#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 4.73 -1.26 1.39 -1.09 0.24 -4.04 121.20 121.17 2bdi s ILE 17 Ca 0.00 -0.04 -0.03 0.00 -2.23 0.00 0.00 60.65 58.35 2bdi s ILE 17 Cb 0.00 -3.17 0.00 0.00 -1.58 0.00 0.00 42.46 37.72 2bdi s ILE 17 CO 0.00 0.41 1.03 0.59 -1.23 0.00 0.00 174.94 175.74 2bdi n ASN 18 N 4.04 -3.23 -0.05 3.58 5.03 -1.26 -2.16 115.26 121.20 2bdi n ASN 18 Ca -0.16 -0.62 0.00 0.00 0.87 0.00 0.00 54.58 54.67 2bdi n ASN 18 Cb 0.52 -5.00 0.00 0.00 -1.02 0.00 0.00 39.78 34.28 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 -1.42 7.71 3.36 7.41 0.00 -1.26 -4.82 105.19 116.17 2bdi n GLY 19 Ca -0.20 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 43.70 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 0.93 1.23 0.03 1.61 2.02 -0.14 -4.91 118.70 119.47 2bdi s GLU 20 Ca 0.00 -1.26 -0.34 0.00 0.02 0.00 0.00 54.97 53.39 2bdi s GLU 20 Cb 0.00 0.37 -0.13 0.00 0.10 0.00 0.00 34.13 34.48 2bdi s GLU 20 CO 0.00 -0.45 1.75 -0.25 0.02 0.00 0.00 175.26 176.32 2bdi n ASP 21 N -0.25 3.33 -4.72 -0.19 9.92 -1.26 -0.18 116.55 123.19 2bdi n ASP 21 Ca -0.05 1.02 -0.30 0.00 -0.53 0.00 0.00 54.79 54.93 2bdi n ASP 21 Cb 0.63 -1.40 0.13 0.00 -0.64 0.00 0.00 41.12 39.84 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 -3.22 6.61 -0.45 0.00 0.15 -1.26 -4.88 113.70 110.66 2bdi s SER 23 Ca 0.63 1.73 -0.41 0.00 0.70 0.00 0.00 55.95 58.60 2bdi s SER 23 Cb -0.19 -2.53 -0.18 0.00 -1.71 0.00 0.00 66.02 61.41 2bdi s SER 23 CO 0.57 -1.04 1.56 -2.65 1.20 0.00 0.00 173.24 172.88 2bdi n PRO 24 N 7.25 0.00 -1.36 5.44 -0.02 -1.26 0.68 135.00 145.73 2bdi n PRO 24 Ca 0.17 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.56 2bdi n PRO 24 Cb 0.45 -1.35 -0.04 0.00 -0.02 0.00 0.00 33.50 32.55 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 4.39 -0.04 0.64 6.00 8.25 -1.26 -4.90 115.22 128.29 2bdi n HIS 25 Ca 0.33 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.92 2bdi n HIS 25 Cb -0.05 -1.86 0.46 0.00 1.12 0.00 0.00 29.99 29.66 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 0.49 0.59 -3.32 0.41 3.41 0.21 -3.95 113.62 111.47 2bdi n SER 26 Ca -0.09 0.58 -0.26 0.00 -0.26 0.00 0.00 58.87 58.84 2bdi n SER 26 Cb 0.33 -0.73 -0.08 0.00 -0.26 0.00 0.00 64.21 63.48 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 -2.07 1.64 0.00 4.33 1.13 -1.26 -4.97 117.38 116.18 2bdi n GLN 27 Ca 0.05 -3.98 0.00 0.00 -1.94 0.00 0.00 57.00 51.14 2bdi n GLN 27 Cb 0.35 -1.77 0.01 0.00 0.11 0.00 0.00 30.24 28.95 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 1.16 0.00 0.00 -1.09 -0.04 -1.25 -1.45 135.00 132.33 2bdi n PRO 28 Ca 0.26 0.47 0.12 0.00 -0.04 0.00 0.00 63.50 64.31 2bdi n PRO 28 Cb 0.47 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.66 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 -1.48 0.00 -2.03 0.54 2.14 -1.08 -2.30 117.44 113.22 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 0.01 -0.13 -0.03 0.00 -0.81 0.00 0.00 31.31 30.35 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 -2.69 4.24 -0.12 -2.67 2.00 -0.53 -1.02 119.66 118.87 2bdi s GLN 30 Ca 0.18 2.21 0.01 0.00 -2.00 0.00 0.00 55.36 55.76 2bdi s GLN 30 Cb 0.18 -3.46 -0.01 0.00 0.80 0.00 0.00 33.01 30.52 2bdi s GLN 30 CO 0.61 -0.63 -0.16 0.00 -0.50 0.00 0.00 175.29 174.62 2bdi s ALA 31 N 2.10 2.52 -0.09 1.58 0.00 0.16 -4.32 121.76 123.71 2bdi s ALA 31 Ca 0.69 -0.91 -0.09 0.00 0.00 0.00 0.00 51.96 51.65 2bdi s ALA 31 Cb -0.38 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.58 2bdi s ALA 31 CO 0.30 0.27 0.21 0.00 0.00 0.00 0.00 175.76 176.55 2bdi s ALA 32 N 0.30 3.83 -0.30 0.00 0.00 -0.69 -0.28 121.76 124.62 2bdi s ALA 32 Ca -0.12 -0.53 -0.03 0.00 0.00 0.00 0.00 51.96 51.28 2bdi s ALA 32 Cb -0.16 -2.08 0.04 0.00 0.00 0.00 0.00 23.12 20.92 2bdi s ALA 32 CO 0.06 0.58 0.01 -0.51 0.00 0.00 0.00 175.76 175.90 2bdi s LEU 33 N -1.03 3.83 0.07 0.00 1.02 -1.09 -1.02 118.68 120.46 2bdi s LEU 33 Ca 0.17 -1.15 0.06 0.00 0.02 0.00 0.00 54.13 53.23 2bdi s LEU 33 Cb -0.13 -1.73 -0.04 0.00 0.02 0.00 0.00 46.19 44.31 2bdi s LEU 33 CO 0.06 -0.24 -0.11 0.68 0.02 0.00 0.00 176.35 176.76 2bdi s VAL 34 N 1.30 3.29 0.00 -1.59 -7.23 -1.15 -1.19 120.40 113.83 2bdi s VAL 34 Ca -0.03 -1.15 0.00 0.00 -1.81 0.00 0.00 61.98 58.99 2bdi s VAL 34 Cb -0.19 -2.48 0.00 0.00 0.56 0.00 0.00 36.38 34.27 2bdi s VAL 34 CO -0.01 0.22 0.00 0.23 -0.31 0.00 0.00 175.10 175.24 2bdi n MET 35 N 1.08 3.76 -0.25 4.82 2.81 0.98 -3.81 117.12 126.52 2bdi n MET 35 Ca -0.15 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.68 2bdi n MET 35 Cb 0.52 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.97 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 -0.26 -0.51 0.03 4.71 -1.26 -3.56 120.64 119.79 2bdi n GLU 36 Ca 0.00 0.89 -0.00 0.00 -0.01 0.00 0.00 57.16 58.04 2bdi n GLU 36 Cb 0.00 -1.32 -0.00 0.00 -1.01 0.00 0.00 31.44 29.11 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 -4.74 -0.01 -4.14 1.62 4.13 -1.26 -5.13 115.26 105.73 2bdi n ASN 37 Ca 0.01 -1.20 -0.09 0.00 1.68 0.00 0.00 54.58 54.98 2bdi n ASN 37 Cb 0.15 -0.03 -0.10 0.00 -1.54 0.00 0.00 39.78 38.26 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 0.76 0.03 3.52 2.12 -1.23 -5.13 118.70 118.77 2bdi s GLU 38 Ca 0.00 -1.31 -0.25 0.00 0.36 0.00 0.00 54.97 53.78 2bdi s GLU 38 Cb 0.00 0.02 -0.05 0.00 0.26 0.00 0.00 34.13 34.36 2bdi s GLU 38 CO -0.00 -0.09 0.76 -1.17 -0.54 0.00 0.00 175.26 174.22 2bdi s LEU 40 N -3.00 4.43 0.00 2.70 1.98 -1.26 -0.01 118.68 123.52 2bdi s LEU 40 Ca 0.12 1.42 0.00 0.00 -2.89 0.00 0.00 54.13 52.77 2bdi s LEU 40 Cb 0.07 -3.21 0.00 0.00 0.66 0.00 0.00 46.19 43.70 2bdi s LEU 40 CO -0.06 -0.00 0.00 2.22 -1.89 0.00 0.00 176.35 176.62 2bdi n PHE 41 N 2.93 0.00 -3.16 5.38 -1.74 -0.34 -4.94 117.46 115.59 2bdi n PHE 41 Ca -0.02 0.00 -0.01 0.00 -0.56 0.00 0.00 57.45 56.86 2bdi n PHE 41 Cb 0.50 0.00 0.00 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 -1.20 0.51 0.31 0.00 0.01 -0.59 -2.66 113.70 110.08 2bdi s SER 43 Ca 0.02 -1.36 -0.12 0.00 1.31 0.00 0.00 55.95 55.80 2bdi s SER 43 Cb -0.00 0.52 0.01 0.00 0.21 0.00 0.00 66.02 66.76 2bdi s SER 43 CO 0.01 -1.06 0.58 -0.83 0.41 0.00 0.00 173.24 172.36 2bdi s GLY 44 N -3.18 0.69 -0.08 3.44 0.00 0.62 -4.14 107.32 104.67 2bdi s GLY 44 Ca 0.33 -0.96 0.02 0.00 0.00 0.00 0.00 44.72 44.11 2bdi s GLY 44 CO 0.16 -0.59 -0.11 0.14 0.00 0.00 0.00 173.10 172.69 2bdi s VAL 45 N -3.33 1.12 -0.58 1.40 1.01 0.38 -0.66 120.40 119.74 2bdi s VAL 45 Ca 0.22 -0.44 -0.27 0.00 0.00 0.00 0.00 61.98 61.48 2bdi s VAL 45 Cb -0.02 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.29 2bdi s VAL 45 CO 0.13 0.36 1.81 -0.22 0.00 0.00 0.00 175.10 177.17 2bdi s LEU 46 N 0.90 3.32 0.00 3.92 2.96 -0.19 0.33 118.68 129.92 2bdi s LEU 46 Ca -0.10 0.42 0.21 0.00 -0.22 0.00 0.00 54.13 54.44 2bdi s LEU 46 Cb -0.15 -2.68 0.36 0.00 0.50 0.00 0.00 46.19 44.21 2bdi s LEU 46 CO 0.01 -2.24 1.31 1.33 -1.32 0.00 0.00 176.35 175.44 2bdi n VAL 47 N 7.19 0.47 -3.57 1.68 0.24 -1.01 -1.66 118.33 121.67 2bdi n VAL 47 Ca 0.20 -0.73 -0.06 0.00 -2.04 0.00 0.00 64.34 61.70 2bdi n VAL 47 Cb 0.51 1.00 -0.03 0.00 -1.47 0.00 0.00 33.84 33.86 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 -1.40 -0.21 0.41 6.34 5.65 -1.19 -4.74 115.29 120.15 2bdi s HIS 48 Ca 0.33 0.19 0.13 0.00 0.25 0.00 0.00 55.06 55.96 2bdi s HIS 48 Cb 0.20 0.51 0.97 0.00 -1.18 0.00 0.00 32.58 33.08 2bdi s HIS 48 CO 0.28 -0.30 1.92 -1.35 -0.65 0.00 0.00 174.74 174.64 2bdi h PRO 49 N 2.08 0.49 -0.14 2.88 0.11 -1.92 -2.80 132.00 132.70 2bdi h PRO 49 Ca -0.14 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.90 2bdi h PRO 49 Cb 1.19 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2bdi h PRO 49 CO 0.26 0.33 -0.13 0.94 -0.21 0.00 0.00 178.00 179.19 2bdi n GLN 50 N -4.49 1.83 -3.75 1.05 7.27 -1.26 -1.46 117.38 116.57 2bdi n GLN 50 Ca 0.14 -2.94 -0.13 0.00 0.07 0.00 0.00 57.00 54.14 2bdi n GLN 50 Cb 0.46 -1.68 -0.14 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 -3.04 -0.22 -0.19 3.69 0.52 -1.06 -1.52 118.94 117.13 2bdi s TRP 51 Ca 0.38 0.57 -0.02 0.00 0.02 0.00 0.00 56.10 57.06 2bdi s TRP 51 Cb 0.34 -0.03 -0.00 0.00 -1.15 0.00 0.00 33.47 32.63 2bdi s TRP 51 CO 0.01 -0.18 -0.11 0.08 0.02 0.00 0.00 176.95 176.77 2bdi s VAL 52 N 1.12 2.91 0.10 4.03 1.01 0.06 -2.39 120.40 127.24 2bdi s VAL 52 Ca -0.08 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.02 2bdi s VAL 52 Cb -0.10 -2.28 -0.07 0.00 0.00 0.00 0.00 36.38 33.93 2bdi s VAL 52 CO -0.06 0.48 0.63 -0.22 0.00 0.00 0.00 175.10 175.93 2bdi s LEU 53 N 1.19 4.55 0.00 3.92 2.96 0.15 -0.14 118.68 131.30 2bdi s LEU 53 Ca 0.02 1.37 -0.12 0.00 -0.22 0.00 0.00 54.13 55.18 2bdi s LEU 53 Cb -0.14 -3.02 0.05 0.00 0.50 0.00 0.00 46.19 43.58 2bdi s LEU 53 CO -0.04 0.25 0.70 -0.24 -1.32 0.00 0.00 176.35 175.70 2bdi n SER 54 N 1.66 -2.03 -4.70 3.68 2.88 0.26 0.14 113.62 115.52 2bdi n SER 54 Ca -0.09 -2.48 -0.40 0.00 -1.33 0.00 0.00 58.87 54.56 2bdi n SER 54 Cb 0.50 3.40 -0.04 0.00 -0.75 0.00 0.00 64.21 67.32 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 -2.05 3.36 0.45 -1.46 0.00 -1.26 0.11 121.76 120.90 2bdi s ALA 55 Ca 0.16 0.16 0.27 0.00 0.00 0.00 0.00 51.96 52.54 2bdi s ALA 55 Cb -0.04 -3.07 1.31 0.00 0.00 0.00 0.00 23.12 21.32 2bdi s ALA 55 CO 0.12 -0.26 1.74 0.00 0.00 0.00 0.00 175.76 177.35 2bdi h ALA 56 N 6.92 2.63 0.00 0.00 0.00 -1.64 0.66 119.26 127.84 2bdi h ALA 56 Ca -0.38 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2bdi h ALA 56 Cb 1.18 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.06 2bdi h ALA 56 CO 0.77 -1.08 0.00 -2.39 0.00 0.00 0.00 179.25 176.56 2bdi n HIS 57 N -4.50 0.00 -0.37 0.00 1.44 -1.26 -2.31 115.22 108.22 2bdi n HIS 57 Ca 0.29 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 56.05 2bdi n HIS 57 Cb 1.14 -0.04 0.14 0.00 0.12 0.00 0.00 29.99 31.35 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 -0.06 2.76 -4.16 0.00 7.35 -0.98 -4.98 117.46 117.39 2bdi n PHE 59 Ca 0.11 0.39 -0.13 0.00 -0.76 0.00 0.00 57.45 57.06 2bdi n PHE 59 Cb 0.50 -2.53 -0.08 0.00 0.35 0.00 0.00 39.48 37.71 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 -1.29 1.45 0.10 -4.13 -1.52 -1.26 -5.05 119.66 107.95 2bdi s GLN 60 Ca 0.59 -1.63 0.12 0.00 -1.95 0.00 0.00 55.36 52.49 2bdi s GLN 60 Cb -0.51 0.34 -0.14 0.00 -0.22 0.00 0.00 33.01 32.48 2bdi s GLN 60 CO 0.56 -0.53 1.07 -0.91 -0.25 0.00 0.00 175.29 175.23 2bdi h ASN 61 N 2.41 0.00 -4.00 5.90 2.35 -1.96 -3.46 115.58 116.82 2bdi h ASN 61 Ca -0.31 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.32 2bdi h ASN 61 Cb 1.25 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 39.38 2bdi h ASN 61 CO 0.45 0.80 -0.20 -0.94 -1.65 0.00 0.00 177.43 175.89 2bdi s SER 62 N -6.30 -0.44 0.24 5.81 1.04 -1.26 -4.59 113.70 108.20 2bdi s SER 62 Ca -0.01 0.81 0.11 0.00 0.48 0.00 0.00 55.95 57.35 2bdi s SER 62 Cb 0.09 0.84 -0.05 0.00 0.10 0.00 0.00 66.02 67.00 2bdi s SER 62 CO 0.80 -0.18 -0.17 -0.31 0.98 0.00 0.00 173.24 174.36 2bdi s TYR 63 N 0.08 2.39 -0.61 5.02 1.51 0.10 -5.00 117.35 120.85 2bdi s TYR 63 Ca -0.01 -0.31 0.04 0.00 -1.01 0.00 0.00 57.07 55.78 2bdi s TYR 63 Cb -0.03 -1.09 0.15 0.00 -0.11 0.00 0.00 41.96 40.88 2bdi s TYR 63 CO 0.01 0.63 0.39 0.99 -1.11 0.00 0.00 175.55 176.45 2bdi s THR 64 N -2.18 2.55 0.04 -0.71 2.01 -1.25 -2.66 115.64 113.46 2bdi s THR 64 Ca 0.27 -3.74 -0.30 0.00 0.31 0.00 0.00 61.69 58.23 2bdi s THR 64 Cb -0.06 -2.72 -0.04 0.00 0.01 0.00 0.00 72.50 69.68 2bdi s THR 64 CO 0.14 -0.94 1.04 -0.63 -0.69 0.00 0.00 174.62 173.55 2bdi s ILE 65 N -0.84 4.53 -0.28 1.82 1.01 -1.04 -2.92 121.20 123.47 2bdi s ILE 65 Ca 0.22 1.87 -0.07 0.00 0.00 0.00 0.00 60.65 62.67 2bdi s ILE 65 Cb -0.13 -4.20 -0.00 0.00 0.01 0.00 0.00 42.46 38.14 2bdi s ILE 65 CO -0.10 0.18 0.08 -0.83 0.00 0.00 0.00 174.94 174.27 2bdi s GLY 66 N 0.80 1.78 0.23 6.18 0.00 -0.19 -1.53 107.32 114.59 2bdi s GLY 66 Ca 0.53 -1.34 0.07 0.00 0.00 0.00 0.00 44.72 43.98 2bdi s GLY 66 CO 0.29 0.61 0.18 1.08 0.00 0.00 0.00 173.10 175.26 2bdi s LEU 67 N 1.55 3.81 -1.77 0.66 1.43 -0.57 -1.71 118.68 122.08 2bdi s LEU 67 Ca 0.04 -0.22 0.00 0.00 -1.03 0.00 0.00 54.13 52.92 2bdi s LEU 67 Cb -0.16 -2.37 0.00 0.00 0.03 0.00 0.00 46.19 43.69 2bdi s LEU 67 CO 0.03 -0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.21 2bdi n GLY 69 N -0.97 1.59 3.96 -3.19 0.00 -1.26 -1.76 105.19 103.57 2bdi n GLY 69 Ca -0.08 -0.22 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.88 3.00 0.00 0.99 1.43 -1.26 -4.11 118.68 114.85 2bdi s LEU 70 Ca 0.00 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 2bdi s LEU 70 Cb 0.00 -2.70 0.00 0.00 0.03 0.00 0.00 46.19 43.52 2bdi s LEU 70 CO 0.00 -1.58 0.00 1.57 0.23 0.00 0.00 176.35 176.57 2bdi n HIS 71 N -2.76 -0.45 -4.29 0.29 -0.00 -1.26 -4.67 115.22 102.08 2bdi n HIS 71 Ca 0.10 0.00 -0.25 0.00 -0.00 0.00 0.00 57.72 57.57 2bdi n HIS 71 Cb 0.60 0.20 -0.08 0.00 -0.00 0.00 0.00 29.99 30.71 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 -2.73 4.41 0.54 0.26 1.04 -1.26 -1.43 113.70 114.53 2bdi s SER 72 Ca 0.00 -0.59 0.33 0.00 0.48 0.00 0.00 55.95 56.16 2bdi s SER 72 Cb 0.00 -0.79 1.44 0.00 0.10 0.00 0.00 66.02 66.77 2bdi s SER 72 CO 0.00 0.06 2.02 -0.07 0.98 0.00 0.00 173.24 176.23 2bdi h LEU 73 N 2.48 0.00 -7.86 2.42 3.38 -1.95 -3.38 115.31 110.40 2bdi h LEU 73 Ca -0.46 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.26 2bdi h LEU 73 Cb 1.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2bdi h LEU 73 CO 0.57 0.05 0.80 -0.62 0.09 0.00 0.00 178.44 179.33 2bdi n GLU 74 N -3.21 0.98 -0.31 1.13 -0.58 -1.26 -4.81 120.64 112.58 2bdi n GLU 74 Ca -0.00 -2.09 0.17 0.00 -0.42 0.00 0.00 57.16 54.82 2bdi n GLU 74 Cb 0.29 -3.70 0.36 0.00 -0.57 0.00 0.00 31.44 27.82 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 10.29 1.48 -0.18 0.62 0.00 -1.95 -1.40 119.26 128.12 2bdi h ALA 74 Ca 0.16 0.25 -0.24 0.00 0.00 0.00 0.00 54.91 55.08 2bdi h ALA 74 Cb 0.93 0.34 -0.09 0.00 0.00 0.00 0.00 17.79 18.97 2bdi h ALA 74 CO 1.24 -0.56 -0.02 -0.40 0.00 0.00 0.00 179.25 179.50 2bdi n ASP 75 N -5.25 5.71 0.00 0.00 5.75 -1.26 -2.06 116.55 119.44 2bdi n ASP 75 Ca 0.25 -2.71 0.00 0.00 -0.01 0.00 0.00 54.79 52.33 2bdi n ASP 75 Cb 0.82 -1.27 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 1.63 0.00 -3.99 0.11 6.02 -0.53 -5.05 117.38 115.58 2bdi n GLN 76 Ca 0.33 -0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 57.02 2bdi n GLN 76 Cb 0.70 -0.19 -0.16 0.00 1.02 0.00 0.00 30.24 31.61 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 2.02 0.00 -1.09 0.41 -0.87 -5.03 118.70 114.14 2bdi s GLU 77 Ca 0.00 -0.75 0.00 0.00 -0.41 0.00 0.00 54.97 53.81 2bdi s GLU 77 Cb 0.00 -2.30 0.00 0.00 -1.78 0.00 0.00 34.13 30.05 2bdi s GLU 77 CO 0.00 -0.39 0.00 -2.30 -0.49 0.00 0.00 175.26 172.08 2bdi n PRO 78 N 4.72 0.00 0.00 0.39 -0.02 -1.26 -2.89 135.00 135.94 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 -0.20 0.00 0.00 -0.02 0.00 0.00 33.50 33.76 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 -4.75 105.19 101.71 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 5.38 -0.13 1.61 1.04 -1.14 -4.74 113.70 114.08 2bdi s SER 80 Ca 0.00 2.59 -0.04 0.00 0.48 0.00 0.00 55.95 58.98 2bdi s SER 80 Cb 0.00 -2.62 0.06 0.00 0.10 0.00 0.00 66.02 63.56 2bdi s SER 80 CO 0.00 -1.48 0.12 -1.10 0.98 0.00 0.00 173.24 171.76 2bdi s GLN 81 N -2.98 0.05 -1.26 4.02 -0.21 -0.72 -4.99 119.66 113.57 2bdi s GLN 81 Ca 0.72 0.18 -0.14 0.00 0.02 0.00 0.00 55.36 56.15 2bdi s GLN 81 Cb -0.36 -1.16 0.14 0.00 1.00 0.00 0.00 33.01 32.63 2bdi s GLN 81 CO 0.42 -0.53 1.63 -1.33 -2.12 0.00 0.00 175.29 173.36 2bdi n MET 82 N 5.30 3.36 -1.48 2.91 2.81 -1.26 -1.51 117.12 127.25 2bdi n MET 82 Ca -0.05 -3.61 -0.30 0.00 -1.81 0.00 0.00 57.70 51.93 2bdi n MET 82 Cb 0.49 -3.12 0.20 0.00 -0.71 0.00 0.00 33.22 30.09 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 1.92 1.81 0.11 2.03 -7.23 -0.58 -4.89 120.40 113.56 2bdi s VAL 83 Ca 0.45 0.00 0.04 0.00 -1.81 0.00 0.00 61.98 60.65 2bdi s VAL 83 Cb 0.02 -2.72 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 2bdi s VAL 83 CO 0.01 0.00 -0.10 -1.61 -0.31 0.00 0.00 175.10 173.10 2bdi s GLU 84 N -5.58 0.89 0.15 4.82 2.02 -1.26 -2.51 118.70 117.23 2bdi s GLU 84 Ca 0.71 -1.25 -0.23 0.00 0.02 0.00 0.00 54.97 54.22 2bdi s GLU 84 Cb -0.08 -0.51 0.07 0.00 0.10 0.00 0.00 34.13 33.71 2bdi s GLU 84 CO 0.54 0.07 0.63 0.00 0.02 0.00 0.00 175.26 176.52 2bdi s ALA 85 N -2.79 -1.60 0.00 5.21 0.00 -1.09 -0.94 121.76 120.55 2bdi s ALA 85 Ca 0.09 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.55 2bdi s ALA 85 Cb -0.01 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.96 2bdi s ALA 85 CO -0.00 -0.77 0.00 -1.13 0.00 0.00 0.00 175.76 173.85 2bdi n SER 86 N -0.37 0.00 -4.58 0.00 3.41 -1.26 -0.72 113.62 110.10 2bdi n SER 86 Ca -0.16 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.02 2bdi n SER 86 Cb 0.64 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.56 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 -0.16 3.86 0.01 1.04 0.20 -1.26 -4.66 118.68 117.71 2bdi s LEU 87 Ca 0.00 0.28 0.08 0.00 0.69 0.00 0.00 54.13 55.17 2bdi s LEU 87 Cb 0.00 -3.34 -0.03 0.00 -0.43 0.00 0.00 46.19 42.40 2bdi s LEU 87 CO 0.00 -1.12 -0.24 -0.94 -0.29 0.00 0.00 176.35 173.76 2bdi s SER 88 N 2.32 3.29 -0.27 3.68 1.04 -1.26 -0.81 113.70 121.69 2bdi s SER 88 Ca 0.41 -0.47 0.02 0.00 0.48 0.00 0.00 55.95 56.39 2bdi s SER 88 Cb -0.09 -0.41 0.07 0.00 0.10 0.00 0.00 66.02 65.69 2bdi s SER 88 CO 0.28 0.29 -0.02 -0.69 0.98 0.00 0.00 173.24 174.09 2bdi s VAL 89 N -0.73 1.73 0.57 5.02 1.01 0.91 -4.98 120.40 123.93 2bdi s VAL 89 Ca 0.11 -1.58 -0.15 0.00 0.00 0.00 0.00 61.98 60.36 2bdi s VAL 89 Cb -0.10 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.15 2bdi s VAL 89 CO 0.01 -0.28 1.02 -0.13 0.00 0.00 0.00 175.10 175.72 2bdi s ARG 90 N 1.26 3.60 0.23 2.72 0.52 -1.26 -1.35 118.95 124.67 2bdi s ARG 90 Ca -0.00 1.02 -0.30 0.00 -0.52 0.00 0.00 55.73 55.93 2bdi s ARG 90 Cb -0.19 -2.08 -0.09 0.00 0.52 0.00 0.00 34.95 33.11 2bdi s ARG 90 CO -0.09 -0.57 1.27 -1.58 0.02 0.00 0.00 175.30 174.36 2bdi s HIS 91 N -2.66 3.28 0.25 -0.53 5.65 -0.85 -4.92 115.29 115.51 2bdi s HIS 91 Ca 0.60 1.33 -0.07 0.00 0.25 0.00 0.00 55.06 57.17 2bdi s HIS 91 Cb -0.13 -3.56 0.41 0.00 -1.18 0.00 0.00 32.58 28.13 2bdi s HIS 91 CO 0.38 -1.65 1.41 -2.30 -0.65 0.00 0.00 174.74 171.93 2bdi n PRO 92 N 2.13 -0.08 -0.24 2.88 -0.02 -1.26 -0.74 135.00 137.67 2bdi n PRO 92 Ca 0.04 1.40 0.05 0.00 -2.02 0.00 0.00 63.50 62.97 2bdi n PRO 92 Cb 0.43 -2.10 0.16 0.00 -0.02 0.00 0.00 33.50 31.97 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 -5.47 2.07 -1.63 -0.52 -0.58 -1.26 -4.98 120.64 108.27 2bdi n GLU 93 Ca 0.14 -1.24 -0.40 0.00 -0.42 0.00 0.00 57.16 55.24 2bdi n GLU 93 Cb 0.45 -1.44 0.02 0.00 -0.57 0.00 0.00 31.44 29.90 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 0.40 1.25 -1.37 -0.32 9.36 0.08 -1.95 117.16 124.61 2bdi n TYR 94 Ca 0.11 0.51 -0.14 0.00 3.32 0.00 0.00 57.90 61.71 2bdi n TYR 94 Cb 0.40 -2.23 -0.06 0.00 -0.63 0.00 0.00 39.34 36.82 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 0.14 -5.28 -3.61 2.98 2.85 0.42 -4.92 115.26 107.84 2bdi n ASN 95 Ca 0.10 0.34 -0.29 0.00 -0.11 0.00 0.00 54.58 54.61 2bdi n ASN 95 Cb 0.41 -4.19 -0.15 0.00 1.24 0.00 0.00 39.78 37.10 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 -3.11 0.47 1.03 1.20 1.81 -0.82 -2.84 118.95 116.69 2bdi s ARG 96 Ca 0.00 -0.89 -0.13 0.00 -1.72 0.00 0.00 55.73 52.99 2bdi s ARG 96 Cb 0.00 -1.54 0.21 0.00 -0.45 0.00 0.00 34.95 33.17 2bdi s ARG 96 CO 0.00 -1.03 1.10 -2.14 -0.68 0.00 0.00 175.30 172.54 2bdi s PRO 97 N 1.73 0.14 0.03 3.54 0.02 -1.26 -4.86 135.00 134.33 2bdi s PRO 97 Ca 0.11 0.41 -0.37 0.00 0.02 0.00 0.00 61.00 61.16 2bdi s PRO 97 Cb -0.18 -1.71 -0.17 0.00 0.02 0.00 0.00 34.50 32.46 2bdi s PRO 97 CO -0.27 -2.90 1.40 -0.11 -0.33 0.00 0.00 177.00 174.79 2bdi n LEU 98 N -4.28 1.73 0.00 -5.54 7.94 -1.13 -0.61 117.00 115.11 2bdi n LEU 98 Ca 0.06 1.11 0.00 0.00 -1.11 0.00 0.00 56.01 56.07 2bdi n LEU 98 Cb 0.58 -1.18 0.00 0.00 0.53 0.00 0.00 43.42 43.35 2bdi n LEU 98 CO 0.56 -0.97 0.00 0.18 -1.11 0.00 0.00 177.39 176.05 2bdi n LEU 99 N 2.94 0.00 -4.75 -1.96 4.77 -1.26 -4.95 117.00 111.78 2bdi n LEU 99 Ca 0.20 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.89 2bdi n LEU 99 Cb 0.18 -0.05 0.16 0.00 -2.33 0.00 0.00 43.42 41.38 2bdi n LEU 99 CO 0.65 0.00 0.70 0.00 -1.33 0.00 0.00 177.39 177.41 2bdi s ALA 100 N -1.72 1.51 -1.56 -1.18 0.00 0.22 -4.14 121.76 114.89 2bdi s ALA 100 Ca 0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 51.96 51.29 2bdi s ALA 100 Cb 0.00 -3.01 0.06 0.00 0.00 0.00 0.00 23.12 20.17 2bdi s ALA 100 CO 0.00 -2.56 0.43 0.09 0.00 0.00 0.00 175.76 173.72 2bdi n ASN 101 N -3.96 -0.89 -2.19 0.00 4.13 -1.26 -0.43 115.26 110.65 2bdi n ASN 101 Ca 0.08 -1.09 -0.14 0.00 1.68 0.00 0.00 54.58 55.10 2bdi n ASN 101 Cb 0.59 -2.51 -0.14 0.00 -1.54 0.00 0.00 39.78 36.18 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 -2.84 5.20 -4.35 6.41 2.03 -1.26 -4.24 116.55 117.50 2bdi n ASP 102 Ca -0.18 -2.41 -0.23 0.00 0.52 0.00 0.00 54.79 52.48 2bdi n ASP 102 Cb 0.62 -1.32 -0.11 0.00 -0.72 0.00 0.00 41.12 39.58 2bdi n ASP 102 CO 0.00 0.00 0.00 -1.48 -1.92 0.00 0.00 177.20 173.80 2bdi s LEU 103 N 0.02 2.42 -0.13 -2.67 2.34 -1.26 -2.65 118.68 116.75 2bdi s LEU 103 Ca 0.62 -0.84 -0.10 0.00 0.06 0.00 0.00 54.13 53.87 2bdi s LEU 103 Cb 0.28 -0.91 0.04 0.00 -0.56 0.00 0.00 46.19 45.03 2bdi s LEU 103 CO -0.01 0.01 0.33 -0.32 -1.06 0.00 0.00 176.35 175.30 2bdi s MET 104 N -2.65 0.35 -0.20 1.48 1.75 0.30 -2.00 119.30 118.32 2bdi s MET 104 Ca 0.16 0.53 -0.13 0.00 -1.25 0.00 0.00 55.69 54.99 2bdi s MET 104 Cb -0.07 0.10 -0.05 0.00 2.84 0.00 0.00 34.83 37.65 2bdi s MET 104 CO 0.07 -0.09 0.28 -0.51 -0.65 0.00 0.00 175.02 174.12 2bdi s LEU 105 N 0.58 4.17 -0.24 4.11 1.43 -0.45 -0.57 118.68 127.70 2bdi s LEU 105 Ca -0.03 0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 53.37 2bdi s LEU 105 Cb -0.05 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 2bdi s LEU 105 CO -0.03 0.04 0.08 -0.63 0.23 0.00 0.00 176.35 176.03 2bdi s ILE 106 N 0.92 4.45 -0.26 -0.59 1.01 0.80 -0.06 121.20 127.46 2bdi s ILE 106 Ca 0.14 -0.13 -0.19 0.00 0.00 0.00 0.00 60.65 60.47 2bdi s ILE 106 Cb -0.14 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.24 2bdi s ILE 106 CO 0.05 0.34 0.59 -0.75 0.00 0.00 0.00 174.94 175.17 2bdi s LYS 107 N 1.50 4.07 0.44 2.79 2.20 0.01 -0.76 119.74 129.98 2bdi s LYS 107 Ca 0.06 0.44 -0.23 0.00 -0.36 0.00 0.00 55.97 55.88 2bdi s LYS 107 Cb -0.15 -3.66 -0.08 0.00 -1.51 0.00 0.00 37.83 32.43 2bdi s LYS 107 CO 0.04 -0.41 1.07 -0.51 -0.36 0.00 0.00 175.35 175.19 2bdi s LEU 108 N 2.44 4.03 0.07 5.43 1.43 -0.58 -4.05 118.68 127.45 2bdi s LEU 108 Ca 0.24 2.07 -0.37 0.00 -1.03 0.00 0.00 54.13 55.04 2bdi s LEU 108 Cb -0.15 -4.30 -0.20 0.00 0.03 0.00 0.00 46.19 41.57 2bdi s LEU 108 CO 0.09 -0.68 1.56 0.44 0.23 0.00 0.00 176.35 178.00 2bdi h ASP 109 N 2.13 -1.21 -3.44 2.29 3.45 -1.38 -3.40 116.42 114.86 2bdi h ASP 109 Ca -0.49 0.06 -0.65 0.00 0.43 0.00 0.00 57.03 56.38 2bdi h ASP 109 Cb 1.22 0.34 -0.25 0.00 -0.56 0.00 0.00 39.33 40.08 2bdi h ASP 109 CO 0.61 -0.79 -0.69 -0.70 -1.57 0.00 0.00 179.24 176.10 2bdi s GLU 110 N -5.94 3.51 0.25 3.56 2.12 -1.26 -5.09 118.70 115.85 2bdi s GLU 110 Ca -0.19 -0.57 -0.30 0.00 0.36 0.00 0.00 54.97 54.27 2bdi s GLU 110 Cb 0.03 -3.06 -0.14 0.00 0.26 0.00 0.00 34.13 31.22 2bdi s GLU 110 CO 0.60 -0.09 1.16 0.45 -0.54 0.00 0.00 175.26 176.84 2bdi n SER 111 N 4.52 1.76 -4.96 -1.70 2.88 -1.26 -4.96 113.62 109.90 2bdi n SER 111 Ca -0.17 1.16 -0.22 0.00 -1.33 0.00 0.00 58.87 58.31 2bdi n SER 111 Cb 0.51 -1.32 -0.00 0.00 -0.75 0.00 0.00 64.21 62.66 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 -0.61 4.37 -0.31 2.46 -7.23 -0.54 -4.97 120.40 113.57 2bdi s VAL 112 Ca 0.64 -0.65 -0.09 0.00 -1.81 0.00 0.00 61.98 60.07 2bdi s VAL 112 Cb -0.72 -3.58 -0.00 0.00 0.56 0.00 0.00 36.38 32.64 2bdi s VAL 112 CO 0.56 -0.34 0.14 -0.44 -0.31 0.00 0.00 175.10 174.70 2bdi s SER 113 N -4.15 5.45 -0.63 4.85 0.01 -1.26 -4.82 113.70 113.16 2bdi s SER 113 Ca 0.44 -0.60 -0.30 0.00 1.31 0.00 0.00 55.95 56.80 2bdi s SER 113 Cb -0.10 -1.97 -0.13 0.00 0.21 0.00 0.00 66.02 64.03 2bdi s SER 113 CO 0.35 -0.21 2.45 -0.62 0.41 0.00 0.00 173.24 175.63 2bdi n GLU 114 N 4.95 0.69 -0.17 12.44 1.02 -1.26 -4.91 120.64 133.41 2bdi n GLU 114 Ca -0.14 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 2bdi n GLU 114 Cb 0.49 -2.52 0.00 0.00 -0.02 0.00 0.00 31.44 29.39 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 12.47 0.00 -0.04 1.62 3.41 -0.20 -4.93 113.62 125.94 2bdi n SER 115 Ca 0.48 -0.22 -0.16 0.00 -0.26 0.00 0.00 58.87 58.70 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 0.95 -0.52 4.04 -0.00 -1.95 -3.21 116.42 115.73 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 1.39 0.00 0.35 -0.00 0.00 0.00 179.24 180.98 2bdi n THR 117 N -3.95 0.82 -3.57 2.25 -2.24 -1.26 -4.82 114.28 101.50 2bdi n THR 117 Ca -0.07 -0.91 -0.29 0.00 -2.27 0.00 0.00 64.05 60.51 2bdi n THR 117 Cb 0.71 0.66 -0.15 0.00 -2.10 0.00 0.00 70.33 69.46 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 -1.12 0.19 0.11 2.28 1.01 -1.21 -4.04 121.20 118.42 2bdi s ILE 118 Ca 0.38 -1.08 0.05 0.00 0.00 0.00 0.00 60.65 60.01 2bdi s ILE 118 Cb 0.21 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.48 2bdi s ILE 118 CO 0.28 -0.76 -0.13 -0.60 0.00 0.00 0.00 174.94 173.73 2bdi s ARG 119 N 1.81 0.96 0.39 2.79 3.52 -0.97 -1.04 118.95 126.41 2bdi s ARG 119 Ca 0.11 -1.20 -0.02 0.00 -0.13 0.00 0.00 55.73 54.48 2bdi s ARG 119 Cb -0.18 -0.79 -0.04 0.00 -1.56 0.00 0.00 34.95 32.39 2bdi s ARG 119 CO -0.28 0.15 0.63 -1.54 -0.81 0.00 0.00 175.30 173.45 2bdi s SER 120 N -2.43 6.30 0.19 -2.12 1.04 -1.26 -2.65 113.70 112.78 2bdi s SER 120 Ca 0.07 0.64 0.10 0.00 0.48 0.00 0.00 55.95 57.25 2bdi s SER 120 Cb -0.04 -2.12 -0.04 0.00 0.10 0.00 0.00 66.02 63.91 2bdi s SER 120 CO 0.02 -0.39 -0.21 -0.51 0.98 0.00 0.00 173.24 173.14 2bdi s ILE 121 N -2.45 2.12 0.15 -1.02 2.07 -0.66 -4.91 121.20 116.49 2bdi s ILE 121 Ca 0.43 -2.05 0.01 0.00 -1.41 0.00 0.00 60.65 57.63 2bdi s ILE 121 Cb -0.10 -2.03 -0.04 0.00 0.13 0.00 0.00 42.46 40.42 2bdi s ILE 121 CO 0.39 -0.27 0.29 -0.94 -1.91 0.00 0.00 174.94 172.51 2bdi s SER 122 N -2.83 6.35 -0.10 4.50 1.04 -1.26 -4.49 113.70 116.91 2bdi s SER 122 Ca 0.20 0.23 -0.19 0.00 0.48 0.00 0.00 55.95 56.67 2bdi s SER 122 Cb -0.06 -1.94 -0.04 0.00 0.10 0.00 0.00 66.02 64.08 2bdi s SER 122 CO 0.09 0.05 0.53 -0.63 0.98 0.00 0.00 173.24 174.26 2bdi s ILE 123 N -1.73 5.14 0.29 -1.02 1.01 -1.26 -0.57 121.20 123.06 2bdi s ILE 123 Ca 0.35 1.08 -0.30 0.00 0.00 0.00 0.00 60.65 61.78 2bdi s ILE 123 Cb -0.11 -3.87 -0.13 0.00 0.01 0.00 0.00 42.46 38.36 2bdi s ILE 123 CO 0.28 0.32 1.39 0.00 0.00 0.00 0.00 174.94 176.93 2bdi n ALA 124 N 3.64 1.45 0.28 9.38 0.00 0.30 -4.81 120.51 130.74 2bdi n ALA 124 Ca -0.06 0.38 0.11 0.00 0.00 0.00 0.00 53.44 53.87 2bdi n ALA 124 Cb 0.52 -2.30 -0.14 0.00 0.00 0.00 0.00 19.45 17.52 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 1.57 0.31 -4.93 0.00 3.41 -1.26 -4.18 113.62 108.54 2bdi n SER 125 Ca 0.08 -0.26 -0.26 0.00 -0.26 0.00 0.00 58.87 58.17 2bdi n SER 125 Cb 0.34 1.65 -0.02 0.00 -0.26 0.00 0.00 64.21 65.92 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 -3.37 3.53 0.23 4.33 0.74 -1.26 -4.92 119.66 118.95 2bdi s GLN 127 Ca -0.03 -0.26 -0.09 0.00 0.05 0.00 0.00 55.36 55.03 2bdi s GLN 127 Cb 0.14 -2.72 -0.07 0.00 1.10 0.00 0.00 33.01 31.47 2bdi s GLN 127 CO 0.89 0.25 0.55 0.00 -0.55 0.00 0.00 175.29 176.43 2bdi n PRO 129 N -0.15 0.28 -4.96 0.00 -0.02 -1.26 -4.98 135.00 123.91 2bdi n PRO 129 Ca 0.00 0.10 -0.32 0.00 -2.02 0.00 0.00 63.50 61.26 2bdi n PRO 129 Cb 0.52 -1.19 -0.15 0.00 -0.02 0.00 0.00 33.50 32.66 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 -1.19 2.71 0.38 3.45 -4.23 -1.26 -5.08 115.64 110.42 2bdi s THR 130 Ca 0.62 -0.80 -0.26 0.00 -1.18 0.00 0.00 61.69 60.06 2bdi s THR 130 Cb -0.80 -2.09 -0.11 0.00 1.34 0.00 0.00 72.50 70.84 2bdi s THR 130 CO 0.58 0.55 1.22 0.00 -0.54 0.00 0.00 174.62 176.43 2bdi n ALA 132 N 3.23 1.01 0.00 3.99 0.00 -1.26 -1.96 120.51 125.51 2bdi n ALA 132 Ca -0.18 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.57 2bdi n ALA 132 Cb 0.53 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.76 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 0.88 2.77 3.71 0.00 0.00 0.42 -4.89 105.19 108.08 2bdi n GLY 133 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 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 0.49 3.23 -4.74 1.61 2.85 -0.83 -4.49 115.26 113.38 2bdi n ASN 134 Ca 0.00 1.16 -0.36 0.00 -0.11 0.00 0.00 54.58 55.28 2bdi n ASN 134 Cb 0.00 -1.51 -0.08 0.00 1.24 0.00 0.00 39.78 39.43 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 0.22 6.30 0.37 1.20 0.15 -1.26 -0.14 113.70 120.53 2bdi s SER 135 Ca 0.63 0.34 0.04 0.00 0.70 0.00 0.00 55.95 57.66 2bdi s SER 135 Cb -0.57 -2.12 -0.06 0.00 -1.71 0.00 0.00 66.02 61.57 2bdi s SER 135 CO 0.53 0.18 0.06 0.00 1.20 0.00 0.00 173.24 175.20 2bdi s LEU 137 N -3.57 2.26 0.03 0.00 2.96 -0.34 -0.14 118.68 119.87 2bdi s LEU 137 Ca 0.32 -0.64 0.01 0.00 -0.22 0.00 0.00 54.13 53.61 2bdi s LEU 137 Cb 0.07 -0.92 -0.02 0.00 0.50 0.00 0.00 46.19 45.83 2bdi s LEU 137 CO 0.15 0.09 -0.06 0.54 -1.32 0.00 0.00 176.35 175.75 2bdi s VAL 138 N -1.05 0.38 0.04 1.68 0.11 -0.56 -0.18 120.40 120.82 2bdi s VAL 138 Ca 0.07 -0.90 -0.01 0.00 -2.93 0.00 0.00 61.98 58.22 2bdi s VAL 138 Cb -0.10 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.26 2bdi s VAL 138 CO 0.03 -0.35 -0.03 -0.94 -3.33 0.00 0.00 175.10 170.49 2bdi s SER 139 N -1.32 0.39 0.00 3.54 1.04 -1.21 -1.40 113.70 114.74 2bdi s SER 139 Ca -0.10 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.52 2bdi s SER 139 Cb -0.09 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.20 2bdi s SER 139 CO -0.00 -0.49 0.00 0.61 0.98 0.00 0.00 173.24 174.34 2bdi n GLY 140 N 0.66 0.34 1.49 7.32 0.00 -0.47 -4.24 105.19 110.30 2bdi n GLY 140 Ca -0.18 -1.01 0.08 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.42 1.60 -1.04 1.61 8.01 -1.26 -1.55 117.44 124.39 2bdi n TRP 141 Ca 0.00 -0.76 -0.30 0.00 -1.31 0.00 0.00 57.50 55.13 2bdi n TRP 141 Cb 0.00 -0.41 0.23 0.00 -2.01 0.00 0.00 31.31 29.12 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 -1.20 1.57 0.49 6.99 0.00 -1.22 -4.30 107.32 109.65 2bdi s GLY 142 Ca 0.49 -0.77 -0.22 0.00 0.00 0.00 0.00 44.72 44.22 2bdi s GLY 142 CO 0.14 0.05 0.90 1.04 0.00 0.00 0.00 173.10 175.23 2bdi n LEU 143 N -4.68 2.45 -5.00 0.66 4.32 0.98 -3.06 117.00 112.67 2bdi n LEU 143 Ca 0.11 0.93 -0.19 0.00 -0.02 0.00 0.00 56.01 56.83 2bdi n LEU 143 Cb 0.59 -1.32 0.03 0.00 -1.62 0.00 0.00 43.42 41.10 2bdi n LEU 143 CO 0.49 -1.89 0.27 -0.76 -1.22 0.00 0.00 177.39 174.27 2bdi s LEU 144 N -0.57 3.43 0.56 2.23 1.43 1.00 -1.51 118.68 125.24 2bdi s LEU 144 Ca 0.67 -0.35 0.31 0.00 -1.03 0.00 0.00 54.13 53.73 2bdi s LEU 144 Cb -0.51 -2.55 1.46 0.00 0.03 0.00 0.00 46.19 44.63 2bdi s LEU 144 CO 0.54 -1.02 1.86 0.00 0.23 0.00 0.00 176.35 177.96 2bdi h ALA 145 N 0.33 2.63 -0.16 4.21 0.00 -1.87 0.44 119.26 124.84 2bdi h ALA 145 Ca -0.39 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2bdi h ALA 145 Cb 1.29 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2bdi h ALA 145 CO 0.46 -1.02 0.00 0.27 0.00 0.00 0.00 179.25 178.96 2bdi n ASN 146 N -4.00 1.26 -0.48 0.00 0.23 -1.26 -4.88 115.26 106.13 2bdi n ASN 146 Ca 0.15 -1.74 -0.06 0.00 -0.53 0.00 0.00 54.58 52.40 2bdi n ASN 146 Cb 0.90 -0.10 -0.03 0.00 -2.08 0.00 0.00 39.78 38.47 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 1.00 0.86 3.52 4.83 0.00 0.16 -5.00 105.19 110.55 2bdi n GLY 147 Ca 0.14 -0.63 -0.28 0.00 0.00 0.00 0.00 46.02 45.24 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 -2.37 1.88 0.10 1.61 3.00 -1.25 -4.76 118.95 117.16 2bdi s ARG 150 Ca 0.00 -1.23 -0.27 0.00 -1.00 0.00 0.00 55.73 53.23 2bdi s ARG 150 Cb 0.00 -2.12 -0.06 0.00 0.00 0.00 0.00 34.95 32.77 2bdi s ARG 150 CO 0.00 0.46 0.85 -1.64 0.00 0.00 0.00 175.30 174.96 2bdi s MET 151 N -2.43 4.60 0.72 5.12 -1.94 -1.26 -0.00 119.30 124.10 2bdi s MET 151 Ca 0.21 1.24 -0.11 0.00 -1.71 0.00 0.00 55.69 55.31 2bdi s MET 151 Cb -0.10 -3.35 0.02 0.00 2.01 0.00 0.00 34.83 33.42 2bdi s MET 151 CO 0.12 0.32 1.08 -1.25 -0.01 0.00 0.00 175.02 175.28 2bdi s PRO 152 N -0.27 2.76 0.01 2.03 0.04 -1.26 -4.95 135.00 133.35 2bdi s PRO 152 Ca 0.41 0.60 0.16 0.00 0.04 0.00 0.00 61.00 62.21 2bdi s PRO 152 Cb -0.22 -2.00 -0.18 0.00 0.04 0.00 0.00 34.50 32.14 2bdi s PRO 152 CO 0.26 -1.13 0.71 0.25 0.04 0.00 0.00 177.00 177.13 2bdi n THR 153 N -3.10 1.31 -4.45 1.26 -2.24 -1.26 -4.95 114.28 100.84 2bdi n THR 153 Ca 0.07 -0.73 -0.22 0.00 -2.27 0.00 0.00 64.05 60.90 2bdi n THR 153 Cb 0.56 -0.80 -0.10 0.00 -2.10 0.00 0.00 70.33 67.89 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 -2.80 1.51 0.20 2.28 -7.23 -1.26 -3.85 120.40 109.25 2bdi s VAL 154 Ca -0.04 -2.07 -0.32 0.00 -1.81 0.00 0.00 61.98 57.75 2bdi s VAL 154 Cb 0.08 -2.62 -0.11 0.00 0.56 0.00 0.00 36.38 34.28 2bdi s VAL 154 CO 0.82 -0.17 1.68 -0.22 -0.31 0.00 0.00 175.10 176.90 2bdi s LEU 155 N -3.48 4.37 0.21 1.32 2.96 -0.52 -4.85 118.68 118.69 2bdi s LEU 155 Ca 0.32 2.80 0.01 0.00 -0.22 0.00 0.00 54.13 57.04 2bdi s LEU 155 Cb 0.06 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.12 2bdi s LEU 155 CO 0.14 -0.93 0.37 -1.10 -1.32 0.00 0.00 176.35 173.51 2bdi s GLN 156 N 1.17 3.48 -0.02 1.98 -1.52 -0.60 -1.25 119.66 122.90 2bdi s GLN 156 Ca 0.73 -0.48 0.03 0.00 -1.95 0.00 0.00 55.36 53.70 2bdi s GLN 156 Cb -0.48 -2.87 -0.00 0.00 -0.22 0.00 0.00 33.01 29.44 2bdi s GLN 156 CO 0.32 0.42 -0.12 0.00 -0.25 0.00 0.00 175.29 175.66 2bdi s VAL 158 N -0.04 0.00 -0.08 0.00 0.11 -0.49 -0.96 120.40 118.94 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 33.75 2bdi s VAL 158 CO 0.00 0.00 -0.07 0.20 -3.33 0.00 0.00 175.10 171.90 2bdi s ASN 159 N -2.25 4.63 -0.00 3.54 -0.87 -1.26 -1.50 114.94 117.23 2bdi s ASN 159 Ca -0.03 -0.04 -0.06 0.00 -1.57 0.00 0.00 52.86 51.16 2bdi s ASN 159 Cb -0.01 -1.24 -0.00 0.00 -0.02 0.00 0.00 41.25 39.98 2bdi s ASN 159 CO -0.06 0.34 0.11 0.68 -2.57 0.00 0.00 177.10 175.60 2bdi s VAL 160 N -0.65 0.07 0.09 1.60 -7.23 0.80 -4.88 120.40 110.20 2bdi s VAL 160 Ca 0.10 -0.61 0.03 0.00 -1.81 0.00 0.00 61.98 59.68 2bdi s VAL 160 Cb -0.11 -0.36 -0.04 0.00 0.56 0.00 0.00 36.38 36.42 2bdi s VAL 160 CO 0.02 -0.34 0.11 -0.44 -0.31 0.00 0.00 175.10 174.14 2bdi s SER 161 N -1.16 5.66 0.34 4.85 0.01 -1.26 -0.95 113.70 121.19 2bdi s SER 161 Ca -0.12 0.02 -0.29 0.00 1.31 0.00 0.00 55.95 56.87 2bdi s SER 161 Cb -0.07 -1.55 -0.11 0.00 0.21 0.00 0.00 66.02 64.50 2bdi s SER 161 CO 0.01 0.16 1.44 -0.69 0.41 0.00 0.00 173.24 174.57 2bdi s VAL 162 N -1.45 2.31 0.03 3.43 1.01 0.80 -0.15 120.40 126.39 2bdi s VAL 162 Ca 0.30 0.30 -0.01 0.00 0.00 0.00 0.00 61.98 62.58 2bdi s VAL 162 Cb -0.12 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2bdi s VAL 162 CO 0.23 0.07 0.19 -0.69 0.00 0.00 0.00 175.10 174.90 2bdi s VAL 163 N -0.89 5.35 0.68 2.92 1.01 -0.94 -0.44 120.40 128.09 2bdi s VAL 163 Ca 0.53 -0.30 -0.16 0.00 0.00 0.00 0.00 61.98 62.05 2bdi s VAL 163 Cb -0.44 -3.56 0.01 0.00 0.00 0.00 0.00 36.38 32.39 2bdi s VAL 163 CO 0.56 0.23 1.19 -0.94 0.00 0.00 0.00 175.10 176.14 2bdi s SER 164 N -2.22 4.66 0.23 3.32 1.04 -1.26 -4.63 113.70 114.83 2bdi s SER 164 Ca 0.31 2.30 -0.07 0.00 0.48 0.00 0.00 55.95 58.96 2bdi s SER 164 Cb -0.13 -2.58 0.31 0.00 0.10 0.00 0.00 66.02 63.71 2bdi s SER 164 CO 0.23 -1.95 1.82 -0.08 0.98 0.00 0.00 173.24 174.24 2bdi h GLU 165 N 0.11 0.76 0.74 4.02 4.81 -1.98 -0.52 114.58 122.52 2bdi h GLU 165 Ca -0.48 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 2bdi h GLU 165 Cb 1.29 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.49 2bdi h GLU 165 CO 0.52 0.50 -0.43 1.49 -0.73 0.00 0.00 179.01 180.36 2bdi h GLU 166 N 0.78 -1.05 -0.56 1.92 4.81 -1.99 0.13 114.58 118.62 2bdi h GLU 166 Ca 0.34 0.07 0.09 0.00 -0.13 0.00 0.00 59.36 59.73 2bdi h GLU 166 Cb 0.23 0.24 -0.07 0.00 0.63 0.00 0.00 28.75 29.78 2bdi h GLU 166 CO -0.20 -0.70 0.19 0.28 -0.73 0.00 0.00 179.01 177.85 2bdi h VAL 167 N -1.09 0.77 -0.63 0.32 2.07 -1.79 -1.62 116.25 114.28 2bdi h VAL 167 Ca -0.10 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.32 2bdi h VAL 167 Cb 0.87 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 2bdi h VAL 167 CO 0.11 0.07 0.40 0.00 0.02 0.00 0.00 177.57 178.16 2bdi h SER 169 N 0.79 0.03 0.13 0.00 4.64 -0.34 -2.42 113.55 116.39 2bdi h SER 169 Ca 0.24 -0.02 -0.24 0.00 -0.47 0.00 0.00 61.79 61.31 2bdi h SER 169 Cb -0.02 -0.01 0.03 0.00 -0.31 0.00 0.00 62.40 62.09 2bdi h SER 169 CO -0.08 0.67 -1.01 0.11 -0.87 0.00 0.00 176.83 175.65 2bdi h LYS 170 N 0.02 0.45 0.00 4.77 1.57 -1.04 0.13 116.57 122.47 2bdi h LYS 170 Ca -0.01 -0.66 -0.00 0.00 -1.87 0.00 0.00 60.65 58.11 2bdi h LYS 170 Cb 1.15 0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.69 2bdi h LYS 170 CO 0.09 1.29 -0.01 -0.07 -0.57 0.00 0.00 179.45 180.17 2bdi h LEU 171 N -0.07 0.00 -2.22 2.94 3.38 -0.47 -2.94 115.31 115.93 2bdi h LEU 171 Ca -0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2bdi h LEU 171 Cb 1.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.50 2bdi h LEU 171 CO 0.19 0.01 0.00 -1.22 0.09 0.00 0.00 178.44 177.51 2bdi n TYR 172 N -3.21 0.00 -1.69 1.13 4.01 -0.92 -5.01 117.16 111.47 2bdi n TYR 172 Ca -0.02 -0.31 -0.41 0.00 -0.16 0.00 0.00 57.90 56.99 2bdi n TYR 172 Cb 0.14 -0.03 0.01 0.00 -0.31 0.00 0.00 39.34 39.14 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 -0.31 2.46 -1.36 7.72 -0.08 0.44 -0.75 116.55 124.67 2bdi n ASP 173 Ca 0.00 1.12 0.11 0.00 -1.51 0.00 0.00 54.79 54.51 2bdi n ASP 173 Cb 0.30 -1.48 0.32 0.00 2.34 0.00 0.00 41.12 42.60 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 0.16 2.88 0.08 -0.67 -0.04 -1.26 -4.84 135.00 131.31 2bdi n PRO 174 Ca 0.06 -2.59 0.12 0.00 -0.04 0.00 0.00 63.50 61.06 2bdi n PRO 174 Cb 0.39 -1.63 0.46 0.00 -0.04 0.00 0.00 33.50 32.68 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 1.45 0.54 -4.76 1.53 4.77 0.07 -4.88 117.00 115.72 2bdi n LEU 175 Ca 0.24 0.58 -0.41 0.00 -0.03 0.00 0.00 56.01 56.39 2bdi n LEU 175 Cb 0.66 -0.44 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2bdi n LEU 175 CO 0.18 -0.26 0.89 -0.47 -1.33 0.00 0.00 177.39 176.40 2bdi s TYR 176 N -3.13 3.34 0.08 -1.77 6.14 -0.46 -4.88 117.35 116.67 2bdi s TYR 176 Ca 0.09 1.51 0.01 0.00 0.64 0.00 0.00 57.07 59.32 2bdi s TYR 176 Cb 0.12 -3.47 -0.04 0.00 0.42 0.00 0.00 41.96 38.99 2bdi s TYR 176 CO 0.49 -1.23 -0.06 -1.58 0.64 0.00 0.00 175.55 173.82 2bdi s HIS 177 N -0.86 0.76 -1.14 4.97 2.46 -1.26 -4.95 115.29 115.27 2bdi s HIS 177 Ca 0.48 -0.92 0.02 0.00 0.47 0.00 0.00 55.06 55.12 2bdi s HIS 177 Cb -0.35 -0.47 0.11 0.00 -0.13 0.00 0.00 32.58 31.74 2bdi s HIS 177 CO 0.44 -0.21 1.02 -2.30 -2.47 0.00 0.00 174.74 171.22 2bdi n PRO 178 N 0.15 0.01 -0.65 2.88 -0.02 -1.26 -1.29 135.00 134.83 2bdi n PRO 178 Ca -0.14 0.39 0.03 0.00 -2.02 0.00 0.00 63.50 61.76 2bdi n PRO 178 Cb 0.60 -1.50 0.26 0.00 -0.02 0.00 0.00 33.50 32.85 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 -1.43 4.20 -3.99 2.55 3.41 -1.26 -4.77 113.62 112.33 2bdi n SER 179 Ca 0.01 -2.69 -0.10 0.00 -0.26 0.00 0.00 58.87 55.83 2bdi n SER 179 Cb 0.03 -0.64 -0.07 0.00 -0.26 0.00 0.00 64.21 63.26 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 -2.22 1.18 0.09 4.33 0.23 -0.41 -1.36 119.30 121.13 2bdi s MET 180 Ca 0.38 -1.22 -0.23 0.00 -1.03 0.00 0.00 55.69 53.59 2bdi s MET 180 Cb 0.29 0.37 0.06 0.00 -1.53 0.00 0.00 34.83 34.02 2bdi s MET 180 CO 0.11 -0.43 0.55 -0.59 -2.03 0.00 0.00 175.02 172.63 2bdi s PHE 181 N -3.99 -0.47 0.11 3.16 -0.12 -0.41 -4.68 117.98 111.58 2bdi s PHE 181 Ca 0.19 0.42 0.05 0.00 -0.05 0.00 0.00 56.93 57.54 2bdi s PHE 181 Cb 0.03 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 2bdi s PHE 181 CO 0.01 -0.72 0.03 0.00 -0.05 0.00 0.00 175.22 174.48 2bdi s ALA 183 N -1.43 -1.23 0.00 0.00 0.00 -0.66 -2.22 121.76 116.23 2bdi s ALA 183 Ca 0.27 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.54 2bdi s ALA 183 Cb -0.11 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.32 2bdi s ALA 183 CO 0.19 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.12 2bdi n GLY 184 N 2.56 0.13 1.90 0.00 0.00 0.78 -2.52 105.19 108.04 2bdi n GLY 184 Ca -0.14 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.41 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 0.59 3.80 -0.02 0.00 -1.26 -4.51 105.19 103.79 2bdi n GLY 185 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.99 1.70 0.39 -0.02 0.00 -1.26 0.01 107.32 106.14 2bdi s GLY 186 Ca 0.00 -1.08 0.20 0.00 0.00 0.00 0.00 44.72 43.84 2bdi s GLY 186 CO 0.00 -0.28 1.77 -1.61 0.00 0.00 0.00 173.10 172.98 2bdi h GLN 186 N -1.99 0.00 0.00 2.90 5.75 -1.95 -2.62 115.11 117.21 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 0.38 0.34 0.00 -0.40 -2.65 0.00 0.00 178.83 176.49 2bdi n ASP 186 N -3.53 0.00 -4.01 -0.69 3.85 -1.26 -4.85 116.55 106.06 2bdi n ASP 186 Ca -0.00 -0.37 -0.32 0.00 -0.71 0.00 0.00 54.79 53.38 2bdi n ASP 186 Cb 0.48 -0.03 0.01 0.00 -1.35 0.00 0.00 41.12 40.23 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 -1.03 -4.87 -3.47 0.11 6.02 -0.99 -4.96 117.38 108.20 2bdi n GLN 187 Ca 0.10 0.53 -0.37 0.00 -0.01 0.00 0.00 57.00 57.25 2bdi n GLN 187 Cb 0.05 -5.39 -0.07 0.00 1.02 0.00 0.00 30.24 25.86 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 -6.72 4.22 0.13 -1.09 1.02 -1.26 -4.42 119.74 111.62 2bdi s LYS 188 Ca 0.70 0.14 -0.26 0.00 0.02 0.00 0.00 55.97 56.57 2bdi s LYS 188 Cb -0.36 -3.48 0.07 0.00 -0.52 0.00 0.00 37.83 33.55 2bdi s LYS 188 CO 0.86 0.11 1.03 0.34 -0.92 0.00 0.00 175.35 176.77 2bdi s ASP 189 N 0.74 -0.14 0.90 2.83 2.15 -0.92 -4.18 116.67 118.05 2bdi s ASP 189 Ca 0.18 -0.38 -0.11 0.00 0.43 0.00 0.00 52.55 52.66 2bdi s ASP 189 Cb -0.14 0.43 0.19 0.00 -0.30 0.00 0.00 42.92 43.11 2bdi s ASP 189 CO 0.06 -0.80 1.23 -0.44 -0.17 0.00 0.00 175.17 175.05 2bdi s SER 190 N -3.00 3.35 0.39 -0.34 0.01 -1.26 0.79 113.70 113.64 2bdi s SER 190 Ca 0.14 -0.07 -0.16 0.00 1.31 0.00 0.00 55.95 57.17 2bdi s SER 190 Cb -0.00 -0.00 0.06 0.00 0.21 0.00 0.00 66.02 66.28 2bdi s SER 190 CO 0.02 -2.55 0.79 0.00 0.41 0.00 0.00 173.24 171.90 2bdi n ASN 192 N -1.43 1.33 0.00 0.00 4.13 -1.26 -2.21 115.26 115.81 2bdi n ASN 192 Ca -0.08 1.13 0.00 0.00 1.68 0.00 0.00 54.58 57.30 2bdi n ASN 192 Cb 0.60 -1.14 0.00 0.00 -1.54 0.00 0.00 39.78 37.69 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 2.31 0.33 0.65 7.41 0.00 -1.26 -0.01 105.19 114.61 2bdi n GLY 193 Ca 0.18 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.28 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 2.35 -4.64 1.61 8.00 -0.94 -3.43 116.55 119.51 2bdi n ASP 194 Ca 0.00 -1.67 -0.43 0.00 0.71 0.00 0.00 54.79 53.40 2bdi n ASP 194 Cb 0.00 -0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.09 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 0.90 1.80 0.00 -2.24 7.64 -1.26 0.27 113.62 120.74 2bdi n SER 195 Ca 0.09 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.10 2bdi n SER 195 Cb 0.40 -1.38 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 1.05 2.19 3.67 0.23 0.00 0.25 -1.54 105.19 111.04 2bdi n GLY 196 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 1.65 0.31 -0.02 0.00 0.14 -3.66 107.32 103.73 2bdi s GLY 197 Ca 0.00 0.28 -0.18 0.00 0.00 0.00 0.00 44.72 44.82 2bdi s GLY 197 CO 0.00 0.75 0.77 2.56 0.00 0.00 0.00 173.10 177.18 2bdi s PRO 198 N -4.72 4.14 -0.28 2.90 0.04 -1.26 -0.53 135.00 135.29 2bdi s PRO 198 Ca 0.65 0.82 0.01 0.00 0.04 0.00 0.00 61.00 62.53 2bdi s PRO 198 Cb -0.21 -2.56 0.08 0.00 0.04 0.00 0.00 34.50 31.86 2bdi s PRO 198 CO 0.59 0.21 0.02 -1.17 0.04 0.00 0.00 177.00 176.69 2bdi s LEU 199 N -2.65 3.05 -0.08 -3.56 2.96 -0.03 -3.32 118.68 115.05 2bdi s LEU 199 Ca 0.52 -1.57 -0.15 0.00 -0.22 0.00 0.00 54.13 52.70 2bdi s LEU 199 Cb -0.12 -1.20 -0.05 0.00 0.50 0.00 0.00 46.19 45.32 2bdi s LEU 199 CO 0.18 -0.33 0.38 -0.63 -1.32 0.00 0.00 176.35 174.64 2bdi s ILE 200 N 1.33 5.17 -0.25 6.68 -1.09 0.74 0.47 121.20 134.26 2bdi s ILE 200 Ca 0.03 0.76 -0.01 0.00 -2.23 0.00 0.00 60.65 59.21 2bdi s ILE 200 Cb -0.18 -3.70 0.08 0.00 -1.58 0.00 0.00 42.46 37.07 2bdi s ILE 200 CO -0.12 0.46 0.03 0.00 -1.23 0.00 0.00 174.94 174.08 2bdi n ASN 202 N 4.82 -2.08 0.00 0.00 5.03 -1.26 -2.36 115.26 119.41 2bdi n ASN 202 Ca -0.07 -0.55 0.00 0.00 0.87 0.00 0.00 54.58 54.84 2bdi n ASN 202 Cb 0.44 -4.58 0.00 0.00 -1.02 0.00 0.00 39.78 34.62 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 -1.12 0.13 3.58 7.41 0.00 -1.26 -5.00 105.19 108.93 2bdi n GLY 203 Ca -0.25 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.27 2.64 -0.51 1.61 1.51 -1.00 -4.74 117.35 115.60 2bdi s TYR 208 Ca 0.00 -0.22 -0.29 0.00 -1.01 0.00 0.00 57.07 55.56 2bdi s TYR 208 Cb 0.00 -1.28 0.02 0.00 -0.11 0.00 0.00 41.96 40.59 2bdi s TYR 208 CO 0.00 0.52 1.26 -1.17 -1.11 0.00 0.00 175.55 175.05 2bdi s LEU 209 N -2.89 3.53 -0.16 -1.29 2.96 0.26 0.07 118.68 121.15 2bdi s LEU 209 Ca 0.25 0.40 -0.04 0.00 -0.22 0.00 0.00 54.13 54.53 2bdi s LEU 209 Cb -0.09 -3.35 -0.23 0.00 0.50 0.00 0.00 46.19 43.03 2bdi s LEU 209 CO 0.16 -1.44 0.18 1.67 -1.32 0.00 0.00 176.35 175.59 2bdi n GLN 210 N 8.22 0.72 -2.79 1.98 -0.06 0.18 -0.54 117.38 125.09 2bdi n GLN 210 Ca 0.12 0.23 -0.06 0.00 -2.00 0.00 0.00 57.00 55.28 2bdi n GLN 210 Cb 0.49 -1.65 0.01 0.00 -4.06 0.00 0.00 30.24 25.03 2bdi n GLN 210 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2bdi n GLY 211 N 2.07 1.56 3.21 1.69 0.00 -0.82 -2.93 105.19 109.97 2bdi n GLY 211 Ca -0.36 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.16 2bdi n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bdi s LEU 212 N 0.00 2.05 -0.17 0.99 1.43 -1.21 -0.85 118.68 120.91 2bdi s LEU 212 Ca 0.11 -0.37 -0.28 0.00 -1.03 0.00 0.00 54.13 52.56 2bdi s LEU 212 Cb -0.03 -1.03 -0.06 0.00 0.03 0.00 0.00 46.19 45.11 2bdi s LEU 212 CO 0.08 0.24 2.18 0.52 0.23 0.00 0.00 176.35 179.61 2bdi n VAL 213 N 2.54 0.42 0.00 -1.59 0.31 0.32 -0.86 118.33 119.47 2bdi n VAL 213 Ca -0.15 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 2bdi n VAL 213 Cb 0.53 -2.53 0.00 0.00 -0.91 0.00 0.00 33.84 30.93 2bdi n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2bdi n SER 214 N 11.01 0.00 -2.66 4.52 2.88 -1.01 0.87 113.62 129.23 2bdi n SER 214 Ca 0.28 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.73 2bdi n SER 214 Cb 0.44 -0.37 0.01 0.00 -0.75 0.00 0.00 64.21 63.55 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 -2.40 -2.03 0.00 0.66 1.16 -1.11 -4.88 117.46 108.86 2bdi n PHE 215 Ca 0.00 -1.80 0.00 0.00 -1.87 0.00 0.00 57.45 53.78 2bdi n PHE 215 Cb 0.00 0.76 0.00 0.00 -1.61 0.00 0.00 39.48 38.63 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 -0.49 0.84 3.70 4.97 0.00 -1.26 0.35 105.19 113.30 2bdi n GLY 216 Ca -0.06 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 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 1.31 0.09 1.61 1.02 -1.26 -5.01 119.74 115.49 2bdi s LYS 217 Ca 0.00 1.37 0.07 0.00 0.02 0.00 0.00 55.97 57.43 2bdi s LYS 217 Cb 0.00 -1.77 -0.03 0.00 -0.52 0.00 0.00 37.83 35.50 2bdi s LYS 217 CO 0.00 -2.37 -0.18 0.00 -0.92 0.00 0.00 175.35 171.88 2bdi s ALA 218 N -2.73 1.53 1.15 5.17 0.00 -1.26 -4.24 121.76 121.37 2bdi s ALA 218 Ca 0.65 -1.13 -0.10 0.00 0.00 0.00 0.00 51.96 51.38 2bdi s ALA 218 Cb -0.21 -0.19 0.16 0.00 0.00 0.00 0.00 23.12 22.88 2bdi s ALA 218 CO 0.58 0.28 0.50 -0.35 0.00 0.00 0.00 175.76 176.77 2bdi n PRO 219 N 1.21 -2.36 -3.20 0.00 -0.04 -1.26 -5.11 135.00 124.23 2bdi n PRO 219 Ca -0.20 -0.81 -0.33 0.00 -0.04 0.00 0.00 63.50 62.12 2bdi n PRO 219 Cb 0.54 -0.82 -0.06 0.00 -0.04 0.00 0.00 33.50 33.12 2bdi n PRO 219 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2bdi n GLY 220 N -0.21 -0.04 3.78 0.00 0.00 -1.26 -4.99 105.19 102.46 2bdi n GLY 220 Ca 0.02 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.22 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 -4.59 4.57 0.24 1.61 -0.21 -1.26 -4.59 119.66 115.43 2bdi s GLN 221 Ca 0.02 1.19 -0.30 0.00 0.02 0.00 0.00 55.36 56.28 2bdi s GLN 221 Cb -0.01 -3.16 -0.10 0.00 1.00 0.00 0.00 33.01 30.74 2bdi s GLN 221 CO 0.02 0.51 1.45 0.08 -2.12 0.00 0.00 175.29 175.24 2bdi s VAL 222 N -1.25 2.66 0.00 1.09 1.01 -1.26 -1.89 120.40 120.75 2bdi s VAL 222 Ca 0.39 0.54 0.00 0.00 0.00 0.00 0.00 61.98 62.91 2bdi s VAL 222 Cb -0.22 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 32.81 2bdi s VAL 222 CO 0.26 0.08 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2bdi n GLY 223 N 2.37 0.80 2.78 4.51 0.00 0.10 -4.94 105.19 110.81 2bdi n GLY 223 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.23 1.70 0.90 1.61 1.01 -0.79 -5.03 120.40 116.58 2bdi s VAL 224 Ca 0.00 -2.70 -0.11 0.00 0.00 0.00 0.00 61.98 59.16 2bdi s VAL 224 Cb 0.00 -2.19 0.13 0.00 0.00 0.00 0.00 36.38 34.32 2bdi s VAL 224 CO 0.00 -0.86 1.09 -2.16 0.00 0.00 0.00 175.10 173.18 2bdi s PRO 225 N 0.25 1.19 0.38 2.72 0.04 -1.26 -4.29 135.00 134.03 2bdi s PRO 225 Ca 0.17 0.85 -0.00 0.00 0.04 0.00 0.00 61.00 62.06 2bdi s PRO 225 Cb -0.25 -1.80 -0.03 0.00 0.04 0.00 0.00 34.50 32.47 2bdi s PRO 225 CO -0.01 -2.29 0.60 0.20 0.04 0.00 0.00 177.00 175.54 2bdi s GLY 226 N -3.37 1.41 -0.04 0.56 0.00 -1.05 -4.64 107.32 100.19 2bdi s GLY 226 Ca 0.64 -0.91 -0.02 0.00 0.00 0.00 0.00 44.72 44.42 2bdi s GLY 226 CO 0.57 -0.81 0.10 0.14 0.00 0.00 0.00 173.10 173.10 2bdi s VAL 227 N -2.41 4.94 0.03 1.40 1.01 0.16 -1.65 120.40 123.87 2bdi s VAL 227 Ca 0.43 -0.23 0.02 0.00 0.00 0.00 0.00 61.98 62.19 2bdi s VAL 227 Cb -0.10 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 2bdi s VAL 227 CO 0.37 0.43 -0.07 -0.31 0.00 0.00 0.00 175.10 175.51 2bdi s TYR 228 N -1.15 0.65 0.17 5.22 1.51 0.58 -2.41 117.35 121.91 2bdi s TYR 228 Ca 0.21 -0.34 -0.31 0.00 -1.01 0.00 0.00 57.07 55.62 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 0.12 -0.05 1.49 0.99 -1.11 0.00 0.00 175.55 176.99 2bdi s THR 229 N -0.88 2.84 -1.29 -0.71 2.01 -0.04 -1.29 115.64 116.29 2bdi s THR 229 Ca -0.05 0.62 -0.16 0.00 0.31 0.00 0.00 61.69 62.42 2bdi s THR 229 Cb -0.07 -3.40 0.11 0.00 0.01 0.00 0.00 72.50 69.15 2bdi s THR 229 CO 0.00 0.06 1.70 -3.20 -0.69 0.00 0.00 174.62 172.49 2bdi n ASN 230 N 3.65 4.94 -0.05 3.53 5.15 -0.46 -3.33 115.26 128.69 2bdi n ASN 230 Ca 0.12 -2.94 0.21 0.00 -0.60 0.00 0.00 54.58 51.36 2bdi n ASN 230 Cb 0.40 -1.67 0.67 0.00 -0.53 0.00 0.00 39.78 38.65 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 11.09 0.06 -0.08 1.20 3.38 -1.85 0.13 115.31 129.23 2bdi h LEU 231 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2bdi h LEU 231 Cb 0.83 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2bdi h LEU 231 CO 1.44 0.03 0.07 0.00 0.09 0.00 0.00 178.44 180.07 2bdi n LYS 233 N -1.48 0.22 -0.33 0.00 4.76 0.47 -4.22 118.16 117.57 2bdi n LYS 233 Ca -0.00 -0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.51 2bdi n LYS 233 Cb 0.07 -1.56 0.18 0.00 -1.84 0.00 0.00 35.03 31.87 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 -1.84 0.22 0.35 2.13 3.72 -0.05 -4.80 117.46 117.20 2bdi n PHE 234 Ca 0.03 -1.17 -0.18 0.00 -0.05 0.00 0.00 57.45 56.07 2bdi n PHE 234 Cb 0.41 -0.23 -0.09 0.00 -0.94 0.00 0.00 39.48 38.63 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 0.59 0.13 -0.75 4.37 1.35 -1.73 0.21 112.91 117.07 2bdi h THR 235 Ca 0.02 0.00 0.16 0.00 -0.55 0.00 0.00 66.41 66.04 2bdi h THR 235 Cb 1.12 0.13 -0.10 0.00 -1.73 0.00 0.00 68.15 67.56 2bdi h THR 235 CO 0.06 0.00 0.25 -0.08 -0.25 0.00 0.00 175.52 175.50 2bdi h GLU 236 N -1.01 0.34 0.06 4.72 4.81 -1.92 0.16 114.58 121.73 2bdi h GLU 236 Ca -0.08 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2bdi h GLU 236 Cb 0.83 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.14 2bdi h GLU 236 CO 0.04 0.22 -0.03 2.35 -0.73 0.00 0.00 179.01 180.87 2bdi h TRP 237 N 0.35 -0.07 -0.84 0.92 7.01 -1.82 -0.97 115.95 120.53 2bdi h TRP 237 Ca 0.43 -0.00 0.16 0.00 2.11 0.00 0.00 58.89 61.59 2bdi h TRP 237 Cb 0.70 0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.73 2bdi h TRP 237 CO -0.21 0.15 0.55 0.82 -2.79 0.00 0.00 178.44 176.96 2bdi h ILE 238 N -0.29 0.78 0.34 2.65 2.04 0.40 -1.95 117.51 121.48 2bdi h ILE 238 Ca -0.01 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 2bdi h ILE 238 Cb 0.26 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2bdi h ILE 238 CO 0.01 0.09 -0.16 -0.08 0.00 0.00 0.00 178.15 178.01 2bdi h GLU 239 N 0.50 -0.44 -0.58 2.37 4.57 -0.32 -1.86 114.58 118.82 2bdi h GLU 239 Ca 0.42 0.03 0.17 0.00 -1.18 0.00 0.00 59.36 58.80 2bdi h GLU 239 Cb 0.89 0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.56 2bdi h GLU 239 CO -0.16 -0.29 0.68 -0.22 -1.18 0.00 0.00 179.01 177.83 2bdi h LYS 240 N -0.97 0.00 0.00 1.92 3.64 -1.02 -0.68 116.57 119.45 2bdi h LYS 240 Ca -0.05 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 2bdi h LYS 240 Cb 0.35 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 2bdi h LYS 240 CO 0.08 0.00 -0.32 1.15 -2.27 0.00 0.00 179.45 178.09 2bdi h THR 241 N 0.00 0.24 -0.56 1.00 2.02 -1.36 -3.16 112.91 111.09 2bdi h THR 241 Ca 0.28 -1.23 0.09 0.00 0.77 0.00 0.00 66.41 66.32 2bdi h THR 241 Cb 1.64 0.50 -0.07 0.00 -1.74 0.00 0.00 68.15 68.48 2bdi h THR 241 CO -0.00 0.08 0.18 0.58 0.37 0.00 0.00 175.52 176.73 2bdi h VAL 242 N -1.00 0.76 0.00 3.16 2.07 -0.51 -3.35 116.25 117.38 2bdi h VAL 242 Ca -0.03 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2bdi h VAL 242 Cb 0.41 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.57 2bdi h VAL 242 CO -0.02 0.06 0.00 1.67 0.02 0.00 0.00 177.57 179.30 2bdi n GLN 243 N -5.03 0.00 0.00 1.57 -0.06 -0.34 -5.10 117.38 108.42 2bdi n GLN 243 Ca 0.07 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.07 2bdi n GLN 243 Cb 0.26 -0.03 0.00 0.00 -4.06 0.00 0.00 30.24 26.41 2bdi n GLN 243 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86