#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bdn s VAL 2 N 0.00 3.03 -0.19 6.31 1.01 -1.26 -4.28 120.40 125.01 2bdn s VAL 2 Ca 0.00 0.80 -0.12 0.00 0.00 0.00 0.00 61.98 62.66 2bdn s VAL 2 Cb 0.00 -3.51 0.06 0.00 0.00 0.00 0.00 36.38 32.93 2bdn s VAL 2 CO 0.00 0.10 0.48 -1.58 0.00 0.00 0.00 175.10 174.09 2bdn s GLN 3 N 0.38 0.48 -0.12 2.72 0.74 -0.23 -5.00 119.66 118.62 2bdn s GLN 3 Ca 0.62 0.87 -0.01 0.00 0.05 0.00 0.00 55.36 56.89 2bdn s GLN 3 Cb -0.39 0.05 -0.02 0.00 1.10 0.00 0.00 33.01 33.75 2bdn s GLN 3 CO 0.36 -0.15 -0.10 -0.51 -0.55 0.00 0.00 175.29 174.34 2bdn s LEU 4 N 1.30 2.89 -0.00 3.68 1.43 -1.26 -1.80 118.68 124.92 2bdn s LEU 4 Ca -0.08 -0.24 0.00 0.00 -1.03 0.00 0.00 54.13 52.78 2bdn s LEU 4 Cb -0.07 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.46 2bdn s LEU 4 CO -0.13 0.20 0.04 -1.10 0.23 0.00 0.00 176.35 175.60 2bdn s GLN 5 N 0.13 2.94 0.04 1.70 -1.52 -0.18 -4.07 119.66 118.70 2bdn s GLN 5 Ca -0.05 -0.54 0.03 0.00 -1.95 0.00 0.00 55.36 52.85 2bdn s GLN 5 Cb -0.14 -2.77 -0.02 0.00 -0.22 0.00 0.00 33.01 29.85 2bdn s GLN 5 CO 0.04 0.64 -0.10 -0.65 -0.25 0.00 0.00 175.29 174.97 2bdn s GLN 6 N -1.65 0.67 0.42 2.91 -0.21 -1.26 -1.98 119.66 118.56 2bdn s GLN 6 Ca 0.21 -0.74 0.38 0.00 0.02 0.00 0.00 55.36 55.23 2bdn s GLN 6 Cb -0.12 -0.56 1.32 0.00 1.00 0.00 0.00 33.01 34.66 2bdn s GLN 6 CO 0.12 0.12 1.19 0.43 -2.12 0.00 0.00 175.29 175.04 2bdn n SER 7 N 1.67 0.01 0.00 5.90 7.64 -1.13 -4.81 113.62 122.88 2bdn n SER 7 Ca -0.20 0.77 0.00 0.00 1.01 0.00 0.00 58.87 60.45 2bdn n SER 7 Cb 0.55 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 2bdn n SER 7 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bdn n GLY 8 N -1.70 2.06 3.29 0.23 0.00 -1.26 -4.90 105.19 102.91 2bdn n GLY 8 Ca 0.34 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.92 2bdn n GLY 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bdn s ALA 9 N 0.00 -0.95 -0.15 4.61 0.00 -1.26 -1.99 121.76 122.02 2bdn s ALA 9 Ca 0.00 0.48 -0.09 0.00 0.00 0.00 0.00 51.96 52.34 2bdn s ALA 9 Cb 0.00 0.09 0.05 0.00 0.00 0.00 0.00 23.12 23.26 2bdn s ALA 9 CO 0.00 -0.29 0.36 -1.21 0.00 0.00 0.00 175.76 174.62 2bdn s GLU 10 N -1.40 0.36 -0.27 0.00 0.41 -0.40 -4.92 118.70 112.48 2bdn s GLU 10 Ca -0.12 0.66 0.03 0.00 -0.41 0.00 0.00 54.97 55.13 2bdn s GLU 10 Cb -0.04 0.01 0.06 0.00 -1.78 0.00 0.00 34.13 32.39 2bdn s GLU 10 CO 0.05 -0.13 -0.08 -0.51 -0.49 0.00 0.00 175.26 174.09 2bdn s LEU 11 N 1.07 3.63 0.01 1.80 2.01 -1.26 -1.76 118.68 124.17 2bdn s LEU 11 Ca -0.07 -1.47 0.04 0.00 0.01 0.00 0.00 54.13 52.64 2bdn s LEU 11 Cb -0.07 -1.57 -0.01 0.00 0.01 0.00 0.00 46.19 44.54 2bdn s LEU 11 CO -0.09 -0.22 -0.13 0.54 1.01 0.00 0.00 176.35 177.47 2bdn s VAL 12 N 1.09 1.00 0.53 -1.59 0.11 -1.16 -4.98 120.40 115.40 2bdn s VAL 12 Ca -0.07 -0.69 -0.21 0.00 -2.93 0.00 0.00 61.98 58.09 2bdn s VAL 12 Cb -0.20 -0.87 -0.06 0.00 -1.53 0.00 0.00 36.38 33.73 2bdn s VAL 12 CO -0.05 0.17 1.23 -0.54 -3.33 0.00 0.00 175.10 172.58 2bdn s LYS 13 N -0.59 3.34 0.25 1.54 3.01 -1.06 -1.66 119.74 124.58 2bdn s LYS 13 Ca 0.03 1.90 -0.30 0.00 -1.01 0.00 0.00 55.97 56.60 2bdn s LYS 13 Cb -0.06 -2.21 -0.11 0.00 -1.01 0.00 0.00 37.83 34.45 2bdn s LYS 13 CO 0.00 -0.93 1.53 0.00 0.51 0.00 0.00 175.35 176.47 2bdn s ALA 14 N -1.51 3.71 0.00 5.17 0.00 -1.25 -2.10 121.76 125.79 2bdn s ALA 14 Ca 0.70 1.45 0.00 0.00 0.00 0.00 0.00 51.96 54.11 2bdn s ALA 14 Cb -0.32 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2bdn s ALA 14 CO 0.37 -0.85 0.00 0.41 0.00 0.00 0.00 175.76 175.69 2bdn n GLY 15 N 2.50 3.34 3.59 0.00 0.00 0.93 -4.92 105.19 110.63 2bdn n GLY 15 Ca 0.09 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 2bdn n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bdn n ALA 16 N -1.43 -1.48 -2.46 4.61 0.00 -0.89 -3.84 120.51 115.01 2bdn n ALA 16 Ca 0.00 -1.61 -0.23 0.00 0.00 0.00 0.00 53.44 51.60 2bdn n ALA 16 Cb 0.00 -0.08 -0.10 0.00 0.00 0.00 0.00 19.45 19.27 2bdn n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2bdn s SER 17 N -5.50 3.32 0.04 0.00 0.01 -1.26 -0.49 113.70 109.82 2bdn s SER 17 Ca 0.70 -1.11 -0.11 0.00 1.31 0.00 0.00 55.95 56.74 2bdn s SER 17 Cb -0.02 -0.26 0.01 0.00 0.21 0.00 0.00 66.02 65.96 2bdn s SER 17 CO 0.49 -0.13 0.25 0.54 0.41 0.00 0.00 173.24 174.80 2bdn s VAL 18 N -2.70 0.09 -0.16 3.43 0.11 -0.10 -4.99 120.40 116.08 2bdn s VAL 18 Ca 0.29 -0.78 -0.01 0.00 -2.93 0.00 0.00 61.98 58.55 2bdn s VAL 18 Cb -0.01 -0.91 0.04 0.00 -1.53 0.00 0.00 36.38 33.98 2bdn s VAL 18 CO 0.14 -0.43 -0.04 -0.75 -3.33 0.00 0.00 175.10 170.68 2bdn s LYS 19 N -2.51 1.30 0.06 1.54 2.20 -1.26 -0.24 119.74 120.82 2bdn s LYS 19 Ca -0.05 -0.45 -0.07 0.00 -0.36 0.00 0.00 55.97 55.03 2bdn s LYS 19 Cb -0.01 -1.92 -0.05 0.00 -1.51 0.00 0.00 37.83 34.34 2bdn s LYS 19 CO -0.03 -0.43 0.34 -0.51 -0.36 0.00 0.00 175.35 174.35 2bdn s LEU 20 N 1.68 4.34 0.11 5.43 1.43 0.52 -4.91 118.68 127.29 2bdn s LEU 20 Ca 0.01 0.65 0.10 0.00 -1.03 0.00 0.00 54.13 53.86 2bdn s LEU 20 Cb -0.15 -2.91 -0.04 0.00 0.03 0.00 0.00 46.19 43.12 2bdn s LEU 20 CO -0.08 0.19 -0.26 -0.94 0.23 0.00 0.00 176.35 175.49 2bdn s SER 21 N -1.87 3.13 -0.32 2.29 1.04 -1.26 -1.00 113.70 115.71 2bdn s SER 21 Ca 0.32 -0.71 -0.02 0.00 0.48 0.00 0.00 55.95 56.03 2bdn s SER 21 Cb -0.13 -0.22 0.12 0.00 0.10 0.00 0.00 66.02 65.89 2bdn s SER 21 CO 0.19 0.17 0.16 0.00 0.98 0.00 0.00 173.24 174.74 2bdn s PRO 23 N 1.56 4.65 0.12 0.00 0.02 -0.84 -1.82 135.00 138.69 2bdn s PRO 23 Ca 0.13 1.47 0.04 0.00 0.02 0.00 0.00 61.00 62.67 2bdn s PRO 23 Cb -0.19 -3.39 -0.04 0.00 0.02 0.00 0.00 34.50 30.90 2bdn s PRO 23 CO -0.19 0.12 0.09 0.00 -0.33 0.00 0.00 177.00 176.69 2bdn s ALA 24 N 0.26 3.51 -0.13 -1.55 0.00 0.19 -1.01 121.76 123.03 2bdn s ALA 24 Ca 0.49 -1.13 -0.14 0.00 0.00 0.00 0.00 51.96 51.17 2bdn s ALA 24 Cb -0.23 -1.35 0.04 0.00 0.00 0.00 0.00 23.12 21.58 2bdn s ALA 24 CO 0.30 0.63 0.40 -1.54 0.00 0.00 0.00 175.76 175.54 2bdn s SER 25 N -2.70 -0.39 0.00 0.00 1.04 -0.75 -4.83 113.70 106.07 2bdn s SER 25 Ca 0.29 0.71 0.00 0.00 0.48 0.00 0.00 55.95 57.43 2bdn s SER 25 Cb -0.11 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2bdn s SER 25 CO 0.22 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.86 2bdn n GLY 26 N 2.61 0.17 3.64 7.32 0.00 -1.26 -1.07 105.19 116.60 2bdn n GLY 26 Ca -0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.78 2bdn n GLY 26 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2bdn s LEU 27 N 0.00 -0.30 -0.29 0.99 2.34 -1.26 -4.40 118.68 115.75 2bdn s LEU 27 Ca 0.00 -0.38 -0.06 0.00 0.06 0.00 0.00 54.13 53.75 2bdn s LEU 27 Cb 0.00 2.56 0.01 0.00 -0.56 0.00 0.00 46.19 48.21 2bdn s LEU 27 CO 0.00 -1.16 0.07 0.20 -1.06 0.00 0.00 176.35 174.40 2bdn s ASN 28 N -2.85 5.07 0.00 1.48 0.01 -1.26 -4.97 114.94 112.42 2bdn s ASN 28 Ca 0.07 -0.76 0.00 0.00 -0.71 0.00 0.00 52.86 51.46 2bdn s ASN 28 Cb -0.03 -1.86 0.00 0.00 0.41 0.00 0.00 41.25 39.77 2bdn s ASN 28 CO -0.02 -0.20 0.94 2.30 -1.51 0.00 0.00 177.10 178.61 2bdn n ILE 29 N 4.84 1.76 -0.12 0.60 -5.35 -1.26 -1.48 119.36 118.35 2bdn n ILE 29 Ca -0.14 0.45 -0.12 0.00 -0.27 0.00 0.00 62.75 62.67 2bdn n ILE 29 Cb 0.48 -1.45 -0.02 0.00 -1.74 0.00 0.00 39.64 36.90 2bdn n ILE 29 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 2bdn h LYS 30 N 0.00 0.73 0.00 6.28 1.57 -1.93 -3.01 116.57 120.21 2bdn h LYS 30 Ca 0.00 -0.30 0.00 0.00 -1.87 0.00 0.00 60.65 58.48 2bdn h LYS 30 Cb 0.02 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2bdn h LYS 30 CO 0.00 0.90 0.00 -0.25 -0.57 0.00 0.00 179.45 179.53 2bdn n ASP 31 N -4.35 0.00 -0.68 0.86 10.43 -0.55 -4.12 116.55 118.14 2bdn n ASP 31 Ca -0.02 -0.66 0.00 0.00 2.57 0.00 0.00 54.79 56.68 2bdn n ASP 31 Cb 0.37 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.33 2bdn n ASP 31 CO 0.00 0.00 0.00 1.07 -1.07 0.00 0.00 177.20 177.20 2bdn n THR 32 N -0.85 0.00 -4.70 -3.53 5.66 -1.14 -4.96 114.28 104.77 2bdn n THR 32 Ca 0.08 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.75 2bdn n THR 32 Cb 0.04 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 68.68 2bdn n THR 32 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 2bdn s TYR 33 N -3.54 2.85 -0.22 1.09 4.12 -1.26 -4.17 117.35 116.21 2bdn s TYR 33 Ca 0.00 -0.59 -0.07 0.00 0.02 0.00 0.00 57.07 56.44 2bdn s TYR 33 Cb 0.00 -1.87 -0.03 0.00 -1.52 0.00 0.00 41.96 38.54 2bdn s TYR 33 CO 0.00 -0.18 0.05 -1.64 0.02 0.00 0.00 175.55 173.79 2bdn s MET 34 N 0.36 3.72 0.28 -0.62 -1.94 -0.53 -2.06 119.30 118.50 2bdn s MET 34 Ca -0.10 -0.46 0.09 0.00 -1.71 0.00 0.00 55.69 53.52 2bdn s MET 34 Cb -0.16 -3.23 -0.04 0.00 2.01 0.00 0.00 34.83 33.41 2bdn s MET 34 CO 0.05 -0.03 0.03 -1.01 -0.01 0.00 0.00 175.02 174.06 2bdn s HIS 35 N 1.16 2.72 -0.03 -0.03 0.09 0.63 -1.01 115.29 118.83 2bdn s HIS 35 Ca 0.04 -0.25 0.05 0.00 -0.00 0.00 0.00 55.06 54.90 2bdn s HIS 35 Cb -0.14 -1.29 -0.01 0.00 -0.00 0.00 0.00 32.58 31.14 2bdn s HIS 35 CO 0.03 0.56 -0.17 -1.58 -0.00 0.00 0.00 174.74 173.58 2bdn s TRP 36 N -2.33 1.58 -0.04 1.40 0.52 -0.82 -0.57 118.94 118.67 2bdn s TRP 36 Ca 0.33 -0.37 0.03 0.00 0.02 0.00 0.00 56.10 56.10 2bdn s TRP 36 Cb -0.06 -1.04 0.01 0.00 -1.15 0.00 0.00 33.47 31.23 2bdn s TRP 36 CO 0.21 -0.09 -0.11 0.08 0.02 0.00 0.00 176.95 177.06 2bdn s VAL 37 N -0.19 0.96 -0.05 4.03 1.01 0.28 -0.88 120.40 125.56 2bdn s VAL 37 Ca 0.02 -0.42 -0.06 0.00 0.00 0.00 0.00 61.98 61.51 2bdn s VAL 37 Cb -0.09 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2bdn s VAL 37 CO 0.01 0.30 0.20 -0.75 0.00 0.00 0.00 175.10 174.86 2bdn s LYS 38 N 0.39 3.51 -0.03 2.72 2.20 0.53 -0.45 119.74 128.62 2bdn s LYS 38 Ca -0.08 -0.12 -0.01 0.00 -0.36 0.00 0.00 55.97 55.41 2bdn s LYS 38 Cb -0.12 -3.14 0.03 0.00 -1.51 0.00 0.00 37.83 33.09 2bdn s LYS 38 CO 0.02 0.71 0.06 -1.14 -0.36 0.00 0.00 175.35 174.64 2bdn s GLN 39 N -1.44 -0.03 0.05 4.03 0.74 -0.14 0.10 119.66 122.97 2bdn s GLN 39 Ca 0.22 0.27 0.07 0.00 0.05 0.00 0.00 55.36 55.97 2bdn s GLN 39 Cb -0.13 -0.30 -0.03 0.00 1.10 0.00 0.00 33.01 33.66 2bdn s GLN 39 CO 0.11 -0.21 -0.21 1.03 -0.55 0.00 0.00 175.29 175.47 2bdn s ARG 40 N 1.37 1.38 0.25 1.67 0.52 -0.89 -1.46 118.95 121.78 2bdn s ARG 40 Ca -0.06 -0.96 -0.04 0.00 -0.52 0.00 0.00 55.73 54.15 2bdn s ARG 40 Cb -0.13 -1.51 0.47 0.00 0.52 0.00 0.00 34.95 34.30 2bdn s ARG 40 CO -0.04 0.38 1.72 -1.35 0.02 0.00 0.00 175.30 176.03 2bdn h PRO 41 N 4.82 0.38 0.23 3.54 0.11 -1.97 -0.11 132.00 139.00 2bdn h PRO 41 Ca -0.43 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 2bdn h PRO 41 Cb 1.16 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2bdn h PRO 41 CO 0.44 0.25 -0.11 0.93 -0.21 0.00 0.00 178.00 179.29 2bdn h GLU 42 N 0.39 -0.30 -0.43 1.05 4.39 -2.03 -3.38 114.58 114.26 2bdn h GLU 42 Ca 0.42 0.02 0.00 0.00 0.34 0.00 0.00 59.36 60.14 2bdn h GLU 42 Cb 0.66 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 2bdn h GLU 42 CO -0.44 -0.20 0.00 0.00 -1.16 0.00 0.00 179.01 177.21 2bdn n GLN 43 N -4.82 2.02 0.00 2.33 0.00 -1.22 -5.06 117.38 110.64 2bdn n GLN 43 Ca -0.04 -1.51 0.00 0.00 0.00 0.00 0.00 57.00 55.45 2bdn n GLN 43 Cb 0.12 -1.35 0.00 0.00 0.00 0.00 0.00 30.24 29.01 2bdn n GLN 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bdn n GLY 44 N 1.12 0.55 3.73 2.61 0.00 -0.06 -4.83 105.19 108.31 2bdn n GLY 44 Ca 0.14 -0.81 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 2bdn n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bdn s LEU 45 N 0.00 4.49 -0.05 0.99 1.43 -1.26 -2.10 118.68 122.18 2bdn s LEU 45 Ca 0.00 1.69 -0.01 0.00 -1.03 0.00 0.00 54.13 54.78 2bdn s LEU 45 Cb 0.00 -3.48 0.03 0.00 0.03 0.00 0.00 46.19 42.77 2bdn s LEU 45 CO 0.00 -0.03 0.03 -1.61 0.23 0.00 0.00 176.35 174.97 2bdn s GLU 46 N -0.07 0.22 0.07 1.70 2.02 0.11 -4.98 118.70 117.78 2bdn s GLU 46 Ca 0.44 0.24 -0.31 0.00 0.02 0.00 0.00 54.97 55.37 2bdn s GLU 46 Cb -0.23 -0.67 -0.06 0.00 0.10 0.00 0.00 34.13 33.27 2bdn s GLU 46 CO 0.28 -0.29 1.23 -0.46 0.02 0.00 0.00 175.26 176.04 2bdn s TRP 47 N 1.94 3.40 -0.12 1.61 -0.00 -1.26 -0.34 118.94 124.17 2bdn s TRP 47 Ca 0.03 1.24 -0.10 0.00 -0.00 0.00 0.00 56.10 57.27 2bdn s TRP 47 Cb -0.12 -3.47 -0.03 0.00 -0.00 0.00 0.00 33.47 29.85 2bdn s TRP 47 CO -0.04 -1.47 -0.20 -0.89 -0.00 0.00 0.00 176.95 174.35 2bdn n ILE 48 N 3.91 1.08 -3.87 5.86 5.41 -0.06 -4.72 119.36 126.97 2bdn n ILE 48 Ca 0.09 0.26 -0.02 0.00 1.00 0.00 0.00 62.75 64.09 2bdn n ILE 48 Cb 0.46 -2.14 0.01 0.00 -0.71 0.00 0.00 39.64 37.26 2bdn n ILE 48 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2bdn s GLY 49 N -4.13 0.00 0.10 7.39 0.00 -1.24 -1.54 107.32 107.90 2bdn s GLY 49 Ca -0.17 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 44.40 2bdn s GLY 49 CO 0.25 2.60 -0.03 1.09 0.00 0.00 0.00 173.10 177.01 2bdn s ARG 50 N -2.27 0.81 0.00 2.90 1.04 -0.52 -1.95 118.95 118.97 2bdn s ARG 50 Ca 0.22 -1.34 0.00 0.00 -1.04 0.00 0.00 55.73 53.57 2bdn s ARG 50 Cb -0.02 -0.03 -0.00 0.00 -2.04 0.00 0.00 34.95 32.86 2bdn s ARG 50 CO 0.03 -0.09 -0.01 -1.50 -0.04 0.00 0.00 175.30 173.69 2bdn s ILE 51 N -3.77 0.06 -0.61 4.99 2.07 -0.18 -2.02 121.20 121.73 2bdn s ILE 51 Ca 0.13 -0.19 -0.16 0.00 -1.41 0.00 0.00 60.65 59.03 2bdn s ILE 51 Cb 0.07 -0.09 0.14 0.00 0.13 0.00 0.00 42.46 42.71 2bdn s ILE 51 CO -0.05 -0.08 0.59 -0.62 -1.91 0.00 0.00 174.94 172.87 2bdn s ASP 52 N -0.28 6.31 0.60 4.50 -1.08 -0.39 -1.46 116.67 124.88 2bdn s ASP 52 Ca -0.03 -1.93 0.28 0.00 -0.52 0.00 0.00 52.55 50.35 2bdn s ASP 52 Cb -0.02 -2.22 1.52 0.00 -1.46 0.00 0.00 42.92 40.74 2bdn s ASP 52 CO -0.00 -0.84 1.84 -0.65 0.52 0.00 0.00 175.17 176.05 2bdn h PRO 53 N 8.70 0.00 -0.27 4.34 0.11 -1.73 0.54 132.00 143.69 2bdn h PRO 53 Ca -0.21 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.80 2bdn h PRO 53 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2bdn h PRO 53 CO 0.99 0.00 -0.21 0.00 -0.21 0.00 0.00 178.00 178.57 2bdn h ALA 54 N 1.38 0.39 -0.00 -0.75 0.00 -1.81 -3.37 119.26 115.10 2bdn h ALA 54 Ca 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2bdn h ALA 54 Cb 0.59 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2bdn h ALA 54 CO 0.00 0.34 -0.05 0.27 0.00 0.00 0.00 179.25 179.81 2bdn n ASN 55 N -4.36 0.55 -0.05 0.00 0.23 -0.70 -5.02 115.26 105.91 2bdn n ASN 55 Ca -0.04 -0.77 -0.01 0.00 -0.53 0.00 0.00 54.58 53.23 2bdn n ASN 55 Cb 0.42 0.58 -0.00 0.00 -2.08 0.00 0.00 39.78 38.69 2bdn n ASN 55 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2bdn n GLY 56 N 0.65 0.47 3.80 4.83 0.00 0.18 -5.02 105.19 110.09 2bdn n GLY 56 Ca 0.01 -0.20 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 2bdn n GLY 56 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bdn s ASN 57 N -2.21 7.12 0.20 1.61 -0.87 -1.24 -4.81 114.94 114.73 2bdn s ASN 57 Ca 0.00 1.79 0.06 0.00 -1.57 0.00 0.00 52.86 53.15 2bdn s ASN 57 Cb 0.00 -2.56 -0.05 0.00 -0.02 0.00 0.00 41.25 38.62 2bdn s ASN 57 CO 0.00 -0.23 -0.11 0.42 -2.57 0.00 0.00 177.10 174.61 2bdn s THR 58 N -1.86 1.50 -0.03 1.60 -4.23 -1.26 -1.26 115.64 110.10 2bdn s THR 58 Ca 0.56 -2.14 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 2bdn s THR 58 Cb -0.15 -2.04 0.03 0.00 1.34 0.00 0.00 72.50 71.67 2bdn s THR 58 CO 0.20 -0.59 0.01 -0.54 -0.54 0.00 0.00 174.62 173.15 2bdn s LYS 59 N -3.70 0.24 0.23 3.99 -0.14 -0.86 -4.98 119.74 114.53 2bdn s LYS 59 Ca 0.22 0.12 0.09 0.00 -1.36 0.00 0.00 55.97 55.04 2bdn s LYS 59 Cb 0.01 -0.48 -0.05 0.00 -1.68 0.00 0.00 37.83 35.63 2bdn s LYS 59 CO 0.05 -0.17 -0.17 -0.06 -0.76 0.00 0.00 175.35 174.25 2bdn s PHE 60 N 1.18 1.94 -0.40 3.18 0.40 -1.26 -1.44 117.98 121.58 2bdn s PHE 60 Ca -0.08 -0.47 -0.23 0.00 -0.60 0.00 0.00 56.93 55.55 2bdn s PHE 60 Cb -0.13 -0.88 0.02 0.00 0.51 0.00 0.00 43.02 42.54 2bdn s PHE 60 CO -0.02 0.49 0.80 0.34 0.70 0.00 0.00 175.22 177.53 2bdn s ASP 61 N -3.35 6.50 0.24 1.36 -1.08 -0.59 -4.90 116.67 114.85 2bdn s ASP 61 Ca 0.25 0.17 0.16 0.00 -0.52 0.00 0.00 52.55 52.61 2bdn s ASP 61 Cb -0.03 -2.40 0.85 0.00 -1.46 0.00 0.00 42.92 39.88 2bdn s ASP 61 CO 0.10 -0.83 0.94 -2.65 0.52 0.00 0.00 175.17 173.25 2bdn n PRO 62 N 6.61 -0.03 0.22 4.34 -0.02 -1.26 0.64 135.00 145.50 2bdn n PRO 62 Ca 0.03 0.79 0.11 0.00 -2.02 0.00 0.00 63.50 62.42 2bdn n PRO 62 Cb 0.48 -1.49 0.59 0.00 -0.02 0.00 0.00 33.50 33.07 2bdn n PRO 62 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2bdn h LYS 63 N 0.00 0.00 -0.03 -0.52 1.57 -1.96 -1.23 116.57 114.40 2bdn h LYS 63 Ca 0.52 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.30 2bdn h LYS 63 Cb 1.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.82 2bdn h LYS 63 CO -0.38 0.00 0.00 1.19 -0.57 0.00 0.00 179.45 179.69 2bdn n PHE 64 N -2.39 0.02 -1.71 -1.35 3.01 0.21 -5.02 117.46 110.23 2bdn n PHE 64 Ca -0.01 -0.04 -0.42 0.00 1.01 0.00 0.00 57.45 57.98 2bdn n PHE 64 Cb 0.25 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.69 2bdn n PHE 64 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 2bdn n GLN 65 N 0.38 2.74 -2.40 -1.08 7.27 -0.47 -2.13 117.38 121.68 2bdn n GLN 65 Ca 0.04 0.99 -0.06 0.00 0.07 0.00 0.00 57.00 58.04 2bdn n GLN 65 Cb 0.19 -2.84 0.03 0.00 2.41 0.00 0.00 30.24 30.03 2bdn n GLN 65 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2bdn n GLY 66 N 3.99 -0.29 0.00 1.69 0.00 -1.26 -4.79 105.19 104.52 2bdn n GLY 66 Ca 0.17 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2bdn n GLY 66 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2bdn n LYS 67 N -2.22 0.00 -4.72 1.61 3.00 -1.17 -4.97 118.16 109.69 2bdn n LYS 67 Ca -0.03 0.00 -0.26 0.00 -0.00 0.00 0.00 58.31 58.02 2bdn n LYS 67 Cb 0.55 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.42 2bdn n LYS 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2bdn s ALA 68 N 0.00 1.45 -0.21 3.14 0.00 -0.91 -1.50 121.76 123.73 2bdn s ALA 68 Ca 0.00 -0.53 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 2bdn s ALA 68 Cb 0.00 -0.61 0.06 0.00 0.00 0.00 0.00 23.12 22.57 2bdn s ALA 68 CO 0.00 0.16 -0.01 0.99 0.00 0.00 0.00 175.76 176.89 2bdn s THR 69 N 0.58 1.02 -0.15 0.00 2.01 0.73 -4.84 115.64 114.99 2bdn s THR 69 Ca -0.15 -0.85 -0.14 0.00 0.31 0.00 0.00 61.69 60.86 2bdn s THR 69 Cb -0.16 -1.39 -0.05 0.00 0.01 0.00 0.00 72.50 70.91 2bdn s THR 69 CO 0.05 -0.12 0.30 -0.63 -0.69 0.00 0.00 174.62 173.52 2bdn s ILE 70 N 1.63 5.30 0.06 1.82 1.01 -1.26 -0.45 121.20 129.31 2bdn s ILE 70 Ca -0.03 0.57 -0.02 0.00 0.00 0.00 0.00 60.65 61.16 2bdn s ILE 70 Cb -0.18 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 2bdn s ILE 70 CO -0.07 0.40 0.02 0.42 0.00 0.00 0.00 174.94 175.70 2bdn s THR 71 N 0.39 0.20 0.16 2.92 -4.23 -0.95 -4.96 115.64 109.15 2bdn s THR 71 Ca 0.17 -1.71 -0.06 0.00 -1.18 0.00 0.00 61.69 58.92 2bdn s THR 71 Cb -0.13 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 72.15 2bdn s THR 71 CO 0.04 -0.89 0.20 0.00 -0.54 0.00 0.00 174.62 173.43 2bdn s ALA 72 N -3.92 0.40 -0.22 3.99 0.00 -1.26 0.62 121.76 121.36 2bdn s ALA 72 Ca 0.08 -1.16 -0.04 0.00 0.00 0.00 0.00 51.96 50.84 2bdn s ALA 72 Cb 0.07 0.91 0.08 0.00 0.00 0.00 0.00 23.12 24.18 2bdn s ALA 72 CO -0.09 -0.59 0.09 0.34 0.00 0.00 0.00 175.76 175.51 2bdn s ASP 73 N -3.01 2.99 0.45 0.00 3.68 -0.13 -5.01 116.67 115.64 2bdn s ASP 73 Ca 0.22 -0.96 0.17 0.00 2.13 0.00 0.00 52.55 54.10 2bdn s ASP 73 Cb 0.05 -0.42 1.05 0.00 -1.45 0.00 0.00 42.92 42.15 2bdn s ASP 73 CO 0.02 -0.37 1.98 0.71 0.13 0.00 0.00 175.17 177.64 2bdn h THR 74 N 6.45 1.05 0.06 1.71 1.35 -1.86 0.10 112.91 121.76 2bdn h THR 74 Ca -0.17 -0.70 -0.00 0.00 -0.55 0.00 0.00 66.41 64.99 2bdn h THR 74 Cb 1.09 1.39 0.00 0.00 -1.73 0.00 0.00 68.15 68.90 2bdn h THR 74 CO 0.36 0.19 -0.03 0.77 -0.25 0.00 0.00 175.52 176.57 2bdn h SER 75 N 0.00 -0.07 0.08 5.36 4.64 -1.96 -3.03 113.55 118.57 2bdn h SER 75 Ca -0.00 -0.32 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2bdn h SER 75 Cb 0.37 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2bdn h SER 75 CO 0.03 0.29 -0.04 -1.54 -0.87 0.00 0.00 176.83 174.69 2bdn n SER 76 N -4.96 0.86 -3.78 4.97 3.41 -1.15 -4.92 113.62 108.04 2bdn n SER 76 Ca -0.08 -1.15 -0.24 0.00 -0.26 0.00 0.00 58.87 57.14 2bdn n SER 76 Cb 0.20 -0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.18 2bdn n SER 76 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2bdn n ASN 77 N -0.42 -2.12 -4.25 4.04 5.15 0.29 -4.67 115.26 113.28 2bdn n ASN 77 Ca 0.19 -0.82 -0.25 0.00 -0.60 0.00 0.00 54.58 53.10 2bdn n ASN 77 Cb 0.27 -3.94 -0.14 0.00 -0.53 0.00 0.00 39.78 35.44 2bdn n ASN 77 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2bdn s THR 78 N -3.59 1.64 0.10 -0.44 2.01 -0.79 -0.63 115.64 113.94 2bdn s THR 78 Ca 0.19 -1.25 0.08 0.00 0.31 0.00 0.00 61.69 61.02 2bdn s THR 78 Cb -0.09 -1.44 -0.04 0.00 0.01 0.00 0.00 72.50 70.94 2bdn s THR 78 CO 0.82 0.14 -0.15 0.00 -0.69 0.00 0.00 174.62 174.74 2bdn s ALA 79 N -0.87 2.76 0.11 7.40 0.00 -0.76 -0.96 121.76 129.44 2bdn s ALA 79 Ca 0.07 -1.29 0.06 0.00 0.00 0.00 0.00 51.96 50.80 2bdn s ALA 79 Cb -0.09 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.25 2bdn s ALA 79 CO 0.02 0.61 -0.16 0.71 0.00 0.00 0.00 175.76 176.94 2bdn s TYR 80 N -1.13 1.45 -0.18 0.00 2.02 0.20 -0.73 117.35 118.99 2bdn s TYR 80 Ca 0.18 -0.49 -0.03 0.00 -0.37 0.00 0.00 57.07 56.36 2bdn s TYR 80 Cb -0.11 -0.78 0.06 0.00 -0.40 0.00 0.00 41.96 40.73 2bdn s TYR 80 CO 0.10 0.14 0.04 -1.17 -1.57 0.00 0.00 175.55 173.10 2bdn s LEU 81 N -2.15 0.96 -0.16 -1.29 1.98 -0.17 -2.25 118.68 115.60 2bdn s LEU 81 Ca 0.06 -0.71 -0.07 0.00 -2.89 0.00 0.00 54.13 50.51 2bdn s LEU 81 Cb -0.07 -0.51 -0.04 0.00 0.66 0.00 0.00 46.19 46.22 2bdn s LEU 81 CO 0.03 -0.30 0.09 -1.58 -1.89 0.00 0.00 176.35 172.70 2bdn s GLN 82 N 1.92 3.78 -0.11 1.98 0.74 0.40 -0.35 119.66 128.02 2bdn s GLN 82 Ca 0.00 -0.26 0.03 0.00 0.05 0.00 0.00 55.36 55.17 2bdn s GLN 82 Cb -0.16 -3.21 0.01 0.00 1.10 0.00 0.00 33.01 30.74 2bdn s GLN 82 CO -0.08 0.46 -0.20 -0.51 -0.55 0.00 0.00 175.29 174.42 2bdn s LEU 83 N -0.14 1.95 0.16 3.68 1.43 0.66 -0.19 118.68 126.22 2bdn s LEU 83 Ca 0.09 -0.51 0.05 0.00 -1.03 0.00 0.00 54.13 52.72 2bdn s LEU 83 Cb -0.12 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.79 2bdn s LEU 83 CO 0.01 0.07 0.13 -0.94 0.23 0.00 0.00 176.35 175.85 2bdn s SER 84 N 0.75 5.51 -0.73 2.29 1.04 -0.57 -0.92 113.70 121.07 2bdn s SER 84 Ca -0.10 -0.13 -0.09 0.00 0.48 0.00 0.00 55.95 56.11 2bdn s SER 84 Cb -0.16 -1.44 0.01 0.00 0.10 0.00 0.00 66.02 64.54 2bdn s SER 84 CO 0.01 0.07 0.48 -1.54 0.98 0.00 0.00 173.24 173.25 2bdn n SER 85 N -0.31 -3.52 -4.73 7.02 3.41 -0.94 -4.83 113.62 109.71 2bdn n SER 85 Ca -0.08 -0.84 -0.37 0.00 -0.26 0.00 0.00 58.87 57.31 2bdn n SER 85 Cb 0.55 -1.22 0.06 0.00 -0.26 0.00 0.00 64.21 63.34 2bdn n SER 85 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2bdn s LEU 86 N -5.13 3.59 0.19 1.04 1.43 0.36 -4.62 118.68 115.54 2bdn s LEU 86 Ca 0.12 2.62 -0.00 0.00 -1.03 0.00 0.00 54.13 55.83 2bdn s LEU 86 Cb -0.07 -4.60 -0.04 0.00 0.03 0.00 0.00 46.19 41.51 2bdn s LEU 86 CO 0.71 -1.96 0.09 0.42 0.23 0.00 0.00 176.35 175.84 2bdn s THR 87 N -1.40 0.21 0.57 5.49 -4.23 -1.26 -0.05 115.64 114.96 2bdn s THR 87 Ca 0.82 -1.97 0.25 0.00 -1.18 0.00 0.00 61.69 59.61 2bdn s THR 87 Cb -0.37 -2.34 0.33 0.00 1.34 0.00 0.00 72.50 71.47 2bdn s THR 87 CO 0.39 -0.20 2.20 0.77 -0.54 0.00 0.00 174.62 177.24 2bdn h SER 88 N 2.67 0.00 0.43 3.99 4.64 -1.97 0.25 113.55 123.55 2bdn h SER 88 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2bdn h SER 88 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2bdn h SER 88 CO 0.57 0.00 0.00 -0.08 -0.87 0.00 0.00 176.83 176.45 2bdn h GLU 89 N 0.00 0.00 0.00 4.77 4.57 -1.97 -2.36 114.58 119.58 2bdn h GLU 89 Ca 0.02 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.14 2bdn h GLU 89 Cb 0.10 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 2bdn h GLU 89 CO -0.00 0.00 -1.20 -0.25 -1.18 0.00 0.00 179.01 176.38 2bdn n ASP 90 N -2.41 0.81 -4.70 1.04 8.00 0.86 -4.89 116.55 115.27 2bdn n ASP 90 Ca 0.00 0.33 -0.42 0.00 0.71 0.00 0.00 54.79 55.41 2bdn n ASP 90 Cb 0.15 0.41 -0.03 0.00 -0.02 0.00 0.00 41.12 41.63 2bdn n ASP 90 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2bdn s THR 91 N -3.21 2.73 0.00 -3.53 -1.32 -0.89 -4.87 115.64 104.54 2bdn s THR 91 Ca -0.02 0.38 0.00 0.00 -1.21 0.00 0.00 61.69 60.84 2bdn s THR 91 Cb 0.09 -3.24 0.00 0.00 -1.51 0.00 0.00 72.50 67.84 2bdn s THR 91 CO 0.80 0.01 0.00 0.00 -2.21 0.00 0.00 174.62 173.23 2bdn n ALA 92 N 4.81 0.00 -2.86 11.08 0.00 -0.81 -4.97 120.51 127.76 2bdn n ALA 92 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.25 2bdn n ALA 92 Cb 0.39 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.74 2bdn n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2bdn s VAL 93 N -2.14 4.55 -0.20 0.00 1.01 -0.54 -0.84 120.40 122.24 2bdn s VAL 93 Ca 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 61.98 61.83 2bdn s VAL 93 Cb 0.00 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 33.33 2bdn s VAL 93 CO 0.00 0.46 -0.06 -0.31 0.00 0.00 0.00 175.10 175.19 2bdn s TYR 94 N 0.41 2.94 0.08 5.22 1.51 -0.38 -0.96 117.35 126.16 2bdn s TYR 94 Ca 0.01 -0.83 0.05 0.00 -1.01 0.00 0.00 57.07 55.29 2bdn s TYR 94 Cb -0.13 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 2bdn s TYR 94 CO 0.01 -0.44 -0.04 0.71 -1.11 0.00 0.00 175.55 174.67 2bdn s TYR 95 N 1.17 2.89 0.06 2.71 2.02 0.40 -1.69 117.35 124.91 2bdn s TYR 95 Ca 0.02 -0.07 0.09 0.00 -0.37 0.00 0.00 57.07 56.75 2bdn s TYR 95 Cb -0.14 -1.52 -0.03 0.00 -0.40 0.00 0.00 41.96 39.87 2bdn s TYR 95 CO -0.01 0.45 -0.26 0.00 -1.57 0.00 0.00 175.55 174.15 2bdn s ALA 97 N -0.84 -0.48 0.12 0.00 0.00 0.26 -1.99 121.76 118.84 2bdn s ALA 97 Ca 0.12 -0.44 -0.01 0.00 0.00 0.00 0.00 51.96 51.62 2bdn s ALA 97 Cb -0.10 0.64 -0.05 0.00 0.00 0.00 0.00 23.12 23.62 2bdn s ALA 97 CO 0.02 -0.60 0.31 0.50 0.00 0.00 0.00 175.76 175.99 2bdn s ARG 98 N -3.86 3.51 0.00 0.00 3.52 -0.68 -0.26 118.95 121.17 2bdn s ARG 98 Ca 0.07 -0.32 0.00 0.00 -0.13 0.00 0.00 55.73 55.34 2bdn s ARG 98 Cb 0.03 -2.93 0.00 0.00 -1.56 0.00 0.00 34.95 30.49 2bdn s ARG 98 CO -0.09 0.51 0.00 0.41 -0.81 0.00 0.00 175.30 175.32 2bdn n GLY 99 N -0.04 -1.89 0.36 8.12 0.00 -0.88 -3.45 105.19 107.41 2bdn n GLY 99 Ca -0.04 0.89 0.15 0.00 0.00 0.00 0.00 46.02 47.02 2bdn n GLY 99 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2bdn h VAL 100 N 0.00 0.83 0.00 1.61 2.07 -1.83 -2.42 116.25 116.50 2bdn h VAL 100 Ca 0.00 -0.09 -0.10 0.00 0.82 0.00 0.00 66.70 67.33 2bdn h VAL 100 Cb 0.00 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 2bdn h VAL 100 CO 0.00 0.05 -0.81 -0.26 0.02 0.00 0.00 177.57 176.57 2bdn h PHE 101 N 0.27 0.00 0.00 1.57 -1.00 -1.96 -3.47 116.94 112.35 2bdn h PHE 101 Ca 0.28 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.06 2bdn h PHE 101 Cb 0.74 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.30 2bdn h PHE 101 CO -0.00 0.39 0.00 0.41 -1.61 0.00 0.00 178.31 177.50 2bdn n GLY 102 N 1.26 1.44 4.01 -1.45 0.00 -0.91 -5.11 105.19 104.43 2bdn n GLY 102 Ca -0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.82 2bdn n GLY 102 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2bdn s PHE 103 N -1.04 2.57 -0.31 1.61 -0.71 -1.26 -5.05 117.98 113.80 2bdn s PHE 103 Ca 0.00 -0.43 0.02 0.00 -1.04 0.00 0.00 56.93 55.48 2bdn s PHE 103 Cb 0.00 -2.38 0.09 0.00 -1.21 0.00 0.00 43.02 39.52 2bdn s PHE 103 CO 0.00 -0.58 0.03 -0.06 -1.34 0.00 0.00 175.22 173.27 2bdn s PHE 104 N -2.44 2.92 -0.65 3.49 0.08 -1.26 -4.31 117.98 115.81 2bdn s PHE 104 Ca 0.56 -2.39 0.25 0.00 0.12 0.00 0.00 56.93 55.47 2bdn s PHE 104 Cb -0.09 -2.29 0.54 0.00 -0.57 0.00 0.00 43.02 40.61 2bdn s PHE 104 CO 0.34 -0.89 1.54 0.38 -0.10 0.00 0.00 175.22 176.49 2bdn h ASP 105 N 7.81 0.00 -3.38 1.36 -0.00 -1.98 -3.45 116.42 116.79 2bdn h ASP 105 Ca -0.10 -0.09 -0.42 0.00 -0.00 0.00 0.00 57.03 56.42 2bdn h ASP 105 Cb 1.03 0.00 -0.36 0.00 -0.00 0.00 0.00 39.33 40.00 2bdn h ASP 105 CO 0.48 0.04 -0.77 -0.31 -0.00 0.00 0.00 179.24 178.69 2bdn s TYR 106 N -3.15 0.71 0.30 4.15 2.02 -1.26 -5.04 117.35 115.09 2bdn s TYR 106 Ca 0.08 -0.20 0.10 0.00 -0.37 0.00 0.00 57.07 56.69 2bdn s TYR 106 Cb 0.12 -0.72 -0.06 0.00 -0.40 0.00 0.00 41.96 40.91 2bdn s TYR 106 CO 0.66 -0.25 -0.15 -1.58 -1.57 0.00 0.00 175.55 172.66 2bdn s TRP 107 N 1.33 2.26 0.27 2.71 0.52 -1.26 -1.69 118.94 123.07 2bdn s TRP 107 Ca -0.05 -0.43 0.00 0.00 0.02 0.00 0.00 56.10 55.65 2bdn s TRP 107 Cb -0.13 -1.12 -0.04 0.00 -1.15 0.00 0.00 33.47 31.03 2bdn s TRP 107 CO -0.02 0.62 0.46 0.20 0.02 0.00 0.00 176.95 178.23 2bdn s GLY 108 N -3.52 1.54 0.19 0.98 0.00 -0.84 -4.36 107.32 101.30 2bdn s GLY 108 Ca 0.30 -0.90 0.17 0.00 0.00 0.00 0.00 44.72 44.29 2bdn s GLY 108 CO 0.15 -0.85 1.51 0.61 0.00 0.00 0.00 173.10 174.52 2bdn n GLN 109 N -1.22 0.11 0.00 2.90 0.00 -1.26 -4.74 117.38 113.17 2bdn n GLN 109 Ca -0.05 0.50 0.00 0.00 0.00 0.00 0.00 57.00 57.44 2bdn n GLN 109 Cb 0.55 -1.78 0.00 0.00 0.00 0.00 0.00 30.24 29.02 2bdn n GLN 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2bdn n GLY 110 N -0.80 1.03 2.98 2.61 0.00 -1.26 -5.03 105.19 104.72 2bdn n GLY 110 Ca 0.01 -1.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 2bdn n GLY 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bdn s THR 111 N -2.53 1.42 -0.00 2.61 2.01 -0.68 -4.14 115.64 114.33 2bdn s THR 111 Ca 0.00 -0.57 -0.30 0.00 0.31 0.00 0.00 61.69 61.13 2bdn s THR 111 Cb 0.00 -1.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.10 2bdn s THR 111 CO 0.00 0.40 0.96 -0.89 -0.69 0.00 0.00 174.62 174.40 2bdn s THR 112 N 1.54 4.87 -0.22 -0.82 2.01 -0.84 -1.26 115.64 120.94 2bdn s THR 112 Ca 0.04 2.02 0.01 0.00 0.31 0.00 0.00 61.69 64.07 2bdn s THR 112 Cb -0.13 -4.30 0.03 0.00 0.01 0.00 0.00 72.50 68.11 2bdn s THR 112 CO -0.10 0.17 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.64 2bdn s LEU 113 N 0.97 2.71 -0.26 4.42 2.96 -0.02 -1.27 118.68 128.19 2bdn s LEU 113 Ca 0.51 -0.85 -0.05 0.00 -0.22 0.00 0.00 54.13 53.52 2bdn s LEU 113 Cb -0.21 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 44.93 2bdn s LEU 113 CO 0.27 -0.07 0.01 -0.89 -1.32 0.00 0.00 176.35 174.35 2bdn s THR 114 N 1.27 3.57 -0.73 3.68 2.01 -0.73 -1.93 115.64 122.79 2bdn s THR 114 Ca 0.01 -0.68 -0.24 0.00 0.31 0.00 0.00 61.69 61.09 2bdn s THR 114 Cb -0.15 -2.77 0.06 0.00 0.01 0.00 0.00 72.50 69.65 2bdn s THR 114 CO -0.09 0.22 1.10 -0.69 -0.69 0.00 0.00 174.62 174.47 2bdn s VAL 115 N 1.46 4.15 0.27 3.82 1.01 -1.26 -2.98 120.40 126.86 2bdn s VAL 115 Ca 0.03 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.78 2bdn s VAL 115 Cb -0.16 -4.79 -0.04 0.00 0.00 0.00 0.00 36.38 31.39 2bdn s VAL 115 CO -0.01 -1.61 0.16 -0.55 0.00 0.00 0.00 175.10 173.09 2bdn s SER 116 N 3.78 1.06 0.00 3.32 0.15 -0.66 -4.76 113.70 116.58 2bdn s SER 116 Ca 0.28 -1.51 0.00 0.00 0.70 0.00 0.00 55.95 55.42 2bdn s SER 116 Cb -0.12 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 2bdn s SER 116 CO 0.09 -0.88 0.50 -1.54 1.20 0.00 0.00 173.24 172.60 2bdn n SER 117 N -0.76 0.94 -4.64 5.45 3.41 -1.26 -2.58 113.62 114.19 2bdn n SER 117 Ca 0.02 -1.17 -0.30 0.00 -0.26 0.00 0.00 58.87 57.17 2bdn n SER 117 Cb 0.65 0.00 0.18 0.00 -0.26 0.00 0.00 64.21 64.78 2bdn n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bdn s ALA 118 N -0.17 0.96 0.33 7.33 0.00 -1.26 -5.05 121.76 123.90 2bdn s ALA 118 Ca 0.00 0.12 0.10 0.00 0.00 0.00 0.00 51.96 52.18 2bdn s ALA 118 Cb 0.00 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 2bdn s ALA 118 CO 0.00 -2.89 -0.11 0.15 0.00 0.00 0.00 175.76 172.91 2bdn s LYS 119 N -4.71 1.81 -0.03 0.00 1.02 -1.26 -5.04 119.74 111.53 2bdn s LYS 119 Ca 0.66 -1.89 -0.30 0.00 0.02 0.00 0.00 55.97 54.47 2bdn s LYS 119 Cb -0.21 -1.74 -0.08 0.00 -0.52 0.00 0.00 37.83 35.28 2bdn s LYS 119 CO 0.59 0.18 1.99 0.99 -0.92 0.00 0.00 175.35 178.19 2bdn s THR 120 N -2.58 3.07 -0.07 2.17 2.01 -1.26 -4.62 115.64 114.36 2bdn s THR 120 Ca 0.32 0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.42 2bdn s THR 120 Cb 0.01 -3.06 0.01 0.00 0.01 0.00 0.00 72.50 69.47 2bdn s THR 120 CO 0.16 -0.02 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.07 2bdn s THR 121 N 5.25 1.15 0.74 -0.82 2.01 1.00 -4.95 115.64 120.01 2bdn s THR 121 Ca 0.90 -0.48 -0.14 0.00 0.31 0.00 0.00 61.69 62.27 2bdn s THR 121 Cb -0.40 -1.05 0.04 0.00 0.01 0.00 0.00 72.50 71.11 2bdn s THR 121 CO 0.39 0.36 1.19 0.00 -0.69 0.00 0.00 174.62 175.87 2bdn s ALA 122 N 0.69 2.11 0.49 7.40 0.00 -1.26 -1.91 121.76 129.28 2bdn s ALA 122 Ca -0.14 0.80 -0.04 0.00 0.00 0.00 0.00 51.96 52.58 2bdn s ALA 122 Cb -0.16 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 2bdn s ALA 122 CO 0.03 -1.88 0.77 -1.25 0.00 0.00 0.00 175.76 173.43 2bdn s PRO 123 N -4.02 3.23 -0.16 0.00 0.04 -1.26 -4.29 135.00 128.53 2bdn s PRO 123 Ca 0.72 -0.08 -0.02 0.00 0.04 0.00 0.00 61.00 61.67 2bdn s PRO 123 Cb -0.27 -2.42 -0.01 0.00 0.04 0.00 0.00 34.50 31.84 2bdn s PRO 123 CO 0.46 -0.34 -0.10 -1.12 0.04 0.00 0.00 177.00 175.95 2bdn s SER 124 N -4.19 4.11 -0.25 6.66 0.01 0.03 -4.95 113.70 115.11 2bdn s SER 124 Ca 0.49 -0.35 -0.07 0.00 1.31 0.00 0.00 55.95 57.32 2bdn s SER 124 Cb -0.10 -1.66 -0.02 0.00 0.21 0.00 0.00 66.02 64.45 2bdn s SER 124 CO 0.42 0.10 0.07 -0.69 0.41 0.00 0.00 173.24 173.56 2bdn s VAL 125 N 0.76 4.29 -0.09 3.43 1.01 -1.26 -0.45 120.40 128.09 2bdn s VAL 125 Ca -0.04 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2bdn s VAL 125 Cb -0.15 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.18 2bdn s VAL 125 CO 0.01 0.31 -0.13 -0.31 0.00 0.00 0.00 175.10 174.99 2bdn s TYR 126 N 1.61 2.79 0.49 5.22 2.02 -0.29 -4.98 117.35 124.21 2bdn s TYR 126 Ca 0.06 -0.37 -0.19 0.00 -0.37 0.00 0.00 57.07 56.20 2bdn s TYR 126 Cb -0.15 -1.75 -0.08 0.00 -0.40 0.00 0.00 41.96 39.57 2bdn s TYR 126 CO 0.04 0.00 1.00 -1.25 -1.57 0.00 0.00 175.55 173.77 2bdn s PRO 127 N -0.18 3.90 -0.31 -1.71 0.04 -1.26 -0.45 135.00 135.03 2bdn s PRO 127 Ca 0.00 1.15 0.01 0.00 0.04 0.00 0.00 61.00 62.21 2bdn s PRO 127 Cb -0.13 -2.12 0.10 0.00 0.04 0.00 0.00 34.50 32.38 2bdn s PRO 127 CO 0.03 -0.32 0.06 -0.51 0.04 0.00 0.00 177.00 176.31 2bdn s LEU 128 N -3.70 3.31 0.12 -3.56 1.43 -0.47 -4.80 118.68 111.01 2bdn s LEU 128 Ca 0.63 -1.81 0.11 0.00 -1.03 0.00 0.00 54.13 52.03 2bdn s LEU 128 Cb -0.12 -1.21 -0.04 0.00 0.03 0.00 0.00 46.19 44.85 2bdn s LEU 128 CO 0.23 -0.38 -0.27 0.00 0.23 0.00 0.00 176.35 176.16 2bdn s ALA 129 N 1.30 2.35 1.05 4.21 0.00 -1.26 -1.41 121.76 128.00 2bdn s ALA 129 Ca 0.09 -1.43 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 2bdn s ALA 129 Cb -0.18 -0.39 0.22 0.00 0.00 0.00 0.00 23.12 22.77 2bdn s ALA 129 CO -0.16 0.54 1.08 -2.14 0.00 0.00 0.00 175.76 175.07 2bdn s PRO 130 N -1.92 -0.03 0.00 0.00 0.02 -1.26 -4.97 135.00 126.83 2bdn s PRO 130 Ca 0.13 1.08 0.00 0.00 0.02 0.00 0.00 61.00 62.24 2bdn s PRO 130 Cb -0.10 -1.64 0.00 0.00 0.02 0.00 0.00 34.50 32.78 2bdn s PRO 130 CO 0.05 -3.20 0.00 1.33 -0.33 0.00 0.00 177.00 174.85 2bdn n VAL 131 N -4.58 0.00 -0.02 3.83 0.24 -1.26 -4.41 118.33 112.13 2bdn n VAL 131 Ca 0.06 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.24 2bdn n VAL 131 Cb 0.54 -1.35 -0.10 0.00 -1.47 0.00 0.00 33.84 31.45 2bdn n VAL 131 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bdn h GLY 133 N -0.75 0.00 -7.28 0.00 0.00 -2.05 -3.37 103.07 89.61 2bdn h GLY 133 Ca -0.00 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.59 2bdn h GLY 133 CO 0.01 0.00 -0.26 0.99 0.00 0.00 0.00 176.54 177.28 2bdn s ASP 134 N -5.31 6.16 0.00 0.19 1.01 -1.19 -4.71 116.67 112.82 2bdn s ASP 134 Ca -0.04 -1.29 0.00 0.00 0.71 0.00 0.00 52.55 51.92 2bdn s ASP 134 Cb 0.13 -2.20 0.00 0.00 1.01 0.00 0.00 42.92 41.85 2bdn s ASP 134 CO 0.44 -0.70 0.00 0.35 0.21 0.00 0.00 175.17 175.47 2bdn n THR 135 N 5.27 0.00 0.00 -1.27 -2.24 -1.26 -4.08 114.28 110.70 2bdn n THR 135 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 2bdn n THR 135 Cb 0.44 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 2bdn n THR 135 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2bdn n THR 136 N 0.00 0.00 -0.26 4.28 5.66 -1.26 -5.13 114.28 117.57 2bdn n THR 136 Ca 0.00 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.72 2bdn n THR 136 Cb 0.00 0.00 0.27 0.00 -1.55 0.00 0.00 70.33 69.05 2bdn n THR 136 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2bdn n GLY 137 N 1.29 -3.65 0.10 1.09 0.00 -1.26 -4.96 105.19 97.81 2bdn n GLY 137 Ca 0.00 -1.18 -0.15 0.00 0.00 0.00 0.00 46.02 44.69 2bdn n GLY 137 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2bdn h SER 138 N -3.52 0.34 -4.32 1.61 0.87 -2.00 -3.44 113.55 103.09 2bdn h SER 138 Ca -0.36 -0.42 -0.65 0.00 -1.23 0.00 0.00 61.79 59.13 2bdn h SER 138 Cb 1.21 -0.11 -0.30 0.00 -0.44 0.00 0.00 62.40 62.76 2bdn h SER 138 CO 0.22 1.34 -0.87 -0.44 -0.53 0.00 0.00 176.83 176.54 2bdn s SER 139 N -6.98 2.77 0.23 6.23 0.01 -1.26 -1.39 113.70 113.31 2bdn s SER 139 Ca -0.06 -0.44 0.07 0.00 1.31 0.00 0.00 55.95 56.84 2bdn s SER 139 Cb 0.07 -0.48 -0.04 0.00 0.21 0.00 0.00 66.02 65.79 2bdn s SER 139 CO 0.86 0.26 0.14 0.54 0.41 0.00 0.00 173.24 175.45 2bdn s VAL 140 N -0.38 4.23 -0.09 3.43 0.11 0.81 -4.79 120.40 123.71 2bdn s VAL 140 Ca 0.04 -1.42 0.02 0.00 -2.93 0.00 0.00 61.98 57.69 2bdn s VAL 140 Cb -0.11 -3.25 0.01 0.00 -1.53 0.00 0.00 36.38 31.51 2bdn s VAL 140 CO 0.01 -0.28 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.46 2bdn s THR 141 N -2.05 1.35 0.29 5.04 2.01 -1.26 -1.65 115.64 119.36 2bdn s THR 141 Ca 0.32 -0.56 0.10 0.00 0.31 0.00 0.00 61.69 61.85 2bdn s THR 141 Cb -0.08 -1.24 -0.05 0.00 0.01 0.00 0.00 72.50 71.14 2bdn s THR 141 CO 0.23 0.41 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.76 2bdn s LEU 142 N 0.93 2.98 0.00 4.42 1.02 -0.36 -4.64 118.68 123.03 2bdn s LEU 142 Ca -0.09 -0.83 0.00 0.00 0.02 0.00 0.00 54.13 53.24 2bdn s LEU 142 Cb -0.15 -1.47 0.00 0.00 0.02 0.00 0.00 46.19 44.59 2bdn s LEU 142 CO 0.00 -0.04 0.34 0.61 0.02 0.00 0.00 176.35 177.28 2bdn n GLY 143 N -0.84 2.52 3.05 -3.19 0.00 -0.50 -0.92 105.19 105.31 2bdn n GLY 143 Ca -0.05 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 2bdn n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bdn s LEU 145 N 1.56 5.35 -0.45 0.00 2.96 0.41 -1.77 118.68 126.74 2bdn s LEU 145 Ca -0.07 -1.67 -0.19 0.00 -0.22 0.00 0.00 54.13 51.98 2bdn s LEU 145 Cb -0.11 -1.99 0.03 0.00 0.50 0.00 0.00 46.19 44.62 2bdn s LEU 145 CO -0.09 -0.59 0.57 -0.69 -1.32 0.00 0.00 176.35 174.23 2bdn s VAL 146 N 1.39 4.92 0.11 1.68 1.01 0.59 -1.14 120.40 128.96 2bdn s VAL 146 Ca 0.04 -0.20 0.07 0.00 0.00 0.00 0.00 61.98 61.89 2bdn s VAL 146 Cb -0.24 -4.18 -0.04 0.00 0.00 0.00 0.00 36.38 31.92 2bdn s VAL 146 CO 0.01 -0.60 -0.16 -0.75 0.00 0.00 0.00 175.10 173.60 2bdn s LYS 147 N 2.55 1.03 -0.46 2.72 2.20 0.41 -0.32 119.74 127.87 2bdn s LYS 147 Ca 0.17 -1.18 0.00 0.00 -0.36 0.00 0.00 55.97 54.60 2bdn s LYS 147 Cb -0.16 -1.05 0.00 0.00 -1.51 0.00 0.00 37.83 35.11 2bdn s LYS 147 CO 0.15 0.22 0.00 0.41 -0.36 0.00 0.00 175.35 175.77 2bdn n GLY 148 N 0.79 0.16 3.78 5.54 0.00 -0.62 -0.79 105.19 114.05 2bdn n GLY 148 Ca -0.17 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 44.96 2bdn n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2bdn s TYR 149 N -2.27 2.75 -0.29 1.61 1.13 -1.08 -4.60 117.35 114.61 2bdn s TYR 149 Ca 0.00 -0.39 -0.23 0.00 -1.41 0.00 0.00 57.07 55.04 2bdn s TYR 149 Cb 0.00 -1.77 0.14 0.00 -1.10 0.00 0.00 41.96 39.23 2bdn s TYR 149 CO 0.00 0.23 1.08 0.12 -2.51 0.00 0.00 175.55 174.47 2bdn s PHE 150 N -2.41 -0.43 0.00 -3.49 5.36 -0.80 -0.83 117.98 115.37 2bdn s PHE 150 Ca 0.40 1.00 0.00 0.00 -0.96 0.00 0.00 56.93 57.37 2bdn s PHE 150 Cb -0.03 0.37 0.00 0.00 -0.34 0.00 0.00 43.02 43.02 2bdn s PHE 150 CO 0.24 -0.21 0.00 -0.35 -1.46 0.00 0.00 175.22 173.44 2bdn n PRO 151 N 2.45 1.24 -1.80 10.12 -0.04 -1.26 -0.00 135.00 145.70 2bdn n PRO 151 Ca -0.13 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.02 2bdn n PRO 151 Cb 0.56 0.00 0.05 0.00 -0.04 0.00 0.00 33.50 34.08 2bdn n PRO 151 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2bdn s GLU 152 N -1.08 2.71 0.36 0.54 0.41 -1.26 -4.82 118.70 115.56 2bdn s GLU 152 Ca 0.00 0.53 0.07 0.00 -0.41 0.00 0.00 54.97 55.16 2bdn s GLU 152 Cb 0.00 -2.00 -0.02 0.00 -1.78 0.00 0.00 34.13 30.33 2bdn s GLU 152 CO 0.00 -1.15 0.36 -1.25 -0.49 0.00 0.00 175.26 172.73 2bdn s PRO 153 N -5.30 2.76 -0.36 0.39 0.04 -1.26 -4.94 135.00 126.34 2bdn s PRO 153 Ca 0.59 -1.29 0.01 0.00 0.04 0.00 0.00 61.00 60.35 2bdn s PRO 153 Cb -0.12 -2.54 0.11 0.00 0.04 0.00 0.00 34.50 31.99 2bdn s PRO 153 CO 0.52 0.00 0.13 0.14 0.04 0.00 0.00 177.00 177.84 2bdn s VAL 154 N -2.32 1.35 1.01 -0.36 -7.23 -1.26 -4.37 120.40 107.23 2bdn s VAL 154 Ca 0.44 -1.97 -0.12 0.00 -1.81 0.00 0.00 61.98 58.52 2bdn s VAL 154 Cb -0.06 -1.99 0.20 0.00 0.56 0.00 0.00 36.38 35.08 2bdn s VAL 154 CO 0.28 -0.73 1.08 0.42 -0.31 0.00 0.00 175.10 175.84 2bdn s THR 155 N 1.06 2.25 -0.27 5.32 -4.23 -0.94 -4.81 115.64 114.02 2bdn s THR 155 Ca 0.12 0.08 -0.22 0.00 -1.18 0.00 0.00 61.69 60.49 2bdn s THR 155 Cb -0.20 -2.33 0.07 0.00 1.34 0.00 0.00 72.50 71.38 2bdn s THR 155 CO -0.14 -0.11 0.70 -0.22 -0.54 0.00 0.00 174.62 174.32 2bdn s LEU 156 N -6.69 -0.77 0.21 4.79 0.20 -1.26 -2.22 118.68 112.94 2bdn s LEU 156 Ca 0.66 1.45 -0.04 0.00 0.69 0.00 0.00 54.13 56.89 2bdn s LEU 156 Cb -0.21 2.42 -0.03 0.00 -0.43 0.00 0.00 46.19 47.93 2bdn s LEU 156 CO 0.60 -0.24 0.22 0.42 -0.29 0.00 0.00 176.35 177.05 2bdn s THR 157 N 0.69 0.00 -0.07 3.68 -4.23 -0.79 -4.97 115.64 109.96 2bdn s THR 157 Ca -0.03 -1.86 0.05 0.00 -1.18 0.00 0.00 61.69 58.68 2bdn s THR 157 Cb -0.05 -2.43 -0.01 0.00 1.34 0.00 0.00 72.50 71.35 2bdn s THR 157 CO -0.04 0.00 -0.24 0.26 -0.54 0.00 0.00 174.62 174.06 2bdn s TRP 158 N -4.10 2.40 -1.37 3.99 0.52 -1.26 -0.23 118.94 118.88 2bdn s TRP 158 Ca 0.35 -0.81 -0.04 0.00 0.02 0.00 0.00 56.10 55.63 2bdn s TRP 158 Cb 0.05 -1.59 0.00 0.00 -1.15 0.00 0.00 33.47 30.78 2bdn s TRP 158 CO 0.12 -0.28 0.47 0.09 0.02 0.00 0.00 176.95 177.36 2bdn n ASN 159 N 3.17 -1.02 -1.74 2.95 3.02 0.11 -0.40 115.26 121.34 2bdn n ASN 159 Ca -0.18 -1.02 -0.17 0.00 -0.03 0.00 0.00 54.58 53.18 2bdn n ASN 159 Cb 0.52 -3.05 -0.05 0.00 -0.61 0.00 0.00 39.78 36.59 2bdn n ASN 159 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2bdn n SER 160 N -2.93 -4.57 0.00 6.41 7.64 -1.26 -1.83 113.62 117.09 2bdn n SER 160 Ca -0.28 0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.93 2bdn n SER 160 Cb 0.67 -4.05 0.00 0.00 -1.01 0.00 0.00 64.21 59.82 2bdn n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bdn n GLY 161 N -0.47 0.63 1.25 0.23 0.00 0.46 -4.93 105.19 102.36 2bdn n GLY 161 Ca -0.18 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.89 2bdn n GLY 161 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bdn n SER 162 N 0.00 3.59 -3.49 1.61 3.41 -0.76 -4.39 113.62 113.60 2bdn n SER 162 Ca 0.00 -2.45 -0.29 0.00 -0.26 0.00 0.00 58.87 55.87 2bdn n SER 162 Cb 0.00 -0.55 -0.12 0.00 -0.26 0.00 0.00 64.21 63.28 2bdn n SER 162 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2bdn s LEU 163 N -1.54 1.19 -0.06 1.04 2.96 -1.19 -4.99 118.68 116.09 2bdn s LEU 163 Ca 0.33 -2.28 0.08 0.00 -0.22 0.00 0.00 54.13 52.03 2bdn s LEU 163 Cb 0.23 -0.47 -0.11 0.00 0.50 0.00 0.00 46.19 46.35 2bdn s LEU 163 CO 0.12 -0.30 0.07 -1.54 -1.32 0.00 0.00 176.35 173.38 2bdn n SER 164 N 3.92 3.00 -4.75 3.68 3.41 -1.26 -4.32 113.62 117.30 2bdn n SER 164 Ca 0.13 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.33 2bdn n SER 164 Cb 0.37 0.87 -0.05 0.00 -0.26 0.00 0.00 64.21 65.15 2bdn n SER 164 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2bdn s SER 165 N -3.75 7.37 -0.11 4.04 0.01 -1.26 -3.35 113.70 116.64 2bdn s SER 165 Ca -0.04 2.11 0.00 0.00 1.31 0.00 0.00 55.95 59.33 2bdn s SER 165 Cb 0.03 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.65 2bdn s SER 165 CO 0.34 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.51 2bdn n GLY 166 N 1.59 0.46 3.69 3.44 0.00 -1.26 -4.58 105.19 108.53 2bdn n GLY 166 Ca 0.00 -1.03 -0.35 0.00 0.00 0.00 0.00 46.02 44.64 2bdn n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bdn s VAL 167 N -2.04 5.17 -0.24 1.61 1.01 -1.21 -1.43 120.40 123.27 2bdn s VAL 167 Ca 0.00 0.10 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 2bdn s VAL 167 Cb 0.00 -3.35 0.07 0.00 0.00 0.00 0.00 36.38 33.10 2bdn s VAL 167 CO 0.00 0.45 -0.01 -1.00 0.00 0.00 0.00 175.10 174.54 2bdn s HIS 168 N 0.38 2.10 -0.33 5.22 3.76 0.98 -4.98 115.29 122.42 2bdn s HIS 168 Ca 0.06 -1.63 -0.07 0.00 -0.15 0.00 0.00 55.06 53.27 2bdn s HIS 168 Cb -0.12 -1.55 0.03 0.00 1.11 0.00 0.00 32.58 32.05 2bdn s HIS 168 CO -0.01 -0.76 0.10 0.99 -0.85 0.00 0.00 174.74 174.21 2bdn s THR 169 N 1.49 3.88 0.34 1.30 2.01 -1.26 -0.18 115.64 123.23 2bdn s THR 169 Ca -0.02 -0.96 -0.24 0.00 0.31 0.00 0.00 61.69 60.78 2bdn s THR 169 Cb -0.18 -3.13 -0.10 0.00 0.01 0.00 0.00 72.50 69.10 2bdn s THR 169 CO -0.09 -0.09 0.91 -0.36 -0.69 0.00 0.00 174.62 174.30 2bdn s PHE 170 N 1.44 3.58 0.62 4.92 0.40 -0.33 -5.00 117.98 123.61 2bdn s PHE 170 Ca 0.00 1.67 -0.18 0.00 -0.60 0.00 0.00 56.93 57.82 2bdn s PHE 170 Cb -0.19 -2.85 -0.03 0.00 0.51 0.00 0.00 43.02 40.46 2bdn s PHE 170 CO 0.03 0.14 1.09 -2.30 0.70 0.00 0.00 175.22 174.88 2bdn n PRO 171 N 0.25 0.99 -2.39 0.24 -0.02 -1.26 -4.27 135.00 128.53 2bdn n PRO 171 Ca 0.03 0.38 -0.34 0.00 -2.02 0.00 0.00 63.50 61.55 2bdn n PRO 171 Cb 0.51 -2.31 -0.02 0.00 -0.02 0.00 0.00 33.50 31.67 2bdn n PRO 171 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bdn s ALA 172 N -1.46 2.79 -0.00 3.55 0.00 -1.26 -4.79 121.76 120.58 2bdn s ALA 172 Ca 0.78 0.67 0.03 0.00 0.00 0.00 0.00 51.96 53.44 2bdn s ALA 172 Cb -0.40 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 19.42 2bdn s ALA 172 CO 0.45 -0.53 -0.08 0.14 0.00 0.00 0.00 175.76 175.73 2bdn s VAL 173 N -1.95 0.67 -0.27 0.00 -7.23 -0.69 -4.96 120.40 105.97 2bdn s VAL 173 Ca 0.69 -0.40 -0.29 0.00 -1.81 0.00 0.00 61.98 60.17 2bdn s VAL 173 Cb -0.19 -0.57 0.01 0.00 0.56 0.00 0.00 36.38 36.19 2bdn s VAL 173 CO 0.24 0.16 1.11 -0.22 -0.31 0.00 0.00 175.10 176.08 2bdn s LEU 174 N -0.27 4.01 -0.74 1.32 2.96 -1.26 -1.55 118.68 123.14 2bdn s LEU 174 Ca 0.03 1.25 0.02 0.00 -0.22 0.00 0.00 54.13 55.20 2bdn s LEU 174 Cb -0.04 -3.54 0.18 0.00 0.50 0.00 0.00 46.19 43.29 2bdn s LEU 174 CO -0.00 -0.82 0.56 -1.58 -1.32 0.00 0.00 176.35 173.19 2bdn s GLN 175 N 3.53 2.69 -0.99 1.98 0.74 0.11 -4.78 119.66 122.95 2bdn s GLN 175 Ca 0.47 -3.19 -0.04 0.00 0.05 0.00 0.00 55.36 52.65 2bdn s GLN 175 Cb -0.15 -3.62 -0.05 0.00 1.10 0.00 0.00 33.01 30.30 2bdn s GLN 175 CO 0.13 -1.25 0.86 0.43 -0.55 0.00 0.00 175.29 174.91 2bdn n SER 176 N 2.33 -5.28 0.00 6.67 7.64 -1.26 -3.15 113.62 120.57 2bdn n SER 176 Ca 0.18 -0.63 0.00 0.00 1.01 0.00 0.00 58.87 59.43 2bdn n SER 176 Cb 0.36 -4.81 0.00 0.00 -1.01 0.00 0.00 64.21 58.75 2bdn n SER 176 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2bdn n ASP 177 N -3.05 -1.70 -3.99 6.43 8.00 -1.26 -5.00 116.55 115.98 2bdn n ASP 177 Ca -0.11 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.21 2bdn n ASP 177 Cb 0.62 -0.99 -0.15 0.00 -0.02 0.00 0.00 41.12 40.58 2bdn n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2bdn s LEU 178 N 0.00 1.88 0.36 0.64 1.43 -1.19 -4.68 118.68 117.12 2bdn s LEU 178 Ca 0.00 -0.14 -0.25 0.00 -1.03 0.00 0.00 54.13 52.71 2bdn s LEU 178 Cb 0.00 -0.43 -0.10 0.00 0.03 0.00 0.00 46.19 45.69 2bdn s LEU 178 CO 0.00 0.07 0.96 -0.31 0.23 0.00 0.00 176.35 177.30 2bdn s TYR 179 N 0.03 3.55 -0.01 0.29 2.02 -0.01 0.08 117.35 123.29 2bdn s TYR 179 Ca -0.00 1.72 0.03 0.00 -0.37 0.00 0.00 57.07 58.46 2bdn s TYR 179 Cb -0.06 -2.93 -0.01 0.00 -0.40 0.00 0.00 41.96 38.57 2bdn s TYR 179 CO -0.00 0.03 -0.11 0.99 -1.57 0.00 0.00 175.55 174.89 2bdn s THR 180 N -1.76 0.92 0.06 -0.71 2.01 -0.60 -1.58 115.64 113.98 2bdn s THR 180 Ca 0.54 -0.48 -0.11 0.00 0.31 0.00 0.00 61.69 61.95 2bdn s THR 180 Cb -0.17 -0.78 0.01 0.00 0.01 0.00 0.00 72.50 71.57 2bdn s THR 180 CO 0.21 0.27 0.23 -0.22 -0.69 0.00 0.00 174.62 174.43 2bdn s LEU 181 N -0.16 1.20 0.05 4.42 0.20 0.56 -1.70 118.68 123.25 2bdn s LEU 181 Ca 0.02 -0.41 -0.06 0.00 0.69 0.00 0.00 54.13 54.38 2bdn s LEU 181 Cb -0.06 1.14 -0.01 0.00 -0.43 0.00 0.00 46.19 46.83 2bdn s LEU 181 CO -0.00 -0.65 0.11 -0.94 -0.29 0.00 0.00 176.35 174.58 2bdn s SER 182 N -2.37 0.19 -0.04 3.68 1.04 -1.26 -0.30 113.70 114.64 2bdn s SER 182 Ca -0.01 -0.59 -0.04 0.00 0.48 0.00 0.00 55.95 55.79 2bdn s SER 182 Cb 0.01 0.25 0.01 0.00 0.10 0.00 0.00 66.02 66.39 2bdn s SER 182 CO -0.07 -0.56 0.12 -0.55 0.98 0.00 0.00 173.24 173.17 2bdn s SER 183 N -2.32 -0.11 0.07 7.02 0.15 -0.73 -1.19 113.70 116.58 2bdn s SER 183 Ca -0.02 0.21 0.07 0.00 0.70 0.00 0.00 55.95 56.91 2bdn s SER 183 Cb 0.01 0.25 -0.03 0.00 -1.71 0.00 0.00 66.02 64.54 2bdn s SER 183 CO -0.06 -0.07 -0.19 -0.94 1.20 0.00 0.00 173.24 173.18 2bdn s SER 184 N -0.05 2.23 0.00 5.45 1.04 0.75 -0.31 113.70 122.82 2bdn s SER 184 Ca -0.01 -0.59 0.02 0.00 0.48 0.00 0.00 55.95 55.85 2bdn s SER 184 Cb -0.01 -0.14 -0.01 0.00 0.10 0.00 0.00 66.02 65.96 2bdn s SER 184 CO 0.00 0.06 -0.08 0.54 0.98 0.00 0.00 173.24 174.74 2bdn s VAL 185 N -1.02 0.61 -0.12 5.02 0.11 -0.10 -0.02 120.40 124.89 2bdn s VAL 185 Ca 0.05 -0.46 0.03 0.00 -2.93 0.00 0.00 61.98 58.66 2bdn s VAL 185 Cb -0.09 -0.54 0.01 0.00 -1.53 0.00 0.00 36.38 34.22 2bdn s VAL 185 CO 0.03 0.08 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.79 2bdn s THR 186 N -0.37 1.87 0.43 5.04 2.01 -0.51 -1.23 115.64 122.88 2bdn s THR 186 Ca 0.01 -0.88 0.04 0.00 0.31 0.00 0.00 61.69 61.17 2bdn s THR 186 Cb -0.04 -1.65 -0.01 0.00 0.01 0.00 0.00 72.50 70.80 2bdn s THR 186 CO -0.00 0.51 0.13 1.33 -0.69 0.00 0.00 174.62 175.90 2bdn n VAL 187 N 3.94 0.00 -3.47 3.82 0.24 -0.66 -4.66 118.33 117.55 2bdn n VAL 187 Ca -0.20 -2.43 -0.36 0.00 -2.04 0.00 0.00 64.34 59.31 2bdn n VAL 187 Cb 0.52 0.82 -0.06 0.00 -1.47 0.00 0.00 33.84 33.65 2bdn n VAL 187 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2bdn s THR 188 N -3.08 4.98 0.35 3.34 -1.32 -1.26 -0.13 115.64 118.51 2bdn s THR 188 Ca 0.18 0.72 0.16 0.00 -1.21 0.00 0.00 61.69 61.54 2bdn s THR 188 Cb 0.01 -3.71 0.34 0.00 -1.51 0.00 0.00 72.50 67.63 2bdn s THR 188 CO 0.13 0.36 1.63 0.28 -2.21 0.00 0.00 174.62 174.81 2bdn h SER 189 N 3.96 0.38 -0.93 8.08 0.02 -1.52 0.49 113.55 124.03 2bdn h SER 189 Ca -0.50 0.22 -0.01 0.00 -0.84 0.00 0.00 61.79 60.67 2bdn h SER 189 Cb 1.20 0.21 -0.04 0.00 0.14 0.00 0.00 62.40 63.90 2bdn h SER 189 CO 0.65 -0.26 0.56 0.77 -1.14 0.00 0.00 176.83 177.40 2bdn h SER 190 N 0.18 1.12 1.00 3.07 4.64 -1.93 -2.68 113.55 118.95 2bdn h SER 190 Ca 0.77 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 62.02 2bdn h SER 190 Cb 1.86 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 63.67 2bdn h SER 190 CO -0.68 0.86 0.00 0.35 -0.87 0.00 0.00 176.83 176.49 2bdn n THR 191 N -4.35 0.58 -4.22 2.95 -2.24 0.16 -4.38 114.28 102.77 2bdn n THR 191 Ca 0.10 0.01 -0.17 0.00 -2.27 0.00 0.00 64.05 61.72 2bdn n THR 191 Cb 0.06 -0.78 -0.15 0.00 -2.10 0.00 0.00 70.33 67.36 2bdn n THR 191 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 2bdn s TRP 192 N -3.11 0.62 -1.22 4.78 -0.00 -1.01 0.52 118.94 119.51 2bdn s TRP 192 Ca 0.09 -0.13 0.05 0.00 -0.00 0.00 0.00 56.10 56.11 2bdn s TRP 192 Cb 0.13 -0.44 0.21 0.00 -0.00 0.00 0.00 33.47 33.37 2bdn s TRP 192 CO 0.47 -0.04 0.95 -0.35 -0.00 0.00 0.00 176.95 177.98 2bdn n PRO 193 N 3.14 1.86 0.21 5.86 -0.04 -1.26 -4.75 135.00 140.02 2bdn n PRO 193 Ca -0.16 -0.82 -0.15 0.00 -0.04 0.00 0.00 63.50 62.34 2bdn n PRO 193 Cb 0.56 -1.51 -0.07 0.00 -0.04 0.00 0.00 33.50 32.43 2bdn n PRO 193 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2bdn h SER 194 N 1.13 -0.80 -3.56 3.54 0.02 -1.76 -3.42 113.55 108.71 2bdn h SER 194 Ca 0.00 0.07 -0.50 0.00 -0.84 0.00 0.00 61.79 60.51 2bdn h SER 194 Cb 0.68 0.27 -0.01 0.00 0.14 0.00 0.00 62.40 63.48 2bdn h SER 194 CO 0.09 -0.44 0.03 -1.10 -1.14 0.00 0.00 176.83 174.27 2bdn s GLN 195 N -6.04 3.77 -0.07 3.45 -1.52 0.18 -5.05 119.66 114.38 2bdn s GLN 195 Ca -0.16 0.36 -0.22 0.00 -1.95 0.00 0.00 55.36 53.39 2bdn s GLN 195 Cb 0.06 -2.48 -0.04 0.00 -0.22 0.00 0.00 33.01 30.33 2bdn s GLN 195 CO 0.64 0.08 0.66 0.45 -0.25 0.00 0.00 175.29 176.86 2bdn s SER 196 N -2.98 6.94 -0.19 5.90 0.15 -1.26 -4.58 113.70 117.67 2bdn s SER 196 Ca 0.49 1.12 0.00 0.00 0.70 0.00 0.00 55.95 58.27 2bdn s SER 196 Cb -0.10 -2.39 0.02 0.00 -1.71 0.00 0.00 66.02 61.83 2bdn s SER 196 CO 0.28 -0.08 -0.17 -0.63 1.20 0.00 0.00 173.24 173.84 2bdn s ILE 197 N 0.71 2.27 0.02 6.45 1.01 -1.26 -4.95 121.20 125.45 2bdn s ILE 197 Ca 0.35 -0.90 0.03 0.00 0.00 0.00 0.00 60.65 60.13 2bdn s ILE 197 Cb -0.17 -1.99 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 2bdn s ILE 197 CO 0.17 0.50 -0.10 -0.89 0.00 0.00 0.00 174.94 174.62 2bdn s THR 198 N 1.31 0.74 -0.06 2.92 2.01 -1.26 -1.00 115.64 120.30 2bdn s THR 198 Ca 0.05 -0.77 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 2bdn s THR 198 Cb -0.13 -0.70 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 2bdn s THR 198 CO -0.11 -0.05 0.05 0.00 -0.69 0.00 0.00 174.62 173.81 2bdn s ASN 200 N -1.22 4.65 -0.23 0.00 -0.87 0.67 -1.50 114.94 116.45 2bdn s ASN 200 Ca 0.17 -1.47 -0.10 0.00 -1.57 0.00 0.00 52.86 49.89 2bdn s ASN 200 Cb -0.12 -1.62 -0.05 0.00 -0.02 0.00 0.00 41.25 39.45 2bdn s ASN 200 CO 0.07 -0.24 0.14 -0.69 -2.57 0.00 0.00 177.10 173.81 2bdn s VAL 201 N 1.13 5.32 -0.04 1.60 1.01 0.80 -1.88 120.40 128.33 2bdn s VAL 201 Ca -0.05 0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.15 2bdn s VAL 201 Cb -0.20 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.70 2bdn s VAL 201 CO -0.04 0.38 -0.22 0.00 0.00 0.00 0.00 175.10 175.22 2bdn s ALA 202 N 0.83 2.34 -0.46 5.51 0.00 -0.94 0.06 121.76 129.09 2bdn s ALA 202 Ca 0.07 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 51.03 2bdn s ALA 202 Cb -0.13 -0.74 0.17 0.00 0.00 0.00 0.00 23.12 22.42 2bdn s ALA 202 CO 0.02 0.49 0.36 -1.58 0.00 0.00 0.00 175.76 175.06 2bdn s HIS 203 N -0.48 1.51 0.26 0.00 2.46 -0.51 -2.22 115.29 116.31 2bdn s HIS 203 Ca 0.06 -2.48 -0.07 0.00 0.47 0.00 0.00 55.06 53.04 2bdn s HIS 203 Cb -0.11 -1.24 0.45 0.00 -0.13 0.00 0.00 32.58 31.55 2bdn s HIS 203 CO 0.01 -0.78 1.44 -2.30 -2.47 0.00 0.00 174.74 170.64 2bdn n PRO 204 N 2.74 -0.08 -0.01 2.88 -0.02 -1.26 -1.38 135.00 137.86 2bdn n PRO 204 Ca 0.27 1.44 0.22 0.00 -2.02 0.00 0.00 63.50 63.41 2bdn n PRO 204 Cb 0.45 -2.15 0.72 0.00 -0.02 0.00 0.00 33.50 32.50 2bdn n PRO 204 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2bdn h ALA 205 N 1.85 2.46 -0.33 3.55 0.00 -1.91 0.24 119.26 125.11 2bdn h ALA 205 Ca 0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.34 2bdn h ALA 205 Cb 0.71 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2bdn h ALA 205 CO -0.94 -0.77 0.00 -1.13 0.00 0.00 0.00 179.25 176.41 2bdn n SER 206 N -4.13 2.95 -3.97 0.00 3.41 -0.48 -4.97 113.62 106.44 2bdn n SER 206 Ca 0.11 -2.07 -0.29 0.00 -0.26 0.00 0.00 58.87 56.37 2bdn n SER 206 Cb 0.70 -0.24 -0.00 0.00 -0.26 0.00 0.00 64.21 64.41 2bdn n SER 206 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2bdn n SER 207 N 0.41 -2.42 -4.44 4.04 7.64 0.07 -4.97 113.62 113.95 2bdn n SER 207 Ca 0.12 -0.91 -0.30 0.00 1.01 0.00 0.00 58.87 58.79 2bdn n SER 207 Cb 0.45 -3.38 -0.12 0.00 -1.01 0.00 0.00 64.21 60.15 2bdn n SER 207 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 2bdn s THR 208 N -3.57 2.62 -0.05 0.44 2.01 -1.16 -5.02 115.64 110.91 2bdn s THR 208 Ca 0.37 -1.46 -0.02 0.00 0.31 0.00 0.00 61.69 60.89 2bdn s THR 208 Cb -0.19 -2.15 0.04 0.00 0.01 0.00 0.00 72.50 70.21 2bdn s THR 208 CO 0.87 0.20 0.11 -0.54 -0.69 0.00 0.00 174.62 174.57 2bdn s LYS 209 N -1.82 0.05 -0.03 4.92 1.02 -1.26 -1.43 119.74 121.19 2bdn s LYS 209 Ca 0.15 0.32 0.02 0.00 0.02 0.00 0.00 55.97 56.49 2bdn s LYS 209 Cb -0.10 -0.21 0.01 0.00 -0.52 0.00 0.00 37.83 37.01 2bdn s LYS 209 CO 0.07 -0.17 -0.08 0.08 -0.92 0.00 0.00 175.35 174.33 2bdn s VAL 210 N 1.18 0.73 -0.15 3.17 1.01 0.11 -4.98 120.40 121.47 2bdn s VAL 210 Ca -0.09 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.58 2bdn s VAL 210 Cb -0.12 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 2bdn s VAL 210 CO -0.05 0.24 -0.12 -1.81 0.00 0.00 0.00 175.10 173.36 2bdn s ASP 211 N 0.35 4.03 -0.22 3.32 -0.00 -1.26 -0.14 116.67 122.75 2bdn s ASP 211 Ca -0.05 -0.34 0.00 0.00 -0.00 0.00 0.00 52.55 52.16 2bdn s ASP 211 Cb -0.10 -1.63 0.06 0.00 -0.00 0.00 0.00 42.92 41.25 2bdn s ASP 211 CO 0.01 0.13 -0.05 -0.75 -0.00 0.00 0.00 175.17 174.50 2bdn s LYS 212 N 0.55 1.61 0.10 8.23 2.47 -0.56 -4.97 119.74 127.16 2bdn s LYS 212 Ca -0.08 -0.92 -0.30 0.00 -1.56 0.00 0.00 55.97 53.11 2bdn s LYS 212 Cb -0.16 -2.51 -0.06 0.00 -1.46 0.00 0.00 37.83 33.64 2bdn s LYS 212 CO 0.04 -0.57 1.19 0.21 0.16 0.00 0.00 175.35 176.38 2bdn s LYS 213 N 1.43 4.46 -0.46 4.03 2.20 -1.26 -2.30 119.74 127.84 2bdn s LYS 213 Ca -0.05 1.79 -0.24 0.00 -0.36 0.00 0.00 55.97 57.11 2bdn s LYS 213 Cb -0.18 -3.31 0.03 0.00 -1.51 0.00 0.00 37.83 32.85 2bdn s LYS 213 CO -0.07 -0.19 0.85 0.42 -0.36 0.00 0.00 175.35 176.01 2bdn s ILE 214 N 0.68 4.56 -0.06 5.43 -1.09 -0.17 -4.96 121.20 125.59 2bdn s ILE 214 Ca 0.57 0.54 0.03 0.00 -2.23 0.00 0.00 60.65 59.56 2bdn s ILE 214 Cb -0.30 -4.38 -0.02 0.00 -1.58 0.00 0.00 42.46 36.17 2bdn s ILE 214 CO 0.31 -0.79 -0.14 -0.69 -1.23 0.00 0.00 174.94 172.40 2bdn s VAL 215 N 3.52 3.07 1.10 2.92 1.01 -1.26 -4.66 120.40 126.10 2bdn s VAL 215 Ca 0.33 -0.71 -0.16 0.00 0.00 0.00 0.00 61.98 61.43 2bdn s VAL 215 Cb -0.11 -2.22 0.26 0.00 0.00 0.00 0.00 36.38 34.31 2bdn s VAL 215 CO 0.24 0.58 0.58 -0.81 0.00 0.00 0.00 175.10 175.69 2bdn n PRO 216 N 2.48 -2.89 -0.95 2.72 -0.04 -1.26 -4.82 135.00 130.24 2bdn n PRO 216 Ca -0.17 -0.97 0.00 0.00 -0.04 0.00 0.00 63.50 62.32 2bdn n PRO 216 Cb 0.52 -1.51 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 2bdn n PRO 216 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33