#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bdi s ILE 17 N 0.00 4.96 -1.21 1.39 -1.09 0.18 -4.09 121.20 121.34 2bdi s ILE 17 Ca 0.00 0.04 -0.03 0.00 -2.23 0.00 0.00 60.65 58.43 2bdi s ILE 17 Cb 0.00 -3.30 0.00 0.00 -1.58 0.00 0.00 42.46 37.58 2bdi s ILE 17 CO 0.00 0.36 1.03 0.59 -1.23 0.00 0.00 174.94 175.68 2bdi n ASN 18 N 4.39 -3.66 -0.08 3.58 5.03 -1.26 -2.18 115.26 121.08 2bdi n ASN 18 Ca -0.15 -0.56 0.00 0.00 0.87 0.00 0.00 54.58 54.73 2bdi n ASN 18 Cb 0.52 -4.90 0.00 0.00 -1.02 0.00 0.00 39.78 34.38 2bdi n ASN 18 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2bdi n GLY 19 N -1.45 7.71 3.32 7.41 0.00 -1.26 -4.81 105.19 116.11 2bdi n GLY 19 Ca -0.17 -2.03 -0.10 0.00 0.00 0.00 0.00 46.02 43.72 2bdi n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bdi s GLU 20 N 0.89 1.22 0.32 1.61 2.02 -0.75 -4.91 118.70 119.09 2bdi s GLU 20 Ca 0.00 -1.39 -0.29 0.00 0.02 0.00 0.00 54.97 53.31 2bdi s GLU 20 Cb 0.00 0.34 -0.12 0.00 0.10 0.00 0.00 34.13 34.45 2bdi s GLU 20 CO 0.00 -0.43 1.37 -0.25 0.02 0.00 0.00 175.26 175.97 2bdi n ASP 21 N -0.25 3.01 -4.85 -0.19 9.92 -1.26 -0.49 116.55 122.44 2bdi n ASP 21 Ca -0.03 1.19 -0.32 0.00 -0.53 0.00 0.00 54.79 55.11 2bdi n ASP 21 Cb 0.64 -1.50 -0.05 0.00 -0.64 0.00 0.00 41.12 39.57 2bdi n ASP 21 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2bdi s SER 23 N -2.76 6.19 -0.44 0.00 0.15 -1.26 -4.78 113.70 110.80 2bdi s SER 23 Ca 0.56 2.28 -0.41 0.00 0.70 0.00 0.00 55.95 59.09 2bdi s SER 23 Cb -0.10 -2.53 -0.17 0.00 -1.71 0.00 0.00 66.02 61.51 2bdi s SER 23 CO 0.25 -1.32 1.48 -2.65 1.20 0.00 0.00 173.24 172.21 2bdi n PRO 24 N 7.85 0.00 -1.60 5.44 -0.02 -1.26 0.11 135.00 145.51 2bdi n PRO 24 Ca 0.22 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.59 2bdi n PRO 24 Cb 0.43 -1.31 -0.03 0.00 -0.02 0.00 0.00 33.50 32.56 2bdi n PRO 24 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 2bdi n HIS 25 N 4.04 -0.17 0.75 6.00 8.25 -1.26 -4.89 115.22 127.93 2bdi n HIS 25 Ca 0.31 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.89 2bdi n HIS 25 Cb -0.05 -2.23 0.49 0.00 1.12 0.00 0.00 29.99 29.32 2bdi n HIS 25 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2bdi n SER 26 N 0.12 0.30 -3.27 0.41 3.41 0.29 -3.97 113.62 110.91 2bdi n SER 26 Ca -0.12 0.54 -0.25 0.00 -0.26 0.00 0.00 58.87 58.78 2bdi n SER 26 Cb 0.44 -0.61 -0.07 0.00 -0.26 0.00 0.00 64.21 63.70 2bdi n SER 26 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdi n GLN 27 N -1.79 1.51 0.03 4.33 1.13 -1.26 -4.97 117.38 116.36 2bdi n GLN 27 Ca 0.05 -3.84 0.02 0.00 -1.94 0.00 0.00 57.00 51.29 2bdi n GLN 27 Cb 0.32 -1.67 0.10 0.00 0.11 0.00 0.00 30.24 29.10 2bdi n GLN 27 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 2bdi n PRO 28 N 1.07 0.02 0.00 -1.09 -0.04 -1.25 -1.57 135.00 132.15 2bdi n PRO 28 Ca 0.25 0.50 0.12 0.00 -0.04 0.00 0.00 63.50 64.34 2bdi n PRO 28 Cb 0.49 -1.61 0.31 0.00 -0.04 0.00 0.00 33.50 32.65 2bdi n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2bdi n TRP 29 N -1.61 0.00 -2.03 0.54 2.14 -1.06 -2.42 117.44 112.99 2bdi n TRP 29 Ca -0.00 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.15 2bdi n TRP 29 Cb 0.03 -0.18 -0.03 0.00 -0.81 0.00 0.00 31.31 30.32 2bdi n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2bdi s GLN 30 N -2.76 4.25 -0.12 -2.67 2.00 -0.61 -1.33 119.66 118.42 2bdi s GLN 30 Ca 0.17 2.23 0.02 0.00 -2.00 0.00 0.00 55.36 55.78 2bdi s GLN 30 Cb 0.18 -3.35 -0.01 0.00 0.80 0.00 0.00 33.01 30.64 2bdi s GLN 30 CO 0.61 -0.59 -0.18 0.00 -0.50 0.00 0.00 175.29 174.64 2bdi s ALA 31 N 1.68 2.43 -0.10 1.58 0.00 0.15 -4.35 121.76 123.15 2bdi s ALA 31 Ca 0.69 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 51.61 2bdi s ALA 31 Cb -0.39 -1.06 -0.05 0.00 0.00 0.00 0.00 23.12 21.62 2bdi s ALA 31 CO 0.31 0.23 0.22 0.00 0.00 0.00 0.00 175.76 176.52 2bdi s ALA 32 N 0.40 3.79 -0.29 0.00 0.00 -0.44 0.00 121.76 125.22 2bdi s ALA 32 Ca -0.13 -0.53 -0.03 0.00 0.00 0.00 0.00 51.96 51.27 2bdi s ALA 32 Cb -0.17 -2.13 0.04 0.00 0.00 0.00 0.00 23.12 20.86 2bdi s ALA 32 CO 0.06 0.50 0.01 -0.51 0.00 0.00 0.00 175.76 175.82 2bdi s LEU 33 N -0.78 3.78 0.07 0.00 1.02 -0.29 -1.03 118.68 121.45 2bdi s LEU 33 Ca 0.17 -1.08 0.07 0.00 0.02 0.00 0.00 54.13 53.30 2bdi s LEU 33 Cb -0.13 -1.75 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 2bdi s LEU 33 CO 0.06 -0.23 -0.13 0.68 0.02 0.00 0.00 176.35 176.75 2bdi s VAL 34 N 1.33 3.16 0.00 -1.59 -7.23 -1.14 -1.33 120.40 113.59 2bdi s VAL 34 Ca -0.02 -1.18 0.00 0.00 -1.81 0.00 0.00 61.98 58.96 2bdi s VAL 34 Cb -0.19 -2.41 0.00 0.00 0.56 0.00 0.00 36.38 34.34 2bdi s VAL 34 CO -0.01 0.23 0.00 0.23 -0.31 0.00 0.00 175.10 175.24 2bdi n MET 35 N 1.14 3.86 -0.23 4.82 2.81 0.93 -3.80 117.12 126.65 2bdi n MET 35 Ca -0.15 0.00 -0.05 0.00 -1.81 0.00 0.00 57.70 55.69 2bdi n MET 35 Cb 0.52 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 33.00 2bdi n MET 35 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 2bdi n GLU 36 N 0.00 -0.22 -0.48 0.03 4.71 -1.26 -3.56 120.64 119.86 2bdi n GLU 36 Ca 0.00 0.84 0.00 0.00 -0.01 0.00 0.00 57.16 57.99 2bdi n GLU 36 Cb 0.00 -1.24 0.00 0.00 -1.01 0.00 0.00 31.44 29.19 2bdi n GLU 36 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2bdi n ASN 37 N -4.72 0.00 -4.14 1.62 4.13 -1.26 -5.13 115.26 105.76 2bdi n ASN 37 Ca 0.02 -1.13 -0.10 0.00 1.68 0.00 0.00 54.58 55.05 2bdi n ASN 37 Cb 0.16 -0.03 -0.10 0.00 -1.54 0.00 0.00 39.78 38.27 2bdi n ASN 37 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 2bdi s GLU 38 N 0.00 0.75 0.10 3.52 2.12 -1.23 -5.13 118.70 118.84 2bdi s GLU 38 Ca 0.00 -1.26 -0.26 0.00 0.36 0.00 0.00 54.97 53.81 2bdi s GLU 38 Cb 0.00 -0.11 -0.07 0.00 0.26 0.00 0.00 34.13 34.21 2bdi s GLU 38 CO 0.00 -0.03 0.80 -1.17 -0.54 0.00 0.00 175.26 174.31 2bdi s LEU 40 N -2.89 4.51 0.00 2.70 1.98 -1.26 -0.05 118.68 123.67 2bdi s LEU 40 Ca 0.09 1.58 0.00 0.00 -2.89 0.00 0.00 54.13 52.90 2bdi s LEU 40 Cb 0.05 -3.31 0.00 0.00 0.66 0.00 0.00 46.19 43.59 2bdi s LEU 40 CO -0.06 0.08 0.00 2.22 -1.89 0.00 0.00 176.35 176.71 2bdi n PHE 41 N 2.33 0.00 -3.82 5.38 -1.74 -0.44 -4.94 117.46 114.22 2bdi n PHE 41 Ca -0.03 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.78 2bdi n PHE 41 Cb 0.49 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.51 2bdi n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2bdi s SER 43 N -3.06 1.28 0.32 0.00 0.01 -0.73 -1.14 113.70 110.38 2bdi s SER 43 Ca 0.15 -1.48 -0.11 0.00 1.31 0.00 0.00 55.95 55.81 2bdi s SER 43 Cb -0.05 0.31 0.02 0.00 0.21 0.00 0.00 66.02 66.51 2bdi s SER 43 CO 0.10 -0.83 0.60 -0.83 0.41 0.00 0.00 173.24 172.69 2bdi s GLY 44 N -3.33 0.71 -0.07 3.44 0.00 0.10 -4.10 107.32 104.07 2bdi s GLY 44 Ca 0.37 -0.97 0.02 0.00 0.00 0.00 0.00 44.72 44.14 2bdi s GLY 44 CO 0.16 -0.58 -0.12 0.14 0.00 0.00 0.00 173.10 172.70 2bdi s VAL 45 N -3.19 1.11 -0.56 1.40 1.01 0.28 -0.67 120.40 119.78 2bdi s VAL 45 Ca 0.21 -0.45 -0.27 0.00 0.00 0.00 0.00 61.98 61.47 2bdi s VAL 45 Cb -0.03 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.31 2bdi s VAL 45 CO 0.13 0.35 1.69 -0.22 0.00 0.00 0.00 175.10 177.05 2bdi s LEU 46 N 0.79 3.34 0.00 3.92 2.96 -0.44 0.51 118.68 129.75 2bdi s LEU 46 Ca -0.12 0.42 0.20 0.00 -0.22 0.00 0.00 54.13 54.41 2bdi s LEU 46 Cb -0.15 -2.83 0.35 0.00 0.50 0.00 0.00 46.19 44.06 2bdi s LEU 46 CO 0.02 -2.05 1.30 1.33 -1.32 0.00 0.00 176.35 175.63 2bdi n VAL 47 N 7.09 0.47 -3.57 1.68 0.24 -0.93 -1.55 118.33 121.76 2bdi n VAL 47 Ca 0.17 -0.74 -0.06 0.00 -2.04 0.00 0.00 64.34 61.68 2bdi n VAL 47 Cb 0.50 0.99 -0.03 0.00 -1.47 0.00 0.00 33.84 33.84 2bdi n VAL 47 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 2bdi s HIS 48 N -1.38 -0.22 0.37 6.34 5.65 -1.19 -4.72 115.29 120.15 2bdi s HIS 48 Ca 0.33 0.19 0.10 0.00 0.25 0.00 0.00 55.06 55.93 2bdi s HIS 48 Cb 0.20 0.51 0.87 0.00 -1.18 0.00 0.00 32.58 32.98 2bdi s HIS 48 CO 0.27 -0.31 1.88 -1.35 -0.65 0.00 0.00 174.74 174.58 2bdi h PRO 49 N 2.07 0.61 -0.14 2.88 0.11 -1.92 -2.77 132.00 132.84 2bdi h PRO 49 Ca -0.14 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.91 2bdi h PRO 49 Cb 1.19 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2bdi h PRO 49 CO 0.26 0.40 -0.07 0.94 -0.21 0.00 0.00 178.00 179.33 2bdi n GLN 50 N -4.54 1.96 -3.74 1.05 7.27 -1.26 -1.77 117.38 116.35 2bdi n GLN 50 Ca 0.17 -2.85 -0.15 0.00 0.07 0.00 0.00 57.00 54.24 2bdi n GLN 50 Cb 0.49 -1.68 -0.15 0.00 2.41 0.00 0.00 30.24 31.30 2bdi n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2bdi s TRP 51 N -2.96 -0.07 -0.19 3.69 0.52 -1.05 -1.04 118.94 117.84 2bdi s TRP 51 Ca 0.38 0.34 -0.03 0.00 0.02 0.00 0.00 56.10 56.81 2bdi s TRP 51 Cb 0.33 -0.19 -0.01 0.00 -1.15 0.00 0.00 33.47 32.45 2bdi s TRP 51 CO 0.03 -0.15 -0.07 0.08 0.02 0.00 0.00 176.95 176.87 2bdi s VAL 52 N 1.31 3.29 0.16 4.03 1.01 0.39 -2.20 120.40 128.39 2bdi s VAL 52 Ca -0.07 -0.54 -0.19 0.00 0.00 0.00 0.00 61.98 61.18 2bdi s VAL 52 Cb -0.12 -2.46 -0.08 0.00 0.00 0.00 0.00 36.38 33.72 2bdi s VAL 52 CO -0.05 0.46 0.66 -0.22 0.00 0.00 0.00 175.10 175.95 2bdi s LEU 53 N 1.09 4.43 0.00 3.92 2.96 0.18 -0.07 118.68 131.20 2bdi s LEU 53 Ca 0.01 1.35 -0.10 0.00 -0.22 0.00 0.00 54.13 55.16 2bdi s LEU 53 Cb -0.15 -3.30 0.04 0.00 0.50 0.00 0.00 46.19 43.28 2bdi s LEU 53 CO -0.01 0.14 0.56 -0.24 -1.32 0.00 0.00 176.35 175.48 2bdi n SER 54 N 1.13 -1.63 -4.72 3.68 2.88 0.57 0.10 113.62 115.63 2bdi n SER 54 Ca -0.05 -2.14 -0.40 0.00 -1.33 0.00 0.00 58.87 54.95 2bdi n SER 54 Cb 0.51 2.72 -0.04 0.00 -0.75 0.00 0.00 64.21 66.64 2bdi n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2bdi s ALA 55 N -1.78 3.32 0.47 -1.46 0.00 -1.26 0.68 121.76 121.73 2bdi s ALA 55 Ca 0.11 0.21 0.27 0.00 0.00 0.00 0.00 51.96 52.56 2bdi s ALA 55 Cb -0.03 -3.01 1.33 0.00 0.00 0.00 0.00 23.12 21.41 2bdi s ALA 55 CO 0.09 -0.09 1.80 0.00 0.00 0.00 0.00 175.76 177.56 2bdi h ALA 56 N 6.60 2.66 0.00 0.00 0.00 -1.62 0.28 119.26 127.18 2bdi h ALA 56 Ca -0.41 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2bdi h ALA 56 Cb 1.20 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2bdi h ALA 56 CO 0.75 -1.02 0.00 -2.39 0.00 0.00 0.00 179.25 176.59 2bdi n HIS 57 N -4.40 0.00 -0.05 0.00 1.44 -1.26 -2.35 115.22 108.60 2bdi n HIS 57 Ca 0.24 -0.17 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 2bdi n HIS 57 Cb 1.03 -0.14 0.00 0.00 0.12 0.00 0.00 29.99 30.99 2bdi n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2bdi n PHE 59 N -0.18 0.67 -4.17 0.00 7.35 -0.99 -5.02 117.46 115.11 2bdi n PHE 59 Ca 0.00 0.81 -0.14 0.00 -0.76 0.00 0.00 57.45 57.35 2bdi n PHE 59 Cb 0.01 -2.15 -0.08 0.00 0.35 0.00 0.00 39.48 37.61 2bdi n PHE 59 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2bdi s GLN 60 N -1.04 1.57 0.06 -4.13 -1.52 -1.26 -5.05 119.66 108.29 2bdi s GLN 60 Ca 0.65 -1.73 0.11 0.00 -1.95 0.00 0.00 55.36 52.44 2bdi s GLN 60 Cb -0.84 0.35 -0.19 0.00 -0.22 0.00 0.00 33.01 32.11 2bdi s GLN 60 CO 0.57 -0.59 1.00 -0.91 -0.25 0.00 0.00 175.29 175.11 2bdi h ASN 61 N 2.31 0.00 -3.88 5.90 2.35 -1.95 -3.46 115.58 116.86 2bdi h ASN 61 Ca -0.30 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.33 2bdi h ASN 61 Cb 1.24 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 39.37 2bdi h ASN 61 CO 0.43 0.93 -0.26 -0.94 -1.65 0.00 0.00 177.43 175.94 2bdi s SER 62 N -6.36 -0.40 0.24 5.81 1.04 -1.26 -4.60 113.70 108.17 2bdi s SER 62 Ca -0.01 0.78 0.11 0.00 0.48 0.00 0.00 55.95 57.31 2bdi s SER 62 Cb 0.09 0.79 -0.05 0.00 0.10 0.00 0.00 66.02 66.95 2bdi s SER 62 CO 0.82 -0.14 -0.15 -0.31 0.98 0.00 0.00 173.24 174.44 2bdi s TYR 63 N 0.20 2.43 -0.60 5.02 1.51 0.00 -5.01 117.35 120.91 2bdi s TYR 63 Ca -0.00 -0.30 0.04 0.00 -1.01 0.00 0.00 57.07 55.80 2bdi s TYR 63 Cb -0.03 -1.11 0.15 0.00 -0.11 0.00 0.00 41.96 40.86 2bdi s TYR 63 CO 0.01 0.62 0.37 0.99 -1.11 0.00 0.00 175.55 176.43 2bdi s THR 64 N -2.17 2.58 0.04 -0.71 2.01 -1.25 -2.37 115.64 113.77 2bdi s THR 64 Ca 0.27 -3.70 -0.30 0.00 0.31 0.00 0.00 61.69 58.27 2bdi s THR 64 Cb -0.06 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.66 2bdi s THR 64 CO 0.15 -0.92 1.01 -0.63 -0.69 0.00 0.00 174.62 173.54 2bdi s ILE 65 N -0.78 4.63 -0.26 1.82 1.01 -1.03 -2.90 121.20 123.68 2bdi s ILE 65 Ca 0.21 1.97 -0.06 0.00 0.00 0.00 0.00 60.65 62.77 2bdi s ILE 65 Cb -0.15 -4.26 -0.00 0.00 0.01 0.00 0.00 42.46 38.06 2bdi s ILE 65 CO -0.08 0.20 0.04 -0.83 0.00 0.00 0.00 174.94 174.26 2bdi s GLY 66 N 0.72 1.72 0.22 6.18 0.00 -0.20 -1.37 107.32 114.59 2bdi s GLY 66 Ca 0.51 -1.31 0.06 0.00 0.00 0.00 0.00 44.72 43.99 2bdi s GLY 66 CO 0.29 0.56 0.17 1.08 0.00 0.00 0.00 173.10 175.19 2bdi s LEU 67 N 1.51 3.79 -1.57 0.66 1.43 -0.65 -1.33 118.68 122.52 2bdi s LEU 67 Ca 0.04 -0.21 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 2bdi s LEU 67 Cb -0.16 -2.36 0.00 0.00 0.03 0.00 0.00 46.19 43.70 2bdi s LEU 67 CO 0.01 0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.20 2bdi n GLY 69 N -0.82 1.50 3.94 -3.19 0.00 -1.26 -1.46 105.19 103.90 2bdi n GLY 69 Ca -0.08 -0.22 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 2bdi n GLY 69 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bdi s LEU 70 N -3.37 2.87 0.00 0.99 1.43 -1.26 -4.09 118.68 115.25 2bdi s LEU 70 Ca 0.00 0.25 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 2bdi s LEU 70 Cb 0.00 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.43 2bdi s LEU 70 CO 0.00 -1.75 0.00 1.57 0.23 0.00 0.00 176.35 176.40 2bdi n HIS 71 N -2.96 -0.24 -4.29 0.29 -0.00 -1.26 -4.65 115.22 102.11 2bdi n HIS 71 Ca 0.10 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.56 2bdi n HIS 71 Cb 0.60 0.13 -0.09 0.00 -0.00 0.00 0.00 29.99 30.63 2bdi n HIS 71 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 2bdi s SER 72 N -2.64 4.32 0.55 0.26 1.04 -1.26 -1.33 113.70 114.64 2bdi s SER 72 Ca 0.00 -0.58 0.33 0.00 0.48 0.00 0.00 55.95 56.18 2bdi s SER 72 Cb 0.00 -0.75 1.52 0.00 0.10 0.00 0.00 66.02 66.89 2bdi s SER 72 CO 0.00 0.09 2.05 -0.07 0.98 0.00 0.00 173.24 176.29 2bdi h LEU 73 N 2.74 0.00 -7.89 2.42 3.38 -1.95 -3.38 115.31 110.63 2bdi h LEU 73 Ca -0.46 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.27 2bdi h LEU 73 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2bdi h LEU 73 CO 0.55 0.05 0.75 -0.62 0.09 0.00 0.00 178.44 179.27 2bdi n GLU 74 N -3.22 0.96 -0.32 1.13 -0.58 -1.26 -4.81 120.64 112.55 2bdi n GLU 74 Ca -0.01 -2.09 0.19 0.00 -0.42 0.00 0.00 57.16 54.83 2bdi n GLU 74 Cb 0.27 -3.72 0.38 0.00 -0.57 0.00 0.00 31.44 27.80 2bdi n GLU 74 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2bdi h ALA 74 N 10.36 1.60 -0.15 0.62 0.00 -1.95 -1.87 119.26 127.86 2bdi h ALA 74 Ca 0.15 0.22 -0.23 0.00 0.00 0.00 0.00 54.91 55.05 2bdi h ALA 74 Cb 0.94 0.27 -0.09 0.00 0.00 0.00 0.00 17.79 18.91 2bdi h ALA 74 CO 1.22 -0.55 -0.08 -0.40 0.00 0.00 0.00 179.25 179.44 2bdi n ASP 75 N -5.18 5.63 0.00 0.00 5.75 -1.26 -2.12 116.55 119.37 2bdi n ASP 75 Ca 0.27 -2.67 0.00 0.00 -0.01 0.00 0.00 54.79 52.37 2bdi n ASP 75 Cb 0.85 -1.30 0.00 0.00 -1.03 0.00 0.00 41.12 39.64 2bdi n ASP 75 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bdi n GLN 76 N 1.79 0.00 -4.01 0.11 6.02 -0.70 -5.05 117.38 115.54 2bdi n GLN 76 Ca 0.35 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 57.04 2bdi n GLN 76 Cb 0.74 -0.15 -0.16 0.00 1.02 0.00 0.00 30.24 31.69 2bdi n GLN 76 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2bdi s GLU 77 N 0.00 2.13 0.00 -1.09 0.41 -0.90 -5.03 118.70 114.22 2bdi s GLU 77 Ca 0.00 -0.77 0.00 0.00 -0.41 0.00 0.00 54.97 53.79 2bdi s GLU 77 Cb 0.00 -2.34 0.00 0.00 -1.78 0.00 0.00 34.13 30.01 2bdi s GLU 77 CO 0.00 -0.37 0.00 -2.30 -0.49 0.00 0.00 175.26 172.10 2bdi n PRO 78 N 4.70 0.00 0.00 0.39 -0.02 -1.26 -2.89 135.00 135.92 2bdi n PRO 78 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 2bdi n PRO 78 Cb 0.47 -0.25 0.00 0.00 -0.02 0.00 0.00 33.50 33.71 2bdi n PRO 78 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bdi n GLY 79 N 0.00 0.00 3.75 -1.23 0.00 -1.26 -4.75 105.19 101.70 2bdi n GLY 79 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 2bdi n GLY 79 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bdi s SER 80 N -1.63 5.47 -0.14 1.61 1.04 -1.14 -4.73 113.70 114.19 2bdi s SER 80 Ca 0.00 2.61 -0.04 0.00 0.48 0.00 0.00 55.95 59.00 2bdi s SER 80 Cb 0.00 -2.62 0.05 0.00 0.10 0.00 0.00 66.02 63.55 2bdi s SER 80 CO 0.00 -1.42 0.10 -1.10 0.98 0.00 0.00 173.24 171.80 2bdi s GLN 81 N -2.90 0.03 -1.25 4.02 -0.21 -0.54 -4.99 119.66 113.82 2bdi s GLN 81 Ca 0.70 0.10 -0.14 0.00 0.02 0.00 0.00 55.36 56.05 2bdi s GLN 81 Cb -0.36 -1.35 0.15 0.00 1.00 0.00 0.00 33.01 32.44 2bdi s GLN 81 CO 0.43 -0.56 1.61 -1.33 -2.12 0.00 0.00 175.29 173.31 2bdi n MET 82 N 5.29 3.36 -1.44 2.91 2.81 -1.26 -1.64 117.12 127.16 2bdi n MET 82 Ca -0.06 -3.64 -0.30 0.00 -1.81 0.00 0.00 57.70 51.90 2bdi n MET 82 Cb 0.49 -3.11 0.21 0.00 -0.71 0.00 0.00 33.22 30.11 2bdi n MET 82 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 2bdi s VAL 83 N 1.88 1.78 0.09 2.03 -7.23 -0.47 -4.88 120.40 113.59 2bdi s VAL 83 Ca 0.44 0.00 0.04 0.00 -1.81 0.00 0.00 61.98 60.66 2bdi s VAL 83 Cb 0.01 -2.70 -0.03 0.00 0.56 0.00 0.00 36.38 34.22 2bdi s VAL 83 CO 0.01 0.00 -0.12 -1.61 -0.31 0.00 0.00 175.10 173.08 2bdi s GLU 84 N -5.59 0.85 0.17 4.82 2.02 -1.26 -2.47 118.70 117.23 2bdi s GLU 84 Ca 0.72 -1.10 -0.20 0.00 0.02 0.00 0.00 54.97 54.41 2bdi s GLU 84 Cb -0.08 -0.66 0.05 0.00 0.10 0.00 0.00 34.13 33.55 2bdi s GLU 84 CO 0.55 0.12 0.55 0.00 0.02 0.00 0.00 175.26 176.50 2bdi s ALA 85 N -2.03 -1.28 0.00 5.21 0.00 -1.00 -0.94 121.76 121.72 2bdi s ALA 85 Ca 0.03 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.14 2bdi s ALA 85 Cb -0.05 0.84 0.00 0.00 0.00 0.00 0.00 23.12 23.90 2bdi s ALA 85 CO 0.01 -0.77 0.00 -1.13 0.00 0.00 0.00 175.76 173.87 2bdi n SER 86 N -0.34 0.00 -4.58 0.00 3.41 -1.26 -0.82 113.62 110.03 2bdi n SER 86 Ca -0.14 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.04 2bdi n SER 86 Cb 0.64 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.55 2bdi n SER 86 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2bdi s LEU 87 N 0.00 3.97 0.02 1.04 0.20 -1.26 -4.68 118.68 117.97 2bdi s LEU 87 Ca 0.00 0.32 0.09 0.00 0.69 0.00 0.00 54.13 55.22 2bdi s LEU 87 Cb 0.00 -3.25 -0.03 0.00 -0.43 0.00 0.00 46.19 42.49 2bdi s LEU 87 CO 0.00 -1.00 -0.25 -0.94 -0.29 0.00 0.00 176.35 173.87 2bdi s SER 88 N 2.14 3.21 -0.28 3.68 1.04 -1.26 -0.59 113.70 121.63 2bdi s SER 88 Ca 0.38 -0.53 0.02 0.00 0.48 0.00 0.00 55.95 56.31 2bdi s SER 88 Cb -0.10 -0.35 0.08 0.00 0.10 0.00 0.00 66.02 65.74 2bdi s SER 88 CO 0.24 0.28 -0.01 -0.69 0.98 0.00 0.00 173.24 174.04 2bdi s VAL 89 N -0.75 1.82 0.55 5.02 1.01 0.10 -4.99 120.40 123.16 2bdi s VAL 89 Ca 0.11 -1.68 -0.17 0.00 0.00 0.00 0.00 61.98 60.25 2bdi s VAL 89 Cb -0.10 -2.16 -0.06 0.00 0.00 0.00 0.00 36.38 34.06 2bdi s VAL 89 CO 0.01 -0.31 1.02 -0.13 0.00 0.00 0.00 175.10 175.69 2bdi s ARG 90 N 1.21 3.64 0.28 2.72 0.52 -1.26 -1.55 118.95 124.50 2bdi s ARG 90 Ca 0.01 1.11 -0.29 0.00 -0.52 0.00 0.00 55.73 56.04 2bdi s ARG 90 Cb -0.19 -2.08 -0.10 0.00 0.52 0.00 0.00 34.95 33.10 2bdi s ARG 90 CO -0.09 -0.54 1.34 -1.58 0.02 0.00 0.00 175.30 174.45 2bdi s HIS 91 N -2.48 3.11 0.26 -0.53 5.65 -0.82 -4.90 115.29 115.57 2bdi s HIS 91 Ca 0.62 1.28 -0.11 0.00 0.25 0.00 0.00 55.06 57.09 2bdi s HIS 91 Cb -0.13 -3.69 0.37 0.00 -1.18 0.00 0.00 32.58 27.95 2bdi s HIS 91 CO 0.33 -2.04 1.53 -2.30 -0.65 0.00 0.00 174.74 171.60 2bdi n PRO 92 N 1.64 -0.14 -0.29 2.88 -0.02 -1.26 -0.99 135.00 136.82 2bdi n PRO 92 Ca 0.03 1.52 0.04 0.00 -2.02 0.00 0.00 63.50 63.07 2bdi n PRO 92 Cb 0.42 -2.27 0.16 0.00 -0.02 0.00 0.00 33.50 31.79 2bdi n PRO 92 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2bdi n GLU 93 N -5.54 2.28 -1.64 -0.52 -0.58 -1.26 -4.97 120.64 108.41 2bdi n GLU 93 Ca 0.14 -1.24 -0.39 0.00 -0.42 0.00 0.00 57.16 55.24 2bdi n GLU 93 Cb 0.45 -1.60 0.03 0.00 -0.57 0.00 0.00 31.44 29.76 2bdi n GLU 93 CO 0.00 0.00 0.00 0.98 -0.48 0.00 0.00 177.13 177.63 2bdi n TYR 94 N 0.32 1.33 -1.26 -0.32 9.36 -0.16 -1.67 117.16 124.75 2bdi n TYR 94 Ca 0.11 0.48 -0.10 0.00 3.32 0.00 0.00 57.90 61.71 2bdi n TYR 94 Cb 0.50 -2.23 -0.04 0.00 -0.63 0.00 0.00 39.34 36.93 2bdi n TYR 94 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 2bdi n ASN 95 N -0.24 -5.37 -3.66 2.98 2.85 0.56 -4.92 115.26 107.45 2bdi n ASN 95 Ca 0.11 0.25 -0.30 0.00 -0.11 0.00 0.00 54.58 54.53 2bdi n ASN 95 Cb 0.43 -3.96 -0.15 0.00 1.24 0.00 0.00 39.78 37.34 2bdi n ASN 95 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2bdi s ARG 96 N -2.79 0.56 1.06 1.20 1.81 -0.67 -2.61 118.95 117.52 2bdi s ARG 96 Ca 0.00 -0.94 -0.15 0.00 -1.72 0.00 0.00 55.73 52.92 2bdi s ARG 96 Cb 0.00 -1.72 0.22 0.00 -0.45 0.00 0.00 34.95 33.00 2bdi s ARG 96 CO 0.00 -1.01 1.10 -2.14 -0.68 0.00 0.00 175.30 172.57 2bdi s PRO 97 N 1.71 -0.11 -0.04 3.54 0.02 -1.26 -4.87 135.00 133.99 2bdi s PRO 97 Ca 0.10 0.29 -0.38 0.00 0.02 0.00 0.00 61.00 61.03 2bdi s PRO 97 Cb -0.17 -1.69 -0.17 0.00 0.02 0.00 0.00 34.50 32.48 2bdi s PRO 97 CO -0.27 -3.04 1.43 -0.11 -0.33 0.00 0.00 177.00 174.68 2bdi n LEU 98 N -4.35 1.69 0.00 -5.54 7.94 -1.07 -0.89 117.00 114.77 2bdi n LEU 98 Ca 0.08 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.09 2bdi n LEU 98 Cb 0.58 -1.14 0.00 0.00 0.53 0.00 0.00 43.42 43.39 2bdi n LEU 98 CO 0.54 -0.95 0.00 0.18 -1.11 0.00 0.00 177.39 176.05 2bdi n LEU 99 N 3.25 0.00 -4.80 -1.96 4.77 -1.26 -4.96 117.00 112.05 2bdi n LEU 99 Ca 0.21 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.90 2bdi n LEU 99 Cb 0.16 -0.11 0.12 0.00 -2.33 0.00 0.00 43.42 41.26 2bdi n LEU 99 CO 0.68 0.00 0.72 0.00 -1.33 0.00 0.00 177.39 177.46 2bdi s ALA 100 N -2.11 1.93 -1.53 -1.18 0.00 -0.07 -4.14 121.76 114.65 2bdi s ALA 100 Ca 0.00 -0.48 -0.07 0.00 0.00 0.00 0.00 51.96 51.42 2bdi s ALA 100 Cb 0.00 -3.04 0.06 0.00 0.00 0.00 0.00 23.12 20.14 2bdi s ALA 100 CO 0.00 -2.13 0.49 0.09 0.00 0.00 0.00 175.76 174.20 2bdi n ASN 101 N -3.67 -1.16 -2.26 0.00 4.13 -1.26 -0.32 115.26 110.72 2bdi n ASN 101 Ca 0.07 -1.05 -0.13 0.00 1.68 0.00 0.00 54.58 55.15 2bdi n ASN 101 Cb 0.59 -2.75 -0.12 0.00 -1.54 0.00 0.00 39.78 35.96 2bdi n ASN 101 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 2bdi n ASP 102 N -2.86 4.67 -4.32 6.41 -0.08 -1.26 -4.23 116.55 114.88 2bdi n ASP 102 Ca -0.18 -2.32 -0.24 0.00 -1.51 0.00 0.00 54.79 50.55 2bdi n ASP 102 Cb 0.62 -1.18 -0.12 0.00 2.34 0.00 0.00 41.12 42.78 2bdi n ASP 102 CO 0.00 0.00 0.00 -1.48 0.12 0.00 0.00 177.20 175.84 2bdi s LEU 103 N 0.02 2.37 -0.15 -2.67 2.34 -1.26 -2.53 118.68 116.80 2bdi s LEU 103 Ca 0.55 -0.78 -0.10 0.00 0.06 0.00 0.00 54.13 53.86 2bdi s LEU 103 Cb 0.24 -0.90 0.05 0.00 -0.56 0.00 0.00 46.19 45.02 2bdi s LEU 103 CO -0.01 0.03 0.38 -0.32 -1.06 0.00 0.00 176.35 175.37 2bdi s MET 104 N -2.35 0.38 -0.18 1.48 1.75 0.21 -1.95 119.30 118.66 2bdi s MET 104 Ca 0.12 0.67 -0.14 0.00 -1.25 0.00 0.00 55.69 55.09 2bdi s MET 104 Cb -0.08 0.04 -0.05 0.00 2.84 0.00 0.00 34.83 37.59 2bdi s MET 104 CO 0.06 -0.12 0.29 -0.51 -0.65 0.00 0.00 175.02 174.08 2bdi s LEU 105 N 0.98 4.22 -0.21 4.11 1.43 -0.59 -0.31 118.68 128.30 2bdi s LEU 105 Ca -0.06 0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 53.44 2bdi s LEU 105 Cb -0.07 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.78 2bdi s LEU 105 CO -0.08 0.08 0.02 -0.63 0.23 0.00 0.00 176.35 175.97 2bdi s ILE 106 N 0.62 4.08 -0.24 -0.59 1.01 0.90 0.02 121.20 127.01 2bdi s ILE 106 Ca 0.16 -0.26 -0.16 0.00 0.00 0.00 0.00 60.65 60.38 2bdi s ILE 106 Cb -0.13 -2.87 -0.03 0.00 0.01 0.00 0.00 42.46 39.44 2bdi s ILE 106 CO 0.04 0.40 0.44 -0.75 0.00 0.00 0.00 174.94 175.07 2bdi s LYS 107 N 1.16 4.09 0.41 2.79 2.20 0.24 -0.46 119.74 130.17 2bdi s LYS 107 Ca 0.03 0.21 -0.24 0.00 -0.36 0.00 0.00 55.97 55.61 2bdi s LYS 107 Cb -0.14 -3.61 -0.09 0.00 -1.51 0.00 0.00 37.83 32.47 2bdi s LYS 107 CO 0.02 -0.22 1.05 -0.51 -0.36 0.00 0.00 175.35 175.33 2bdi s LEU 108 N 1.90 4.12 0.06 5.43 1.43 -0.21 -3.99 118.68 127.41 2bdi s LEU 108 Ca 0.19 2.04 -0.29 0.00 -1.03 0.00 0.00 54.13 55.04 2bdi s LEU 108 Cb -0.15 -4.21 -0.15 0.00 0.03 0.00 0.00 46.19 41.71 2bdi s LEU 108 CO 0.09 -0.52 1.44 0.44 0.23 0.00 0.00 176.35 178.04 2bdi h ASP 109 N 2.43 -1.00 -3.47 2.29 3.45 -1.38 -3.39 116.42 115.34 2bdi h ASP 109 Ca -0.48 0.06 -0.65 0.00 0.43 0.00 0.00 57.03 56.39 2bdi h ASP 109 Cb 1.22 0.30 -0.24 0.00 -0.56 0.00 0.00 39.33 40.04 2bdi h ASP 109 CO 0.62 -0.60 -0.67 -0.70 -1.57 0.00 0.00 179.24 176.32 2bdi s GLU 110 N -5.30 3.55 0.26 3.56 2.12 -1.26 -5.08 118.70 116.54 2bdi s GLU 110 Ca -0.15 -0.54 -0.30 0.00 0.36 0.00 0.00 54.97 54.34 2bdi s GLU 110 Cb 0.02 -3.11 -0.14 0.00 0.26 0.00 0.00 34.13 31.16 2bdi s GLU 110 CO 0.47 -0.09 1.11 0.45 -0.54 0.00 0.00 175.26 176.67 2bdi n SER 111 N 4.54 1.56 -4.95 -1.70 2.88 -1.26 -4.96 113.62 109.73 2bdi n SER 111 Ca -0.17 1.17 -0.23 0.00 -1.33 0.00 0.00 58.87 58.31 2bdi n SER 111 Cb 0.51 -1.30 -0.01 0.00 -0.75 0.00 0.00 64.21 62.67 2bdi n SER 111 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 2bdi s VAL 112 N -0.72 4.79 -0.31 2.46 -7.23 -0.73 -4.97 120.40 113.70 2bdi s VAL 112 Ca 0.63 -0.62 -0.10 0.00 -1.81 0.00 0.00 61.98 60.09 2bdi s VAL 112 Cb -0.73 -3.73 -0.00 0.00 0.56 0.00 0.00 36.38 32.47 2bdi s VAL 112 CO 0.57 -0.43 0.15 -0.44 -0.31 0.00 0.00 175.10 174.64 2bdi s SER 113 N -4.08 5.54 -0.75 4.85 0.01 -1.26 -4.81 113.70 113.20 2bdi s SER 113 Ca 0.41 -0.56 -0.28 0.00 1.31 0.00 0.00 55.95 56.83 2bdi s SER 113 Cb -0.10 -2.00 -0.15 0.00 0.21 0.00 0.00 66.02 63.99 2bdi s SER 113 CO 0.35 -0.21 2.56 -0.62 0.41 0.00 0.00 173.24 175.73 2bdi n GLU 114 N 4.98 0.51 -0.20 12.44 1.02 -1.26 -4.90 120.64 133.22 2bdi n GLU 114 Ca -0.14 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 2bdi n GLU 114 Cb 0.49 -2.47 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 2bdi n GLU 114 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2bdi n SER 115 N 13.23 0.00 -0.05 1.62 3.41 -0.52 -4.92 113.62 126.39 2bdi n SER 115 Ca 0.52 -0.34 -0.16 0.00 -0.26 0.00 0.00 58.87 58.62 2bdi n SER 115 Cb 0.29 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 2bdi n SER 115 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2bdi h ASP 116 N 0.00 0.96 -0.50 4.04 -0.00 -1.95 -3.20 116.42 115.76 2bdi h ASP 116 Ca 0.00 -0.59 0.00 0.00 -0.00 0.00 0.00 57.03 56.44 2bdi h ASP 116 Cb 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 39.33 39.05 2bdi h ASP 116 CO 0.00 1.38 0.00 0.35 -0.00 0.00 0.00 179.24 180.97 2bdi n THR 117 N -3.98 0.92 -3.57 2.25 -2.24 -1.26 -4.81 114.28 101.59 2bdi n THR 117 Ca -0.06 -0.96 -0.29 0.00 -2.27 0.00 0.00 64.05 60.47 2bdi n THR 117 Cb 0.70 0.57 -0.14 0.00 -2.10 0.00 0.00 70.33 69.36 2bdi n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2bdi s ILE 118 N -1.04 0.32 0.13 2.28 1.01 -1.21 -3.98 121.20 118.71 2bdi s ILE 118 Ca 0.35 -1.37 0.06 0.00 0.00 0.00 0.00 60.65 59.69 2bdi s ILE 118 Cb 0.19 -1.25 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 2bdi s ILE 118 CO 0.25 -0.82 -0.15 -0.60 0.00 0.00 0.00 174.94 173.61 2bdi s ARG 119 N 1.49 1.08 0.41 2.79 3.52 -1.02 -1.44 118.95 125.79 2bdi s ARG 119 Ca 0.13 -1.27 -0.02 0.00 -0.13 0.00 0.00 55.73 54.44 2bdi s ARG 119 Cb -0.19 -1.01 -0.03 0.00 -1.56 0.00 0.00 34.95 32.15 2bdi s ARG 119 CO -0.18 0.20 0.66 -1.54 -0.81 0.00 0.00 175.30 173.63 2bdi s SER 120 N -2.47 6.24 0.19 -2.12 1.04 -1.26 -2.58 113.70 112.74 2bdi s SER 120 Ca 0.10 0.65 0.09 0.00 0.48 0.00 0.00 55.95 57.27 2bdi s SER 120 Cb -0.05 -2.09 -0.04 0.00 0.10 0.00 0.00 66.02 63.94 2bdi s SER 120 CO 0.04 -0.45 -0.19 -0.51 0.98 0.00 0.00 173.24 173.11 2bdi s ILE 121 N -2.52 1.95 0.13 -1.02 2.07 -0.60 -4.91 121.20 116.29 2bdi s ILE 121 Ca 0.44 -2.03 0.01 0.00 -1.41 0.00 0.00 60.65 57.65 2bdi s ILE 121 Cb -0.10 -1.96 -0.04 0.00 0.13 0.00 0.00 42.46 40.49 2bdi s ILE 121 CO 0.40 -0.35 0.28 -0.94 -1.91 0.00 0.00 174.94 172.43 2bdi s SER 122 N -2.87 6.36 -0.07 4.50 1.04 -1.26 -4.48 113.70 116.91 2bdi s SER 122 Ca 0.19 0.26 -0.21 0.00 0.48 0.00 0.00 55.95 56.67 2bdi s SER 122 Cb -0.05 -1.95 -0.04 0.00 0.10 0.00 0.00 66.02 64.08 2bdi s SER 122 CO 0.08 0.08 0.59 -0.63 0.98 0.00 0.00 173.24 174.33 2bdi s ILE 123 N -1.68 5.08 0.31 -1.02 1.01 -1.26 -0.84 121.20 122.79 2bdi s ILE 123 Ca 0.36 1.20 -0.29 0.00 0.00 0.00 0.00 60.65 61.92 2bdi s ILE 123 Cb -0.12 -3.93 -0.12 0.00 0.01 0.00 0.00 42.46 38.31 2bdi s ILE 123 CO 0.28 0.32 1.46 0.00 0.00 0.00 0.00 174.94 177.00 2bdi n ALA 124 N 3.52 1.92 0.30 9.38 0.00 0.45 -4.81 120.51 131.27 2bdi n ALA 124 Ca -0.05 0.37 0.11 0.00 0.00 0.00 0.00 53.44 53.87 2bdi n ALA 124 Cb 0.51 -2.37 -0.15 0.00 0.00 0.00 0.00 19.45 17.45 2bdi n ALA 124 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bdi n SER 125 N 1.50 0.31 -4.90 0.00 3.41 -1.26 -4.20 113.62 108.48 2bdi n SER 125 Ca 0.07 -0.30 -0.29 0.00 -0.26 0.00 0.00 58.87 58.09 2bdi n SER 125 Cb 0.36 1.67 -0.04 0.00 -0.26 0.00 0.00 64.21 65.95 2bdi n SER 125 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2bdi s GLN 127 N -3.36 3.64 0.28 4.33 0.74 -1.26 -4.90 119.66 119.14 2bdi s GLN 127 Ca -0.03 -0.01 -0.13 0.00 0.05 0.00 0.00 55.36 55.24 2bdi s GLN 127 Cb 0.15 -2.69 -0.08 0.00 1.10 0.00 0.00 33.01 31.48 2bdi s GLN 127 CO 0.90 0.28 0.65 0.00 -0.55 0.00 0.00 175.29 176.57 2bdi n PRO 129 N -0.29 0.06 -4.73 0.00 -0.02 -1.26 -4.98 135.00 123.78 2bdi n PRO 129 Ca 0.02 0.02 -0.33 0.00 -2.02 0.00 0.00 63.50 61.19 2bdi n PRO 129 Cb 0.53 -1.04 -0.13 0.00 -0.02 0.00 0.00 33.50 32.84 2bdi n PRO 129 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2bdi s THR 130 N -1.04 3.27 0.36 3.45 -4.23 -1.26 -5.08 115.64 111.11 2bdi s THR 130 Ca 0.64 -0.61 -0.28 0.00 -1.18 0.00 0.00 61.69 60.26 2bdi s THR 130 Cb -0.90 -2.36 -0.12 0.00 1.34 0.00 0.00 72.50 70.46 2bdi s THR 130 CO 0.57 0.54 1.33 0.00 -0.54 0.00 0.00 174.62 176.52 2bdi n ALA 132 N 3.10 1.54 0.00 3.99 0.00 -1.26 -2.15 120.51 125.73 2bdi n ALA 132 Ca -0.18 0.35 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2bdi n ALA 132 Cb 0.53 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.68 2bdi n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bdi n GLY 133 N 0.70 2.69 3.69 0.00 0.00 0.13 -4.91 105.19 107.49 2bdi n GLY 133 Ca 0.04 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 2bdi n GLY 133 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2bdi n ASN 134 N 0.60 2.96 -4.87 1.61 2.85 -0.91 -4.46 115.26 113.03 2bdi n ASN 134 Ca 0.00 1.17 -0.36 0.00 -0.11 0.00 0.00 54.58 55.27 2bdi n ASN 134 Cb 0.00 -1.48 -0.06 0.00 1.24 0.00 0.00 39.78 39.49 2bdi n ASN 134 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 2bdi s SER 135 N 0.11 6.51 0.29 1.20 0.15 -1.26 0.06 113.70 120.76 2bdi s SER 135 Ca 0.63 0.59 0.06 0.00 0.70 0.00 0.00 55.95 57.93 2bdi s SER 135 Cb -0.59 -2.11 -0.02 0.00 -1.71 0.00 0.00 66.02 61.58 2bdi s SER 135 CO 0.54 0.34 0.27 0.00 1.20 0.00 0.00 173.24 175.58 2bdi s LEU 137 N 0.00 2.24 0.02 0.00 2.96 -0.34 -1.29 118.68 122.29 2bdi s LEU 137 Ca 0.34 -0.57 0.01 0.00 -0.22 0.00 0.00 54.13 53.69 2bdi s LEU 137 Cb 0.01 -0.53 -0.02 0.00 0.50 0.00 0.00 46.19 46.15 2bdi s LEU 137 CO 0.24 -0.05 -0.04 0.54 -1.32 0.00 0.00 176.35 175.72 2bdi s VAL 138 N -1.15 0.27 0.04 1.68 0.11 -0.51 -0.35 120.40 120.48 2bdi s VAL 138 Ca -0.01 -0.84 -0.03 0.00 -2.93 0.00 0.00 61.98 58.17 2bdi s VAL 138 Cb -0.09 -0.36 -0.02 0.00 -1.53 0.00 0.00 36.38 34.37 2bdi s VAL 138 CO 0.02 -0.38 0.03 -0.94 -3.33 0.00 0.00 175.10 170.51 2bdi s SER 139 N -1.28 0.27 0.00 3.54 1.04 -1.21 -1.11 113.70 114.95 2bdi s SER 139 Ca -0.11 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.67 2bdi s SER 139 Cb -0.09 0.19 0.00 0.00 0.10 0.00 0.00 66.02 66.22 2bdi s SER 139 CO -0.00 -0.48 0.00 0.61 0.98 0.00 0.00 173.24 174.34 2bdi n GLY 140 N 0.80 0.57 1.59 7.32 0.00 -0.64 -4.25 105.19 110.58 2bdi n GLY 140 Ca -0.19 -0.98 0.08 0.00 0.00 0.00 0.00 46.02 44.93 2bdi n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2bdi n TRP 141 N -0.40 1.72 -1.09 1.61 8.01 -1.26 -1.66 117.44 124.36 2bdi n TRP 141 Ca 0.00 -0.76 -0.29 0.00 -1.31 0.00 0.00 57.50 55.14 2bdi n TRP 141 Cb 0.00 -0.43 0.22 0.00 -2.01 0.00 0.00 31.31 29.09 2bdi n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2bdi s GLY 142 N -1.11 1.57 0.43 6.99 0.00 -1.22 -4.30 107.32 109.68 2bdi s GLY 142 Ca 0.51 -0.73 -0.23 0.00 0.00 0.00 0.00 44.72 44.27 2bdi s GLY 142 CO 0.15 0.06 0.78 1.04 0.00 0.00 0.00 173.10 175.12 2bdi n LEU 143 N -4.58 1.35 -5.00 0.66 4.32 0.65 -2.93 117.00 111.47 2bdi n LEU 143 Ca 0.10 0.96 -0.19 0.00 -0.02 0.00 0.00 56.01 56.86 2bdi n LEU 143 Cb 0.59 -1.23 0.03 0.00 -1.62 0.00 0.00 43.42 41.18 2bdi n LEU 143 CO 0.50 -2.20 0.26 -0.76 -1.22 0.00 0.00 177.39 173.96 2bdi s LEU 144 N 0.53 3.44 0.57 2.23 1.43 0.80 -1.45 118.68 126.22 2bdi s LEU 144 Ca 0.64 -0.40 0.30 0.00 -1.03 0.00 0.00 54.13 53.64 2bdi s LEU 144 Cb -0.58 -2.49 1.46 0.00 0.03 0.00 0.00 46.19 44.60 2bdi s LEU 144 CO 0.57 -1.01 1.86 0.00 0.23 0.00 0.00 176.35 178.00 2bdi h ALA 145 N 0.36 2.53 -0.21 4.21 0.00 -1.87 0.68 119.26 124.96 2bdi h ALA 145 Ca -0.39 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 2bdi h ALA 145 Cb 1.28 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2bdi h ALA 145 CO 0.46 -0.95 0.00 0.27 0.00 0.00 0.00 179.25 179.03 2bdi n ASN 146 N -3.94 1.54 -0.67 0.00 0.23 -1.26 -4.88 115.26 106.28 2bdi n ASN 146 Ca 0.14 -1.81 -0.09 0.00 -0.53 0.00 0.00 54.58 52.29 2bdi n ASN 146 Cb 0.85 -0.14 -0.04 0.00 -2.08 0.00 0.00 39.78 38.37 2bdi n ASN 146 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bdi n GLY 147 N 1.05 1.02 3.50 4.83 0.00 0.24 -5.00 105.19 110.82 2bdi n GLY 147 Ca 0.14 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 2bdi n GLY 147 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2bdi s ARG 150 N -2.77 1.80 0.09 1.61 3.00 -1.25 -4.77 118.95 116.66 2bdi s ARG 150 Ca 0.00 -1.24 -0.27 0.00 -1.00 0.00 0.00 55.73 53.22 2bdi s ARG 150 Cb 0.00 -2.09 -0.06 0.00 0.00 0.00 0.00 34.95 32.80 2bdi s ARG 150 CO 0.00 0.46 0.85 -1.64 0.00 0.00 0.00 175.30 174.97 2bdi s MET 151 N -2.35 4.60 0.73 5.12 -1.94 -1.26 -0.14 119.30 124.06 2bdi s MET 151 Ca 0.20 1.24 -0.11 0.00 -1.71 0.00 0.00 55.69 55.30 2bdi s MET 151 Cb -0.10 -3.35 0.03 0.00 2.01 0.00 0.00 34.83 33.42 2bdi s MET 151 CO 0.11 0.31 1.08 -1.25 -0.01 0.00 0.00 175.02 175.25 2bdi s PRO 152 N -0.23 2.68 0.01 2.03 0.04 -1.26 -4.95 135.00 133.31 2bdi s PRO 152 Ca 0.41 0.71 0.15 0.00 0.04 0.00 0.00 61.00 62.31 2bdi s PRO 152 Cb -0.22 -1.98 -0.18 0.00 0.04 0.00 0.00 34.50 32.16 2bdi s PRO 152 CO 0.26 -1.22 0.74 0.25 0.04 0.00 0.00 177.00 177.07 2bdi n THR 153 N -3.17 1.38 -4.43 1.26 -2.24 -1.26 -4.95 114.28 100.86 2bdi n THR 153 Ca 0.07 -0.74 -0.21 0.00 -2.27 0.00 0.00 64.05 60.90 2bdi n THR 153 Cb 0.55 -0.87 -0.10 0.00 -2.10 0.00 0.00 70.33 67.81 2bdi n THR 153 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2bdi s VAL 154 N -2.77 1.50 0.22 2.28 -7.23 -1.26 -3.86 120.40 109.27 2bdi s VAL 154 Ca -0.04 -2.08 -0.32 0.00 -1.81 0.00 0.00 61.98 57.73 2bdi s VAL 154 Cb 0.08 -2.53 -0.12 0.00 0.56 0.00 0.00 36.38 34.38 2bdi s VAL 154 CO 0.82 -0.23 1.68 -0.22 -0.31 0.00 0.00 175.10 176.83 2bdi s LEU 155 N -3.45 4.37 0.26 1.32 2.96 -0.44 -4.85 118.68 118.84 2bdi s LEU 155 Ca 0.31 2.85 0.02 0.00 -0.22 0.00 0.00 54.13 57.09 2bdi s LEU 155 Cb 0.05 -3.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.10 2bdi s LEU 155 CO 0.12 -0.94 0.42 -1.10 -1.32 0.00 0.00 176.35 173.53 2bdi s GLN 156 N 0.86 3.47 -0.02 1.98 -1.52 -0.66 -1.29 119.66 122.48 2bdi s GLN 156 Ca 0.72 -0.52 0.03 0.00 -1.95 0.00 0.00 55.36 53.64 2bdi s GLN 156 Cb -0.48 -2.81 -0.00 0.00 -0.22 0.00 0.00 33.01 29.49 2bdi s GLN 156 CO 0.35 0.34 -0.11 0.00 -0.25 0.00 0.00 175.29 175.63 2bdi s VAL 158 N -0.04 0.00 -0.08 0.00 0.11 -0.26 -1.82 120.40 118.30 2bdi s VAL 158 Ca 0.00 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.06 2bdi s VAL 158 Cb -0.07 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.76 2bdi s VAL 158 CO 0.00 0.00 -0.07 0.20 -3.33 0.00 0.00 175.10 171.91 2bdi s ASN 159 N -2.45 4.65 0.01 3.54 -0.87 -1.26 -1.42 114.94 117.14 2bdi s ASN 159 Ca 0.00 -0.05 -0.02 0.00 -1.57 0.00 0.00 52.86 51.22 2bdi s ASN 159 Cb -0.01 -1.29 -0.01 0.00 -0.02 0.00 0.00 41.25 39.92 2bdi s ASN 159 CO -0.09 0.32 0.02 0.68 -2.57 0.00 0.00 177.10 175.46 2bdi s VAL 160 N -0.57 0.09 0.12 1.60 -7.23 -0.41 -4.89 120.40 109.12 2bdi s VAL 160 Ca 0.09 -0.78 0.03 0.00 -1.81 0.00 0.00 61.98 59.51 2bdi s VAL 160 Cb -0.12 -0.28 -0.04 0.00 0.56 0.00 0.00 36.38 36.50 2bdi s VAL 160 CO 0.02 -0.43 0.16 -0.44 -0.31 0.00 0.00 175.10 174.10 2bdi s SER 161 N -1.32 5.80 0.32 4.85 0.01 -1.26 -0.89 113.70 121.20 2bdi s SER 161 Ca -0.14 0.02 -0.29 0.00 1.31 0.00 0.00 55.95 56.84 2bdi s SER 161 Cb -0.09 -1.62 -0.10 0.00 0.21 0.00 0.00 66.02 64.42 2bdi s SER 161 CO -0.00 0.11 1.40 -0.69 0.41 0.00 0.00 173.24 174.47 2bdi s VAL 162 N -1.61 2.51 0.09 3.43 1.01 0.11 0.76 120.40 126.70 2bdi s VAL 162 Ca 0.32 0.48 0.01 0.00 0.00 0.00 0.00 61.98 62.79 2bdi s VAL 162 Cb -0.11 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2bdi s VAL 162 CO 0.25 0.10 0.21 -0.69 0.00 0.00 0.00 175.10 174.97 2bdi s VAL 163 N -0.76 5.22 0.64 2.92 1.01 -0.12 0.21 120.40 129.51 2bdi s VAL 163 Ca 0.53 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.80 2bdi s VAL 163 Cb -0.42 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 2bdi s VAL 163 CO 0.52 0.07 1.16 -0.94 0.00 0.00 0.00 175.10 175.92 2bdi s SER 164 N -2.71 5.00 0.21 3.32 1.04 -1.26 -4.62 113.70 114.69 2bdi s SER 164 Ca 0.34 2.22 -0.08 0.00 0.48 0.00 0.00 55.95 58.91 2bdi s SER 164 Cb -0.12 -2.58 0.27 0.00 0.10 0.00 0.00 66.02 63.68 2bdi s SER 164 CO 0.27 -1.71 1.81 -0.08 0.98 0.00 0.00 173.24 174.51 2bdi h GLU 165 N 0.37 0.67 0.60 4.02 4.81 -1.98 -1.00 114.58 122.07 2bdi h GLU 165 Ca -0.49 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.68 2bdi h GLU 165 Cb 1.28 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 2bdi h GLU 165 CO 0.54 0.44 -0.50 1.49 -0.73 0.00 0.00 179.01 180.25 2bdi h GLU 166 N 0.69 -1.03 -0.99 1.92 4.81 -1.99 0.23 114.58 118.21 2bdi h GLU 166 Ca 0.31 0.07 0.14 0.00 -0.13 0.00 0.00 59.36 59.75 2bdi h GLU 166 Cb 0.22 0.23 -0.09 0.00 0.63 0.00 0.00 28.75 29.75 2bdi h GLU 166 CO -0.20 -0.69 0.62 0.28 -0.73 0.00 0.00 179.01 178.29 2bdi h VAL 167 N -1.07 0.87 -0.38 0.32 2.07 -1.81 -1.60 116.25 114.65 2bdi h VAL 167 Ca -0.08 -0.32 -0.13 0.00 0.82 0.00 0.00 66.70 66.99 2bdi h VAL 167 Cb 0.90 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 2bdi h VAL 167 CO -0.01 0.17 -0.29 0.00 0.02 0.00 0.00 177.57 177.46 2bdi h SER 169 N 0.69 0.37 0.03 0.00 4.64 -0.24 -2.49 113.55 116.55 2bdi h SER 169 Ca 0.08 -0.28 -0.19 0.00 -0.47 0.00 0.00 61.79 60.93 2bdi h SER 169 Cb 0.83 -0.11 0.02 0.00 -0.31 0.00 0.00 62.40 62.82 2bdi h SER 169 CO 0.07 1.05 -0.77 0.11 -0.87 0.00 0.00 176.83 176.42 2bdi h LYS 170 N 0.18 0.48 -0.10 4.77 1.57 -1.16 0.12 116.57 122.42 2bdi h LYS 170 Ca -0.05 -0.55 0.03 0.00 -1.87 0.00 0.00 60.65 58.22 2bdi h LYS 170 Cb 1.44 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.91 2bdi h LYS 170 CO 0.14 1.19 0.12 -0.07 -0.57 0.00 0.00 179.45 180.26 2bdi h LEU 171 N 0.00 0.00 -2.43 2.94 3.38 -0.63 -3.01 115.31 115.56 2bdi h LEU 171 Ca -0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2bdi h LEU 171 Cb 1.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.23 2bdi h LEU 171 CO 0.15 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.46 2bdi n TYR 172 N -3.79 0.00 -1.69 1.13 4.01 -0.94 -5.01 117.16 110.87 2bdi n TYR 172 Ca -0.00 -0.36 -0.44 0.00 -0.16 0.00 0.00 57.90 56.94 2bdi n TYR 172 Cb 0.22 -0.04 -0.02 0.00 -0.31 0.00 0.00 39.34 39.20 2bdi n TYR 172 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 2bdi n ASP 173 N -0.36 2.83 -1.23 7.72 -0.08 0.40 -0.98 116.55 124.85 2bdi n ASP 173 Ca 0.00 1.17 0.11 0.00 -1.51 0.00 0.00 54.79 54.56 2bdi n ASP 173 Cb 0.24 -1.46 0.27 0.00 2.34 0.00 0.00 41.12 42.50 2bdi n ASP 173 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2bdi n PRO 174 N 1.47 2.63 0.11 -0.67 -0.04 -1.26 -4.85 135.00 132.38 2bdi n PRO 174 Ca 0.09 -2.47 0.12 0.00 -0.04 0.00 0.00 63.50 61.19 2bdi n PRO 174 Cb 0.34 -1.53 0.46 0.00 -0.04 0.00 0.00 33.50 32.73 2bdi n PRO 174 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2bdi n LEU 175 N 1.51 0.65 -4.76 1.53 4.77 -0.16 -4.88 117.00 115.66 2bdi n LEU 175 Ca 0.22 0.61 -0.40 0.00 -0.03 0.00 0.00 56.01 56.41 2bdi n LEU 175 Cb 0.60 -0.47 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2bdi n LEU 175 CO 0.16 -0.37 0.87 -0.47 -1.33 0.00 0.00 177.39 176.24 2bdi s TYR 176 N -3.20 3.30 0.07 -1.77 6.14 -0.75 -4.88 117.35 116.26 2bdi s TYR 176 Ca 0.07 1.57 0.00 0.00 0.64 0.00 0.00 57.07 59.36 2bdi s TYR 176 Cb 0.11 -3.44 -0.04 0.00 0.42 0.00 0.00 41.96 39.00 2bdi s TYR 176 CO 0.47 -1.15 -0.04 -1.58 0.64 0.00 0.00 175.55 173.89 2bdi s HIS 177 N -1.20 0.67 -1.22 4.97 2.46 -1.26 -4.94 115.29 114.77 2bdi s HIS 177 Ca 0.48 -1.00 0.05 0.00 0.47 0.00 0.00 55.06 55.06 2bdi s HIS 177 Cb -0.34 -0.44 0.26 0.00 -0.13 0.00 0.00 32.58 31.92 2bdi s HIS 177 CO 0.45 -0.29 1.10 -2.30 -2.47 0.00 0.00 174.74 171.23 2bdi n PRO 178 N 0.06 0.04 -0.63 2.88 -0.02 -1.26 -1.20 135.00 134.87 2bdi n PRO 178 Ca -0.13 0.32 0.02 0.00 -2.02 0.00 0.00 63.50 61.69 2bdi n PRO 178 Cb 0.61 -1.50 0.25 0.00 -0.02 0.00 0.00 33.50 32.84 2bdi n PRO 178 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bdi n SER 179 N -1.39 4.06 -4.01 2.55 3.41 -1.26 -4.78 113.62 112.19 2bdi n SER 179 Ca 0.02 -2.68 -0.09 0.00 -0.26 0.00 0.00 58.87 55.86 2bdi n SER 179 Cb 0.05 -0.64 -0.08 0.00 -0.26 0.00 0.00 64.21 63.29 2bdi n SER 179 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdi s MET 180 N -2.17 1.07 0.06 4.33 0.23 -0.34 -1.73 119.30 120.75 2bdi s MET 180 Ca 0.36 -1.24 -0.21 0.00 -1.03 0.00 0.00 55.69 53.57 2bdi s MET 180 Cb 0.28 0.33 0.05 0.00 -1.53 0.00 0.00 34.83 33.96 2bdi s MET 180 CO 0.10 -0.37 0.50 -0.59 -2.03 0.00 0.00 175.02 172.63 2bdi s PHE 181 N -3.99 -0.39 -0.07 3.16 -0.12 -0.25 -4.68 117.98 111.65 2bdi s PHE 181 Ca 0.18 0.38 -0.04 0.00 -0.05 0.00 0.00 56.93 57.40 2bdi s PHE 181 Cb 0.05 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 2bdi s PHE 181 CO -0.00 -0.65 0.14 0.00 -0.05 0.00 0.00 175.22 174.67 2bdi s ALA 183 N -1.15 -0.89 0.00 0.00 0.00 -0.70 -0.95 121.76 118.08 2bdi s ALA 183 Ca 0.20 1.02 0.00 0.00 0.00 0.00 0.00 51.96 53.18 2bdi s ALA 183 Cb -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.40 2bdi s ALA 183 CO 0.10 -0.17 0.00 0.41 0.00 0.00 0.00 175.76 176.10 2bdi n GLY 184 N 2.92 0.32 2.07 0.00 0.00 0.23 -2.53 105.19 108.20 2bdi n GLY 184 Ca -0.13 -1.41 -0.00 0.00 0.00 0.00 0.00 46.02 44.48 2bdi n GLY 184 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bdi n GLY 185 N 0.00 0.46 3.85 -0.02 0.00 -1.26 -4.52 105.19 103.71 2bdi n GLY 185 Ca 0.00 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.71 2bdi n GLY 185 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bdi s GLY 186 N -2.01 1.72 0.42 -0.02 0.00 -1.26 0.05 107.32 106.21 2bdi s GLY 186 Ca 0.00 -1.08 0.21 0.00 0.00 0.00 0.00 44.72 43.85 2bdi s GLY 186 CO 0.00 -0.31 1.84 -1.61 0.00 0.00 0.00 173.10 173.02 2bdi h GLN 186 N -1.79 0.00 0.00 2.90 5.75 -1.95 -2.58 115.11 117.44 2bdi h GLN 186 Ca -0.45 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.05 2bdi h GLN 186 Cb 1.26 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.81 2bdi h GLN 186 CO 0.40 0.29 0.00 -0.40 -2.65 0.00 0.00 178.83 176.47 2bdi n ASP 186 N -3.60 0.00 -3.95 -0.69 3.85 -1.26 -4.84 116.55 106.06 2bdi n ASP 186 Ca -0.01 -0.55 -0.32 0.00 -0.71 0.00 0.00 54.79 53.20 2bdi n ASP 186 Cb 0.42 0.00 -0.00 0.00 -1.35 0.00 0.00 41.12 40.19 2bdi n ASP 186 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2bdi n GLN 187 N -0.96 -4.22 -3.35 0.11 6.02 -0.97 -4.95 117.38 109.06 2bdi n GLN 187 Ca 0.11 0.49 -0.38 0.00 -0.01 0.00 0.00 57.00 57.21 2bdi n GLN 187 Cb 0.05 -5.29 -0.07 0.00 1.02 0.00 0.00 30.24 25.95 2bdi n GLN 187 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2bdi s LYS 188 N -6.65 4.24 0.16 -1.09 1.02 -1.26 -4.44 119.74 111.71 2bdi s LYS 188 Ca 0.66 0.32 -0.25 0.00 0.02 0.00 0.00 55.97 56.72 2bdi s LYS 188 Cb -0.35 -3.50 0.06 0.00 -0.52 0.00 0.00 37.83 33.53 2bdi s LYS 188 CO 0.81 0.02 0.97 0.34 -0.92 0.00 0.00 175.35 176.58 2bdi s ASP 189 N 0.88 -0.15 0.89 2.83 2.15 -0.93 -4.20 116.67 118.14 2bdi s ASP 189 Ca 0.22 -0.44 -0.10 0.00 0.43 0.00 0.00 52.55 52.66 2bdi s ASP 189 Cb -0.15 0.49 0.19 0.00 -0.30 0.00 0.00 42.92 43.15 2bdi s ASP 189 CO 0.09 -0.92 1.22 -0.44 -0.17 0.00 0.00 175.17 174.94 2bdi s SER 190 N -2.99 3.42 0.28 -0.34 0.01 -1.26 0.50 113.70 113.32 2bdi s SER 190 Ca 0.13 -0.07 -0.20 0.00 1.31 0.00 0.00 55.95 57.12 2bdi s SER 190 Cb -0.01 -0.03 0.05 0.00 0.21 0.00 0.00 66.02 66.24 2bdi s SER 190 CO 0.03 -2.51 0.85 0.00 0.41 0.00 0.00 173.24 172.02 2bdi n ASN 192 N -0.97 1.23 0.00 0.00 4.13 -1.26 -1.13 115.26 117.25 2bdi n ASN 192 Ca -0.06 1.13 0.00 0.00 1.68 0.00 0.00 54.58 57.33 2bdi n ASN 192 Cb 0.60 -1.07 0.00 0.00 -1.54 0.00 0.00 39.78 37.76 2bdi n ASN 192 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2bdi n GLY 193 N 2.62 0.33 0.76 7.41 0.00 -1.26 -0.25 105.19 114.80 2bdi n GLY 193 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.32 2bdi n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bdi n ASP 194 N 0.00 2.69 -4.67 1.61 8.00 -0.29 -3.46 116.55 120.43 2bdi n ASP 194 Ca 0.00 -1.79 -0.43 0.00 0.71 0.00 0.00 54.79 53.28 2bdi n ASP 194 Cb 0.00 -0.09 -0.01 0.00 -0.02 0.00 0.00 41.12 41.00 2bdi n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2bdi n SER 195 N 0.99 2.38 0.00 -2.24 7.64 -1.26 -0.09 113.62 121.04 2bdi n SER 195 Ca 0.12 1.20 0.00 0.00 1.01 0.00 0.00 58.87 61.20 2bdi n SER 195 Cb 0.45 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.22 2bdi n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bdi n GLY 196 N 0.88 2.05 3.70 0.23 0.00 0.22 -1.78 105.19 110.48 2bdi n GLY 196 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 2bdi n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bdi s GLY 197 N -2.00 1.64 0.33 -0.02 0.00 0.87 -3.55 107.32 104.59 2bdi s GLY 197 Ca 0.00 0.18 -0.19 0.00 0.00 0.00 0.00 44.72 44.71 2bdi s GLY 197 CO 0.00 0.63 0.82 2.56 0.00 0.00 0.00 173.10 177.12 2bdi s PRO 198 N -4.81 4.19 -0.26 2.90 0.04 -1.26 -0.57 135.00 135.24 2bdi s PRO 198 Ca 0.64 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.61 2bdi s PRO 198 Cb -0.20 -2.50 0.07 0.00 0.04 0.00 0.00 34.50 31.92 2bdi s PRO 198 CO 0.58 0.17 0.01 -1.17 0.04 0.00 0.00 177.00 176.62 2bdi s LEU 199 N -2.72 2.52 -0.02 -3.56 2.96 0.09 -3.36 118.68 114.60 2bdi s LEU 199 Ca 0.54 -1.33 -0.12 0.00 -0.22 0.00 0.00 54.13 52.99 2bdi s LEU 199 Cb -0.12 -1.06 -0.05 0.00 0.50 0.00 0.00 46.19 45.45 2bdi s LEU 199 CO 0.18 -0.30 0.34 -0.63 -1.32 0.00 0.00 176.35 174.62 2bdi s ILE 200 N 1.46 5.15 -0.22 6.68 -1.09 0.52 -0.25 121.20 133.46 2bdi s ILE 200 Ca 0.00 0.65 -0.04 0.00 -2.23 0.00 0.00 60.65 59.04 2bdi s ILE 200 Cb -0.18 -3.63 0.09 0.00 -1.58 0.00 0.00 42.46 37.15 2bdi s ILE 200 CO -0.11 0.56 0.16 0.00 -1.23 0.00 0.00 174.94 174.33 2bdi n ASN 202 N 5.29 -3.13 0.00 0.00 5.03 -1.26 -2.73 115.26 118.46 2bdi n ASN 202 Ca -0.06 -0.51 0.00 0.00 0.87 0.00 0.00 54.58 54.89 2bdi n ASN 202 Cb 0.47 -4.40 0.00 0.00 -1.02 0.00 0.00 39.78 34.83 2bdi n ASN 202 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2bdi n GLY 203 N -1.31 0.20 3.63 7.41 0.00 -1.26 -5.00 105.19 108.86 2bdi n GLY 203 Ca -0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 2bdi n GLY 203 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bdi s TYR 208 N -1.42 2.75 -0.48 1.61 1.51 -1.10 -4.73 117.35 115.49 2bdi s TYR 208 Ca 0.00 -0.18 -0.29 0.00 -1.01 0.00 0.00 57.07 55.59 2bdi s TYR 208 Cb 0.00 -1.31 0.03 0.00 -0.11 0.00 0.00 41.96 40.56 2bdi s TYR 208 CO 0.00 0.54 1.19 -1.17 -1.11 0.00 0.00 175.55 174.99 2bdi s LEU 209 N -3.07 3.61 -0.19 -1.29 2.96 -0.02 -0.17 118.68 120.50 2bdi s LEU 209 Ca 0.28 0.48 0.01 0.00 -0.22 0.00 0.00 54.13 54.68 2bdi s LEU 209 Cb -0.09 -3.51 -0.21 0.00 0.50 0.00 0.00 46.19 42.88 2bdi s LEU 209 CO 0.18 -1.31 0.07 1.67 -1.32 0.00 0.00 176.35 175.64 2bdi n GLN 210 N 7.95 0.69 -3.82 1.98 -0.06 0.66 -0.41 117.38 124.37 2bdi n GLN 210 Ca 0.12 0.18 -0.09 0.00 -2.00 0.00 0.00 57.00 55.22 2bdi n GLN 210 Cb 0.49 -1.60 0.02 0.00 -4.06 0.00 0.00 30.24 25.09 2bdi n GLN 210 CO 0.00 0.00 0.00 0.20 -0.20 0.00 0.00 177.06 177.06 2bdi s GLY 211 N -6.00 0.40 0.01 1.69 0.00 -0.89 -2.95 107.32 99.57 2bdi s GLY 211 Ca -0.26 -0.77 0.07 0.00 0.00 0.00 0.00 44.72 43.76 2bdi s GLY 211 CO 0.70 -0.33 -0.23 1.08 0.00 0.00 0.00 173.10 174.32 2bdi s LEU 212 N -3.07 2.10 -0.14 0.66 1.43 -1.22 -0.73 118.68 117.71 2bdi s LEU 212 Ca 0.16 -0.46 -0.29 0.00 -1.03 0.00 0.00 54.13 52.51 2bdi s LEU 212 Cb -0.05 -1.13 -0.06 0.00 0.03 0.00 0.00 46.19 44.99 2bdi s LEU 212 CO 0.12 0.24 1.98 -0.69 0.23 0.00 0.00 176.35 178.23 2bdi s VAL 213 N -0.64 3.19 0.00 -1.59 1.01 0.26 -0.99 120.40 121.65 2bdi s VAL 213 Ca 0.09 0.21 0.00 0.00 0.00 0.00 0.00 61.98 62.28 2bdi s VAL 213 Cb -0.09 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.09 2bdi s VAL 213 CO 0.00 -0.09 0.00 -0.24 0.00 0.00 0.00 175.10 174.77 2bdi n SER 214 N 9.57 0.00 -2.76 3.32 2.88 -1.04 0.69 113.62 126.28 2bdi n SER 214 Ca 0.24 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.69 2bdi n SER 214 Cb 0.44 -0.34 0.02 0.00 -0.75 0.00 0.00 64.21 63.58 2bdi n SER 214 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 2bdi n PHE 215 N -2.31 -2.25 0.00 0.66 1.16 -1.14 -4.88 117.46 108.70 2bdi n PHE 215 Ca 0.00 -1.87 0.00 0.00 -1.87 0.00 0.00 57.45 53.71 2bdi n PHE 215 Cb 0.00 0.87 0.00 0.00 -1.61 0.00 0.00 39.48 38.74 2bdi n PHE 215 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2bdi n GLY 216 N -0.53 0.75 3.70 4.97 0.00 -1.26 0.43 105.19 113.25 2bdi n GLY 216 Ca -0.08 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 2bdi n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bdi s LYS 217 N -2.00 1.47 0.11 1.61 1.02 -1.26 -5.01 119.74 115.68 2bdi s LYS 217 Ca 0.00 1.56 0.09 0.00 0.02 0.00 0.00 55.97 57.63 2bdi s LYS 217 Cb 0.00 -1.78 -0.04 0.00 -0.52 0.00 0.00 37.83 35.50 2bdi s LYS 217 CO 0.00 -2.30 -0.22 0.00 -0.92 0.00 0.00 175.35 171.91 2bdi s ALA 218 N -2.51 1.92 1.17 5.17 0.00 -1.26 -4.00 121.76 122.24 2bdi s ALA 218 Ca 0.68 -1.30 -0.17 0.00 0.00 0.00 0.00 51.96 51.17 2bdi s ALA 218 Cb -0.24 -0.27 0.27 0.00 0.00 0.00 0.00 23.12 22.88 2bdi s ALA 218 CO 0.54 0.39 1.08 -1.25 0.00 0.00 0.00 175.76 176.52 2bdi s PRO 219 N -1.98 -0.92 0.76 0.00 0.04 -1.26 -5.11 135.00 126.54 2bdi s PRO 219 Ca 0.08 0.18 -0.13 0.00 0.04 0.00 0.00 61.00 61.17 2bdi s PRO 219 Cb -0.10 -1.61 0.17 0.00 0.04 0.00 0.00 34.50 33.01 2bdi s PRO 219 CO 0.05 -3.56 1.03 0.00 0.04 0.00 0.00 177.00 174.56 2bdi n GLY 220 N -1.73 -0.50 3.80 0.00 0.00 -1.26 -4.92 105.19 100.58 2bdi n GLY 220 Ca 0.13 0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 2bdi n GLY 220 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bdi s GLN 221 N -5.37 4.34 0.23 1.61 -0.21 -1.26 -4.61 119.66 114.39 2bdi s GLN 221 Ca 0.14 0.94 -0.30 0.00 0.02 0.00 0.00 55.36 56.16 2bdi s GLN 221 Cb -0.07 -3.03 -0.10 0.00 1.00 0.00 0.00 33.01 30.81 2bdi s GLN 221 CO 0.17 0.47 1.40 0.08 -2.12 0.00 0.00 175.29 175.30 2bdi s VAL 222 N -1.37 2.83 0.00 1.09 1.01 -1.26 -2.31 120.40 120.39 2bdi s VAL 222 Ca 0.39 0.69 0.00 0.00 0.00 0.00 0.00 61.98 63.07 2bdi s VAL 222 Cb -0.19 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.75 2bdi s VAL 222 CO 0.22 0.11 0.00 0.61 0.00 0.00 0.00 175.10 176.04 2bdi n GLY 223 N 2.27 0.63 2.73 4.51 0.00 0.11 -4.95 105.19 110.49 2bdi n GLY 223 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 2bdi n GLY 223 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bdi s VAL 224 N -2.65 1.54 0.91 1.61 1.01 -0.98 -5.02 120.40 116.83 2bdi s VAL 224 Ca 0.00 -2.68 -0.11 0.00 0.00 0.00 0.00 61.98 59.18 2bdi s VAL 224 Cb 0.00 -2.08 0.14 0.00 0.00 0.00 0.00 36.38 34.44 2bdi s VAL 224 CO 0.00 -0.90 1.09 -2.16 0.00 0.00 0.00 175.10 173.14 2bdi s PRO 225 N 0.23 1.11 0.37 2.72 0.04 -1.26 -4.33 135.00 133.88 2bdi s PRO 225 Ca 0.18 0.91 0.01 0.00 0.04 0.00 0.00 61.00 62.14 2bdi s PRO 225 Cb -0.23 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 2bdi s PRO 225 CO -0.01 -2.36 0.58 0.20 0.04 0.00 0.00 177.00 175.44 2bdi s GLY 226 N -3.28 1.42 -0.06 0.56 0.00 -1.05 -4.67 107.32 100.24 2bdi s GLY 226 Ca 0.64 -0.99 -0.03 0.00 0.00 0.00 0.00 44.72 44.34 2bdi s GLY 226 CO 0.58 -0.90 0.10 0.14 0.00 0.00 0.00 173.10 173.02 2bdi s VAL 227 N -2.37 5.04 0.02 1.40 1.01 0.17 -1.72 120.40 123.95 2bdi s VAL 227 Ca 0.43 -0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.29 2bdi s VAL 227 Cb -0.10 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 2bdi s VAL 227 CO 0.36 0.48 -0.08 -0.31 0.00 0.00 0.00 175.10 175.56 2bdi s TYR 228 N -1.11 0.66 0.12 5.22 1.51 0.62 -2.50 117.35 121.88 2bdi s TYR 228 Ca 0.19 -0.31 -0.31 0.00 -1.01 0.00 0.00 57.07 55.63 2bdi s TYR 228 Cb -0.12 -0.40 -0.09 0.00 -0.11 0.00 0.00 41.96 41.24 2bdi s TYR 228 CO 0.09 -0.04 1.56 0.99 -1.11 0.00 0.00 175.55 177.05 2bdi s THR 229 N -0.80 2.87 -1.32 -0.71 2.01 -0.16 -1.09 115.64 116.44 2bdi s THR 229 Ca -0.04 0.55 -0.15 0.00 0.31 0.00 0.00 61.69 62.35 2bdi s THR 229 Cb -0.06 -3.35 0.09 0.00 0.01 0.00 0.00 72.50 69.18 2bdi s THR 229 CO 0.00 0.03 1.83 -3.20 -0.69 0.00 0.00 174.62 172.59 2bdi n ASN 230 N 4.50 4.73 -0.07 3.53 5.15 -0.70 -3.37 115.26 129.03 2bdi n ASN 230 Ca 0.14 -2.93 0.25 0.00 -0.60 0.00 0.00 54.58 51.44 2bdi n ASN 230 Cb 0.40 -1.67 0.72 0.00 -0.53 0.00 0.00 39.78 38.70 2bdi n ASN 230 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2bdi h LEU 231 N 10.98 0.00 0.00 1.20 3.38 -1.86 0.59 115.31 129.60 2bdi h LEU 231 Ca 0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.42 2bdi h LEU 231 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 2bdi h LEU 231 CO 1.55 0.00 0.00 0.00 0.09 0.00 0.00 178.44 180.08 2bdi n LYS 233 N -0.89 0.73 -0.38 0.00 4.76 0.20 -4.53 118.16 118.05 2bdi n LYS 233 Ca 0.05 -0.06 0.07 0.00 -2.87 0.00 0.00 58.31 55.50 2bdi n LYS 233 Cb 0.02 -1.41 0.18 0.00 -1.84 0.00 0.00 35.03 31.99 2bdi n LYS 233 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2bdi n PHE 234 N -1.69 0.19 0.40 2.13 3.72 0.13 -4.79 117.46 117.54 2bdi n PHE 234 Ca 0.01 -1.24 -0.19 0.00 -0.05 0.00 0.00 57.45 55.98 2bdi n PHE 234 Cb 0.36 -0.24 -0.10 0.00 -0.94 0.00 0.00 39.48 38.57 2bdi n PHE 234 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 2bdi h THR 235 N 0.63 0.05 -0.75 4.37 1.35 -1.79 0.41 112.91 117.19 2bdi h THR 235 Ca 0.02 0.00 0.17 0.00 -0.55 0.00 0.00 66.41 66.05 2bdi h THR 235 Cb 1.10 0.05 -0.12 0.00 -1.73 0.00 0.00 68.15 67.46 2bdi h THR 235 CO 0.06 0.00 0.16 -0.08 -0.25 0.00 0.00 175.52 175.40 2bdi h GLU 236 N -1.14 0.23 -0.08 4.72 4.81 -1.94 0.90 114.58 122.08 2bdi h GLU 236 Ca -0.10 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 2bdi h GLU 236 Cb 0.92 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.25 2bdi h GLU 236 CO 0.08 0.15 0.03 2.35 -0.73 0.00 0.00 179.01 180.89 2bdi h TRP 237 N 0.24 0.12 -0.87 0.92 7.01 -1.82 -0.77 115.95 120.79 2bdi h TRP 237 Ca 0.43 -0.01 0.12 0.00 2.11 0.00 0.00 58.89 61.54 2bdi h TRP 237 Cb 0.75 -0.04 -0.07 0.00 -2.10 0.00 0.00 29.16 27.71 2bdi h TRP 237 CO -0.29 0.25 0.56 0.82 -2.79 0.00 0.00 178.44 176.99 2bdi h ILE 238 N -0.04 0.88 0.38 2.65 2.04 0.12 -2.24 117.51 121.32 2bdi h ILE 238 Ca 0.03 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 65.62 2bdi h ILE 238 Cb 0.18 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 2bdi h ILE 238 CO -0.00 0.13 -0.18 -0.08 0.00 0.00 0.00 178.15 178.02 2bdi h GLU 239 N 0.73 -0.50 -0.48 2.37 4.57 -0.48 -1.56 114.58 119.23 2bdi h GLU 239 Ca 0.42 0.03 0.14 0.00 -1.18 0.00 0.00 59.36 58.77 2bdi h GLU 239 Cb 0.60 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.28 2bdi h GLU 239 CO -0.18 -0.33 0.67 -0.22 -1.18 0.00 0.00 179.01 177.77 2bdi h LYS 240 N -0.90 0.00 0.00 1.92 3.64 -1.05 0.76 116.57 120.94 2bdi h LYS 240 Ca -0.05 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 2bdi h LYS 240 Cb 0.40 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 2bdi h LYS 240 CO 0.09 0.00 -0.47 1.15 -2.27 0.00 0.00 179.45 177.94 2bdi h THR 241 N 0.00 0.31 -0.75 1.00 2.02 -1.39 -3.16 112.91 110.93 2bdi h THR 241 Ca 0.23 -1.32 0.08 0.00 0.77 0.00 0.00 66.41 66.17 2bdi h THR 241 Cb 1.57 0.67 -0.06 0.00 -1.74 0.00 0.00 68.15 68.58 2bdi h THR 241 CO -0.00 0.10 0.42 0.58 0.37 0.00 0.00 175.52 176.99 2bdi h VAL 242 N -1.00 0.94 0.00 3.16 2.07 -0.30 -3.35 116.25 117.76 2bdi h VAL 242 Ca -0.06 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.20 2bdi h VAL 242 Cb 0.56 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2bdi h VAL 242 CO -0.04 0.14 0.00 1.67 0.02 0.00 0.00 177.57 179.36 2bdi n GLN 243 N -4.76 0.00 0.00 1.57 -0.06 0.17 -5.10 117.38 109.20 2bdi n GLN 243 Ca 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.11 2bdi n GLN 243 Cb 0.22 -0.04 0.00 0.00 -4.06 0.00 0.00 30.24 26.36 2bdi n GLN 243 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86