#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b0f s VAL 17 N 0.00 5.32 0.00 1.39 1.01 0.16 -4.37 120.40 123.90 1b0f s VAL 17 Ca 0.00 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.23 1b0f s VAL 17 Cb 0.00 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.84 1b0f s VAL 17 CO 0.00 0.30 0.00 0.61 0.00 0.00 0.00 175.10 176.01 1b0f n GLY 18 N 4.49 0.50 0.00 4.51 0.00 -1.26 -0.39 105.19 113.05 1b0f n GLY 18 Ca -0.14 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1b0f n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b0f n GLY 19 N -1.17 3.81 3.42 -0.02 0.00 -1.26 -4.88 105.19 105.08 1b0f n GLY 19 Ca 0.00 -1.74 -0.10 0.00 0.00 0.00 0.00 46.02 44.18 1b0f n GLY 19 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1b0f s ARG 20 N 4.05 1.23 0.06 1.61 1.70 -0.42 -4.93 118.95 122.26 1b0f s ARG 20 Ca 0.00 -0.89 -0.31 0.00 -0.47 0.00 0.00 55.73 54.06 1b0f s ARG 20 Cb 0.00 0.47 -0.07 0.00 -0.57 0.00 0.00 34.95 34.78 1b0f s ARG 20 CO 0.00 -0.50 1.46 1.03 -1.08 0.00 0.00 175.30 176.21 1b0f s ARG 21 N -3.88 4.27 0.38 3.89 0.52 -1.26 0.50 118.95 123.38 1b0f s ARG 21 Ca 0.09 2.10 -0.25 0.00 -0.52 0.00 0.00 55.73 57.15 1b0f s ARG 21 Cb 0.01 -3.45 -0.09 0.00 0.52 0.00 0.00 34.95 31.94 1b0f s ARG 21 CO -0.05 -0.57 1.03 0.00 0.02 0.00 0.00 175.30 175.74 1b0f s ALA 22 N 1.96 3.13 0.39 2.13 0.00 0.13 -4.82 121.76 124.69 1b0f s ALA 22 Ca 0.67 0.68 -0.27 0.00 0.00 0.00 0.00 51.96 53.03 1b0f s ALA 22 Cb -0.36 -3.26 -0.10 0.00 0.00 0.00 0.00 23.12 19.40 1b0f s ALA 22 CO 0.29 -0.14 1.48 0.50 0.00 0.00 0.00 175.76 177.90 1b0f s ARG 23 N -2.35 4.02 -0.33 0.00 3.52 -1.26 -4.80 118.95 117.75 1b0f s ARG 23 Ca 0.55 2.55 -0.38 0.00 -0.13 0.00 0.00 55.73 58.33 1b0f s ARG 23 Cb -0.22 -2.90 -0.14 0.00 -1.56 0.00 0.00 34.95 30.13 1b0f s ARG 23 CO 0.28 -0.60 2.01 -2.30 -0.81 0.00 0.00 175.30 173.88 1b0f n PRO 24 N 0.32 1.01 -3.01 5.12 -0.02 -1.26 -1.42 135.00 135.74 1b0f n PRO 24 Ca 0.02 0.32 -0.16 0.00 -2.02 0.00 0.00 63.50 61.66 1b0f n PRO 24 Cb 0.40 -2.22 0.04 0.00 -0.02 0.00 0.00 33.50 31.70 1b0f n PRO 24 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1b0f n HIS 25 N 7.83 -1.66 0.12 6.00 8.25 -1.26 -4.92 115.22 129.58 1b0f n HIS 25 Ca 0.37 0.52 -0.01 0.00 -0.26 0.00 0.00 57.72 58.34 1b0f n HIS 25 Cb 0.16 -3.60 0.10 0.00 1.12 0.00 0.00 29.99 27.77 1b0f n HIS 25 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1b0f h ALA 26 N 0.70 0.77 -2.99 -1.41 0.00 -1.59 -3.38 119.26 111.35 1b0f h ALA 26 Ca -0.38 -0.61 -0.61 0.00 0.00 0.00 0.00 54.91 53.31 1b0f h ALA 26 Cb 1.25 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 18.54 1b0f h ALA 26 CO 0.39 0.84 -0.73 -1.58 0.00 0.00 0.00 179.25 178.17 1b0f s TRP 27 N -3.28 2.14 -1.04 0.00 0.52 -1.26 -4.99 118.94 111.03 1b0f s TRP 27 Ca 0.00 -2.54 0.10 0.00 0.02 0.00 0.00 56.10 53.68 1b0f s TRP 27 Cb 0.11 -1.96 0.45 0.00 -1.15 0.00 0.00 33.47 30.92 1b0f s TRP 27 CO 0.76 -0.76 1.32 -2.30 0.02 0.00 0.00 176.95 175.99 1b0f n PRO 28 N 3.35 0.01 0.00 4.98 -0.02 -1.26 -1.89 135.00 140.17 1b0f n PRO 28 Ca 0.11 0.31 0.12 0.00 -2.02 0.00 0.00 63.50 62.01 1b0f n PRO 28 Cb 0.35 -1.50 0.19 0.00 -0.02 0.00 0.00 33.50 32.52 1b0f n PRO 28 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 1b0f n PHE 29 N -1.48 0.01 -2.02 6.00 1.16 -1.17 -1.65 117.46 118.30 1b0f n PHE 29 Ca 0.03 0.00 -0.42 0.00 -1.87 0.00 0.00 57.45 55.19 1b0f n PHE 29 Cb 0.12 -0.22 -0.03 0.00 -1.61 0.00 0.00 39.48 37.74 1b0f n PHE 29 CO 0.00 0.00 0.00 1.41 -1.87 0.00 0.00 176.76 176.30 1b0f s MET 30 N -3.00 4.26 0.01 3.97 1.75 -0.79 -0.45 119.30 125.05 1b0f s MET 30 Ca 0.10 2.26 0.06 0.00 -1.25 0.00 0.00 55.69 56.86 1b0f s MET 30 Cb 0.17 -3.16 -0.02 0.00 2.84 0.00 0.00 34.83 34.66 1b0f s MET 30 CO 0.73 -0.50 -0.18 0.08 -0.65 0.00 0.00 175.02 174.51 1b0f s VAL 31 N 0.75 1.40 -0.27 10.11 1.01 0.83 -4.37 120.40 129.86 1b0f s VAL 31 Ca 0.65 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.70 1b0f s VAL 31 Cb -0.41 -1.19 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1b0f s VAL 31 CO 0.35 0.28 0.01 -0.55 0.00 0.00 0.00 175.10 175.19 1b0f s SER 32 N -0.70 4.70 -0.03 3.32 0.15 -0.31 -1.02 113.70 119.81 1b0f s SER 32 Ca 0.06 -0.78 -0.26 0.00 0.70 0.00 0.00 55.95 55.68 1b0f s SER 32 Cb -0.07 -1.77 -0.04 0.00 -1.71 0.00 0.00 66.02 62.43 1b0f s SER 32 CO 0.00 -0.15 0.80 -0.76 1.20 0.00 0.00 173.24 174.33 1b0f s LEU 33 N 1.41 4.35 0.03 3.45 1.43 0.07 -0.67 118.68 128.77 1b0f s LEU 33 Ca 0.01 1.37 0.03 0.00 -1.03 0.00 0.00 54.13 54.51 1b0f s LEU 33 Cb -0.17 -3.25 -0.02 0.00 0.03 0.00 0.00 46.19 42.78 1b0f s LEU 33 CO -0.01 -0.14 -0.08 -1.10 0.23 0.00 0.00 176.35 175.24 1b0f s GLN 34 N 0.74 0.57 -0.11 1.70 -0.21 0.08 -0.86 119.66 121.57 1b0f s GLN 34 Ca 0.42 -0.66 0.02 0.00 0.02 0.00 0.00 55.36 55.16 1b0f s GLN 34 Cb -0.19 -0.42 0.01 0.00 1.00 0.00 0.00 33.01 33.42 1b0f s GLN 34 CO 0.22 0.09 -0.16 -1.17 -2.12 0.00 0.00 175.29 172.15 1b0f s LEU 35 N -1.26 1.76 -1.09 2.90 0.20 -0.48 -0.97 118.68 119.74 1b0f s LEU 35 Ca -0.06 -0.44 -0.22 0.00 0.69 0.00 0.00 54.13 54.10 1b0f s LEU 35 Cb -0.08 -1.12 0.02 0.00 -0.43 0.00 0.00 46.19 44.57 1b0f s LEU 35 CO 0.00 0.02 0.71 0.00 -0.29 0.00 0.00 176.35 176.80 1b0f n ALA 36 N 4.16 -2.62 0.00 5.97 0.00 -1.26 -1.21 120.51 125.55 1b0f n ALA 36 Ca -0.19 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1b0f n ALA 36 Cb 0.51 -2.81 0.00 0.00 0.00 0.00 0.00 19.45 17.15 1b0f n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b0f n GLY 38 N -1.85 1.87 3.44 0.00 0.00 -1.26 -4.96 105.19 102.42 1b0f n GLY 38 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 1b0f n GLY 38 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b0f s GLY 39 N -1.30 1.73 0.21 -0.02 0.00 -0.35 -5.06 107.32 102.53 1b0f s GLY 39 Ca 0.00 -1.05 -0.32 0.00 0.00 0.00 0.00 44.72 43.34 1b0f s GLY 39 CO 0.00 0.37 1.51 1.57 0.00 0.00 0.00 173.10 176.55 1b0f n HIS 40 N 4.54 2.30 0.00 1.90 -0.00 -1.26 -1.39 115.22 121.32 1b0f n HIS 40 Ca -0.17 0.33 0.00 0.00 0.46 0.00 0.00 57.72 58.35 1b0f n HIS 40 Cb 0.52 -2.52 0.00 0.00 -0.12 0.00 0.00 29.99 27.87 1b0f n HIS 40 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1b0f n PHE 41 N 2.61 0.00 -3.49 1.57 -1.74 -0.04 -4.90 117.46 111.47 1b0f n PHE 41 Ca 0.14 0.00 -0.13 0.00 -0.56 0.00 0.00 57.45 56.90 1b0f n PHE 41 Cb 0.31 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.28 1b0f n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1b0f s GLY 43 N -2.49 1.31 0.18 0.00 0.00 0.58 -0.75 107.32 106.16 1b0f s GLY 43 Ca -0.01 -1.30 -0.17 0.00 0.00 0.00 0.00 44.72 43.24 1b0f s GLY 43 CO -0.09 -1.30 0.50 0.00 0.00 0.00 0.00 173.10 172.21 1b0f s ALA 44 N -2.04 -0.92 -0.05 3.20 0.00 -0.19 -3.19 121.76 118.57 1b0f s ALA 44 Ca 0.36 -0.20 0.06 0.00 0.00 0.00 0.00 51.96 52.18 1b0f s ALA 44 Cb -0.09 0.83 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 1b0f s ALA 44 CO 0.29 -0.77 -0.23 0.99 0.00 0.00 0.00 175.76 176.03 1b0f s THR 45 N -3.86 1.92 -0.10 0.00 2.01 0.08 -0.12 115.64 115.57 1b0f s THR 45 Ca 0.08 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 60.79 1b0f s THR 45 Cb -0.00 -1.62 -0.02 0.00 0.01 0.00 0.00 72.50 70.87 1b0f s THR 45 CO -0.04 0.54 1.07 -0.22 -0.69 0.00 0.00 174.62 175.27 1b0f s LEU 46 N -0.18 4.25 0.00 4.42 2.96 0.41 -0.85 118.68 129.69 1b0f s LEU 46 Ca -0.02 1.61 0.00 0.00 -0.22 0.00 0.00 54.13 55.50 1b0f s LEU 46 Cb -0.13 -3.56 0.00 0.00 0.50 0.00 0.00 46.19 43.01 1b0f s LEU 46 CO 0.03 -0.50 0.57 2.30 -1.32 0.00 0.00 176.35 177.43 1b0f n ILE 47 N 4.61 0.15 -3.55 6.68 -5.35 0.40 -1.48 119.36 120.82 1b0f n ILE 47 Ca 0.10 -0.57 -0.08 0.00 -0.27 0.00 0.00 62.75 61.92 1b0f n ILE 47 Cb 0.48 0.93 -0.03 0.00 -1.74 0.00 0.00 39.64 39.27 1b0f n ILE 47 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1b0f s ALA 48 N -0.15 -1.92 0.63 -1.28 0.00 -1.03 -4.79 121.76 113.21 1b0f s ALA 48 Ca 0.00 1.38 0.27 0.00 0.00 0.00 0.00 51.96 53.61 1b0f s ALA 48 Cb 0.00 -0.20 1.42 0.00 0.00 0.00 0.00 23.12 24.34 1b0f s ALA 48 CO 0.00 -0.50 1.82 -1.35 0.00 0.00 0.00 175.76 175.72 1b0f h PRO 49 N 2.22 0.00 0.00 0.00 0.11 -1.96 -1.72 132.00 130.65 1b0f h PRO 49 Ca -0.18 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.88 1b0f h PRO 49 Cb 1.19 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 32.19 1b0f h PRO 49 CO 0.29 0.00 -0.56 0.27 -0.21 0.00 0.00 178.00 177.79 1b0f n ASN 50 N -3.20 1.36 -3.78 -2.05 6.94 -1.26 -0.03 115.26 113.24 1b0f n ASN 50 Ca 0.03 -2.90 -0.13 0.00 -0.02 0.00 0.00 54.58 51.56 1b0f n ASN 50 Cb 0.59 -0.39 -0.14 0.00 -2.36 0.00 0.00 39.78 37.48 1b0f n ASN 50 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1b0f s PHE 51 N -1.72 -0.15 0.07 -2.53 0.08 -0.65 -1.22 117.98 111.85 1b0f s PHE 51 Ca 0.30 0.42 0.09 0.00 0.12 0.00 0.00 56.93 57.86 1b0f s PHE 51 Cb 0.30 -0.04 -0.03 0.00 -0.57 0.00 0.00 43.02 42.68 1b0f s PHE 51 CO -0.07 -0.13 -0.24 0.08 -0.10 0.00 0.00 175.22 174.77 1b0f s VAL 52 N 0.75 1.94 -0.05 -0.44 1.01 -0.52 -0.45 120.40 122.63 1b0f s VAL 52 Ca -0.06 -1.41 0.05 0.00 0.00 0.00 0.00 61.98 60.57 1b0f s VAL 52 Cb -0.07 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1b0f s VAL 52 CO -0.04 0.21 -0.21 -0.32 0.00 0.00 0.00 175.10 174.74 1b0f s MET 53 N -1.45 2.52 0.03 2.72 1.75 -0.03 -0.82 119.30 124.02 1b0f s MET 53 Ca 0.10 -0.84 -0.00 0.00 -1.25 0.00 0.00 55.69 53.70 1b0f s MET 53 Cb -0.10 -2.23 0.00 0.00 2.84 0.00 0.00 34.83 35.34 1b0f s MET 53 CO 0.03 0.47 0.05 0.45 -0.65 0.00 0.00 175.02 175.36 1b0f n SER 54 N 2.73 -0.13 -4.73 1.11 2.88 -0.75 -0.74 113.62 114.00 1b0f n SER 54 Ca -0.17 -1.15 -0.39 0.00 -1.33 0.00 0.00 58.87 55.83 1b0f n SER 54 Cb 0.52 0.23 -0.05 0.00 -0.75 0.00 0.00 64.21 64.16 1b0f n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b0f s ALA 55 N -1.56 3.44 0.48 -1.46 0.00 -1.26 -1.46 121.76 119.95 1b0f s ALA 55 Ca 0.02 -0.05 0.26 0.00 0.00 0.00 0.00 51.96 52.19 1b0f s ALA 55 Cb -0.00 -2.75 1.31 0.00 0.00 0.00 0.00 23.12 21.67 1b0f s ALA 55 CO 0.02 0.01 1.86 0.00 0.00 0.00 0.00 175.76 177.65 1b0f h ALA 56 N 6.47 2.57 0.00 0.00 0.00 -1.73 0.10 119.26 126.68 1b0f h ALA 56 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1b0f h ALA 56 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1b0f h ALA 56 CO 0.74 -0.86 0.00 -2.39 0.00 0.00 0.00 179.25 176.74 1b0f n HIS 57 N -4.39 0.00 0.01 0.00 1.44 -1.26 -2.49 115.22 108.53 1b0f n HIS 57 Ca 0.20 0.00 -0.18 0.00 -2.01 0.00 0.00 57.72 55.73 1b0f n HIS 57 Cb 0.88 -0.35 -0.12 0.00 0.12 0.00 0.00 29.99 30.52 1b0f n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1b0f n VAL 59 N -4.21 0.00 0.00 0.00 0.24 -1.20 -4.62 118.33 108.55 1b0f n VAL 59 Ca -0.11 -0.14 0.00 0.00 -2.04 0.00 0.00 64.34 62.04 1b0f n VAL 59 Cb 0.70 0.39 0.00 0.00 -1.47 0.00 0.00 33.84 33.47 1b0f n VAL 59 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b0f n ALA 60 N -0.53 0.00 -3.69 2.33 0.00 -1.04 -3.47 120.51 114.12 1b0f n ALA 60 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.22 1b0f n ALA 60 Cb 0.35 0.22 -0.08 0.00 0.00 0.00 0.00 19.45 19.94 1b0f n ALA 60 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1b0f s ASN 61 N -2.96 5.66 -0.08 0.00 2.47 -1.26 -4.98 114.94 113.79 1b0f s ASN 61 Ca 0.00 -3.48 -0.22 0.00 0.42 0.00 0.00 52.86 49.58 1b0f s ASN 61 Cb 0.00 -1.87 0.05 0.00 -1.45 0.00 0.00 41.25 37.98 1b0f s ASN 61 CO 0.00 -0.23 0.51 0.54 -3.72 0.00 0.00 177.10 174.20 1b0f s VAL 62 N -0.98 0.02 -0.83 -5.21 0.11 -1.23 -5.09 120.40 107.20 1b0f s VAL 62 Ca 0.24 -0.17 -0.26 0.00 -2.93 0.00 0.00 61.98 58.86 1b0f s VAL 62 Cb -0.11 -0.79 0.03 0.00 -1.53 0.00 0.00 36.38 33.98 1b0f s VAL 62 CO -0.10 -0.09 1.44 0.21 -3.33 0.00 0.00 175.10 173.22 1b0f s ASN 62 N -0.84 6.11 0.53 3.54 3.04 -1.26 -4.84 114.94 121.22 1b0f s ASN 62 Ca -0.09 -0.70 0.22 0.00 0.04 0.00 0.00 52.86 52.32 1b0f s ASN 62 Cb -0.03 -2.56 1.37 0.00 -1.54 0.00 0.00 41.25 38.49 1b0f s ASN 62 CO 0.05 -1.85 2.07 0.58 -3.04 0.00 0.00 177.10 174.92 1b0f h VAL 62 N 6.44 0.83 0.00 -5.21 2.07 -1.96 -0.51 116.25 117.91 1b0f h VAL 62 Ca -0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1b0f h VAL 62 Cb 1.05 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 1b0f h VAL 62 CO 1.32 0.00 0.00 0.03 0.02 0.00 0.00 177.57 178.94 1b0f h ARG 63 N 0.00 0.00 -0.01 1.57 3.08 -1.93 -2.44 114.38 114.65 1b0f h ARG 63 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1b0f h ARG 63 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.57 1b0f h ARG 63 CO -0.00 0.00 -0.21 0.00 -1.07 0.00 0.00 179.97 178.69 1b0f n ALA 64 N -1.89 2.88 -2.32 0.04 0.00 -0.21 -4.97 120.51 114.05 1b0f n ALA 64 Ca -0.00 -0.51 -0.41 0.00 0.00 0.00 0.00 53.44 52.51 1b0f n ALA 64 Cb 0.16 -0.46 -0.04 0.00 0.00 0.00 0.00 19.45 19.12 1b0f n ALA 64 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1b0f s VAL 65 N -1.51 4.22 -0.11 0.00 1.01 -0.92 -4.40 120.40 118.69 1b0f s VAL 65 Ca 0.12 1.75 0.01 0.00 0.00 0.00 0.00 61.98 63.85 1b0f s VAL 65 Cb 0.11 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 1b0f s VAL 65 CO 0.29 0.22 -0.14 -0.13 0.00 0.00 0.00 175.10 175.34 1b0f s ARG 65 N 0.33 3.16 -0.57 2.72 0.52 -0.14 -4.12 118.95 120.86 1b0f s ARG 65 Ca 0.52 -0.70 -0.18 0.00 -0.52 0.00 0.00 55.73 54.85 1b0f s ARG 65 Cb -0.27 -2.55 0.11 0.00 0.52 0.00 0.00 34.95 32.76 1b0f s ARG 65 CO 0.31 0.31 0.62 0.08 0.02 0.00 0.00 175.30 176.64 1b0f s VAL 66 N 0.09 4.96 -0.24 3.52 1.01 0.10 -0.74 120.40 129.10 1b0f s VAL 66 Ca -0.06 -1.13 -0.20 0.00 0.00 0.00 0.00 61.98 60.59 1b0f s VAL 66 Cb -0.15 -4.42 -0.02 0.00 0.00 0.00 0.00 36.38 31.80 1b0f s VAL 66 CO 0.05 -1.00 0.62 -0.69 0.00 0.00 0.00 175.10 174.07 1b0f s VAL 67 N 2.29 5.00 0.21 2.92 1.01 0.16 -1.63 120.40 130.37 1b0f s VAL 67 Ca 0.09 1.11 0.07 0.00 0.00 0.00 0.00 61.98 63.25 1b0f s VAL 67 Cb -0.26 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1b0f s VAL 67 CO 0.06 0.05 0.07 -0.76 0.00 0.00 0.00 175.10 174.52 1b0f s LEU 68 N 2.38 3.50 -0.92 3.92 1.43 0.56 -1.16 118.68 128.38 1b0f s LEU 68 Ca 0.26 -0.37 0.00 0.00 -1.03 0.00 0.00 54.13 52.99 1b0f s LEU 68 Cb -0.16 -2.08 0.00 0.00 0.03 0.00 0.00 46.19 43.98 1b0f s LEU 68 CO 0.09 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.31 1b0f n GLY 69 N -0.62 0.14 3.95 -3.19 0.00 -1.26 -0.80 105.19 103.42 1b0f n GLY 69 Ca -0.08 -0.47 -0.20 0.00 0.00 0.00 0.00 46.02 45.27 1b0f n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0f s ALA 70 N -2.50 4.08 0.08 4.61 0.00 -1.26 -3.28 121.76 123.49 1b0f s ALA 70 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 50.50 1b0f s ALA 70 Cb 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.55 1b0f s ALA 70 CO 0.00 0.04 0.00 1.58 0.00 0.00 0.00 175.76 177.38 1b0f n HIS 71 N -1.52 -1.32 -3.90 0.00 -0.00 -1.26 -4.80 115.22 102.41 1b0f n HIS 71 Ca -0.02 0.18 -0.34 0.00 0.46 0.00 0.00 57.72 58.00 1b0f n HIS 71 Cb 0.58 0.76 -0.13 0.00 -0.12 0.00 0.00 29.99 31.08 1b0f n HIS 71 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1b0f s ASN 72 N -4.08 5.00 0.65 0.26 3.84 -1.26 -1.41 114.94 117.94 1b0f s ASN 72 Ca 0.00 -2.04 0.42 0.00 0.21 0.00 0.00 52.86 51.45 1b0f s ASN 72 Cb 0.00 -1.73 2.25 0.00 -0.55 0.00 0.00 41.25 41.22 1b0f s ASN 72 CO 0.00 -0.45 2.31 -0.07 -2.79 0.00 0.00 177.10 176.10 1b0f h LEU 73 N 7.84 0.00 -0.09 3.21 3.38 -0.33 -2.71 115.31 126.61 1b0f h LEU 73 Ca -0.09 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1b0f h LEU 73 Cb 1.04 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1b0f h LEU 73 CO 0.60 0.00 -0.11 0.77 0.09 0.00 0.00 178.44 179.80 1b0f h SER 74 N 0.00 0.00 -2.55 -0.43 4.64 -1.95 -3.46 113.55 109.81 1b0f h SER 74 Ca -0.00 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 60.78 1b0f h SER 74 Cb 0.08 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.14 1b0f h SER 74 CO 0.00 0.11 -0.49 0.00 -0.87 0.00 0.00 176.83 175.58 1b0f s ARG 75 N -3.19 3.31 -0.24 4.77 1.70 -1.02 -5.05 118.95 119.23 1b0f s ARG 75 Ca 0.06 -0.68 -0.29 0.00 -0.47 0.00 0.00 55.73 54.35 1b0f s ARG 75 Cb 0.06 -2.88 -0.00 0.00 -0.57 0.00 0.00 34.95 31.56 1b0f s ARG 75 CO 0.68 0.50 1.21 -0.98 -1.08 0.00 0.00 175.30 175.63 1b0f s ARG 76 N -3.29 4.12 -0.08 3.89 1.70 -1.26 -4.94 118.95 119.09 1b0f s ARG 76 Ca 0.34 1.41 0.04 0.00 -0.47 0.00 0.00 55.73 57.04 1b0f s ARG 76 Cb -0.11 -3.77 -0.01 0.00 -0.57 0.00 0.00 34.95 30.49 1b0f s ARG 76 CO 0.27 -0.84 -0.20 -1.21 -1.08 0.00 0.00 175.30 172.24 1b0f s GLU 77 N 3.67 2.82 0.00 3.89 2.02 -1.26 -4.99 118.70 124.85 1b0f s GLU 77 Ca 0.52 -0.81 0.28 0.00 0.02 0.00 0.00 54.97 54.98 1b0f s GLU 77 Cb -0.18 -2.34 1.15 0.00 0.10 0.00 0.00 34.13 32.87 1b0f s GLU 77 CO 0.16 0.35 1.84 -0.35 0.02 0.00 0.00 175.26 177.28 1b0f n PRO 78 N 3.06 0.27 0.16 0.39 -0.04 -1.26 -3.60 135.00 133.98 1b0f n PRO 78 Ca -0.18 -0.07 0.02 0.00 -0.04 0.00 0.00 63.50 63.24 1b0f n PRO 78 Cb 0.52 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.69 1b0f n PRO 78 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1b0f h THR 79 N 0.17 1.11 -3.88 0.52 2.02 -1.94 -3.46 112.91 107.45 1b0f h THR 79 Ca 0.00 -1.96 -0.53 0.00 0.77 0.00 0.00 66.41 64.69 1b0f h THR 79 Cb 0.42 2.14 0.08 0.00 -1.74 0.00 0.00 68.15 69.06 1b0f h THR 79 CO 0.00 0.51 0.69 -0.13 0.37 0.00 0.00 175.52 176.96 1b0f s ARG 80 N -3.44 4.26 -0.07 6.66 0.52 -1.21 -4.55 118.95 121.13 1b0f s ARG 80 Ca 0.00 2.35 0.03 0.00 -0.52 0.00 0.00 55.73 57.59 1b0f s ARG 80 Cb 0.11 -3.03 0.01 0.00 0.52 0.00 0.00 34.95 32.55 1b0f s ARG 80 CO 0.73 -0.32 -0.16 -0.65 0.02 0.00 0.00 175.30 174.92 1b0f s GLN 81 N -1.84 2.04 -0.15 3.54 -0.21 0.02 -4.97 119.66 118.09 1b0f s GLN 81 Ca 0.51 -0.54 0.01 0.00 0.02 0.00 0.00 55.36 55.35 1b0f s GLN 81 Cb -0.42 -1.64 -0.00 0.00 1.00 0.00 0.00 33.01 31.95 1b0f s GLN 81 CO 0.56 0.08 -0.16 0.08 -2.12 0.00 0.00 175.29 173.73 1b0f s VAL 82 N 0.53 2.58 0.37 1.09 1.01 -1.26 -0.32 120.40 124.40 1b0f s VAL 82 Ca -0.15 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.10 1b0f s VAL 82 Cb -0.16 -2.08 -0.07 0.00 0.00 0.00 0.00 36.38 34.07 1b0f s VAL 82 CO 0.05 0.52 -0.01 -0.36 0.00 0.00 0.00 175.10 175.30 1b0f s PHE 83 N 0.80 2.34 0.26 5.22 0.08 -0.64 -4.95 117.98 121.08 1b0f s PHE 83 Ca -0.06 -0.69 0.10 0.00 0.12 0.00 0.00 56.93 56.41 1b0f s PHE 83 Cb -0.15 -1.55 -0.05 0.00 -0.57 0.00 0.00 43.02 40.71 1b0f s PHE 83 CO -0.00 0.38 -0.08 0.00 -0.10 0.00 0.00 175.22 175.42 1b0f s ALA 84 N -2.82 3.00 0.37 5.36 0.00 -1.26 0.02 121.76 126.43 1b0f s ALA 84 Ca 0.34 -1.71 -0.25 0.00 0.00 0.00 0.00 51.96 50.35 1b0f s ALA 84 Cb 0.08 -0.60 -0.10 0.00 0.00 0.00 0.00 23.12 22.50 1b0f s ALA 84 CO 0.17 0.29 0.99 0.08 0.00 0.00 0.00 175.76 177.29 1b0f s VAL 85 N -2.31 4.00 0.00 0.00 1.01 -1.26 -1.57 120.40 120.27 1b0f s VAL 85 Ca 0.30 1.56 0.00 0.00 0.00 0.00 0.00 61.98 63.84 1b0f s VAL 85 Cb -0.06 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.50 1b0f s VAL 85 CO 0.18 0.03 0.00 1.67 0.00 0.00 0.00 175.10 176.98 1b0f n GLN 86 N 0.16 1.66 -3.82 2.72 7.27 0.24 -4.71 117.38 120.91 1b0f n GLN 86 Ca 0.04 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 56.99 1b0f n GLN 86 Cb 0.50 -0.84 -0.11 0.00 2.41 0.00 0.00 30.24 32.20 1b0f n GLN 86 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1b0f s ARG 87 N -1.69 0.35 -0.10 3.69 0.52 -1.11 -4.95 118.95 115.65 1b0f s ARG 87 Ca 0.00 0.06 0.01 0.00 -0.52 0.00 0.00 55.73 55.29 1b0f s ARG 87 Cb 0.00 0.16 -0.02 0.00 0.52 0.00 0.00 34.95 35.61 1b0f s ARG 87 CO 0.00 -0.07 -0.15 0.42 0.02 0.00 0.00 175.30 175.53 1b0f s ILE 88 N -0.42 2.95 -0.09 1.52 1.01 -1.26 -0.63 121.20 124.28 1b0f s ILE 88 Ca -0.05 -0.72 0.02 0.00 0.00 0.00 0.00 60.65 59.90 1b0f s ILE 88 Cb -0.03 -2.20 0.01 0.00 0.01 0.00 0.00 42.46 40.25 1b0f s ILE 88 CO 0.01 0.55 -0.13 -0.36 0.00 0.00 0.00 174.94 175.01 1b0f s PHE 89 N 0.03 1.63 0.04 3.97 0.40 -0.30 -4.99 117.98 118.77 1b0f s PHE 89 Ca -0.05 -0.69 0.02 0.00 -0.60 0.00 0.00 56.93 55.61 1b0f s PHE 89 Cb -0.15 -1.21 -0.03 0.00 0.51 0.00 0.00 43.02 42.15 1b0f s PHE 89 CO 0.04 -0.37 -0.07 -1.21 0.70 0.00 0.00 175.22 174.32 1b0f s GLU 90 N 0.90 0.53 -0.52 0.44 2.02 -1.26 -1.40 118.70 119.40 1b0f s GLU 90 Ca -0.10 -0.82 0.05 0.00 0.02 0.00 0.00 54.97 54.12 1b0f s GLU 90 Cb -0.15 -0.19 0.17 0.00 0.10 0.00 0.00 34.13 34.06 1b0f s GLU 90 CO 0.01 0.02 0.41 -3.47 0.02 0.00 0.00 175.26 172.24 1b0f n ASP 91 N 1.26 0.87 -1.05 -0.19 2.03 -1.26 -4.89 116.55 113.32 1b0f n ASP 91 Ca -0.21 -2.70 -0.06 0.00 0.52 0.00 0.00 54.79 52.33 1b0f n ASP 91 Cb 0.56 -0.63 0.01 0.00 -0.72 0.00 0.00 41.12 40.34 1b0f n ASP 91 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1b0f n GLY 92 N 2.44 0.43 3.68 0.27 0.00 -1.26 -4.88 105.19 105.87 1b0f n GLY 92 Ca 0.26 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 1b0f n GLY 92 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b0f s TYR 94 N -2.80 2.35 -0.47 1.61 5.04 -1.26 -4.54 117.35 117.28 1b0f s TYR 94 Ca 0.10 0.39 -0.14 0.00 -2.44 0.00 0.00 57.07 54.98 1b0f s TYR 94 Cb -0.04 -3.88 0.09 0.00 0.35 0.00 0.00 41.96 38.48 1b0f s TYR 94 CO 0.12 -3.53 0.38 0.34 -1.34 0.00 0.00 175.55 171.52 1b0f s ASP 95 N 2.64 6.03 0.36 4.32 -1.08 -0.16 -4.97 116.67 123.80 1b0f s ASP 95 Ca 0.71 -1.48 0.06 0.00 -0.52 0.00 0.00 52.55 51.33 1b0f s ASP 95 Cb -0.35 -2.14 0.68 0.00 -1.46 0.00 0.00 42.92 39.65 1b0f s ASP 95 CO 0.30 -0.67 1.89 1.55 0.52 0.00 0.00 175.17 178.77 1b0f h PRO 98 N 8.69 0.41 0.21 4.34 0.13 -1.92 -0.15 132.00 143.71 1b0f h PRO 98 Ca -0.27 -0.09 -0.33 0.00 -0.87 0.00 0.00 66.00 64.44 1b0f h PRO 98 Cb 1.10 -0.06 0.03 0.00 0.13 0.00 0.00 31.00 32.20 1b0f h PRO 98 CO 0.88 0.48 -1.49 -0.24 -0.23 0.00 0.00 178.00 177.40 1b0f h VAL 99 N 0.39 1.25 -0.18 1.56 3.04 -1.97 -3.35 116.25 116.99 1b0f h VAL 99 Ca 0.08 -2.74 0.00 0.00 -1.01 0.00 0.00 66.70 63.03 1b0f h VAL 99 Cb 0.34 2.96 0.00 0.00 -2.01 0.00 0.00 31.29 32.58 1b0f h VAL 99 CO 0.01 0.83 0.00 0.59 -1.01 0.00 0.00 177.57 178.00 1b0f n ASN 99 N -3.64 3.16 -3.69 3.17 3.02 -1.23 -5.00 115.26 111.05 1b0f n ASN 99 Ca -0.17 -1.99 -0.23 0.00 -0.03 0.00 0.00 54.58 52.17 1b0f n ASN 99 Cb 1.08 -0.11 0.03 0.00 -0.61 0.00 0.00 39.78 40.18 1b0f n ASN 99 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1b0f n LEU 99 N 1.39 -3.17 -4.60 3.41 4.77 -0.10 -5.00 117.00 113.70 1b0f n LEU 99 Ca 0.16 -0.86 -0.30 0.00 -0.03 0.00 0.00 56.01 54.99 1b0f n LEU 99 Cb 0.60 -2.62 -0.09 0.00 -2.33 0.00 0.00 43.42 38.97 1b0f n LEU 99 CO 0.15 0.40 -0.40 -0.76 -1.33 0.00 0.00 177.39 175.45 1b0f s LEU 100 N -6.58 3.12 -1.45 2.23 1.43 -1.00 -4.61 118.68 111.82 1b0f s LEU 100 Ca 0.10 -0.36 -0.09 0.00 -1.03 0.00 0.00 54.13 52.75 1b0f s LEU 100 Cb -0.03 -1.89 0.05 0.00 0.03 0.00 0.00 46.19 44.35 1b0f s LEU 100 CO 0.82 0.17 0.91 0.59 0.23 0.00 0.00 176.35 179.07 1b0f n ASN 101 N 0.62 -3.75 -3.61 2.29 5.03 -1.26 -0.99 115.26 113.59 1b0f n ASN 101 Ca -0.13 -0.77 -0.41 0.00 0.87 0.00 0.00 54.58 54.14 1b0f n ASN 101 Cb 0.52 -4.04 -0.01 0.00 -1.02 0.00 0.00 39.78 35.23 1b0f n ASN 101 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1b0f n ASP 102 N -2.92 4.83 -3.86 6.41 -0.08 -1.26 -4.06 116.55 115.61 1b0f n ASP 102 Ca -0.07 -2.75 -0.12 0.00 -1.51 0.00 0.00 54.79 50.34 1b0f n ASP 102 Cb 0.58 -1.57 -0.12 0.00 2.34 0.00 0.00 41.12 42.34 1b0f n ASP 102 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 1b0f s ILE 103 N 3.15 0.03 -0.02 5.18 2.07 -1.26 -3.36 121.20 126.99 1b0f s ILE 103 Ca 0.53 -0.21 -0.00 0.00 -1.41 0.00 0.00 60.65 59.55 1b0f s ILE 103 Cb 0.15 -0.20 0.02 0.00 0.13 0.00 0.00 42.46 42.56 1b0f s ILE 103 CO -0.06 -0.12 0.03 0.54 -1.91 0.00 0.00 174.94 173.42 1b0f s VAL 104 N -0.35 -0.03 -0.22 4.00 0.11 -0.53 -4.23 120.40 119.15 1b0f s VAL 104 Ca -0.04 0.12 -0.07 0.00 -2.93 0.00 0.00 61.98 59.06 1b0f s VAL 104 Cb -0.03 -0.07 -0.03 0.00 -1.53 0.00 0.00 36.38 34.72 1b0f s VAL 104 CO 0.00 0.05 0.06 -0.63 -3.33 0.00 0.00 175.10 171.26 1b0f s ILE 105 N 0.60 4.51 -0.25 7.04 1.01 -0.49 -1.80 121.20 131.82 1b0f s ILE 105 Ca -0.05 -0.12 -0.05 0.00 0.00 0.00 0.00 60.65 60.43 1b0f s ILE 105 Cb -0.07 -3.07 -0.00 0.00 0.01 0.00 0.00 42.46 39.32 1b0f s ILE 105 CO -0.02 0.39 0.00 -0.76 0.00 0.00 0.00 174.94 174.56 1b0f s LEU 106 N 1.06 3.26 -0.02 2.97 1.43 0.00 -1.15 118.68 126.23 1b0f s LEU 106 Ca 0.04 -0.50 -0.22 0.00 -1.03 0.00 0.00 54.13 52.42 1b0f s LEU 106 Cb -0.14 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 1b0f s LEU 106 CO 0.03 -0.08 0.65 -1.58 0.23 0.00 0.00 176.35 175.60 1b0f s GLN 107 N 1.49 4.39 0.61 1.70 0.74 0.20 -1.44 119.66 127.34 1b0f s GLN 107 Ca 0.04 0.83 -0.10 0.00 0.05 0.00 0.00 55.36 56.18 1b0f s GLN 107 Cb -0.15 -3.38 -0.03 0.00 1.10 0.00 0.00 33.01 30.54 1b0f s GLN 107 CO -0.01 0.26 1.00 -0.51 -0.55 0.00 0.00 175.29 175.48 1b0f s LEU 108 N 0.14 3.26 0.00 3.68 1.43 -0.36 0.83 118.68 127.66 1b0f s LEU 108 Ca 0.34 1.30 0.31 0.00 -1.03 0.00 0.00 54.13 55.05 1b0f s LEU 108 Cb -0.18 -4.30 1.74 0.00 0.03 0.00 0.00 46.19 43.47 1b0f s LEU 108 CO 0.18 -0.88 2.14 -0.46 0.23 0.00 0.00 176.35 177.56 1b0f n ASN 109 N -2.70 0.00 -0.43 2.29 6.94 -0.61 -4.67 115.26 116.09 1b0f n ASN 109 Ca 0.05 -0.68 0.00 0.00 -0.02 0.00 0.00 54.58 53.93 1b0f n ASN 109 Cb 0.55 -0.10 0.00 0.00 -2.36 0.00 0.00 39.78 37.86 1b0f n ASN 109 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1b0f n GLY 110 N 1.06 2.86 3.04 4.83 0.00 -1.26 -5.01 105.19 110.70 1b0f n GLY 110 Ca 0.20 -0.95 -0.22 0.00 0.00 0.00 0.00 46.02 45.04 1b0f n GLY 110 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b0f s SER 111 N 0.65 1.54 0.40 1.61 0.01 -1.26 -4.46 113.70 112.19 1b0f s SER 111 Ca 0.00 -0.25 -0.27 0.00 1.31 0.00 0.00 55.95 56.75 1b0f s SER 111 Cb 0.00 -0.47 -0.09 0.00 0.21 0.00 0.00 66.02 65.67 1b0f s SER 111 CO 0.00 0.08 1.40 0.00 0.41 0.00 0.00 173.24 175.13 1b0f s ALA 112 N 0.23 3.37 -0.50 1.44 0.00 0.96 -4.92 121.76 122.34 1b0f s ALA 112 Ca -0.05 1.41 -0.26 0.00 0.00 0.00 0.00 51.96 53.06 1b0f s ALA 112 Cb -0.11 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.49 1b0f s ALA 112 CO 0.01 -0.99 0.99 0.99 0.00 0.00 0.00 175.76 176.76 1b0f s THR 113 N -1.19 4.36 0.15 0.00 2.01 -1.26 -4.87 115.64 114.84 1b0f s THR 113 Ca 0.56 0.71 -0.31 0.00 0.31 0.00 0.00 61.69 62.96 1b0f s THR 113 Cb -0.43 -4.52 -0.10 0.00 0.01 0.00 0.00 72.50 67.47 1b0f s THR 113 CO 0.56 -0.99 1.56 -0.63 -0.69 0.00 0.00 174.62 174.43 1b0f s ILE 114 N 4.05 2.73 0.00 1.82 -1.09 -1.26 -4.77 121.20 122.68 1b0f s ILE 114 Ca 0.38 0.49 0.00 0.00 -2.23 0.00 0.00 60.65 59.29 1b0f s ILE 114 Cb -0.10 -3.32 0.00 0.00 -1.58 0.00 0.00 42.46 37.47 1b0f s ILE 114 CO 0.25 0.03 0.00 -0.46 -1.23 0.00 0.00 174.94 173.54 1b0f n ASN 115 N 4.18 0.00 0.18 3.58 0.23 -0.30 -4.97 115.26 118.15 1b0f n ASN 115 Ca 0.14 0.00 0.03 0.00 -0.53 0.00 0.00 54.58 54.22 1b0f n ASN 115 Cb 0.39 0.00 0.36 0.00 -2.08 0.00 0.00 39.78 38.45 1b0f n ASN 115 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1b0f h ALA 116 N 1.53 1.23 0.00 -2.53 0.00 -2.01 -3.22 119.26 114.27 1b0f h ALA 116 Ca 0.00 -0.36 -0.30 0.00 0.00 0.00 0.00 54.91 54.25 1b0f h ALA 116 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 1b0f h ALA 116 CO 0.00 0.49 -1.89 0.09 0.00 0.00 0.00 179.25 177.94 1b0f n ASN 117 N -3.89 0.61 -4.10 0.00 5.03 -1.26 -4.78 115.26 106.87 1b0f n ASN 117 Ca -0.01 0.29 -0.35 0.00 0.87 0.00 0.00 54.58 55.38 1b0f n ASN 117 Cb 0.45 0.27 -0.13 0.00 -1.02 0.00 0.00 39.78 39.36 1b0f n ASN 117 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1b0f s VAL 118 N -2.59 3.01 0.23 2.41 1.01 -1.21 -4.28 120.40 118.97 1b0f s VAL 118 Ca -0.06 -2.06 0.10 0.00 0.00 0.00 0.00 61.98 59.96 1b0f s VAL 118 Cb 0.07 -3.06 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 1b0f s VAL 118 CO 0.83 -0.61 -0.18 -1.10 0.00 0.00 0.00 175.10 174.04 1b0f s GLN 119 N 1.09 1.46 0.01 2.72 -0.21 -0.66 -1.15 119.66 122.93 1b0f s GLN 119 Ca 0.08 -1.63 -0.18 0.00 0.02 0.00 0.00 55.36 53.65 1b0f s GLN 119 Cb -0.22 -1.44 -0.06 0.00 1.00 0.00 0.00 33.01 32.30 1b0f s GLN 119 CO -0.05 0.26 0.50 0.08 -2.12 0.00 0.00 175.29 173.97 1b0f s VAL 120 N -2.60 4.92 0.55 1.09 1.01 -1.26 -3.05 120.40 121.06 1b0f s VAL 120 Ca 0.24 1.06 -0.10 0.00 0.00 0.00 0.00 61.98 63.18 1b0f s VAL 120 Cb -0.03 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 1b0f s VAL 120 CO 0.10 0.52 0.93 0.00 0.00 0.00 0.00 175.10 176.65 1b0f s ALA 121 N -0.76 3.20 0.01 5.51 0.00 -0.55 -4.91 121.76 124.26 1b0f s ALA 121 Ca 0.27 -0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.10 1b0f s ALA 121 Cb -0.18 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.00 1b0f s ALA 121 CO 0.16 -0.49 -0.15 -0.65 0.00 0.00 0.00 175.76 174.63 1b0f s GLN 122 N -4.82 2.29 0.25 0.00 -0.21 -1.26 -4.79 119.66 111.11 1b0f s GLN 122 Ca 0.53 -0.85 0.08 0.00 0.02 0.00 0.00 55.36 55.14 1b0f s GLN 122 Cb -0.11 -2.30 -0.04 0.00 1.00 0.00 0.00 33.01 31.57 1b0f s GLN 122 CO 0.47 0.58 0.12 -0.51 -2.12 0.00 0.00 175.29 173.83 1b0f s LEU 123 N -1.23 3.60 1.06 2.90 1.43 -1.26 -1.18 118.68 124.01 1b0f s LEU 123 Ca 0.14 -0.37 -0.17 0.00 -1.03 0.00 0.00 54.13 52.70 1b0f s LEU 123 Cb -0.11 -2.14 0.23 0.00 0.03 0.00 0.00 46.19 44.21 1b0f s LEU 123 CO 0.04 -0.02 1.23 -2.16 0.23 0.00 0.00 176.35 175.68 1b0f s PRO 124 N -3.72 -0.12 0.39 1.29 0.04 -1.26 -4.87 135.00 126.75 1b0f s PRO 124 Ca 0.32 -0.26 -0.19 0.00 0.04 0.00 0.00 61.00 60.91 1b0f s PRO 124 Cb -0.08 -1.74 -0.10 0.00 0.04 0.00 0.00 34.50 32.62 1b0f s PRO 124 CO 0.23 -2.94 0.87 0.00 0.04 0.00 0.00 177.00 175.20 1b0f s ALA 125 N -3.52 3.15 -0.28 8.56 0.00 -1.26 -4.86 121.76 123.54 1b0f s ALA 125 Ca 0.73 0.27 -0.41 0.00 0.00 0.00 0.00 51.96 52.55 1b0f s ALA 125 Cb -0.06 -3.01 -0.16 0.00 0.00 0.00 0.00 23.12 19.89 1b0f s ALA 125 CO 0.54 0.21 1.72 0.94 0.00 0.00 0.00 175.76 179.17 1b0f n GLN 126 N -0.52 1.05 -0.83 0.00 -0.06 -1.26 -1.15 117.38 114.62 1b0f n GLN 126 Ca 0.06 0.39 0.00 0.00 -2.00 0.00 0.00 57.00 55.44 1b0f n GLN 126 Cb 0.54 -2.05 0.00 0.00 -4.06 0.00 0.00 30.24 24.66 1b0f n GLN 126 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1b0f n GLY 127 N 4.12 0.56 3.56 1.69 0.00 -0.20 -4.99 105.19 109.93 1b0f n GLY 127 Ca 0.27 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 1b0f n GLY 127 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1b0f s ARG 128 N -0.48 3.14 0.00 1.61 3.52 -0.30 -4.96 118.95 121.48 1b0f s ARG 128 Ca 0.00 -0.48 -0.30 0.00 -0.13 0.00 0.00 55.73 54.82 1b0f s ARG 128 Cb 0.00 -4.85 -0.04 0.00 -1.56 0.00 0.00 34.95 28.49 1b0f s ARG 128 CO 0.00 -2.51 1.16 0.50 -0.81 0.00 0.00 175.30 173.65 1b0f s ARG 129 N 5.88 4.42 0.29 5.12 6.06 -1.26 -4.79 118.95 134.68 1b0f s ARG 129 Ca 0.51 1.67 -0.23 0.00 -2.50 0.00 0.00 55.73 55.19 1b0f s ARG 129 Cb -0.05 -3.45 -0.09 0.00 0.06 0.00 0.00 34.95 31.41 1b0f s ARG 129 CO 0.03 -0.31 0.85 -0.51 -2.50 0.00 0.00 175.30 172.86 1b0f s LEU 130 N 1.53 4.29 0.33 -0.88 1.43 -1.26 -5.05 118.68 119.07 1b0f s LEU 130 Ca 0.56 1.63 -0.06 0.00 -1.03 0.00 0.00 54.13 55.23 1b0f s LEU 130 Cb -0.26 -3.90 -0.05 0.00 0.03 0.00 0.00 46.19 42.01 1b0f s LEU 130 CO 0.26 -0.06 0.62 -0.83 0.23 0.00 0.00 176.35 176.57 1b0f s GLY 131 N -1.72 1.84 0.15 -3.19 0.00 -1.26 -5.02 107.32 98.12 1b0f s GLY 131 Ca 0.49 -0.48 -0.32 0.00 0.00 0.00 0.00 44.72 44.41 1b0f s GLY 131 CO 0.21 -0.35 1.77 -2.01 0.00 0.00 0.00 173.10 172.73 1b0f n ASN 132 N -1.13 3.90 0.00 1.64 5.15 -1.26 -2.07 115.26 121.48 1b0f n ASN 132 Ca -0.01 1.02 0.00 0.00 -0.60 0.00 0.00 54.58 54.99 1b0f n ASN 132 Cb 0.54 -1.53 0.00 0.00 -0.53 0.00 0.00 39.78 38.26 1b0f n ASN 132 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b0f n GLY 133 N 4.06 0.33 3.77 8.20 0.00 0.15 -4.98 105.19 116.72 1b0f n GLY 133 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1b0f n GLY 133 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b0f s VAL 134 N -2.11 2.25 -0.15 1.61 1.01 -0.88 -4.65 120.40 117.48 1b0f s VAL 134 Ca 0.00 0.24 -0.23 0.00 0.00 0.00 0.00 61.98 61.98 1b0f s VAL 134 Cb 0.00 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1b0f s VAL 134 CO 0.00 0.05 0.74 -1.10 0.00 0.00 0.00 175.10 174.79 1b0f s GLN 135 N -1.46 4.31 0.24 2.72 -1.52 -1.26 -1.35 119.66 121.35 1b0f s GLN 135 Ca 0.55 0.86 0.03 0.00 -1.95 0.00 0.00 55.36 54.85 1b0f s GLN 135 Cb -0.45 -3.54 -0.05 0.00 -0.22 0.00 0.00 33.01 28.75 1b0f s GLN 135 CO 0.55 -0.19 0.03 0.00 -0.25 0.00 0.00 175.29 175.43 1b0f s LEU 137 N -3.32 1.70 0.19 0.00 2.96 -0.46 -1.29 118.68 118.46 1b0f s LEU 137 Ca 0.32 -0.33 0.08 0.00 -0.22 0.00 0.00 54.13 53.97 1b0f s LEU 137 Cb 0.07 -0.90 -0.04 0.00 0.50 0.00 0.00 46.19 45.81 1b0f s LEU 137 CO 0.10 0.05 -0.01 0.00 -1.32 0.00 0.00 176.35 175.18 1b0f s ALA 138 N 0.62 3.18 0.18 5.97 0.00 -0.02 -1.73 121.76 129.95 1b0f s ALA 138 Ca -0.15 -1.41 -0.17 0.00 0.00 0.00 0.00 51.96 50.23 1b0f s ALA 138 Cb -0.16 -0.95 0.03 0.00 0.00 0.00 0.00 23.12 22.04 1b0f s ALA 138 CO 0.04 0.45 0.48 0.00 0.00 0.00 0.00 175.76 176.73 1b0f s MET 139 N -3.04 1.29 0.00 0.00 0.23 -1.25 -0.14 119.30 116.39 1b0f s MET 139 Ca 0.28 -0.85 0.00 0.00 -1.03 0.00 0.00 55.69 54.08 1b0f s MET 139 Cb -0.09 0.50 0.00 0.00 -1.53 0.00 0.00 34.83 33.71 1b0f s MET 139 CO 0.18 -0.54 0.00 0.41 -2.03 0.00 0.00 175.02 173.05 1b0f n GLY 140 N -0.31 1.26 1.21 3.16 0.00 -1.12 -4.51 105.19 104.88 1b0f n GLY 140 Ca -0.11 -1.11 -0.05 0.00 0.00 0.00 0.00 46.02 44.75 1b0f n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1b0f n TRP 141 N -0.88 1.19 -1.46 1.61 8.01 -1.26 -2.77 117.44 121.87 1b0f n TRP 141 Ca 0.00 -1.58 -0.16 0.00 -1.31 0.00 0.00 57.50 54.45 1b0f n TRP 141 Cb 0.00 -0.51 0.11 0.00 -2.01 0.00 0.00 31.31 28.90 1b0f n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1b0f n GLY 142 N -1.09 -1.40 3.54 6.99 0.00 -1.24 -3.23 105.19 108.75 1b0f n GLY 142 Ca 0.34 -1.68 -0.51 0.00 0.00 0.00 0.00 46.02 44.17 1b0f n GLY 142 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b0f n LEU 143 N 0.00 0.80 0.17 0.99 4.77 0.38 -2.46 117.00 121.66 1b0f n LEU 143 Ca 0.09 1.14 0.13 0.00 -0.03 0.00 0.00 56.01 57.34 1b0f n LEU 143 Cb 0.31 -1.12 0.30 0.00 -2.33 0.00 0.00 43.42 40.58 1b0f n LEU 143 CO 0.23 -1.68 0.85 -0.07 -1.33 0.00 0.00 177.39 175.39 1b0f h LEU 144 N 2.93 0.00 -7.02 2.23 3.38 0.50 -1.47 115.31 115.86 1b0f h LEU 144 Ca -0.42 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 1b0f h LEU 144 Cb 1.37 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.99 1b0f h LEU 144 CO 0.67 0.00 0.19 -0.83 0.09 0.00 0.00 178.44 178.56 1b0f s GLY 145 N -3.93 -0.60 0.44 0.83 0.00 -0.36 -4.40 107.32 99.31 1b0f s GLY 145 Ca 0.08 0.60 0.36 0.00 0.00 0.00 0.00 44.72 45.76 1b0f s GLY 145 CO 0.63 0.27 1.41 0.54 0.00 0.00 0.00 173.10 175.95 1b0f n ARG 147 N -0.16 -0.02 0.00 2.90 3.00 -1.26 -1.64 116.66 119.48 1b0f n ARG 147 Ca -0.17 1.08 0.00 0.00 -0.01 0.00 0.00 57.85 58.74 1b0f n ARG 147 Cb 0.64 -2.25 0.00 0.00 0.00 0.00 0.00 32.46 30.85 1b0f n ARG 147 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1b0f n ASN 148 N -4.22 3.77 -4.70 0.55 4.13 -1.26 -4.96 115.26 108.57 1b0f n ASN 148 Ca 0.38 0.00 -0.44 0.00 1.68 0.00 0.00 54.58 56.20 1b0f n ASN 148 Cb 1.58 0.15 -0.03 0.00 -1.54 0.00 0.00 39.78 39.93 1b0f n ASN 148 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1b0f n ARG 149 N -2.17 2.56 -0.66 3.52 5.12 -0.65 -4.94 116.66 119.43 1b0f n ARG 149 Ca 0.00 0.93 -0.25 0.00 -1.93 0.00 0.00 57.85 56.60 1b0f n ARG 149 Cb 0.43 -2.76 0.02 0.00 -1.16 0.00 0.00 32.46 29.00 1b0f n ARG 149 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1b0f n GLY 150 N 3.87 -2.74 3.77 -0.13 0.00 -1.26 -1.22 105.19 107.48 1b0f n GLY 150 Ca 0.17 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1b0f n GLY 150 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1b0f s ILE 151 N -1.33 2.51 0.72 -0.61 2.07 -1.26 -0.59 121.20 122.70 1b0f s ILE 151 Ca 0.26 0.50 -0.14 0.00 -1.41 0.00 0.00 60.65 59.86 1b0f s ILE 151 Cb -0.06 -3.32 0.03 0.00 0.13 0.00 0.00 42.46 39.25 1b0f s ILE 151 CO 0.51 0.12 1.16 0.00 -1.91 0.00 0.00 174.94 174.82 1b0f s ALA 152 N -1.05 2.21 -0.07 1.50 0.00 -1.03 -4.82 121.76 118.51 1b0f s ALA 152 Ca 0.51 0.69 0.05 0.00 0.00 0.00 0.00 51.96 53.21 1b0f s ALA 152 Cb -0.42 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.23 1b0f s ALA 152 CO 0.55 -1.70 0.00 0.43 0.00 0.00 0.00 175.76 175.04 1b0f n SER 153 N -2.76 3.41 -4.40 0.00 7.64 -1.26 -4.83 113.62 111.41 1b0f n SER 153 Ca 0.12 -0.01 -0.33 0.00 1.01 0.00 0.00 58.87 59.65 1b0f n SER 153 Cb 0.51 0.49 -0.14 0.00 -1.01 0.00 0.00 64.21 64.06 1b0f n SER 153 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1b0f s VAL 154 N -2.16 3.38 -0.15 0.44 1.01 -1.26 0.48 120.40 122.15 1b0f s VAL 154 Ca -0.05 -0.53 -0.41 0.00 0.00 0.00 0.00 61.98 60.99 1b0f s VAL 154 Cb 0.02 -2.46 -0.18 0.00 0.00 0.00 0.00 36.38 33.76 1b0f s VAL 154 CO 0.25 0.50 1.43 -0.11 0.00 0.00 0.00 175.10 177.16 1b0f n LEU 155 N 3.74 1.34 -4.89 3.92 7.94 -0.50 -4.82 117.00 123.73 1b0f n LEU 155 Ca -0.18 1.13 -0.21 0.00 -1.11 0.00 0.00 56.01 55.64 1b0f n LEU 155 Cb 0.52 -1.05 -0.03 0.00 0.53 0.00 0.00 43.42 43.39 1b0f n LEU 155 CO 0.31 -1.06 -0.09 -1.10 -1.11 0.00 0.00 177.39 174.35 1b0f s GLN 156 N 1.67 3.02 0.12 1.96 -1.52 -1.12 0.18 119.66 123.98 1b0f s GLN 156 Ca 0.94 -1.04 -0.01 0.00 -1.95 0.00 0.00 55.36 53.31 1b0f s GLN 156 Cb -1.17 -2.65 -0.04 0.00 -0.22 0.00 0.00 33.01 28.92 1b0f s GLN 156 CO 0.61 0.29 0.03 -1.83 -0.25 0.00 0.00 175.29 174.14 1b0f s GLU 157 N -3.95 0.88 -0.25 2.91 -1.05 0.18 -2.77 118.70 114.65 1b0f s GLU 157 Ca 0.37 -1.40 -0.14 0.00 -0.15 0.00 0.00 54.97 53.64 1b0f s GLU 157 Cb -0.08 0.16 0.07 0.00 -0.44 0.00 0.00 34.13 33.84 1b0f s GLU 157 CO 0.27 -0.21 0.61 -1.17 0.95 0.00 0.00 175.26 175.71 1b0f s LEU 158 N -3.04 -0.69 -0.20 1.83 2.96 0.80 -1.31 118.68 119.04 1b0f s LEU 158 Ca 0.20 1.34 -0.28 0.00 -0.22 0.00 0.00 54.13 55.16 1b0f s LEU 158 Cb 0.07 2.09 0.00 0.00 0.50 0.00 0.00 46.19 48.86 1b0f s LEU 158 CO -0.00 -0.23 0.99 0.20 -1.32 0.00 0.00 176.35 175.99 1b0f s ASN 159 N 1.51 7.10 0.16 3.68 -0.87 -1.26 -0.84 114.94 124.41 1b0f s ASN 159 Ca -0.09 1.37 0.05 0.00 -1.57 0.00 0.00 52.86 52.61 1b0f s ASN 159 Cb -0.06 -2.53 -0.04 0.00 -0.02 0.00 0.00 41.25 38.60 1b0f s ASN 159 CO -0.17 -0.58 -0.11 0.68 -2.57 0.00 0.00 177.10 174.35 1b0f s VAL 160 N 2.80 1.28 -0.08 1.60 -7.23 -0.41 -4.80 120.40 113.56 1b0f s VAL 160 Ca 0.44 -2.09 0.05 0.00 -1.81 0.00 0.00 61.98 58.57 1b0f s VAL 160 Cb -0.16 -1.88 -0.00 0.00 0.56 0.00 0.00 36.38 34.90 1b0f s VAL 160 CO 0.09 -0.71 -0.23 -0.89 -0.31 0.00 0.00 175.10 173.05 1b0f s THR 162 N -3.24 1.95 0.34 5.32 2.01 -0.72 -1.17 115.64 120.13 1b0f s THR 162 Ca 0.18 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 60.91 1b0f s THR 162 Cb 0.02 -1.67 -0.11 0.00 0.01 0.00 0.00 72.50 70.75 1b0f s THR 162 CO 0.02 0.54 1.42 -0.69 -0.69 0.00 0.00 174.62 175.22 1b0f s VAL 163 N 0.12 2.36 0.09 3.82 1.01 -0.46 -0.92 120.40 126.42 1b0f s VAL 163 Ca -0.11 0.35 0.01 0.00 0.00 0.00 0.00 61.98 62.24 1b0f s VAL 163 Cb -0.16 -3.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.96 1b0f s VAL 163 CO 0.06 0.08 -0.06 0.68 0.00 0.00 0.00 175.10 175.86 1b0f s VAL 164 N -0.95 0.62 0.00 2.92 -7.23 -0.34 0.29 120.40 115.72 1b0f s VAL 164 Ca 0.53 -1.81 0.00 0.00 -1.81 0.00 0.00 61.98 58.89 1b0f s VAL 164 Cb -0.44 -1.52 0.00 0.00 0.56 0.00 0.00 36.38 34.98 1b0f s VAL 164 CO 0.56 -0.82 0.00 0.35 -0.31 0.00 0.00 175.10 174.88 1b0f n THR 165 N 0.17 0.00 -2.92 5.32 -2.24 -1.26 -4.15 114.28 109.20 1b0f n THR 165 Ca -0.14 -0.23 -0.39 0.00 -2.27 0.00 0.00 64.05 61.02 1b0f n THR 165 Cb 0.60 0.73 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 1b0f n THR 165 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1b0f s SER 166 N -1.48 7.40 -0.99 3.42 0.01 -1.26 -3.59 113.70 117.21 1b0f s SER 166 Ca 0.00 1.71 -0.03 0.00 1.31 0.00 0.00 55.95 58.94 1b0f s SER 166 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1b0f s SER 166 CO 0.00 0.15 0.85 0.18 0.41 0.00 0.00 173.24 174.82 1b0f n LEU 167 N 1.34 -3.40 -3.63 2.44 4.32 -1.26 -4.91 117.00 111.90 1b0f n LEU 167 Ca -0.04 -0.46 -0.05 0.00 -0.02 0.00 0.00 56.01 55.44 1b0f n LEU 167 Cb 0.49 -2.53 -0.06 0.00 -1.62 0.00 0.00 43.42 39.69 1b0f n LEU 167 CO 0.46 0.39 0.39 0.00 -1.22 0.00 0.00 177.39 177.41 1b0f s ARG 177 N 1.84 2.81 0.28 0.00 0.52 -1.26 -4.89 118.95 118.24 1b0f s ARG 177 Ca -0.09 1.80 0.24 0.00 -0.52 0.00 0.00 55.73 57.16 1b0f s ARG 177 Cb -0.06 -1.91 1.00 0.00 0.52 0.00 0.00 34.95 34.50 1b0f s ARG 177 CO -0.19 -1.33 1.73 2.89 0.02 0.00 0.00 175.30 178.42 1b0f n ARG 178 N -1.84 0.21 -0.13 3.54 0.00 -1.26 -1.78 116.66 115.40 1b0f n ARG 178 Ca 0.13 0.43 0.04 0.00 -0.00 0.00 0.00 57.85 58.45 1b0f n ARG 178 Cb 0.50 -1.90 0.10 0.00 -0.00 0.00 0.00 32.46 31.17 1b0f n ARG 178 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 1b0f n SER 179 N -2.29 1.32 -4.08 2.89 3.41 -1.26 -4.80 113.62 108.80 1b0f n SER 179 Ca 0.02 -2.01 -0.08 0.00 -0.26 0.00 0.00 58.87 56.53 1b0f n SER 179 Cb 0.24 -0.18 -0.09 0.00 -0.26 0.00 0.00 64.21 63.92 1b0f n SER 179 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1b0f s ASN 180 N -0.96 0.34 -0.26 4.04 0.02 -0.74 -4.50 114.94 112.87 1b0f s ASN 180 Ca 0.16 -1.03 0.03 0.00 -1.02 0.00 0.00 52.86 50.99 1b0f s ASN 180 Cb 0.08 0.28 0.06 0.00 0.02 0.00 0.00 41.25 41.69 1b0f s ASN 180 CO 0.10 -0.69 -0.09 0.54 0.02 0.00 0.00 177.10 176.98 1b0f s VAL 181 N -3.97 2.09 0.05 1.60 0.11 -0.81 -4.76 120.40 114.72 1b0f s VAL 181 Ca 0.15 -1.64 -0.01 0.00 -2.93 0.00 0.00 61.98 57.55 1b0f s VAL 181 Cb 0.07 -2.24 -0.04 0.00 -1.53 0.00 0.00 36.38 32.63 1b0f s VAL 181 CO -0.04 -0.09 0.21 0.00 -3.33 0.00 0.00 175.10 171.85 1b0f s THR 183 N -1.48 1.69 -0.19 0.00 -4.23 -0.83 -1.20 115.64 109.40 1b0f s THR 183 Ca 0.34 -2.17 -0.13 0.00 -1.18 0.00 0.00 61.69 58.55 1b0f s THR 183 Cb -0.13 -2.27 0.06 0.00 1.34 0.00 0.00 72.50 71.50 1b0f s THR 183 CO 0.26 -0.43 0.47 -0.22 -0.54 0.00 0.00 174.62 174.16 1b0f s LEU 184 N -3.39 -0.13 -1.11 4.79 2.96 -0.09 -1.93 118.68 119.78 1b0f s LEU 184 Ca 0.27 1.00 -0.12 0.00 -0.22 0.00 0.00 54.13 55.06 1b0f s LEU 184 Cb 0.02 1.59 0.22 0.00 0.50 0.00 0.00 46.19 48.51 1b0f s LEU 184 CO 0.10 -0.19 1.21 -0.69 -1.32 0.00 0.00 176.35 175.46 1b0f s VAL 185 N 1.06 5.47 -0.34 1.68 1.01 -1.26 -1.75 120.40 126.27 1b0f s VAL 185 Ca -0.07 -2.86 -0.44 0.00 0.00 0.00 0.00 61.98 58.61 1b0f s VAL 185 Cb -0.06 -4.73 -0.20 0.00 0.00 0.00 0.00 36.38 31.39 1b0f s VAL 185 CO -0.09 -1.38 1.42 0.54 0.00 0.00 0.00 175.10 175.58 1b0f n ARG 186 N 4.34 0.00 -2.18 2.72 1.74 -1.26 -2.62 116.66 119.40 1b0f n ARG 186 Ca 0.28 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.26 1b0f n ARG 186 Cb 0.42 -1.49 -0.01 0.00 -1.02 0.00 0.00 32.46 30.37 1b0f n ARG 186 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1b0f n GLY 186 N 3.16 -0.03 3.51 -0.13 0.00 -1.26 -5.03 105.19 105.42 1b0f n GLY 186 Ca 0.27 -0.47 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 1b0f n GLY 186 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b0f s ARG 187 N -4.48 1.38 -1.01 1.61 0.52 -1.08 -5.08 118.95 110.81 1b0f s ARG 187 Ca 0.00 -0.90 -0.07 0.00 -0.52 0.00 0.00 55.73 54.24 1b0f s ARG 187 Cb 0.00 0.51 0.25 0.00 0.52 0.00 0.00 34.95 36.23 1b0f s ARG 187 CO 0.00 -0.58 0.96 -0.65 0.02 0.00 0.00 175.30 175.05 1b0f s GLN 188 N -3.89 3.81 0.08 3.54 -0.21 -1.26 -4.43 119.66 117.31 1b0f s GLN 188 Ca 0.10 -3.19 -0.10 0.00 0.02 0.00 0.00 55.36 52.20 1b0f s GLN 188 Cb -0.01 -4.32 0.00 0.00 1.00 0.00 0.00 33.01 29.68 1b0f s GLN 188 CO -0.02 -1.25 0.21 0.00 -2.12 0.00 0.00 175.29 172.11 1b0f s ALA 188 N -1.20 -0.32 0.00 6.09 0.00 -1.26 -4.62 121.76 120.46 1b0f s ALA 188 Ca 0.29 -0.48 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1b0f s ALA 188 Cb -0.09 0.45 0.00 0.00 0.00 0.00 0.00 23.12 23.47 1b0f s ALA 188 CO -0.10 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.59 1b0f n GLY 189 N 0.12 -2.44 3.80 0.00 0.00 0.48 -4.51 105.19 102.63 1b0f n GLY 189 Ca -0.16 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.17 1b0f n GLY 189 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b0f s VAL 190 N -2.11 3.75 0.27 1.61 -7.23 -1.26 0.36 120.40 115.80 1b0f s VAL 190 Ca 0.00 0.99 0.04 0.00 -1.81 0.00 0.00 61.98 61.21 1b0f s VAL 190 Cb 0.00 -3.41 -0.02 0.00 0.56 0.00 0.00 36.38 33.51 1b0f s VAL 190 CO 0.00 -0.33 0.16 0.00 -0.31 0.00 0.00 175.10 174.62 1b0f n PHE 192 N -0.57 2.24 0.00 0.00 3.72 -1.26 -2.09 117.46 119.50 1b0f n PHE 192 Ca 0.01 0.22 0.00 0.00 -0.05 0.00 0.00 57.45 57.63 1b0f n PHE 192 Cb 0.45 -2.56 0.00 0.00 -0.94 0.00 0.00 39.48 36.43 1b0f n PHE 192 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b0f n GLY 193 N 3.65 0.65 0.11 1.37 0.00 -1.26 -0.47 105.19 109.24 1b0f n GLY 193 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 1b0f n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1b0f n ASP 194 N 0.00 1.06 -4.69 1.61 8.00 -0.89 -3.68 116.55 117.96 1b0f n ASP 194 Ca 0.00 -0.90 -0.44 0.00 0.71 0.00 0.00 54.79 54.16 1b0f n ASP 194 Cb 0.00 0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 41.73 1b0f n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1b0f n SER 195 N -1.17 3.14 0.00 -2.24 7.64 -1.26 -0.37 113.62 119.37 1b0f n SER 195 Ca 0.06 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.08 1b0f n SER 195 Cb 0.36 -1.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.08 1b0f n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1b0f n GLY 196 N 2.28 2.95 3.70 0.23 0.00 0.95 -0.31 105.19 115.00 1b0f n GLY 196 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1b0f n GLY 196 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1b0f n SER 197 N 0.13 2.04 -4.83 1.61 7.64 0.50 -3.73 113.62 116.98 1b0f n SER 197 Ca 0.00 0.92 -0.30 0.00 1.01 0.00 0.00 58.87 60.50 1b0f n SER 197 Cb 0.00 -1.51 0.07 0.00 -1.01 0.00 0.00 64.21 61.76 1b0f n SER 197 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1b0f s PRO 198 N -2.85 2.44 -0.26 1.43 0.04 -1.26 -0.08 135.00 134.46 1b0f s PRO 198 Ca 0.73 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.39 1b0f s PRO 198 Cb -0.42 -1.96 0.07 0.00 0.04 0.00 0.00 34.50 32.23 1b0f s PRO 198 CO 0.48 -1.36 0.01 -1.17 0.04 0.00 0.00 177.00 174.99 1b0f s LEU 199 N -5.61 2.64 -0.39 -3.56 2.96 -0.39 -3.97 118.68 110.36 1b0f s LEU 199 Ca 0.60 -1.38 -0.15 0.00 -0.22 0.00 0.00 54.13 52.98 1b0f s LEU 199 Cb -0.13 -1.10 0.01 0.00 0.50 0.00 0.00 46.19 45.46 1b0f s LEU 199 CO 0.53 -0.30 0.34 0.54 -1.32 0.00 0.00 176.35 176.14 1b0f s VAL 200 N 1.43 5.20 -0.15 1.68 0.11 -0.71 0.12 120.40 128.08 1b0f s VAL 200 Ca 0.01 -0.36 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 1b0f s VAL 200 Cb -0.18 -3.90 0.00 0.00 -1.53 0.00 0.00 36.38 30.77 1b0f s VAL 200 CO -0.11 -0.25 -0.17 0.00 -3.33 0.00 0.00 175.10 171.24 1b0f n ASN 204 N 4.12 -5.63 -1.05 0.00 3.02 -1.26 -1.64 115.26 112.82 1b0f n ASN 204 Ca -0.19 -0.53 -0.14 0.00 -0.03 0.00 0.00 54.58 53.69 1b0f n ASN 204 Cb 0.51 -4.49 -0.06 0.00 -0.61 0.00 0.00 39.78 35.13 1b0f n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1b0f n GLY 205 N -1.71 1.40 3.07 7.41 0.00 -1.26 -4.99 105.19 109.10 1b0f n GLY 205 Ca -0.01 -0.39 -0.20 0.00 0.00 0.00 0.00 46.02 45.41 1b0f n GLY 205 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b0f s LEU 208 N -3.09 2.04 -0.65 0.99 1.43 -0.65 -4.65 118.68 114.10 1b0f s LEU 208 Ca 0.00 -0.23 -0.27 0.00 -1.03 0.00 0.00 54.13 52.60 1b0f s LEU 208 Cb 0.00 -0.59 0.00 0.00 0.03 0.00 0.00 46.19 45.63 1b0f s LEU 208 CO 0.00 0.13 1.61 -0.63 0.23 0.00 0.00 176.35 177.69 1b0f s ILE 209 N -0.33 3.53 -2.05 -0.59 1.09 -0.32 -1.13 121.20 121.39 1b0f s ILE 209 Ca 0.04 0.33 0.23 0.00 -1.10 0.00 0.00 60.65 60.15 1b0f s ILE 209 Cb -0.05 -4.33 -0.01 0.00 -1.06 0.00 0.00 42.46 37.02 1b0f s ILE 209 CO -0.00 -1.26 1.10 1.41 -0.10 0.00 0.00 174.94 176.09 1b0f n HIS 210 N 11.20 0.00 -3.70 3.97 8.25 0.12 -4.28 115.22 130.77 1b0f n HIS 210 Ca 0.14 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.48 1b0f n HIS 210 Cb 0.51 -0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.55 1b0f n HIS 210 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1b0f s GLY 211 N -2.47 -0.19 -0.24 -1.41 0.00 -1.12 -3.33 107.32 98.55 1b0f s GLY 211 Ca 0.19 0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.93 1b0f s GLY 211 CO 0.57 -0.22 -0.01 -0.42 0.00 0.00 0.00 173.10 173.02 1b0f s ILE 212 N -3.01 1.31 -0.29 0.90 1.01 -0.84 -1.26 121.20 119.02 1b0f s ILE 212 Ca -0.02 -1.20 -0.43 0.00 0.00 0.00 0.00 60.65 59.00 1b0f s ILE 212 Cb 0.01 -1.70 -0.19 0.00 0.01 0.00 0.00 42.46 40.58 1b0f s ILE 212 CO -0.06 -0.23 1.49 0.00 0.00 0.00 0.00 174.94 176.13 1b0f n ALA 213 N 4.73 -1.62 -0.04 9.38 0.00 0.89 -0.80 120.51 133.05 1b0f n ALA 213 Ca -0.09 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1b0f n ALA 213 Cb 0.44 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.93 1b0f n ALA 213 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b0f n SER 214 N 3.58 0.00 -3.83 0.00 2.88 -0.86 -0.03 113.62 115.36 1b0f n SER 214 Ca 0.27 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.69 1b0f n SER 214 Cb 0.03 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.40 1b0f n SER 214 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 1b0f s PHE 215 N -0.96 -0.01 0.30 0.66 -0.71 -1.12 -4.87 117.98 111.27 1b0f s PHE 215 Ca 0.00 -0.11 0.10 0.00 -1.04 0.00 0.00 56.93 55.88 1b0f s PHE 215 Cb 0.00 -0.00 -0.05 0.00 -1.21 0.00 0.00 43.02 41.76 1b0f s PHE 215 CO 0.00 -0.39 -0.04 0.14 -1.34 0.00 0.00 175.22 173.59 1b0f s VAL 216 N -2.00 2.85 0.00 -2.49 -7.23 -1.26 -1.22 120.40 109.05 1b0f s VAL 216 Ca -0.09 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.05 1b0f s VAL 216 Cb -0.04 -2.70 -0.01 0.00 0.56 0.00 0.00 36.38 34.20 1b0f s VAL 216 CO -0.01 -0.30 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.82 1b0f s ARG 217 N -3.66 0.54 -0.32 4.82 3.52 -1.26 -4.68 118.95 117.92 1b0f s ARG 217 Ca 0.33 -0.29 0.00 0.00 -0.13 0.00 0.00 55.73 55.64 1b0f s ARG 217 Cb -0.03 -0.51 0.00 0.00 -1.56 0.00 0.00 34.95 32.85 1b0f s ARG 217 CO 0.19 0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.22 1b0f n GLY 218 N 2.77 0.62 0.00 8.12 0.00 -1.26 -4.44 105.19 111.00 1b0f n GLY 218 Ca -0.14 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.10 1b0f n GLY 218 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b0f n GLY 219 N -2.53 -1.52 3.76 -0.02 0.00 -1.26 -4.36 105.19 99.26 1b0f n GLY 219 Ca -0.03 -1.56 -0.39 0.00 0.00 0.00 0.00 46.02 44.03 1b0f n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0f n ALA 221 N -0.35 -1.38 0.10 0.00 0.00 -1.26 -4.80 120.51 112.81 1b0f n ALA 221 Ca 0.06 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.77 1b0f n ALA 221 Cb 0.43 -4.03 0.65 0.00 0.00 0.00 0.00 19.45 16.50 1b0f n ALA 221 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1b0f h SER 222 N -2.00 0.04 0.00 0.00 4.64 -1.75 -3.39 113.55 111.08 1b0f h SER 222 Ca -0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.73 1b0f h SER 222 Cb 1.38 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1b0f h SER 222 CO 0.67 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 177.26 1b0f n GLY 222 N -1.59 2.25 0.03 -0.77 0.00 -1.26 -4.77 105.19 99.07 1b0f n GLY 222 Ca 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.03 1b0f n GLY 222 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b0f n LEU 223 N 0.00 1.88 -4.65 0.99 4.32 -1.26 -4.87 117.00 113.41 1b0f n LEU 223 Ca 0.00 -0.02 -0.34 0.00 -0.02 0.00 0.00 56.01 55.63 1b0f n LEU 223 Cb 0.00 -0.08 -0.10 0.00 -1.62 0.00 0.00 43.42 41.62 1b0f n LEU 223 CO 0.00 0.42 -0.34 -0.31 -1.22 0.00 0.00 177.39 175.94 1b0f s TYR 224 N -2.11 3.06 0.51 -1.77 2.02 -1.26 -5.11 117.35 112.69 1b0f s TYR 224 Ca -0.06 0.10 -0.20 0.00 -0.37 0.00 0.00 57.07 56.55 1b0f s TYR 224 Cb 0.02 -1.72 -0.07 0.00 -0.40 0.00 0.00 41.96 39.78 1b0f s TYR 224 CO 0.15 0.43 1.07 -2.14 -1.57 0.00 0.00 175.55 173.48 1b0f s PRO 225 N -1.08 3.63 0.30 -1.71 0.02 -1.26 -4.72 135.00 130.18 1b0f s PRO 225 Ca 0.15 1.41 -0.09 0.00 0.02 0.00 0.00 61.00 62.49 1b0f s PRO 225 Cb -0.11 -2.06 -0.07 0.00 0.02 0.00 0.00 34.50 32.28 1b0f s PRO 225 CO 0.04 -0.59 0.63 -0.51 -0.33 0.00 0.00 177.00 176.24 1b0f s ASP 226 N -2.01 6.56 -0.08 2.53 1.01 -0.81 -4.34 116.67 119.53 1b0f s ASP 226 Ca 0.68 0.95 0.02 0.00 0.71 0.00 0.00 52.55 54.91 1b0f s ASP 226 Cb -0.18 -2.24 -0.02 0.00 1.01 0.00 0.00 42.92 41.48 1b0f s ASP 226 CO 0.24 -0.21 -0.12 0.00 0.21 0.00 0.00 175.17 175.29 1b0f s ALA 227 N -2.05 2.71 0.22 5.23 0.00 -0.36 -1.97 121.76 125.53 1b0f s ALA 227 Ca 0.48 -0.93 0.10 0.00 0.00 0.00 0.00 51.96 51.61 1b0f s ALA 227 Cb -0.11 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.86 1b0f s ALA 227 CO 0.26 0.44 -0.09 -0.06 0.00 0.00 0.00 175.76 176.31 1b0f s PHE 228 N -0.33 2.59 0.08 0.00 0.40 0.67 -2.02 117.98 119.36 1b0f s PHE 228 Ca 0.03 -0.24 -0.30 0.00 -0.60 0.00 0.00 56.93 55.82 1b0f s PHE 228 Cb -0.13 -1.22 -0.05 0.00 0.51 0.00 0.00 43.02 42.14 1b0f s PHE 228 CO 0.02 0.57 0.98 0.00 0.70 0.00 0.00 175.22 177.49 1b0f s ALA 229 N -1.96 3.22 -0.90 5.36 0.00 0.02 -1.92 121.76 125.58 1b0f s ALA 229 Ca 0.27 0.58 -0.25 0.00 0.00 0.00 0.00 51.96 52.56 1b0f s ALA 229 Cb -0.08 -3.30 0.03 0.00 0.00 0.00 0.00 23.12 19.77 1b0f s ALA 229 CO 0.16 -0.11 1.49 -1.25 0.00 0.00 0.00 175.76 176.05 1b0f s PRO 230 N 0.33 3.30 0.27 0.00 0.04 -1.26 -1.99 135.00 135.68 1b0f s PRO 230 Ca 0.49 -0.67 -0.01 0.00 0.04 0.00 0.00 61.00 60.86 1b0f s PRO 230 Cb -0.23 -4.93 0.59 0.00 0.04 0.00 0.00 34.50 29.97 1b0f s PRO 230 CO 0.29 -2.36 1.70 0.28 0.04 0.00 0.00 177.00 176.95 1b0f h VAL 231 N 6.64 0.51 -0.93 -0.36 2.07 -1.83 -1.41 116.25 120.94 1b0f h VAL 231 Ca 0.02 -0.12 0.19 0.00 0.82 0.00 0.00 66.70 67.61 1b0f h VAL 231 Cb 1.03 0.12 -0.11 0.00 -1.52 0.00 0.00 31.29 30.81 1b0f h VAL 231 CO 1.35 0.07 0.51 0.00 0.02 0.00 0.00 177.57 179.51 1b0f h ALA 232 N 1.65 1.52 0.00 1.67 0.00 -1.82 0.25 119.26 122.52 1b0f h ALA 232 Ca 0.49 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.50 1b0f h ALA 232 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1b0f h ALA 232 CO -0.51 -0.15 0.00 1.04 0.00 0.00 0.00 179.25 179.63 1b0f n GLN 233 N -4.87 0.13 -0.00 0.00 6.02 -0.53 -1.04 117.38 117.09 1b0f n GLN 233 Ca 0.22 0.19 0.00 0.00 -0.01 0.00 0.00 57.00 57.40 1b0f n GLN 233 Cb 0.57 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.33 1b0f n GLN 233 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1b0f n PHE 234 N -1.36 0.00 -0.34 1.08 3.72 0.83 -4.82 117.46 116.57 1b0f n PHE 234 Ca 0.06 -0.48 0.05 0.00 -0.05 0.00 0.00 57.45 57.03 1b0f n PHE 234 Cb 0.13 -0.05 0.21 0.00 -0.94 0.00 0.00 39.48 38.84 1b0f n PHE 234 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1b0f h VAL 235 N 0.20 0.93 0.02 -4.37 2.07 -1.36 -0.83 116.25 112.90 1b0f h VAL 235 Ca 0.00 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1b0f h VAL 235 Cb 0.55 -0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1b0f h VAL 235 CO 0.00 0.17 -0.01 0.78 0.02 0.00 0.00 177.57 178.53 1b0f h ASN 236 N 0.94 -0.02 -0.14 0.57 -0.26 -1.87 -1.03 115.58 113.77 1b0f h ASN 236 Ca 0.46 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 56.18 1b0f h ASN 236 Cb 0.43 0.01 -0.01 0.00 -1.06 0.00 0.00 38.32 37.68 1b0f h ASN 236 CO -0.25 0.01 0.09 -0.25 -1.06 0.00 0.00 177.43 175.97 1b0f h TRP 237 N -0.05 0.18 -0.91 1.19 7.01 -1.84 -1.72 115.95 119.82 1b0f h TRP 237 Ca -0.00 0.00 0.11 0.00 2.11 0.00 0.00 58.89 61.11 1b0f h TRP 237 Cb 0.04 -0.06 -0.08 0.00 -2.10 0.00 0.00 29.16 26.96 1b0f h TRP 237 CO -0.07 0.13 0.55 0.82 -2.79 0.00 0.00 178.44 177.08 1b0f h ILE 238 N 0.18 0.90 -0.23 2.65 2.04 -0.88 -2.45 117.51 119.73 1b0f h ILE 238 Ca 0.05 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.54 1b0f h ILE 238 Cb -0.00 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.02 1b0f h ILE 238 CO -0.01 0.16 -0.14 0.44 0.00 0.00 0.00 178.15 178.60 1b0f h ASP 239 N 0.88 0.52 -0.35 1.72 3.32 -0.88 -1.30 116.42 120.33 1b0f h ASP 239 Ca 0.45 -0.43 0.10 0.00 0.02 0.00 0.00 57.03 57.17 1b0f h ASP 239 Cb 0.44 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1b0f h ASP 239 CO -0.26 0.84 0.33 0.77 -1.72 0.00 0.00 179.24 179.19 1b0f h SER 240 N 0.21 0.00 0.00 6.45 4.64 -0.83 0.87 113.55 124.89 1b0f h SER 240 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1b0f h SER 240 Cb 0.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1b0f h SER 240 CO 0.04 0.00 -0.14 0.40 -0.87 0.00 0.00 176.83 176.26 1b0f h ILE 241 N 0.00 0.00 0.00 0.95 2.04 -1.34 -3.34 117.51 115.82 1b0f h ILE 241 Ca 0.17 -0.68 0.00 0.00 1.00 0.00 0.00 64.86 65.35 1b0f h ILE 241 Cb 0.82 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1b0f h ILE 241 CO -0.00 0.00 0.00 2.30 0.00 0.00 0.00 178.15 180.45 1b0f n ILE 242 N -3.87 0.00 -0.54 -0.67 -5.35 -0.51 -5.14 119.36 103.28 1b0f n ILE 242 Ca -0.02 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.46 1b0f n ILE 242 Cb 0.07 -0.66 0.00 0.00 -1.74 0.00 0.00 39.64 37.31 1b0f n ILE 242 CO 0.00 0.00 0.00 1.67 -1.76 0.00 0.00 176.55 176.46