.95 -1.46 0.00 0.00 175.22 172.13 2r9b s THR 311 N -1.14 1.04 -0.15 0.12 -4.23 -1.12 -1.13 115.64 109.03 2r9b s THR 311 Ca 0.51 -0.85 0.01 0.00 -1.18 0.00 0.00 61.69 60.18 2r9b s THR 311 Cb -0.43 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 72.49 2r9b s THR 311 CO 0.57 0.08 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.87 2r9b s VAL 312 N -0.69 2.45 -0.52 2.29 1.01 -0.08 -2.01 120.40 122.85 2r9b s VAL 312 Ca 0.02 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.08 2r9b s VAL 312 Cb -0.07 -2.02 0.13 0.00 0.00 0.00 0.00 36.38 34.42 2r9b s VAL 312 CO 0.01 0.52 0.39 -0.36 0.00 0.00 0.00 175.10 175.66 2r9b s PHE 313 N 0.87 3.48 -0.48 5.22 0.40 0.41 -0.18 117.98 127.70 2r9b s PHE 313 Ca -0.05 -2.09 -0.12 0.00 -0.60 0.00 0.00 56.93 54.07 2r9b s PHE 313 Cb -0.15 -3.45 0.11 0.00 0.51 0.00 0.00 43.02 40.04 2r9b s PHE 313 CO -0.02 -0.97 0.38 0.34 0.70 0.00 0.00 175.22 175.66 2r9b s ASP 314 N 2.20 5.88 0.13 1.36 -1.08 -0.88 -1.73 116.67 122.56 2r9b s ASP 314 Ca 0.09 -1.74 -0.16 0.00 -0.52 0.00 0.00 52.55 50.22 2r9b s ASP 314 Cb -0.23 -2.08 -0.02 0.00 -1.46 0.00 0.00 42.92 39.12 2r9b s ASP 314 CO -0.02 -0.71 1.67 1.88 0.52 0.00 0.00 175.17 178.50 2r9b h TYR 315 N 8.61 0.57 -0.20 -5.34 -1.99 -1.57 -0.41 116.97 116.64 2r9b h TYR 315 Ca -0.25 -0.05 0.06 0.00 2.00 0.00 0.00 58.73 60.49 2r9b h TYR 315 Cb 1.09 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 39.64 2r9b h TYR 315 CO 0.66 0.53 0.18 -0.44 -0.00 0.00 0.00 178.16 179.09 2r9b h ASP 316 N 0.45 0.00 -0.12 3.88 3.32 -1.93 -1.63 116.42 120.39 2r9b h ASP 316 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2r9b h ASP 316 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 2r9b h ASP 316 CO -0.01 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.10 2r9b n ASN 317 N -4.02 2.10 -4.24 6.45 3.02 -1.11 -4.99 115.26 112.47 2r9b n ASN 317 Ca 0.02 -1.68 -0.32 0.00 -0.03 0.00 0.00 54.58 52.56 2r9b n ASN 317 Cb 0.32 -0.08 -0.07 0.00 -0.61 0.00 0.00 39.78 39.34 2r9b n ASN 317 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2r9b n HIS 318 N 0.21 -1.42 -4.01 3.10 8.25 -0.19 -4.88 115.22 116.29 2r9b n HIS 318 Ca 0.05 0.69 -0.10 0.00 -0.26 0.00 0.00 57.72 58.10 2r9b n HIS 318 Cb 0.27 -2.93 -0.07 0.00 1.12 0.00 0.00 29.99 28.39 2r9b n HIS 318 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2r9b s SER 319 N -4.05 0.01 -0.10 0.41 1.04 -1.02 -1.79 113.70 108.21 2r9b s SER 319 Ca 0.24 -0.96 0.04 0.00 0.48 0.00 0.00 55.95 55.74 2r9b s SER 319 Cb -0.14 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.46 2r9b s SER 319 CO 0.96 -0.97 -0.23 -0.69 0.98 0.00 0.00 173.24 173.30 2r9b s VAL 320 N -4.01 2.15 -0.05 5.02 1.01 0.09 -2.06 120.40 122.55 2r9b s VAL 320 Ca 0.22 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 2r9b s VAL 320 Cb 0.03 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 2r9b s VAL 320 CO 0.05 0.56 0.18 -0.83 0.00 0.00 0.00 175.10 175.06 2r9b s GLY 321 N 0.26 2.19 -0.06 4.51 0.00 0.75 -0.10 107.32 114.88 2r9b s GLY 321 Ca -0.16 -0.69 0.02 0.00 0.00 0.00 0.00 44.72 43.89 2r9b s GLY 321 CO 0.08 -0.51 -0.10 -0.42 0.00 0.00 0.00 173.10 172.15 2r9b s ILE 322 N -1.21 0.98 -0.02 0.90 1.01 -0.84 -0.90 121.20 121.11 2r9b s ILE 322 Ca 0.23 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.43 2r9b s ILE 322 Cb -0.13 -0.90 0.00 0.00 0.01 0.00 0.00 42.46 41.45 2r9b s ILE 322 CO 0.13 0.32 0.12 0.00 0.00 0.00 0.00 174.94 175.51 2r9b s ALA 323 N 0.65 -0.29 0.13 9.38 0.00 -0.28 -1.26 121.76 130.10 2r9b s ALA 323 Ca -0.13 0.06 -0.31 0.00 0.00 0.00 0.00 51.96 51.58 2r9b s ALA 323 Cb -0.15 -0.04 -0.09 0.00 0.00 0.00 0.00 23.12 22.84 2r9b s ALA 323 CO 0.03 -0.14 1.59 -1.17 0.00 0.00 0.00 175.76 176.07 2r9b s LEU 324 N -0.72 4.37 0.18 0.00 2.96 -1.25 0.16 118.68 124.37 2r9b s LEU 324 Ca -0.08 2.57 -0.27 0.00 -0.22 0.00 0.00 54.13 56.14 2r9b s LEU 324 Cb -0.05 -3.58 -0.08 0.00 0.50 0.00 0.00 46.19 42.98 2r9b s LEU 324 CO 0.01 -0.84 0.82 0.00 -1.32 0.00 0.00 176.35 175.01 2r9b s ALA 325 N 1.62 3.41 0.18 5.97 0.00 -0.54 -2.04 121.76 130.36 2r9b s ALA 325 Ca 0.71 0.43 -0.32 0.00 0.00 0.00 0.00 51.96 52.78 2r9b s ALA 325 Cb -0.42 -3.03 -0.11 0.00 0.00 0.00 0.00 23.12 19.55 2r9b s ALA 325 CO 0.32 0.25 1.77 0.15 0.00 0.00 0.00 175.76 178.24 2r9b s LYS 326 N -1.06 4.13 0.50 0.00 -0.14 0.31 -4.83 119.74 118.66 2r9b s LYS 326 Ca 0.37 2.61 0.34 0.00 -1.36 0.00 0.00 55.97 57.93 2r9b s LYS 326 Cb -0.24 -3.27 1.77 0.00 -1.68 0.00 0.00 37.83 34.41 2r9b s LYS 326 CO 0.28 -0.79 2.04 0.87 -0.76 0.00 0.00 175.35 176.98 2r9b h LYS 327 N 7.50 0.00 -1.77 1.68 1.57 -1.94 -3.43 116.57 120.17 2r9b h LYS 327 Ca -0.44 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.35 2r9b h LYS 327 Cb 1.21 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.29 2r9b h LYS 327 CO 0.95 0.00 0.34 -0.80 -0.57 0.00 0.00 179.45 179.38 2r9b s ASN 328 N -4.77 -0.54 0.00 0.86 0.01 -1.26 -4.96 114.94 104.28 2r9b s ASN 328 Ca -0.03 0.82 0.27 0.00 -0.71 0.00 0.00 52.86 53.22 2r9b s ASN 328 Cb 0.10 0.76 0.87 0.00 0.41 0.00 0.00 41.25 43.39 2r9b s ASN 328 CO 0.35 -0.34 1.64 0.18 -1.51 0.00 0.00 177.10 177.43