#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bhy s PHE 15 N 0.00 3.08 -0.12 7.33 5.36 -1.26 -5.02 117.98 127.35 2bhy s PHE 15 Ca 0.00 0.79 0.01 0.00 -0.96 0.00 0.00 56.93 56.77 2bhy s PHE 15 Cb 0.00 -3.86 -0.01 0.00 -0.34 0.00 0.00 43.02 38.81 2bhy s PHE 15 CO 0.00 -3.04 -0.16 -0.65 -1.46 0.00 0.00 175.22 169.91 2bhy s GLN 16 N 0.74 3.31 0.52 10.12 -0.21 -1.26 -5.04 119.66 127.84 2bhy s GLN 16 Ca 0.66 -0.73 -0.22 0.00 0.02 0.00 0.00 55.36 55.09 2bhy s GLN 16 Cb -0.42 -2.56 -0.06 0.00 1.00 0.00 0.00 33.01 30.97 2bhy s GLN 16 CO 0.34 0.21 1.29 -2.37 -2.12 0.00 0.00 175.29 172.64 2bhy n THR 17 N 3.53 3.45 1.66 -0.19 5.66 -1.26 -4.89 114.28 122.23 2bhy n THR 17 Ca -0.18 -0.50 0.15 0.00 -3.05 0.00 0.00 64.05 60.47 2bhy n THR 17 Cb 0.53 -1.59 0.77 0.00 -1.55 0.00 0.00 70.33 68.49 2bhy n THR 17 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bhy n GLN 18 N -0.70 0.86 -4.05 1.09 6.02 -1.26 -4.88 117.38 114.46 2bhy n GLN 18 Ca 0.10 -0.17 -0.35 0.00 -0.01 0.00 0.00 57.00 56.57 2bhy n GLN 18 Cb 0.43 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 30.12 2bhy n GLN 18 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2bhy s HIS 19 N -2.25 3.35 -0.04 1.08 3.76 -1.26 -5.09 115.29 114.84 2bhy s HIS 19 Ca 0.37 0.28 0.00 0.00 -0.15 0.00 0.00 55.06 55.56 2bhy s HIS 19 Cb 0.21 -1.95 0.03 0.00 1.11 0.00 0.00 32.58 31.97 2bhy s HIS 19 CO 0.41 0.45 -0.00 0.34 -0.85 0.00 0.00 174.74 175.09 2bhy s ASP 20 N -0.46 0.66 0.50 1.40 -1.08 -1.26 -5.04 116.67 111.39 2bhy s ASP 20 Ca 0.10 -0.04 0.23 0.00 -0.52 0.00 0.00 52.55 52.33 2bhy s ASP 20 Cb -0.12 -0.27 1.30 0.00 -1.46 0.00 0.00 42.92 42.38 2bhy s ASP 20 CO 0.02 -0.11 1.96 -0.65 0.52 0.00 0.00 175.17 176.90 2bhy h PRO 21 N 7.43 0.13 0.00 4.34 0.11 -1.98 -1.49 132.00 140.54 2bhy h PRO 21 Ca -0.38 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.72 2bhy h PRO 21 Cb 1.13 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 2bhy h PRO 21 CO 0.43 0.08 -0.05 0.00 -0.21 0.00 0.00 178.00 178.26 2bhy h ARG 22 N 0.13 0.00 -0.10 1.05 3.08 -2.01 -2.80 114.38 113.74 2bhy h ARG 22 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2bhy h ARG 22 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2bhy h ARG 22 CO -0.04 0.05 0.00 0.25 -1.07 0.00 0.00 179.97 179.15 2bhy n THR 23 N -3.23 1.53 -1.76 2.04 -2.24 -0.59 -5.05 114.28 104.98 2bhy n THR 23 Ca -0.01 -1.59 -0.42 0.00 -2.27 0.00 0.00 64.05 59.76 2bhy n THR 23 Cb 0.25 0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 2bhy n THR 23 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2bhy s ARG 24 N -1.97 4.14 0.48 -0.78 3.52 -1.01 -4.94 118.95 118.40 2bhy s ARG 24 Ca 0.22 2.55 -0.21 0.00 -0.13 0.00 0.00 55.73 58.16 2bhy s ARG 24 Cb 0.17 -3.29 -0.08 0.00 -1.56 0.00 0.00 34.95 30.20 2bhy s ARG 24 CO 0.05 -0.76 1.09 -0.51 -0.81 0.00 0.00 175.30 174.35 2bhy s LEU 25 N 1.77 3.89 0.00 -0.88 1.43 -1.26 -4.54 118.68 119.09 2bhy s LEU 25 Ca 0.76 2.08 0.00 0.00 -1.03 0.00 0.00 54.13 55.94 2bhy s LEU 25 Cb -0.47 -4.45 0.00 0.00 0.03 0.00 0.00 46.19 41.30 2bhy s LEU 25 CO 0.33 -0.88 0.00 0.61 0.23 0.00 0.00 176.35 176.65 2bhy n GLY 26 N 0.07 0.35 3.07 -3.19 0.00 -0.09 -4.91 105.19 100.49 2bhy n GLY 26 Ca 0.09 -1.81 -0.32 0.00 0.00 0.00 0.00 46.02 43.98 2bhy n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhy s ALA 27 N -2.00 2.23 -0.12 4.61 0.00 -1.26 -0.59 121.76 124.62 2bhy s ALA 27 Ca 0.00 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.69 2bhy s ALA 27 Cb 0.00 -1.26 0.02 0.00 0.00 0.00 0.00 23.12 21.88 2bhy s ALA 27 CO 0.00 -0.63 -0.14 0.99 0.00 0.00 0.00 175.76 175.98 2bhy s THR 28 N 1.31 1.46 0.33 0.00 2.01 -0.36 -4.65 115.64 115.74 2bhy s THR 28 Ca 0.01 -0.59 -0.28 0.00 0.31 0.00 0.00 61.69 61.14 2bhy s THR 28 Cb -0.15 -1.36 -0.13 0.00 0.01 0.00 0.00 72.50 70.87 2bhy s THR 28 CO -0.10 0.44 1.16 -2.65 -0.69 0.00 0.00 174.62 172.78 2bhy n PRO 29 N 4.50 1.76 -3.12 4.92 -0.02 -1.26 -1.10 135.00 140.67 2bhy n PRO 29 Ca -0.18 0.62 -0.30 0.00 -2.02 0.00 0.00 63.50 61.62 2bhy n PRO 29 Cb 0.51 -2.12 -0.04 0.00 -0.02 0.00 0.00 33.50 31.83 2bhy n PRO 29 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2bhy s LEU 30 N -0.46 3.97 0.90 2.45 1.43 0.47 -4.81 118.68 122.62 2bhy s LEU 30 Ca 0.57 0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 54.51 2bhy s LEU 30 Cb -0.61 -3.79 0.13 0.00 0.03 0.00 0.00 46.19 41.94 2bhy s LEU 30 CO 0.61 -0.28 1.09 -2.16 0.23 0.00 0.00 176.35 175.84 2bhy s PRO 31 N -3.58 1.24 -1.50 1.29 0.04 -1.26 -3.93 135.00 127.30 2bhy s PRO 31 Ca 0.48 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.37 2bhy s PRO 31 Cb -0.11 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2bhy s PRO 31 CO 0.29 -2.26 0.00 0.41 0.04 0.00 0.00 177.00 175.48 2bhy n GLY 32 N -1.07 0.93 2.45 0.56 0.00 -1.26 -2.43 105.19 104.37 2bhy n GLY 32 Ca 0.07 -0.29 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 2bhy n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhy n GLY 33 N -1.08 0.52 0.02 -0.02 0.00 -1.25 -4.88 105.19 98.49 2bhy n GLY 33 Ca -0.16 -0.07 0.14 0.00 0.00 0.00 0.00 46.02 45.92 2bhy n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhy n ALA 34 N -0.59 2.30 0.00 4.61 0.00 -1.02 -5.02 120.51 120.80 2bhy n ALA 34 Ca -0.22 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2bhy n ALA 34 Cb 0.66 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.65 2bhy n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhy n GLY 35 N 1.41 0.18 2.91 0.00 0.00 -1.26 -3.95 105.19 104.48 2bhy n GLY 35 Ca 0.07 -1.43 -0.13 0.00 0.00 0.00 0.00 46.02 44.53 2bhy n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bhy s THR 36 N -0.02 0.12 -0.24 2.61 2.01 -0.08 -0.39 115.64 119.64 2bhy s THR 36 Ca 0.00 -0.16 -0.08 0.00 0.31 0.00 0.00 61.69 61.76 2bhy s THR 36 Cb 0.00 -0.13 -0.03 0.00 0.01 0.00 0.00 72.50 72.35 2bhy s THR 36 CO 0.00 -0.03 0.09 -0.60 -0.69 0.00 0.00 174.62 173.39 2bhy s ARG 37 N -0.20 3.75 -0.18 4.92 3.52 -0.26 -1.69 118.95 128.80 2bhy s ARG 37 Ca -0.01 -0.43 -0.09 0.00 -0.13 0.00 0.00 55.73 55.07 2bhy s ARG 37 Cb -0.02 -3.35 -0.05 0.00 -1.56 0.00 0.00 34.95 29.98 2bhy s ARG 37 CO -0.00 -0.10 0.12 -0.06 -0.81 0.00 0.00 175.30 174.44 2bhy s PHE 38 N 1.41 3.41 0.00 5.12 0.08 0.24 -1.23 117.98 127.02 2bhy s PHE 38 Ca 0.06 0.32 -0.02 0.00 0.12 0.00 0.00 56.93 57.41 2bhy s PHE 38 Cb -0.15 -2.10 -0.01 0.00 -0.57 0.00 0.00 43.02 40.19 2bhy s PHE 38 CO 0.04 0.35 0.03 1.03 -0.10 0.00 0.00 175.22 176.57 2bhy s ARG 39 N 0.11 0.24 0.12 0.44 0.52 0.24 -1.20 118.95 119.42 2bhy s ARG 39 Ca 0.08 -0.33 -0.10 0.00 -0.52 0.00 0.00 55.73 54.86 2bhy s ARG 39 Cb -0.11 0.09 0.00 0.00 0.52 0.00 0.00 34.95 35.45 2bhy s ARG 39 CO -0.01 -0.04 0.26 -0.48 0.02 0.00 0.00 175.30 175.05 2bhy s LEU 40 N -0.90 1.08 -0.14 2.53 0.05 -0.66 -0.91 118.68 119.72 2bhy s LEU 40 Ca -0.10 -0.64 -0.00 0.00 0.05 0.00 0.00 54.13 53.43 2bhy s LEU 40 Cb -0.06 1.26 -0.01 0.00 -2.05 0.00 0.00 46.19 45.33 2bhy s LEU 40 CO -0.00 -0.80 -0.13 0.86 -0.55 0.00 0.00 176.35 175.72 2bhy s TRP 41 N -3.88 2.82 -0.02 3.48 -0.00 -1.26 -1.13 118.94 118.95 2bhy s TRP 41 Ca 0.08 -0.78 0.01 0.00 -0.00 0.00 0.00 56.10 55.41 2bhy s TRP 41 Cb 0.04 -1.88 0.01 0.00 -0.00 0.00 0.00 33.47 31.64 2bhy s TRP 41 CO -0.08 -0.31 -0.02 -0.08 -0.00 0.00 0.00 176.95 176.46 2bhy s THR 42 N 0.57 0.23 -0.62 5.86 -1.32 0.13 -4.59 115.64 115.91 2bhy s THR 42 Ca -0.08 -0.02 0.23 0.00 -1.21 0.00 0.00 61.69 60.61 2bhy s THR 42 Cb -0.16 -0.26 -0.06 0.00 -1.51 0.00 0.00 72.50 70.52 2bhy s THR 42 CO 0.03 0.11 1.13 -1.54 -2.21 0.00 0.00 174.62 172.14 2bhy n SER 43 N 3.62 0.64 0.00 8.08 3.41 -0.64 -4.38 113.62 124.34 2bhy n SER 43 Ca -0.20 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.31 2bhy n SER 43 Cb 0.54 0.58 0.00 0.00 -0.26 0.00 0.00 64.21 65.07 2bhy n SER 43 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2bhy n THR 44 N -2.02 0.00 -2.29 6.66 -2.24 -1.25 -5.06 114.28 108.09 2bhy n THR 44 Ca 0.02 -0.03 -0.38 0.00 -2.27 0.00 0.00 64.05 61.39 2bhy n THR 44 Cb 0.44 0.39 -0.02 0.00 -2.10 0.00 0.00 70.33 69.03 2bhy n THR 44 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bhy s ALA 45 N -1.20 3.18 -0.17 6.98 0.00 -1.26 -4.95 121.76 124.33 2bhy s ALA 45 Ca 0.00 0.98 0.08 0.00 0.00 0.00 0.00 51.96 53.03 2bhy s ALA 45 Cb 0.00 -3.39 -0.22 0.00 0.00 0.00 0.00 23.12 19.51 2bhy s ALA 45 CO 0.00 -0.53 0.14 0.54 0.00 0.00 0.00 175.76 175.91 2bhy n ARG 46 N 0.13 0.68 -4.88 0.00 1.74 -1.26 -4.93 116.66 108.14 2bhy n ARG 46 Ca 0.04 0.14 -0.27 0.00 -0.77 0.00 0.00 57.85 56.99 2bhy n ARG 46 Cb 0.46 -1.60 -0.15 0.00 -1.02 0.00 0.00 32.46 30.15 2bhy n ARG 46 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2bhy s THR 47 N -2.53 1.64 -0.05 0.55 -4.23 -1.26 -5.00 115.64 104.77 2bhy s THR 47 Ca -0.18 -0.99 -0.02 0.00 -1.18 0.00 0.00 61.69 59.32 2bhy s THR 47 Cb 0.07 -1.38 0.03 0.00 1.34 0.00 0.00 72.50 72.56 2bhy s THR 47 CO 0.75 0.37 0.08 -0.69 -0.54 0.00 0.00 174.62 174.59 2bhy s VAL 48 N -0.59 -0.13 0.08 2.29 1.01 -1.26 -1.13 120.40 120.68 2bhy s VAL 48 Ca 0.08 0.38 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 2bhy s VAL 48 Cb -0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 2bhy s VAL 48 CO 0.00 0.16 -0.00 0.00 0.00 0.00 0.00 175.10 175.26 2bhy s ALA 49 N 2.02 0.69 -0.07 5.51 0.00 -0.61 -4.60 121.76 124.71 2bhy s ALA 49 Ca 0.02 -1.32 0.02 0.00 0.00 0.00 0.00 51.96 50.69 2bhy s ALA 49 Cb -0.12 0.47 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 2bhy s ALA 49 CO -0.04 -0.40 -0.13 0.54 0.00 0.00 0.00 175.76 175.73 2bhy s VAL 50 N -3.93 3.11 -0.32 0.00 0.11 0.01 -0.22 120.40 119.17 2bhy s VAL 50 Ca 0.14 -0.69 -0.07 0.00 -2.93 0.00 0.00 61.98 58.43 2bhy s VAL 50 Cb 0.08 -2.24 0.02 0.00 -1.53 0.00 0.00 36.38 32.71 2bhy s VAL 50 CO -0.05 0.58 0.09 -0.60 -3.33 0.00 0.00 175.10 171.79 2bhy s ARG 51 N -0.48 2.86 -0.17 1.54 3.52 -0.13 -0.42 118.95 125.67 2bhy s ARG 51 Ca 0.06 -1.02 0.01 0.00 -0.13 0.00 0.00 55.73 54.65 2bhy s ARG 51 Cb -0.12 -3.42 0.01 0.00 -1.56 0.00 0.00 34.95 29.87 2bhy s ARG 51 CO 0.02 -0.55 -0.18 0.08 -0.81 0.00 0.00 175.30 173.85 2bhy s VAL 52 N 1.45 2.32 -1.71 7.11 1.01 0.25 -2.01 120.40 128.83 2bhy s VAL 52 Ca 0.01 -0.87 -0.19 0.00 0.00 0.00 0.00 61.98 60.93 2bhy s VAL 52 Cb -0.18 -1.97 0.16 0.00 0.00 0.00 0.00 36.38 34.39 2bhy s VAL 52 CO 0.03 0.53 0.80 0.59 0.00 0.00 0.00 175.10 177.04 2bhy n ASN 53 N 4.36 -3.36 0.00 3.32 3.02 0.57 -1.48 115.26 121.69 2bhy n ASN 53 Ca -0.20 -1.01 0.00 0.00 -0.03 0.00 0.00 54.58 53.34 2bhy n ASN 53 Cb 0.51 -2.76 0.00 0.00 -0.61 0.00 0.00 39.78 36.91 2bhy n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bhy n GLY 54 N -1.39 1.15 3.49 7.41 0.00 -1.26 -5.04 105.19 109.55 2bhy n GLY 54 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.76 2bhy n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bhy s THR 55 N -2.40 4.04 0.22 2.61 2.01 -0.55 -5.06 115.64 116.51 2bhy s THR 55 Ca 0.00 -0.29 -0.25 0.00 0.31 0.00 0.00 61.69 61.46 2bhy s THR 55 Cb 0.00 -2.81 -0.09 0.00 0.01 0.00 0.00 72.50 69.61 2bhy s THR 55 CO 0.00 0.45 0.82 -1.61 -0.69 0.00 0.00 174.62 173.60 2bhy s GLU 56 N 0.73 4.56 -0.04 4.92 2.02 -1.26 -0.58 118.70 129.05 2bhy s GLU 56 Ca -0.00 1.19 -0.00 0.00 0.02 0.00 0.00 54.97 56.17 2bhy s GLU 56 Cb -0.14 -3.11 0.03 0.00 0.10 0.00 0.00 34.13 31.01 2bhy s GLU 56 CO 0.02 0.48 0.01 -1.01 0.02 0.00 0.00 175.26 174.78 2bhy s HIS 57 N -1.31 0.32 0.24 1.61 3.76 0.44 -4.98 115.29 115.37 2bhy s HIS 57 Ca 0.41 0.03 -0.04 0.00 -0.15 0.00 0.00 55.06 55.30 2bhy s HIS 57 Cb -0.22 -0.49 0.06 0.00 1.11 0.00 0.00 32.58 33.04 2bhy s HIS 57 CO 0.26 -0.18 0.19 0.28 -0.85 0.00 0.00 174.74 174.44 2bhy n VAL 58 N 4.57 0.00 -4.69 -0.90 0.31 -1.26 -0.81 118.33 115.55 2bhy n VAL 58 Ca -0.18 -0.07 -0.26 0.00 -0.01 0.00 0.00 64.34 63.82 2bhy n VAL 58 Cb 0.50 -0.82 -0.17 0.00 -0.91 0.00 0.00 33.84 32.45 2bhy n VAL 58 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2bhy s THR 60 N -1.33 1.28 -0.18 2.52 2.01 0.12 -4.88 115.64 115.17 2bhy s THR 60 Ca 0.13 -0.56 -0.27 0.00 0.31 0.00 0.00 61.69 61.30 2bhy s THR 60 Cb -0.02 -1.15 -0.01 0.00 0.01 0.00 0.00 72.50 71.34 2bhy s THR 60 CO 0.10 0.39 0.91 -0.55 -0.69 0.00 0.00 174.62 174.77 2bhy s SER 61 N 0.59 7.02 0.00 3.53 0.15 -1.26 -1.26 113.70 122.46 2bhy s SER 61 Ca -0.15 1.26 0.18 0.00 0.70 0.00 0.00 55.95 57.94 2bhy s SER 61 Cb -0.16 -2.49 -0.19 0.00 -1.71 0.00 0.00 66.02 61.47 2bhy s SER 61 CO 0.04 -0.48 0.79 0.18 1.20 0.00 0.00 173.24 174.97 2bhy n LEU 62 N 5.54 0.90 0.00 3.45 4.77 0.06 -5.01 117.00 126.71 2bhy n LEU 62 Ca 0.07 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.54 2bhy n LEU 62 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2bhy n LEU 62 CO 0.50 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 2bhy n GLY 63 N 1.43 2.15 2.37 -0.72 0.00 -1.25 -4.93 105.19 104.24 2bhy n GLY 63 Ca 0.04 -1.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.14 2bhy n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhy n GLY 64 N 1.95 1.12 2.28 -0.02 0.00 -1.26 -2.31 105.19 106.95 2bhy n GLY 64 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 46.02 45.60 2bhy n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhy n GLY 65 N -1.45 0.37 3.75 -0.02 0.00 -1.26 -4.83 105.19 101.75 2bhy n GLY 65 Ca -0.10 -0.02 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 2bhy n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bhy s ILE 66 N -1.73 4.85 0.05 -0.61 -1.09 -0.98 -0.69 121.20 121.00 2bhy s ILE 66 Ca 0.00 1.42 0.07 0.00 -2.23 0.00 0.00 60.65 59.91 2bhy s ILE 66 Cb 0.00 -4.02 -0.03 0.00 -1.58 0.00 0.00 42.46 36.84 2bhy s ILE 66 CO 0.00 0.38 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.59 2bhy s TYR 67 N -0.04 1.62 -0.05 3.97 2.02 -0.29 -0.76 117.35 123.83 2bhy s TYR 67 Ca 0.35 -0.37 -0.10 0.00 -0.37 0.00 0.00 57.07 56.57 2bhy s TYR 67 Cb -0.19 -0.95 0.02 0.00 -0.40 0.00 0.00 41.96 40.43 2bhy s TYR 67 CO 0.20 0.09 0.23 -2.00 -1.57 0.00 0.00 175.55 172.50 2bhy s GLU 68 N -1.27 0.45 -0.17 -0.62 2.12 -0.39 -1.66 118.70 117.16 2bhy s GLU 68 Ca 0.05 -0.01 -0.18 0.00 0.36 0.00 0.00 54.97 55.20 2bhy s GLU 68 Cb -0.09 0.20 0.05 0.00 0.26 0.00 0.00 34.13 34.55 2bhy s GLU 68 CO 0.02 -0.10 0.49 -1.17 -0.54 0.00 0.00 175.26 173.96 2bhy s LEU 69 N -0.69 0.13 -0.14 2.70 2.96 -0.34 -0.70 118.68 122.60 2bhy s LEU 69 Ca -0.08 0.91 -0.02 0.00 -0.22 0.00 0.00 54.13 54.72 2bhy s LEU 69 Cb -0.04 1.71 -0.02 0.00 0.50 0.00 0.00 46.19 48.33 2bhy s LEU 69 CO 0.02 -0.22 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.16 2bhy s GLU 70 N 0.06 3.50 0.07 1.98 2.02 -1.26 -0.59 118.70 124.48 2bhy s GLU 70 Ca -0.02 -0.56 0.03 0.00 0.02 0.00 0.00 54.97 54.44 2bhy s GLU 70 Cb -0.03 -2.81 -0.03 0.00 0.10 0.00 0.00 34.13 31.36 2bhy s GLU 70 CO 0.01 0.29 -0.10 -0.51 0.02 0.00 0.00 175.26 174.97 2bhy s LEU 71 N 0.21 2.33 0.00 1.80 1.43 -0.68 -5.00 118.68 118.77 2bhy s LEU 71 Ca -0.04 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.38 2bhy s LEU 71 Cb -0.14 -0.27 0.00 0.00 0.03 0.00 0.00 46.19 45.80 2bhy s LEU 71 CO 0.03 -0.22 0.36 -2.65 0.23 0.00 0.00 176.35 174.11 2bhy n PRO 72 N 1.02 0.62 -2.95 1.29 -0.02 -1.25 -0.91 135.00 132.79 2bhy n PRO 72 Ca -0.19 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 60.94 2bhy n PRO 72 Cb 0.56 -1.29 -0.06 0.00 -0.02 0.00 0.00 33.50 32.69 2bhy n PRO 72 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2bhy s VAL 73 N -0.76 4.45 0.15 -1.45 -7.23 -1.26 -4.56 120.40 109.74 2bhy s VAL 73 Ca 0.00 1.42 0.01 0.00 -1.81 0.00 0.00 61.98 61.60 2bhy s VAL 73 Cb 0.00 -3.79 0.01 0.00 0.56 0.00 0.00 36.38 33.16 2bhy s VAL 73 CO 0.00 -0.02 0.10 0.61 -0.31 0.00 0.00 175.10 175.49 2bhy n GLY 74 N 0.13 3.09 3.65 2.32 0.00 -1.26 -2.01 105.19 111.11 2bhy n GLY 74 Ca 0.02 -2.21 -0.45 0.00 0.00 0.00 0.00 46.02 43.38 2bhy n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bhy n PRO 75 N -0.81 1.84 0.00 1.61 -0.02 -1.26 -1.71 135.00 134.65 2bhy n PRO 75 Ca -0.01 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 2bhy n PRO 75 Cb 0.18 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 2bhy n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bhy n GLY 76 N 1.80 3.28 3.75 -1.23 0.00 -0.23 -4.97 105.19 107.59 2bhy n GLY 76 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 2bhy n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhy s ALA 77 N -2.87 2.71 -0.10 4.61 0.00 -0.69 -4.67 121.76 120.75 2bhy s ALA 77 Ca 0.00 1.24 -0.01 0.00 0.00 0.00 0.00 51.96 53.19 2bhy s ALA 77 Cb 0.00 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.55 2bhy s ALA 77 CO 0.00 -1.34 -0.04 1.03 0.00 0.00 0.00 175.76 175.41 2bhy s ARG 78 N -3.03 3.11 0.13 0.00 1.81 -1.26 -1.07 118.95 118.64 2bhy s ARG 78 Ca 0.74 -0.50 -0.17 0.00 -1.72 0.00 0.00 55.73 54.08 2bhy s ARG 78 Cb -0.38 -2.75 0.04 0.00 -0.45 0.00 0.00 34.95 31.41 2bhy s ARG 78 CO 0.43 0.54 0.43 1.52 -0.68 0.00 0.00 175.30 177.54 2bhy s TYR 79 N -0.45 -0.24 0.31 -0.53 -0.85 -0.37 -0.32 117.35 114.91 2bhy s TYR 79 Ca 0.07 -0.07 -0.06 0.00 -0.52 0.00 0.00 57.07 56.49 2bhy s TYR 79 Cb -0.12 0.30 0.00 0.00 0.38 0.00 0.00 41.96 42.52 2bhy s TYR 79 CO 0.02 -0.73 0.47 -0.48 -1.52 0.00 0.00 175.55 173.31 2bhy s LEU 80 N -2.80 0.77 0.17 -3.49 0.05 -0.85 -0.48 118.68 112.04 2bhy s LEU 80 Ca 0.03 -1.30 0.04 0.00 0.05 0.00 0.00 54.13 52.95 2bhy s LEU 80 Cb 0.01 1.56 -0.04 0.00 -2.05 0.00 0.00 46.19 45.68 2bhy s LEU 80 CO -0.12 -1.25 0.21 -0.36 -0.55 0.00 0.00 176.35 174.29 2bhy s PHE 81 N -3.35 3.30 -0.22 3.48 0.08 -0.61 -0.96 117.98 119.70 2bhy s PHE 81 Ca 0.28 0.03 0.01 0.00 0.12 0.00 0.00 56.93 57.37 2bhy s PHE 81 Cb -0.00 -1.57 0.05 0.00 -0.57 0.00 0.00 43.02 40.93 2bhy s PHE 81 CO 0.16 0.51 -0.08 0.08 -0.10 0.00 0.00 175.22 175.80 2bhy s VAL 82 N -1.78 1.58 -0.26 -0.44 1.01 0.69 -0.09 120.40 121.11 2bhy s VAL 82 Ca 0.33 -1.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 2bhy s VAL 82 Cb -0.10 -1.75 0.02 0.00 0.00 0.00 0.00 36.38 34.55 2bhy s VAL 82 CO 0.26 0.03 -0.02 -0.76 0.00 0.00 0.00 175.10 174.61 2bhy s LEU 83 N 1.40 3.38 -1.63 3.92 1.43 -0.57 -1.57 118.68 125.04 2bhy s LEU 83 Ca -0.04 -0.84 -0.16 0.00 -1.03 0.00 0.00 54.13 52.07 2bhy s LEU 83 Cb -0.18 -1.72 0.13 0.00 0.03 0.00 0.00 46.19 44.45 2bhy s LEU 83 CO -0.07 -0.15 0.84 0.47 0.23 0.00 0.00 176.35 177.67 2bhy n ASP 84 N 4.72 -3.68 0.00 2.29 8.00 -0.28 -0.98 116.55 126.62 2bhy n ASP 84 Ca -0.16 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.41 2bhy n ASP 84 Cb 0.47 -3.16 0.00 0.00 -0.02 0.00 0.00 41.12 38.41 2bhy n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhy n GLY 85 N -1.52 1.19 3.54 0.44 0.00 -1.26 -5.01 105.19 102.57 2bhy n GLY 85 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 2bhy n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bhy s VAL 86 N -3.49 5.28 0.13 1.61 1.01 -0.16 -5.05 120.40 119.74 2bhy s VAL 86 Ca 0.00 -0.12 -0.31 0.00 0.00 0.00 0.00 61.98 61.55 2bhy s VAL 86 Cb 0.00 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.59 2bhy s VAL 86 CO 0.00 0.03 1.63 -2.84 0.00 0.00 0.00 175.10 173.92 2bhy s PRO 87 N 1.76 4.20 -0.03 2.72 0.02 -1.26 -1.51 135.00 140.89 2bhy s PRO 87 Ca 0.07 2.39 -0.01 0.00 0.02 0.00 0.00 61.00 63.47 2bhy s PRO 87 Cb -0.17 -3.33 0.03 0.00 0.02 0.00 0.00 34.50 31.05 2bhy s PRO 87 CO 0.11 -0.68 0.04 0.99 -0.33 0.00 0.00 177.00 177.13 2bhy s THR 88 N 1.75 -0.03 0.73 0.99 2.01 0.87 -4.97 115.64 116.99 2bhy s THR 88 Ca 0.73 0.31 -0.16 0.00 0.31 0.00 0.00 61.69 62.87 2bhy s THR 88 Cb -0.43 -0.16 0.00 0.00 0.01 0.00 0.00 72.50 71.92 2bhy s THR 88 CO 0.32 0.15 0.91 -2.65 -0.69 0.00 0.00 174.62 172.66 2bhy n PRO 89 N 4.80 0.44 -2.77 4.92 -0.02 -1.26 -1.58 135.00 139.54 2bhy n PRO 89 Ca -0.14 0.21 -0.43 0.00 -2.02 0.00 0.00 63.50 61.12 2bhy n PRO 89 Cb 0.50 -2.17 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 2bhy n PRO 89 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2bhy s ASP 90 N -1.65 6.71 0.64 2.55 2.15 -1.26 -4.78 116.67 121.03 2bhy s ASP 90 Ca 0.72 0.62 0.37 0.00 0.43 0.00 0.00 52.55 54.69 2bhy s ASP 90 Cb -0.34 -2.48 2.05 0.00 -0.30 0.00 0.00 42.92 41.85 2bhy s ASP 90 CO 0.52 -0.90 2.24 -0.65 -0.17 0.00 0.00 175.17 176.20 2bhy h PRO 91 N 8.50 0.00 -0.64 4.34 0.11 -1.92 -0.50 132.00 141.89 2bhy h PRO 91 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 2bhy h PRO 91 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2bhy h PRO 91 CO 1.00 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.45 2bhy n TYR 92 N -3.35 1.32 -1.66 0.65 4.01 -1.26 -4.43 117.16 112.44 2bhy n TYR 92 Ca -0.02 -0.52 -0.45 0.00 -0.16 0.00 0.00 57.90 56.75 2bhy n TYR 92 Cb 0.16 -0.23 -0.03 0.00 -0.31 0.00 0.00 39.34 38.94 2bhy n TYR 92 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bhy n ALA 93 N 0.96 0.91 0.83 -0.72 0.00 -0.20 -4.72 120.51 117.57 2bhy n ALA 93 Ca 0.23 0.41 0.12 0.00 0.00 0.00 0.00 53.44 54.20 2bhy n ALA 93 Cb 0.80 -2.24 0.20 0.00 0.00 0.00 0.00 19.45 18.20 2bhy n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2bhy n ARG 94 N 1.85 0.12 -3.60 0.00 5.12 -1.26 -2.82 116.66 116.06 2bhy n ARG 94 Ca 0.11 0.02 -0.12 0.00 -1.93 0.00 0.00 57.85 55.94 2bhy n ARG 94 Cb 0.31 -1.56 -0.06 0.00 -1.16 0.00 0.00 32.46 29.99 2bhy n ARG 94 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2bhy s PHE 95 N -3.07 -0.53 -0.53 -1.55 5.36 -1.26 -4.15 117.98 112.25 2bhy s PHE 95 Ca 0.09 1.16 0.05 0.00 -0.96 0.00 0.00 56.93 57.26 2bhy s PHE 95 Cb 0.16 0.37 0.18 0.00 -0.34 0.00 0.00 43.02 43.39 2bhy s PHE 95 CO 0.72 -0.34 0.42 1.28 -1.46 0.00 0.00 175.22 175.84 2bhy n LEU 96 N 1.73 1.04 0.28 6.12 4.77 -1.26 -1.22 117.00 128.46 2bhy n LEU 96 Ca -0.13 -4.75 0.12 0.00 -0.03 0.00 0.00 56.01 51.22 2bhy n LEU 96 Cb 0.56 0.00 0.78 0.00 -2.33 0.00 0.00 43.42 42.43 2bhy n LEU 96 CO 0.09 1.83 1.07 1.55 -1.33 0.00 0.00 177.39 180.60 2bhy h PRO 97 N 5.43 0.00 -0.44 3.23 0.13 -1.94 -1.60 132.00 136.81 2bhy h PRO 97 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 2bhy h PRO 97 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2bhy h PRO 97 CO 0.52 0.04 0.00 -0.25 -0.23 0.00 0.00 178.00 178.08 2bhy n ASP 98 N -4.04 4.48 0.00 1.44 8.00 -1.26 -4.96 116.55 120.20 2bhy n ASP 98 Ca -0.03 -2.76 0.00 0.00 0.71 0.00 0.00 54.79 52.72 2bhy n ASP 98 Cb 0.12 -0.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.67 2bhy n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhy n GLY 99 N 0.27 -2.76 0.03 0.44 0.00 -0.60 -4.46 105.19 98.11 2bhy n GLY 99 Ca 0.23 -1.85 0.11 0.00 0.00 0.00 0.00 46.02 44.50 2bhy n GLY 99 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bhy n VAL 100 N -0.21 0.61 -0.02 1.61 0.24 -1.26 -2.21 118.33 117.08 2bhy n VAL 100 Ca 0.00 0.11 0.09 0.00 -2.04 0.00 0.00 64.34 62.50 2bhy n VAL 100 Cb 0.00 -0.82 0.21 0.00 -1.47 0.00 0.00 33.84 31.76 2bhy n VAL 100 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2bhy n HIS 101 N -1.69 0.57 -3.64 6.34 8.25 -1.26 -4.75 115.22 119.04 2bhy n HIS 101 Ca 0.05 -0.37 -0.15 0.00 -0.26 0.00 0.00 57.72 56.98 2bhy n HIS 101 Cb 0.26 -0.01 0.01 0.00 1.12 0.00 0.00 29.99 31.37 2bhy n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bhy n GLY 102 N 1.14 2.75 3.77 -1.41 0.00 -0.94 -4.83 105.19 105.67 2bhy n GLY 102 Ca 0.17 -2.24 -0.38 0.00 0.00 0.00 0.00 46.02 43.57 2bhy n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bhy s GLU 103 N -3.36 3.88 0.56 1.61 2.02 -1.26 -4.66 118.70 117.50 2bhy s GLU 103 Ca 0.21 1.92 -0.07 0.00 0.02 0.00 0.00 54.97 57.04 2bhy s GLU 103 Cb -0.02 -2.58 -0.02 0.00 0.10 0.00 0.00 34.13 31.61 2bhy s GLU 103 CO 0.13 -0.49 0.90 0.00 0.02 0.00 0.00 175.26 175.82 2bhy s ALA 104 N -1.41 3.27 -0.06 5.21 0.00 0.37 -4.16 121.76 124.97 2bhy s ALA 104 Ca 0.60 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.11 2bhy s ALA 104 Cb -0.32 -2.73 -0.03 0.00 0.00 0.00 0.00 23.12 20.04 2bhy s ALA 104 CO 0.40 -0.63 -0.10 -2.00 0.00 0.00 0.00 175.76 173.44 2bhy s GLU 105 N -4.96 2.69 0.06 0.00 2.12 -0.36 -1.23 118.70 117.03 2bhy s GLU 105 Ca 0.52 -0.60 -0.31 0.00 0.36 0.00 0.00 54.97 54.94 2bhy s GLU 105 Cb -0.11 -2.52 -0.06 0.00 0.26 0.00 0.00 34.13 31.70 2bhy s GLU 105 CO 0.47 0.63 1.26 0.08 -0.54 0.00 0.00 175.26 177.16 2bhy s VAL 106 N -0.73 3.85 -0.05 3.70 1.01 -0.23 -4.02 120.40 123.93 2bhy s VAL 106 Ca 0.11 1.32 0.06 0.00 0.00 0.00 0.00 61.98 63.47 2bhy s VAL 106 Cb -0.11 -3.85 -0.01 0.00 0.00 0.00 0.00 36.38 32.41 2bhy s VAL 106 CO 0.01 0.09 -0.24 -0.69 0.00 0.00 0.00 175.10 174.27 2bhy s VAL 107 N 1.20 2.17 -0.26 2.92 1.01 -1.26 -1.07 120.40 125.11 2bhy s VAL 107 Ca 0.60 -1.04 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 2bhy s VAL 107 Cb -0.31 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.30 2bhy s VAL 107 CO 0.29 0.57 -0.00 -0.62 0.00 0.00 0.00 175.10 175.34 2bhy s ASP 108 N -0.33 4.62 0.00 3.32 -1.08 -1.26 -4.56 116.67 117.38 2bhy s ASP 108 Ca 0.02 -0.72 0.28 0.00 -0.52 0.00 0.00 52.55 51.60 2bhy s ASP 108 Cb -0.12 -1.76 1.19 0.00 -1.46 0.00 0.00 42.92 40.77 2bhy s ASP 108 CO 0.02 -0.13 1.89 0.49 0.52 0.00 0.00 175.17 177.96 2bhy n PHE 109 N 4.77 0.00 1.16 -5.34 3.72 -1.26 -3.72 117.46 116.79 2bhy n PHE 109 Ca -0.16 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.37 2bhy n PHE 109 Cb 0.48 -0.49 0.44 0.00 -0.94 0.00 0.00 39.48 38.97 2bhy n PHE 109 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bhy n GLY 110 N 1.35 -1.07 0.12 1.37 0.00 -1.26 -4.10 105.19 101.60 2bhy n GLY 110 Ca 0.07 -0.30 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 2bhy n GLY 110 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2bhy h THR 111 N 0.41 1.49 -2.91 2.61 2.02 -2.02 -3.47 112.91 111.05 2bhy h THR 111 Ca 0.00 -2.18 -0.57 0.00 0.77 0.00 0.00 66.41 64.43 2bhy h THR 111 Cb 0.46 2.83 0.09 0.00 -1.74 0.00 0.00 68.15 69.79 2bhy h THR 111 CO 0.00 0.62 0.62 0.33 0.37 0.00 0.00 175.52 177.46 2bhy n PHE 112 N -4.28 2.27 -3.03 3.16 7.35 -1.26 -4.89 117.46 116.79 2bhy n PHE 112 Ca -0.11 0.44 -0.45 0.00 -0.76 0.00 0.00 57.45 56.57 2bhy n PHE 112 Cb 0.66 -2.47 -0.02 0.00 0.35 0.00 0.00 39.48 38.01 2bhy n PHE 112 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 2bhy s ASP 113 N 0.17 6.67 0.42 -2.13 1.01 -1.26 -5.02 116.67 116.52 2bhy s ASP 113 Ca 0.64 -2.22 -0.25 0.00 0.71 0.00 0.00 52.55 51.44 2bhy s ASP 113 Cb -0.61 -2.35 -0.08 0.00 1.01 0.00 0.00 42.92 40.89 2bhy s ASP 113 CO 0.53 -0.94 1.21 0.26 0.21 0.00 0.00 175.17 176.44 2bhy s TRP 114 N 2.04 2.92 -0.14 4.23 0.52 -1.26 -4.95 118.94 122.30 2bhy s TRP 114 Ca 0.29 1.51 0.06 0.00 0.02 0.00 0.00 56.10 57.97 2bhy s TRP 114 Cb -0.06 -3.48 0.11 0.00 -1.15 0.00 0.00 33.47 28.89 2bhy s TRP 114 CO -0.09 -1.63 1.07 0.25 0.02 0.00 0.00 176.95 176.57 2bhy n THR 115 N -0.09 1.22 -1.27 2.01 -2.24 -1.26 -4.82 114.28 107.83 2bhy n THR 115 Ca 0.05 -1.28 -0.26 0.00 -2.27 0.00 0.00 64.05 60.29 2bhy n THR 115 Cb 0.46 0.33 0.15 0.00 -2.10 0.00 0.00 70.33 69.17 2bhy n THR 115 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2bhy n ASP 116 N -0.56 4.79 0.26 3.42 5.75 -1.26 -4.59 116.55 124.36 2bhy n ASP 116 Ca 0.05 -3.67 0.11 0.00 -0.01 0.00 0.00 54.79 51.28 2bhy n ASP 116 Cb 0.37 -0.87 0.70 0.00 -1.03 0.00 0.00 41.12 40.29 2bhy n ASP 116 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bhy h ALA 117 N 1.28 1.47 -0.32 2.12 0.00 -2.00 -2.00 119.26 119.81 2bhy h ALA 117 Ca 0.62 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.43 2bhy h ALA 117 Cb 2.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 20.04 2bhy h ALA 117 CO 1.21 0.14 0.00 -0.25 0.00 0.00 0.00 179.25 180.35 2bhy n ASP 118 N -3.90 2.18 -4.74 0.00 8.00 -1.26 -4.82 116.55 112.01 2bhy n ASP 118 Ca -0.02 -1.89 -0.37 0.00 0.71 0.00 0.00 54.79 53.22 2bhy n ASP 118 Cb 0.20 -0.21 -0.06 0.00 -0.02 0.00 0.00 41.12 41.03 2bhy n ASP 118 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2bhy s TRP 119 N -1.58 3.52 -0.17 1.24 -0.11 -0.75 -5.00 118.94 116.10 2bhy s TRP 119 Ca 0.31 0.78 0.15 0.00 1.22 0.00 0.00 56.10 58.56 2bhy s TRP 119 Cb 0.17 -2.42 0.43 0.00 -1.50 0.00 0.00 33.47 30.15 2bhy s TRP 119 CO 0.24 0.27 1.20 0.72 -4.62 0.00 0.00 176.95 174.75 2bhy n HIS 120 N 3.36 0.39 -3.33 5.86 8.25 -1.26 -5.07 115.22 123.43 2bhy n HIS 120 Ca -0.10 -1.36 0.00 0.00 -0.26 0.00 0.00 57.72 55.99 2bhy n HIS 120 Cb 0.52 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 31.39 2bhy n HIS 120 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bhy n GLY 121 N -0.63 -2.07 3.05 -1.41 0.00 -1.26 -4.76 105.19 98.11 2bhy n GLY 121 Ca 0.18 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 2bhy n GLY 121 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2bhy s ILE 122 N -0.03 -0.01 0.43 -0.61 2.07 -1.26 -5.01 121.20 116.79 2bhy s ILE 122 Ca 0.00 0.02 -0.21 0.00 -1.41 0.00 0.00 60.65 59.05 2bhy s ILE 122 Cb 0.00 -0.26 -0.10 0.00 0.13 0.00 0.00 42.46 42.22 2bhy s ILE 122 CO 0.00 0.01 0.97 -0.54 -1.91 0.00 0.00 174.94 173.47 2bhy s LYS 123 N 0.23 4.16 0.26 3.50 1.02 -1.26 -4.91 119.74 122.74 2bhy s LYS 123 Ca -0.01 1.19 -0.03 0.00 0.02 0.00 0.00 55.97 57.14 2bhy s LYS 123 Cb -0.02 -2.21 0.40 0.00 -0.52 0.00 0.00 37.83 35.47 2bhy s LYS 123 CO -0.01 -0.10 1.85 1.25 -0.92 0.00 0.00 175.35 177.43 2bhy h LEU 124 N 1.93 0.89 -1.58 3.17 5.85 -1.97 -0.92 115.31 122.69 2bhy h LEU 124 Ca -0.49 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.25 2bhy h LEU 124 Cb 1.19 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.06 2bhy h LEU 124 CO 0.61 0.55 0.00 0.00 -0.34 0.00 0.00 178.44 179.26 2bhy h ALA 125 N 1.45 1.00 -0.09 1.25 0.00 -1.93 -0.88 119.26 120.06 2bhy h ALA 125 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 2bhy h ALA 125 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2bhy h ALA 125 CO -0.20 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.80 2bhy n ASP 126 N -2.43 2.90 -4.73 0.00 8.00 -0.36 -4.98 116.55 114.94 2bhy n ASP 126 Ca -0.01 -1.91 -0.41 0.00 0.71 0.00 0.00 54.79 53.17 2bhy n ASP 126 Cb 0.09 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.10 2bhy n ASP 126 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bhy s VAL 128 N 0.45 1.76 0.36 0.00 1.01 -1.26 -4.20 120.40 118.51 2bhy s VAL 128 Ca 0.44 -1.49 -0.23 0.00 0.00 0.00 0.00 61.98 60.70 2bhy s VAL 128 Cb -0.21 -2.03 -0.10 0.00 0.00 0.00 0.00 36.38 34.04 2bhy s VAL 128 CO 0.25 -0.18 0.92 -0.36 0.00 0.00 0.00 175.10 175.73 2bhy s PHE 129 N 1.26 3.53 -0.19 5.22 0.08 -0.35 -1.62 117.98 125.91 2bhy s PHE 129 Ca -0.04 1.66 -0.02 0.00 0.12 0.00 0.00 56.93 58.65 2bhy s PHE 129 Cb -0.19 -2.85 0.06 0.00 -0.57 0.00 0.00 43.02 39.47 2bhy s PHE 129 CO -0.07 0.09 0.01 -0.47 -0.10 0.00 0.00 175.22 174.68 2bhy s TYR 130 N -1.85 1.28 -0.24 0.36 5.04 0.20 -0.49 117.35 121.65 2bhy s TYR 130 Ca 0.54 -0.98 -0.24 0.00 -2.44 0.00 0.00 57.07 53.95 2bhy s TYR 130 Cb -0.14 -1.12 -0.01 0.00 0.35 0.00 0.00 41.96 41.04 2bhy s TYR 130 CO 0.19 -0.62 0.81 -2.00 -1.34 0.00 0.00 175.55 172.58 2bhy s GLU 131 N 1.77 4.18 -0.03 4.97 2.12 0.38 -0.38 118.70 131.71 2bhy s GLU 131 Ca -0.01 0.90 0.06 0.00 0.36 0.00 0.00 54.97 56.28 2bhy s GLU 131 Cb -0.17 -3.64 -0.01 0.00 0.26 0.00 0.00 34.13 30.57 2bhy s GLU 131 CO -0.07 -0.50 -0.20 0.14 -0.54 0.00 0.00 175.26 174.08 2bhy s VAL 132 N 2.78 1.64 -0.34 3.70 -7.23 -0.04 -1.08 120.40 119.83 2bhy s VAL 132 Ca 0.34 -0.87 -0.11 0.00 -1.81 0.00 0.00 61.98 59.54 2bhy s VAL 132 Cb -0.15 -1.38 0.01 0.00 0.56 0.00 0.00 36.38 35.41 2bhy s VAL 132 CO 0.08 0.47 0.19 -2.28 -0.31 0.00 0.00 175.10 173.24 2bhy s HIS 133 N -0.28 3.21 0.29 2.82 2.46 -1.26 -4.40 115.29 118.12 2bhy s HIS 133 Ca 0.03 -0.70 -0.02 0.00 0.47 0.00 0.00 55.06 54.84 2bhy s HIS 133 Cb -0.10 -2.41 0.42 0.00 -0.13 0.00 0.00 32.58 30.36 2bhy s HIS 133 CO 0.01 -0.53 1.95 0.28 -2.47 0.00 0.00 174.74 173.98 2bhy h VAL 134 N 5.73 1.19 -0.10 0.89 2.07 -1.94 -0.85 116.25 123.24 2bhy h VAL 134 Ca -0.29 -0.40 -0.06 0.00 0.82 0.00 0.00 66.70 66.77 2bhy h VAL 134 Cb 1.13 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 2bhy h VAL 134 CO 0.64 0.21 -0.21 1.23 0.02 0.00 0.00 177.57 179.47 2bhy h GLY 135 N 1.16 0.18 0.00 2.17 0.00 -1.92 -3.19 103.07 101.47 2bhy h GLY 135 Ca 0.34 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2bhy h GLY 135 CO -0.09 0.11 -1.06 -1.30 0.00 0.00 0.00 176.54 174.20 2bhy n THR 136 N -4.22 0.00 0.14 4.70 -2.24 -0.94 -4.17 114.28 107.55 2bhy n THR 136 Ca -0.01 -0.23 0.03 0.00 -2.27 0.00 0.00 64.05 61.57 2bhy n THR 136 Cb 0.31 0.68 0.43 0.00 -2.10 0.00 0.00 70.33 69.65 2bhy n THR 136 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2bhy h PHE 137 N 0.00 0.20 -3.82 4.78 3.57 -1.16 -2.02 116.94 118.50 2bhy h PHE 137 Ca 0.00 -0.02 -0.24 0.00 3.53 0.00 0.00 57.97 61.24 2bhy h PHE 137 Cb 0.47 -0.06 -0.15 0.00 2.79 0.00 0.00 35.95 39.00 2bhy h PHE 137 CO 0.00 0.30 -0.68 0.95 -2.23 0.00 0.00 178.31 176.65 2bhy s THR 138 N -4.79 0.67 0.20 4.41 -4.23 -1.26 -4.65 115.64 105.99 2bhy s THR 138 Ca -0.05 -1.95 -0.11 0.00 -1.18 0.00 0.00 61.69 58.40 2bhy s THR 138 Cb 0.16 -1.84 0.15 0.00 1.34 0.00 0.00 72.50 72.31 2bhy s THR 138 CO 0.72 -0.73 1.70 -0.65 -0.54 0.00 0.00 174.62 175.12 2bhy h PRO 139 N 2.87 0.21 -0.51 3.99 0.11 -1.85 -2.16 132.00 134.66 2bhy h PRO 139 Ca -0.36 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.69 2bhy h PRO 139 Cb 1.18 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2bhy h PRO 139 CO 0.64 0.14 0.12 0.93 -0.21 0.00 0.00 178.00 179.61 2bhy h GLU 140 N 0.22 0.78 -2.07 1.05 3.07 -1.95 -3.47 114.58 112.21 2bhy h GLU 140 Ca 0.30 -0.16 -0.16 0.00 -0.50 0.00 0.00 59.36 58.84 2bhy h GLU 140 Cb 0.45 -0.12 0.02 0.00 -0.84 0.00 0.00 28.75 28.26 2bhy h GLU 140 CO -0.41 0.71 -0.24 0.41 -1.40 0.00 0.00 179.01 178.09 2bhy n GLY 141 N -0.87 0.21 3.35 -3.84 0.00 -0.81 -5.04 105.19 98.18 2bhy n GLY 141 Ca 0.04 -0.42 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 2bhy n GLY 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bhy s THR 142 N -2.78 1.26 0.23 2.61 -4.23 -1.25 -4.07 115.64 107.41 2bhy s THR 142 Ca 0.12 -2.07 -0.07 0.00 -1.18 0.00 0.00 61.69 58.48 2bhy s THR 142 Cb -0.05 -2.29 0.21 0.00 1.34 0.00 0.00 72.50 71.70 2bhy s THR 142 CO 0.15 -0.39 1.86 1.88 -0.54 0.00 0.00 174.62 177.59 2bhy h TYR 143 N 2.46 1.20 -0.70 3.99 0.99 -1.54 -1.59 116.97 121.78 2bhy h TYR 143 Ca -0.39 -0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.27 2bhy h TYR 143 Cb 1.22 -0.39 -0.03 0.00 1.00 0.00 0.00 36.73 38.53 2bhy h TYR 143 CO 0.62 0.81 0.20 0.00 -0.00 0.00 0.00 178.16 179.79 2bhy h ARG 144 N 1.23 1.10 -0.28 4.88 2.47 -1.83 0.49 114.38 122.44 2bhy h ARG 144 Ca 0.32 -0.25 -0.15 0.00 -1.26 0.00 0.00 59.98 58.64 2bhy h ARG 144 Cb -0.01 -0.15 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 2bhy h ARG 144 CO -0.06 0.95 -0.42 0.00 0.56 0.00 0.00 179.97 181.01 2bhy h ALA 145 N 1.09 0.74 -0.91 0.04 0.00 -1.91 -2.93 119.26 115.38 2bhy h ALA 145 Ca 0.22 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2bhy h ALA 145 Cb 0.33 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2bhy h ALA 145 CO -0.00 0.66 0.57 0.00 0.00 0.00 0.00 179.25 180.48 2bhy h ALA 146 N 0.97 1.30 -0.13 0.00 0.00 -0.67 -2.55 119.26 118.18 2bhy h ALA 146 Ca 0.04 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2bhy h ALA 146 Cb 0.96 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2bhy h ALA 146 CO 0.09 0.62 0.09 0.00 0.00 0.00 0.00 179.25 180.05 2bhy h ALA 147 N 1.39 1.95 0.00 0.00 0.00 -0.72 -0.95 119.26 120.92 2bhy h ALA 147 Ca 0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2bhy h ALA 147 Cb -0.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2bhy h ALA 147 CO -0.07 0.04 0.00 0.39 0.00 0.00 0.00 179.25 179.62 2bhy n GLU 148 N -4.52 0.20 0.00 0.00 -0.58 -0.96 -2.04 120.64 112.74 2bhy n GLU 148 Ca -0.01 0.39 0.14 0.00 -0.42 0.00 0.00 57.16 57.26 2bhy n GLU 148 Cb 0.10 -1.86 0.46 0.00 -0.57 0.00 0.00 31.44 29.58 2bhy n GLU 148 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2bhy n LYS 149 N -2.23 1.49 -0.18 3.49 4.76 -0.36 -4.45 118.16 120.68 2bhy n LYS 149 Ca 0.03 -0.89 -0.09 0.00 -2.87 0.00 0.00 58.31 54.48 2bhy n LYS 149 Cb 0.25 -1.48 0.01 0.00 -1.84 0.00 0.00 35.03 31.97 2bhy n LYS 149 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2bhy h LEU 150 N 2.18 0.81 -1.06 -0.35 3.38 -1.46 -2.01 115.31 116.80 2bhy h LEU 150 Ca 0.00 -0.26 0.07 0.00 0.09 0.00 0.00 57.88 57.78 2bhy h LEU 150 Cb 0.53 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.00 2bhy h LEU 150 CO 0.00 0.87 0.63 -0.65 0.09 0.00 0.00 178.44 179.38 2bhy h PRO 151 N 0.72 1.08 -0.45 1.13 0.11 -1.80 -0.15 132.00 132.64 2bhy h PRO 151 Ca 0.15 -0.07 0.05 0.00 0.11 0.00 0.00 66.00 66.25 2bhy h PRO 151 Cb 0.41 -0.24 -0.05 0.00 0.11 0.00 0.00 31.00 31.23 2bhy h PRO 151 CO 0.01 0.72 0.19 -0.92 -0.21 0.00 0.00 178.00 177.78 2bhy h TYR 152 N 1.11 0.33 -0.55 0.65 3.20 -1.73 -1.17 116.97 118.82 2bhy h TYR 152 Ca 0.43 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.20 2bhy h TYR 152 Cb 0.21 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 2bhy h TYR 152 CO -0.00 0.14 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.49 2bhy h LEU 153 N 0.37 1.02 -0.39 2.82 3.38 -0.59 0.63 115.31 122.56 2bhy h LEU 153 Ca 0.21 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 2bhy h LEU 153 Cb 0.17 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2bhy h LEU 153 CO -0.19 1.12 0.23 0.50 0.09 0.00 0.00 178.44 180.19 2bhy h LYS 154 N 0.91 0.53 -0.18 1.13 1.63 -0.82 -2.45 116.57 117.31 2bhy h LYS 154 Ca 0.14 -0.05 -0.13 0.00 -0.85 0.00 0.00 60.65 59.76 2bhy h LYS 154 Cb 0.66 -0.11 -0.01 0.00 -0.60 0.00 0.00 32.23 32.17 2bhy h LYS 154 CO 0.05 0.40 -0.45 1.49 -3.45 0.00 0.00 179.45 177.49 2bhy h GLU 155 N 0.51 0.46 -0.78 1.90 4.57 -1.01 -2.74 114.58 117.49 2bhy h GLU 155 Ca 0.14 -0.25 0.09 0.00 -1.18 0.00 0.00 59.36 58.16 2bhy h GLU 155 Cb 0.01 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.54 2bhy h GLU 155 CO -0.03 0.82 0.42 1.25 -1.18 0.00 0.00 179.01 180.30 2bhy h LEU 156 N 0.37 0.59 0.00 1.64 5.85 -0.57 -3.47 115.31 119.72 2bhy h LEU 156 Ca 0.03 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2bhy h LEU 156 Cb 0.94 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.91 2bhy h LEU 156 CO 0.08 0.33 0.00 0.61 -0.34 0.00 0.00 178.44 179.13 2bhy n GLY 157 N -1.31 1.36 3.86 3.75 0.00 -0.95 -4.43 105.19 107.47 2bhy n GLY 157 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2bhy n GLY 157 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bhy s VAL 158 N -2.00 4.60 0.00 1.61 -7.23 -1.19 -4.93 120.40 111.26 2bhy s VAL 158 Ca 0.00 0.90 0.00 0.00 -1.81 0.00 0.00 61.98 61.07 2bhy s VAL 158 Cb 0.00 -3.79 0.00 0.00 0.56 0.00 0.00 36.38 33.15 2bhy s VAL 158 CO 0.00 -1.05 0.02 0.35 -0.31 0.00 0.00 175.10 174.11 2bhy n THR 159 N -2.63 0.00 -3.69 5.32 -2.24 -0.64 -4.63 114.28 105.76 2bhy n THR 159 Ca 0.06 -0.39 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 2bhy n THR 159 Cb 0.54 1.01 -0.13 0.00 -2.10 0.00 0.00 70.33 69.65 2bhy n THR 159 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bhy s ALA 160 N -0.74 -0.66 -0.09 6.98 0.00 -0.78 -1.25 121.76 125.22 2bhy s ALA 160 Ca 0.00 1.07 -0.21 0.00 0.00 0.00 0.00 51.96 52.82 2bhy s ALA 160 Cb 0.00 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 2bhy s ALA 160 CO 0.00 -0.43 0.62 0.42 0.00 0.00 0.00 175.76 176.36 2bhy s ILE 161 N 1.87 5.10 -0.38 0.00 -1.09 0.13 -0.63 121.20 126.20 2bhy s ILE 161 Ca -0.04 1.25 -0.04 0.00 -2.23 0.00 0.00 60.65 59.59 2bhy s ILE 161 Cb -0.11 -3.95 0.08 0.00 -1.58 0.00 0.00 42.46 36.90 2bhy s ILE 161 CO -0.09 0.27 0.15 -1.58 -1.23 0.00 0.00 174.94 172.46 2bhy s GLN 162 N 0.78 2.31 0.00 2.79 2.00 0.49 0.00 119.66 128.03 2bhy s GLN 162 Ca 0.33 -1.53 0.00 0.00 -2.00 0.00 0.00 55.36 52.16 2bhy s GLN 162 Cb -0.17 -3.51 0.00 0.00 0.80 0.00 0.00 33.01 30.13 2bhy s GLN 162 CO 0.15 -0.89 0.00 0.28 -0.50 0.00 0.00 175.29 174.33 2bhy n VAL 163 N 4.69 0.00 -3.18 1.34 0.31 0.09 -0.86 118.33 120.72 2bhy n VAL 163 Ca -0.08 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 63.87 2bhy n VAL 163 Cb 0.43 -1.29 -0.06 0.00 -0.91 0.00 0.00 33.84 32.01 2bhy n VAL 163 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2bhy s PRO 165 N 1.77 4.30 0.00 5.55 0.02 -1.25 -1.11 135.00 144.29 2bhy s PRO 165 Ca 0.00 0.86 0.12 0.00 0.02 0.00 0.00 61.00 62.00 2bhy s PRO 165 Cb 0.00 -3.22 -0.03 0.00 0.02 0.00 0.00 34.50 31.27 2bhy s PRO 165 CO 0.00 0.61 0.65 1.28 -0.33 0.00 0.00 177.00 179.20 2bhy n LEU 166 N 1.61 1.16 -4.75 -5.54 4.77 -1.26 -4.48 117.00 108.50 2bhy n LEU 166 Ca -0.09 -0.71 -0.42 0.00 -0.03 0.00 0.00 56.01 54.77 2bhy n LEU 166 Cb 0.50 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.58 2bhy n LEU 166 CO 0.43 0.23 1.13 0.00 -1.33 0.00 0.00 177.39 177.85 2bhy n ALA 167 N -0.44 2.21 -1.74 -1.18 0.00 -1.26 -0.22 120.51 117.88 2bhy n ALA 167 Ca 0.04 0.36 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 2bhy n ALA 167 Cb 0.23 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.26 2bhy n ALA 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bhy n ALA 168 N 0.98 2.66 -2.38 0.00 0.00 0.34 -4.42 120.51 117.69 2bhy n ALA 168 Ca 0.04 0.38 -0.19 0.00 0.00 0.00 0.00 53.44 53.68 2bhy n ALA 168 Cb 0.37 -2.49 -0.10 0.00 0.00 0.00 0.00 19.45 17.23 2bhy n ALA 168 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 2bhy s PHE 169 N 0.40 1.73 0.44 0.00 -0.12 -1.26 -0.43 117.98 118.74 2bhy s PHE 169 Ca 0.68 -0.96 -0.17 0.00 -0.05 0.00 0.00 56.93 56.43 2bhy s PHE 169 Cb -0.50 -1.05 -0.09 0.00 -0.63 0.00 0.00 43.02 40.75 2bhy s PHE 169 CO 0.43 -0.05 0.91 0.34 -0.05 0.00 0.00 175.22 176.80 2bhy s ASP 170 N -3.38 6.75 0.00 1.98 2.15 -1.26 -4.68 116.67 118.22 2bhy s ASP 170 Ca 0.33 1.52 0.00 0.00 0.43 0.00 0.00 52.55 54.83 2bhy s ASP 170 Cb 0.07 -2.48 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 2bhy s ASP 170 CO 0.12 -0.43 0.00 0.61 -0.17 0.00 0.00 175.17 175.30 2bhy n GLY 171 N -1.04 -0.13 0.57 2.66 0.00 -1.25 -4.62 105.19 101.38 2bhy n GLY 171 Ca 0.06 -1.86 0.11 0.00 0.00 0.00 0.00 46.02 44.33 2bhy n GLY 171 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bhy n GLN 172 N -0.15 1.43 -3.53 1.61 1.13 -1.26 -4.94 117.38 111.67 2bhy n GLN 172 Ca 0.00 -1.15 -0.12 0.00 -1.94 0.00 0.00 57.00 53.79 2bhy n GLN 172 Cb 0.00 -1.46 -0.04 0.00 0.11 0.00 0.00 30.24 28.85 2bhy n GLN 172 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 2bhy s ARG 173 N -2.35 1.15 0.00 -1.09 3.03 -1.26 -5.00 118.95 113.43 2bhy s ARG 173 Ca 0.20 -0.49 0.00 0.00 2.03 0.00 0.00 55.73 57.47 2bhy s ARG 173 Cb 0.18 0.52 0.00 0.00 -1.03 0.00 0.00 34.95 34.62 2bhy s ARG 173 CO 0.51 -0.46 0.00 0.41 -1.13 0.00 0.00 175.30 174.63 2bhy n GLY 174 N -0.12 1.39 0.21 3.88 0.00 -1.26 -3.45 105.19 105.83 2bhy n GLY 174 Ca -0.17 -0.80 -0.01 0.00 0.00 0.00 0.00 46.02 45.03 2bhy n GLY 174 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2bhy h TRP 175 N 0.00 0.32 0.00 1.61 4.06 -1.96 -3.48 115.95 116.50 2bhy h TRP 175 Ca 0.00 -0.07 0.00 0.00 2.06 0.00 0.00 58.89 60.88 2bhy h TRP 175 Cb 0.00 -0.08 0.00 0.00 -1.00 0.00 0.00 29.16 28.08 2bhy h TRP 175 CO 0.00 0.58 0.00 0.41 -3.56 0.00 0.00 178.44 175.87 2bhy n GLY 176 N -0.36 1.86 0.00 1.49 0.00 -1.26 -4.14 105.19 102.77 2bhy n GLY 176 Ca -0.01 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.16 2bhy n GLY 176 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bhy n TYR 177 N -0.03 0.00 0.04 1.61 4.01 -1.26 -2.03 117.16 119.51 2bhy n TYR 177 Ca 0.00 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.82 2bhy n TYR 177 Cb 0.00 -0.14 0.26 0.00 -0.31 0.00 0.00 39.34 39.15 2bhy n TYR 177 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2bhy n ASP 178 N -1.14 3.41 -4.49 7.72 8.00 -1.26 -4.56 116.55 124.22 2bhy n ASP 178 Ca 0.19 -2.17 -0.49 0.00 0.71 0.00 0.00 54.79 53.03 2bhy n ASP 178 Cb 0.17 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.80 2bhy n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhy n GLY 179 N 1.17 -0.87 0.00 0.44 0.00 -0.86 -3.58 105.19 101.50 2bhy n GLY 179 Ca 0.19 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.64 2bhy n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhy n ALA 180 N 0.52 1.50 -3.85 4.61 0.00 0.43 -0.91 120.51 122.81 2bhy n ALA 180 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.26 2bhy n ALA 180 Cb 0.25 0.12 -0.12 0.00 0.00 0.00 0.00 19.45 19.69 2bhy n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bhy s ALA 181 N -1.50 3.32 0.34 0.00 0.00 -1.03 -4.55 121.76 118.35 2bhy s ALA 181 Ca 0.00 -3.04 0.29 0.00 0.00 0.00 0.00 51.96 49.20 2bhy s ALA 181 Cb 0.00 -2.35 1.41 0.00 0.00 0.00 0.00 23.12 22.18 2bhy s ALA 181 CO 0.00 -1.96 2.03 0.74 0.00 0.00 0.00 175.76 176.57 2bhy h PHE 182 N 7.09 0.00 -0.01 0.00 0.04 -1.88 -2.66 116.94 119.53 2bhy h PHE 182 Ca -0.06 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.71 2bhy h PHE 182 Cb 0.96 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.11 2bhy h PHE 182 CO 0.58 0.12 -0.20 0.66 -0.60 0.00 0.00 178.31 178.87 2bhy n TYR 183 N -3.48 0.00 -3.79 -0.55 4.01 -1.26 -4.65 117.16 107.44 2bhy n TYR 183 Ca -0.01 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.36 2bhy n TYR 183 Cb 0.27 -0.08 -0.13 0.00 -0.31 0.00 0.00 39.34 39.09 2bhy n TYR 183 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bhy s ALA 184 N -2.37 2.99 0.25 -0.72 0.00 -1.02 -4.36 121.76 116.53 2bhy s ALA 184 Ca 0.27 -1.74 -0.30 0.00 0.00 0.00 0.00 51.96 50.19 2bhy s ALA 184 Cb 0.20 -2.18 -0.10 0.00 0.00 0.00 0.00 23.12 21.03 2bhy s ALA 184 CO 0.47 -1.31 1.43 -2.14 0.00 0.00 0.00 175.76 174.21 2bhy s PRO 185 N 1.37 4.27 -0.09 0.00 0.02 -1.26 -0.51 135.00 138.80 2bhy s PRO 185 Ca -0.02 2.30 -0.31 0.00 0.02 0.00 0.00 61.00 62.98 2bhy s PRO 185 Cb -0.19 -3.11 -0.09 0.00 0.02 0.00 0.00 34.50 31.13 2bhy s PRO 185 CO 0.02 -0.41 2.02 0.98 -0.33 0.00 0.00 177.00 179.28 2bhy n TYR 186 N 2.23 2.26 -0.17 6.54 9.36 0.69 -4.69 117.16 133.38 2bhy n TYR 186 Ca 0.06 -0.15 0.01 0.00 3.32 0.00 0.00 57.90 61.15 2bhy n TYR 186 Cb 0.40 -2.72 0.28 0.00 -0.63 0.00 0.00 39.34 36.67 2bhy n TYR 186 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2bhy h ALA 187 N 11.31 1.51 -0.07 2.98 0.00 -1.82 -1.99 119.26 131.18 2bhy h ALA 187 Ca -0.46 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.42 2bhy h ALA 187 Cb 1.26 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 2bhy h ALA 187 CO 0.95 0.45 0.11 -1.35 0.00 0.00 0.00 179.25 179.42 2bhy h PRO 188 N 0.92 0.00 0.00 0.00 0.11 -1.94 -1.02 132.00 130.08 2bhy h PRO 188 Ca 0.25 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.34 2bhy h PRO 188 Cb -0.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.01 2bhy h PRO 188 CO -0.05 0.00 -0.09 1.88 -0.21 0.00 0.00 178.00 179.52 2bhy h TYR 189 N 0.00 0.00 0.00 0.65 0.99 -1.59 -3.44 116.97 113.58 2bhy h TYR 189 Ca 0.03 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.76 2bhy h TYR 189 Cb 0.25 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.98 2bhy h TYR 189 CO 0.00 0.09 0.00 0.41 -0.00 0.00 0.00 178.16 178.66 2bhy n GLY 190 N 0.76 2.10 3.92 3.88 0.00 -0.39 -1.32 105.19 114.16 2bhy n GLY 190 Ca 0.02 -1.79 -0.26 0.00 0.00 0.00 0.00 46.02 43.99 2bhy n GLY 190 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bhy s ARG 191 N -1.57 2.60 0.26 1.61 0.52 -1.26 -4.48 118.95 116.63 2bhy s ARG 191 Ca 0.00 -0.10 -0.02 0.00 -0.52 0.00 0.00 55.73 55.09 2bhy s ARG 191 Cb 0.00 -2.22 0.53 0.00 0.52 0.00 0.00 34.95 33.78 2bhy s ARG 191 CO 0.00 -0.95 1.74 -1.35 0.02 0.00 0.00 175.30 174.76 2bhy h PRO 192 N -0.38 0.49 -0.94 3.54 0.11 -1.92 -0.53 132.00 132.37 2bhy h PRO 192 Ca -0.45 -0.03 0.15 0.00 0.11 0.00 0.00 66.00 65.78 2bhy h PRO 192 Cb 1.28 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 32.20 2bhy h PRO 192 CO 0.61 0.32 0.60 1.05 -0.21 0.00 0.00 178.00 180.37 2bhy h GLU 193 N 0.50 0.74 -0.17 1.05 4.11 -1.99 -2.08 114.58 116.74 2bhy h GLU 193 Ca 0.46 -0.04 -0.17 0.00 0.07 0.00 0.00 59.36 59.67 2bhy h GLU 193 Cb 0.71 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 2bhy h GLU 193 CO -0.41 0.49 -0.60 -0.44 0.07 0.00 0.00 179.01 178.12 2bhy h ASP 194 N 0.76 0.63 0.00 3.06 3.32 -1.46 -0.47 116.42 122.25 2bhy h ASP 194 Ca 0.48 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2bhy h ASP 194 Cb 0.72 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.09 2bhy h ASP 194 CO -0.25 1.08 0.00 -0.11 -1.72 0.00 0.00 179.24 178.24 2bhy n LEU 195 N -3.94 1.01 0.00 1.55 7.94 -0.78 -1.95 117.00 120.84 2bhy n LEU 195 Ca -0.04 -0.51 0.00 0.00 -1.11 0.00 0.00 56.01 54.36 2bhy n LEU 195 Cb 0.63 -0.21 0.00 0.00 0.53 0.00 0.00 43.42 44.38 2bhy n LEU 195 CO 0.48 0.18 0.00 0.00 -1.11 0.00 0.00 177.39 176.93 2bhy n ALA 197 N 0.66 0.00 -0.07 1.96 0.00 -0.19 -1.76 120.51 121.11 2bhy n ALA 197 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2bhy n ALA 197 Cb 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.58 2bhy n ALA 197 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2bhy h LEU 198 N 0.00 0.35 -0.58 0.00 5.85 -1.66 -0.83 115.31 118.44 2bhy h LEU 198 Ca 0.00 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.43 2bhy h LEU 198 Cb 0.00 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2bhy h LEU 198 CO 0.00 0.52 0.24 0.58 -0.34 0.00 0.00 178.44 179.44 2bhy h VAL 199 N 0.17 1.22 -0.56 1.05 2.07 -1.64 -1.36 116.25 117.21 2bhy h VAL 199 Ca 0.07 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.90 2bhy h VAL 199 Cb 0.32 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2bhy h VAL 199 CO 0.00 0.27 0.32 -0.78 0.02 0.00 0.00 177.57 177.40 2bhy h ASP 200 N 0.79 0.68 -0.78 0.57 3.58 -1.80 -0.99 116.42 118.47 2bhy h ASP 200 Ca 0.19 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.52 2bhy h ASP 200 Cb 0.19 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.03 2bhy h ASP 200 CO -0.02 0.55 0.29 0.00 -2.88 0.00 0.00 179.24 177.18 2bhy h ALA 201 N 1.15 1.04 -0.28 -0.78 0.00 -0.94 -1.10 119.26 118.35 2bhy h ALA 201 Ca 0.20 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2bhy h ALA 201 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2bhy h ALA 201 CO -0.04 0.67 0.11 0.00 0.00 0.00 0.00 179.25 179.99 2bhy h ALA 202 N 1.17 0.36 -0.67 0.00 0.00 -0.84 -2.62 119.26 116.66 2bhy h ALA 202 Ca 0.26 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2bhy h ALA 202 Cb 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2bhy h ALA 202 CO -0.02 -0.04 0.40 0.45 0.00 0.00 0.00 179.25 180.04 2bhy h HIS 203 N 0.30 0.88 0.00 0.00 -0.00 -0.92 -0.23 115.15 115.18 2bhy h HIS 203 Ca 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 2bhy h HIS 203 Cb 0.18 -0.29 -0.00 0.00 -0.00 0.00 0.00 27.41 27.30 2bhy h HIS 203 CO -0.01 0.59 -0.05 -0.09 -0.00 0.00 0.00 177.93 178.37 2bhy h ARG 204 N 0.93 0.00 -0.03 2.45 9.65 -0.88 -0.63 114.38 125.88 2bhy h ARG 204 Ca 0.24 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.12 2bhy h ARG 204 Cb -0.03 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.55 2bhy h ARG 204 CO -0.04 0.05 0.00 1.28 2.80 0.00 0.00 179.97 184.06 2bhy n LEU 205 N -3.25 2.11 0.00 3.80 4.77 -0.72 -4.96 117.00 118.75 2bhy n LEU 205 Ca -0.01 -0.71 0.00 0.00 -0.03 0.00 0.00 56.01 55.26 2bhy n LEU 205 Cb 0.25 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2bhy n LEU 205 CO 0.27 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2bhy n GLY 206 N 1.25 0.42 3.72 -0.72 0.00 -0.24 -5.02 105.19 104.60 2bhy n GLY 206 Ca 0.17 -0.99 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 2bhy n GLY 206 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bhy s LEU 207 N 0.00 3.95 0.61 0.99 1.43 -0.18 -4.97 118.68 120.51 2bhy s LEU 207 Ca 0.00 0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 53.20 2bhy s LEU 207 Cb 0.00 -1.97 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 2bhy s LEU 207 CO 0.00 0.30 1.02 -0.83 0.23 0.00 0.00 176.35 177.07 2bhy s GLY 208 N -0.36 1.71 -0.05 -3.19 0.00 -0.38 -3.47 107.32 101.58 2bhy s GLY 208 Ca 0.09 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.76 2bhy s GLY 208 CO 0.02 0.21 -0.02 0.14 0.00 0.00 0.00 173.10 173.44 2bhy s VAL 209 N -3.11 0.40 0.08 1.40 1.01 -1.26 -0.69 120.40 118.23 2bhy s VAL 209 Ca 0.55 -0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.62 2bhy s VAL 209 Cb -0.11 -0.47 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 2bhy s VAL 209 CO 0.51 0.21 -0.24 -0.36 0.00 0.00 0.00 175.10 175.23 2bhy s PHE 210 N 1.19 2.04 -0.07 5.22 0.08 0.10 -0.50 117.98 126.03 2bhy s PHE 210 Ca -0.07 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.63 2bhy s PHE 210 Cb -0.14 -1.16 -0.00 0.00 -0.57 0.00 0.00 43.02 41.16 2bhy s PHE 210 CO -0.02 0.20 -0.21 -1.17 -0.10 0.00 0.00 175.22 173.92 2bhy s LEU 211 N -1.63 1.99 -0.17 -0.37 2.96 -0.66 -0.73 118.68 120.07 2bhy s LEU 211 Ca 0.10 -0.47 -0.29 0.00 -0.22 0.00 0.00 54.13 53.24 2bhy s LEU 211 Cb -0.10 -1.24 -0.01 0.00 0.50 0.00 0.00 46.19 45.35 2bhy s LEU 211 CO 0.04 0.16 1.16 -0.62 -1.32 0.00 0.00 176.35 175.76 2bhy s ASP 212 N 0.22 7.04 0.10 3.68 -1.08 -0.27 -0.76 116.67 125.60 2bhy s ASP 212 Ca -0.12 1.59 0.09 0.00 -0.52 0.00 0.00 52.55 53.59 2bhy s ASP 212 Cb -0.16 -2.54 -0.03 0.00 -1.46 0.00 0.00 42.92 38.73 2bhy s ASP 212 CO 0.06 -0.68 -0.23 0.68 0.52 0.00 0.00 175.17 175.52 2bhy s VAL 213 N 3.08 1.86 -0.40 1.11 -7.23 -0.44 -3.84 120.40 114.54 2bhy s VAL 213 Ca 0.51 -1.54 0.04 0.00 -1.81 0.00 0.00 61.98 59.18 2bhy s VAL 213 Cb -0.20 -1.66 0.11 0.00 0.56 0.00 0.00 36.38 35.19 2bhy s VAL 213 CO 0.13 0.04 0.12 -0.69 -0.31 0.00 0.00 175.10 174.39 2bhy s VAL 214 N -1.06 2.37 -0.35 1.32 1.01 -1.26 -1.30 120.40 121.13 2bhy s VAL 214 Ca 0.09 -2.66 0.15 0.00 0.00 0.00 0.00 61.98 59.56 2bhy s VAL 214 Cb -0.10 -2.72 0.52 0.00 0.00 0.00 0.00 36.38 34.08 2bhy s VAL 214 CO 0.04 -0.67 1.42 -1.22 0.00 0.00 0.00 175.10 174.68 2bhy n TYR 215 N 3.88 0.96 0.26 5.22 4.01 -1.26 -4.36 117.16 125.87 2bhy n TYR 215 Ca 0.04 -0.79 0.08 0.00 -0.16 0.00 0.00 57.90 57.08 2bhy n TYR 215 Cb 0.39 -0.27 -0.12 0.00 -0.31 0.00 0.00 39.34 39.02 2bhy n TYR 215 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2bhy n ASN 216 N -0.18 0.97 -3.45 7.72 0.23 -1.26 -4.98 115.26 114.31 2bhy n ASN 216 Ca 0.20 -0.30 -0.11 0.00 -0.53 0.00 0.00 54.58 53.84 2bhy n ASN 216 Cb 0.83 1.52 -0.02 0.00 -2.08 0.00 0.00 39.78 40.03 2bhy n ASN 216 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 2bhy s HIS 217 N -2.99 -0.48 0.06 -2.53 -3.43 -1.26 -4.62 115.29 100.04 2bhy s HIS 217 Ca -0.02 0.31 0.02 0.00 -0.80 0.00 0.00 55.06 54.57 2bhy s HIS 217 Cb 0.12 0.55 -0.04 0.00 -1.43 0.00 0.00 32.58 31.78 2bhy s HIS 217 CO 0.71 -0.75 0.10 -0.06 -2.00 0.00 0.00 174.74 172.73 2bhy s PHE 218 N -3.51 3.26 1.03 0.38 0.08 -1.26 -4.92 117.98 113.03 2bhy s PHE 218 Ca 0.02 0.12 -0.12 0.00 0.12 0.00 0.00 56.93 57.07 2bhy s PHE 218 Cb -0.01 -1.66 0.21 0.00 -0.57 0.00 0.00 43.02 40.99 2bhy s PHE 218 CO -0.11 0.54 1.08 0.20 -0.10 0.00 0.00 175.22 176.82 2bhy s GLY 219 N -2.31 1.57 0.46 4.36 0.00 -0.09 -4.78 107.32 106.54 2bhy s GLY 219 Ca 0.29 -0.21 0.29 0.00 0.00 0.00 0.00 44.72 45.09 2bhy s GLY 219 CO 0.22 0.41 1.82 -0.56 0.00 0.00 0.00 173.10 174.99 2bhy h PRO 220 N -2.06 0.00 -4.23 2.90 0.13 -1.89 -3.41 132.00 123.43 2bhy h PRO 220 Ca -0.55 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.11 2bhy h PRO 220 Cb 1.32 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 32.11 2bhy h PRO 220 CO 0.54 0.00 -0.79 0.45 -0.23 0.00 0.00 178.00 177.97 2bhy s SER 221 N -5.58 1.45 0.00 1.44 0.15 -1.26 -4.79 113.70 105.11 2bhy s SER 221 Ca 0.04 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.48 2bhy s SER 221 Cb 0.08 -0.64 0.00 0.00 -1.71 0.00 0.00 66.02 63.75 2bhy s SER 221 CO 0.57 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.58 2bhy n GLY 222 N 4.11 0.59 3.37 9.45 0.00 -1.26 -4.33 105.19 117.12 2bhy n GLY 222 Ca -0.22 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.35 2bhy n GLY 222 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bhy s ASN 223 N -2.66 6.19 -0.04 1.61 2.47 -1.26 -4.57 114.94 116.68 2bhy s ASN 223 Ca 0.00 -1.46 0.21 0.00 0.42 0.00 0.00 52.86 52.04 2bhy s ASN 223 Cb 0.00 -2.26 0.69 0.00 -1.45 0.00 0.00 41.25 38.23 2bhy s ASN 223 CO 0.00 -0.96 1.59 -1.22 -3.72 0.00 0.00 177.10 172.79 2bhy n TYR 224 N 5.88 1.20 -0.34 0.43 4.01 -1.26 -4.59 117.16 122.48 2bhy n TYR 224 Ca -0.11 -0.54 0.05 0.00 -0.16 0.00 0.00 57.90 57.14 2bhy n TYR 224 Cb 0.42 -0.09 0.21 0.00 -0.31 0.00 0.00 39.34 39.57 2bhy n TYR 224 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2bhy h LEU 225 N 4.30 0.87 -1.79 7.72 3.38 -1.93 -0.74 115.31 127.12 2bhy h LEU 225 Ca 0.00 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2bhy h LEU 225 Cb 1.18 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.79 2bhy h LEU 225 CO 0.09 0.49 -0.07 -1.28 0.09 0.00 0.00 178.44 177.76 2bhy h SER 226 N 0.96 0.00 0.28 -0.43 0.87 -1.81 -1.15 113.55 112.27 2bhy h SER 226 Ca 0.46 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.97 2bhy h SER 226 Cb 0.40 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.36 2bhy h SER 226 CO -0.25 0.07 -0.24 0.28 -0.53 0.00 0.00 176.83 176.16 2bhy h SER 227 N 0.00 0.00 0.03 6.23 0.02 -1.47 -3.20 113.55 115.17 2bhy h SER 227 Ca -0.00 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.76 2bhy h SER 227 Cb 0.42 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.94 2bhy h SER 227 CO 0.01 0.24 -0.98 1.88 -1.14 0.00 0.00 176.83 176.84 2bhy h TYR 228 N 0.00 0.13 -1.50 3.45 0.05 -1.28 -3.46 116.97 114.36 2bhy h TYR 228 Ca -0.00 -0.10 -0.03 0.00 0.05 0.00 0.00 58.73 58.65 2bhy h TYR 228 Cb 0.45 -0.01 -0.25 0.00 1.01 0.00 0.00 36.73 37.93 2bhy h TYR 228 CO 0.00 1.38 -0.37 0.00 -1.05 0.00 0.00 178.16 178.12 2bhy s ALA 229 N -2.36 -1.67 0.57 3.88 0.00 -0.62 -1.62 121.76 119.95 2bhy s ALA 229 Ca -0.24 1.41 0.27 0.00 0.00 0.00 0.00 51.96 53.41 2bhy s ALA 229 Cb 0.03 -1.90 1.55 0.00 0.00 0.00 0.00 23.12 22.81 2bhy s ALA 229 CO 0.67 -1.27 2.04 -1.35 0.00 0.00 0.00 175.76 175.85 2bhy h PRO 230 N 8.09 0.00 0.00 0.00 0.11 -1.80 -2.55 132.00 135.85 2bhy h PRO 230 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 2bhy h PRO 230 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2bhy h PRO 230 CO 0.26 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.92 2bhy n SER 231 N -3.92 0.00 0.29 -2.05 3.41 -1.26 -1.75 113.62 108.33 2bhy n SER 231 Ca 0.04 -0.90 0.13 0.00 -0.26 0.00 0.00 58.87 57.89 2bhy n SER 231 Cb 0.44 0.00 0.85 0.00 -0.26 0.00 0.00 64.21 65.25 2bhy n SER 231 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2bhy h TYR 232 N 0.00 0.00 -2.20 7.33 0.05 -1.80 -3.45 116.97 116.89 2bhy h TYR 232 Ca 0.00 0.00 -0.58 0.00 0.05 0.00 0.00 58.73 58.20 2bhy h TYR 232 Cb 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 36.73 37.60 2bhy h TYR 232 CO 0.00 0.00 -0.70 -0.06 -1.05 0.00 0.00 178.16 176.36 2bhy s PHE 233 N -4.71 2.24 0.04 4.88 0.08 -0.72 -1.40 117.98 118.39 2bhy s PHE 233 Ca -0.05 -0.52 0.03 0.00 0.12 0.00 0.00 56.93 56.51 2bhy s PHE 233 Cb 0.15 -1.21 -0.02 0.00 -0.57 0.00 0.00 43.02 41.37 2bhy s PHE 233 CO 0.57 0.53 -0.09 -0.08 -0.10 0.00 0.00 175.22 176.06 2bhy s THR 234 N -2.70 0.64 -1.20 0.64 -1.32 -0.26 -4.72 115.64 106.72 2bhy s THR 234 Ca 0.31 -1.03 0.07 0.00 -1.21 0.00 0.00 61.69 59.82 2bhy s THR 234 Cb 0.01 -0.67 0.29 0.00 -1.51 0.00 0.00 72.50 70.62 2bhy s THR 234 CO 0.15 -0.29 1.07 -0.90 -2.21 0.00 0.00 174.62 172.43 2bhy n ASP 235 N 1.60 2.34 0.05 8.08 5.75 -1.26 -3.46 116.55 129.65 2bhy n ASP 235 Ca -0.21 -2.22 -0.15 0.00 -0.01 0.00 0.00 54.79 52.20 2bhy n ASP 235 Cb 0.55 -0.43 -0.14 0.00 -1.03 0.00 0.00 41.12 40.07 2bhy n ASP 235 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 2bhy h ARG 236 N 1.59 0.19 -3.91 0.11 2.43 -1.95 -3.48 114.38 109.36 2bhy h ARG 236 Ca 0.00 -0.32 -0.18 0.00 -0.81 0.00 0.00 59.98 58.68 2bhy h ARG 236 Cb 0.81 0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.40 2bhy h ARG 236 CO 0.12 1.03 -0.16 -0.59 -1.51 0.00 0.00 179.97 178.85 2bhy s PHE 237 N -2.63 0.75 0.38 2.20 -0.12 -1.26 -5.11 117.98 112.19 2bhy s PHE 237 Ca -0.07 -1.06 -0.13 0.00 -0.05 0.00 0.00 56.93 55.61 2bhy s PHE 237 Cb 0.07 0.05 0.04 0.00 -0.63 0.00 0.00 43.02 42.56 2bhy s PHE 237 CO 0.84 -1.09 0.73 -1.12 -0.05 0.00 0.00 175.22 174.54 2bhy s SER 238 N -3.14 0.19 -0.36 1.98 0.01 -1.26 -1.99 113.70 109.13 2bhy s SER 238 Ca 0.27 -1.21 -0.15 0.00 1.31 0.00 0.00 55.95 56.17 2bhy s SER 238 Cb -0.00 0.82 -0.01 0.00 0.21 0.00 0.00 66.02 67.04 2bhy s SER 238 CO 0.15 -1.61 0.33 -0.44 0.41 0.00 0.00 173.24 172.08 2bhy s SER 239 N -3.10 6.14 0.00 2.44 0.01459.27 -4.95 113.70 573.51 2bhy s SER 239 Ca 0.18 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 57.03 2bhy s SER 239 Cb -0.04 -2.18 0.00 0.00 0.21 0.00 0.00 66.02 64.01 2bhy s SER 239 CO 0.13 -0.36 0.27 0.00 0.41 0.00 0.00 173.24 173.69 2bhy n ALA 240 N 5.32 0.05 0.20 1.44 0.00 -1.26 0.30 120.51 126.56 2bhy n ALA 240 Ca -0.10 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.36 2bhy n ALA 240 Cb 0.49 -0.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.87 2bhy n ALA 240 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 2bhy n TRP 241 N -0.77 0.00 0.00 0.00 8.01 -1.26 -5.25 117.44 118.17 2bhy n TRP 241 Ca 0.00 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.19 2bhy n TRP 241 Cb 0.24 -0.01 0.00 0.00 -2.01 0.00 0.00 31.31 29.53 2bhy n TRP 241 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bhy n GLY 242 N 1.21 -0.66 3.63 6.99 0.00 0.87 -4.85 105.19 112.37 2bhy n GLY 242 Ca 0.01 0.54 -0.36 0.00 0.00 0.00 0.00 46.02 46.20 2bhy n GLY 242 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2bhy s GLY 244 N 0.00 1.95 -0.10 -0.02 0.00 -0.84 5.86 107.32 114.16 2bhy s GLY 244 Ca 0.00 -0.91 -0.30 0.00 0.00 0.00 0.00 44.72 43.51 2bhy s GLY 244 CO 0.00 0.39 1.25 1.08 0.00 0.00 0.00 173.10 175.82 2bhy s LEU 245 N 1.09 4.23 -0.83 0.66 1.02 -1.26 -1.10 118.68 122.49 2bhy s LEU 245 Ca 0.07 1.78 -0.20 0.00 0.02 0.00 0.00 54.13 55.80 2bhy s LEU 245 Cb -0.14 -3.55 0.11 0.00 0.02 0.00 0.00 46.19 42.64 2bhy s LEU 245 CO 0.04 -0.69 1.04 -0.62 0.02 0.00 0.00 176.35 176.15 2bhy s ASP 246 N 1.79 6.47 0.00 2.29 -1.08 -0.49 -4.82 116.67 120.83 2bhy s ASP 246 Ca 0.56 -1.73 0.21 0.00 -0.52 0.00 0.00 52.55 51.08 2bhy s ASP 246 Cb -0.24 -2.39 1.26 0.00 -1.46 0.00 0.00 42.92 40.09 2bhy s ASP 246 CO 0.19 -1.16 1.67 -1.22 0.52 0.00 0.00 175.17 175.17 2bhy n TYR 247 N 6.79 0.00 0.63 -5.34 4.01 -1.26 -1.47 117.16 120.52 2bhy n TYR 247 Ca 0.14 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 58.00 2bhy n TYR 247 Cb 0.48 0.00 0.45 0.00 -0.31 0.00 0.00 39.34 39.96 2bhy n TYR 247 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bhy n ALA 248 N -0.95 2.13 -2.50 -0.72 0.00 -1.26 -4.70 120.51 112.51 2bhy n ALA 248 Ca 0.16 -0.02 -0.43 0.00 0.00 0.00 0.00 53.44 53.16 2bhy n ALA 248 Cb 0.07 -1.44 -0.08 0.00 0.00 0.00 0.00 19.45 18.00 2bhy n ALA 248 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2bhy s GLU 249 N -3.12 3.23 0.41 0.00 2.56 -0.54 -4.98 118.70 116.25 2bhy s GLU 249 Ca 0.10 -0.56 0.17 0.00 0.00 0.00 0.00 54.97 54.67 2bhy s GLU 249 Cb 0.13 -3.94 1.05 0.00 2.00 0.00 0.00 34.13 33.37 2bhy s GLU 249 CO 0.53 -0.87 1.84 -1.35 -0.56 0.00 0.00 175.26 174.85 2bhy h PRO 250 N 8.74 0.43 -1.60 4.30 0.11 -1.86 -2.34 132.00 139.78 2bhy h PRO 250 Ca -0.26 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2bhy h PRO 250 Cb 1.11 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2bhy h PRO 250 CO 0.82 0.28 0.00 0.72 -0.21 0.00 0.00 178.00 179.61 2bhy n HIS 251 N -4.54 0.00 0.00 0.65 8.25 -1.26 -1.08 115.22 117.24 2bhy n HIS 251 Ca 0.20 -0.09 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 2bhy n HIS 251 Cb 0.71 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 31.70 2bhy n HIS 251 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2bhy n ARG 253 N 0.84 0.00 0.19 -0.41 1.74 -0.88 -1.46 116.66 116.68 2bhy n ARG 253 Ca 0.00 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.13 2bhy n ARG 253 Cb 0.09 0.00 0.37 0.00 -1.02 0.00 0.00 32.46 31.90 2bhy n ARG 253 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bhy h ARG 254 N 0.00 0.00 -0.34 5.56 3.08 -1.38 -0.77 114.38 120.53 2bhy h ARG 254 Ca 0.00 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.09 2bhy h ARG 254 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2bhy h ARG 254 CO 0.00 0.37 0.12 -0.92 -1.07 0.00 0.00 179.97 178.47 2bhy h TYR 255 N 0.00 0.21 0.12 3.04 3.20 -1.50 0.85 116.97 122.89 2bhy h TYR 255 Ca -0.00 0.02 -0.28 0.00 3.14 0.00 0.00 58.73 61.61 2bhy h TYR 255 Cb 0.79 -0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.02 2bhy h TYR 255 CO 0.00 0.09 -1.28 -0.39 -1.64 0.00 0.00 178.16 174.93 2bhy h VAL 256 N 0.26 1.45 -0.21 1.81 -1.51 -1.76 -2.61 116.25 113.67 2bhy h VAL 256 Ca 0.15 -3.03 -0.15 0.00 -1.23 0.00 0.00 66.70 62.44 2bhy h VAL 256 Cb 0.13 2.92 -0.01 0.00 -2.13 0.00 0.00 31.29 32.20 2bhy h VAL 256 CO -0.16 0.88 -0.49 0.71 -1.23 0.00 0.00 177.57 177.28 2bhy h THR 257 N 0.07 1.31 -0.19 7.19 1.35 -1.06 -1.11 112.91 120.47 2bhy h THR 257 Ca -0.15 -1.71 -0.07 0.00 -0.55 0.00 0.00 66.41 63.93 2bhy h THR 257 Cb 1.98 1.68 -0.01 0.00 -1.73 0.00 0.00 68.15 70.06 2bhy h THR 257 CO 0.20 0.53 -0.21 1.23 -0.25 0.00 0.00 175.52 177.03 2bhy h GLY 258 N 1.04 0.37 0.79 5.82 0.00 -0.91 -2.10 103.07 108.07 2bhy h GLY 258 Ca 0.02 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 2bhy h GLY 258 CO 0.09 0.25 -0.05 -0.57 0.00 0.00 0.00 176.54 176.26 2bhy h ASN 259 N 0.31 0.36 -0.67 0.19 -0.73 -1.05 -3.06 115.58 110.93 2bhy h ASN 259 Ca 0.05 -0.38 0.05 0.00 1.87 0.00 0.00 56.30 57.90 2bhy h ASN 259 Cb 0.54 -0.10 -0.05 0.00 0.27 0.00 0.00 38.32 38.98 2bhy h ASN 259 CO 0.04 0.65 0.38 0.00 -0.37 0.00 0.00 177.43 178.13 2bhy h ALA 260 N 0.72 0.89 0.00 1.57 0.00 -1.08 -2.02 119.26 119.34 2bhy h ALA 260 Ca 0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2bhy h ALA 260 Cb 0.50 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2bhy h ALA 260 CO 0.02 0.07 0.00 0.54 0.00 0.00 0.00 179.25 179.88 2bhy n ARG 261 N -4.77 0.19 0.00 0.00 1.74 -0.80 -2.31 116.66 110.71 2bhy n ARG 261 Ca 0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.16 2bhy n ARG 261 Cb 0.16 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.19 2bhy n ARG 261 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 2bhy n TRP 263 N 0.95 0.00 -0.03 -1.55 5.03 -0.76 -0.55 117.44 120.52 2bhy n TRP 263 Ca 0.00 0.00 -0.13 0.00 3.03 0.00 0.00 57.50 60.40 2bhy n TRP 263 Cb 0.09 0.00 -0.11 0.00 -1.03 0.00 0.00 31.31 30.26 2bhy n TRP 263 CO 0.00 0.00 0.00 -0.07 -0.03 0.00 0.00 177.69 177.59 2bhy h LEU 264 N 0.00 -0.02 0.03 -0.99 3.38 -1.70 -2.56 115.31 113.45 2bhy h LEU 264 Ca 0.00 -0.69 -0.00 0.00 0.09 0.00 0.00 57.88 57.27 2bhy h LEU 264 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2bhy h LEU 264 CO 0.00 0.70 -0.02 -0.09 0.09 0.00 0.00 178.44 179.13 2bhy h ARG 265 N -0.76 -0.04 0.00 1.13 2.43 -1.08 -2.40 114.38 113.66 2bhy h ARG 265 Ca -0.00 0.00 -0.24 0.00 -0.81 0.00 0.00 59.98 58.93 2bhy h ARG 265 Cb 0.71 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.23 2bhy h ARG 265 CO 0.00 0.63 -1.30 -0.44 -1.51 0.00 0.00 179.97 177.36 2bhy h ASP 266 N -0.83 0.00 -0.02 -3.80 3.32 -1.75 -3.33 116.42 110.01 2bhy h ASP 266 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2bhy h ASP 266 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 2bhy h ASP 266 CO 0.01 0.96 -0.11 -1.22 -1.72 0.00 0.00 179.24 177.16 2bhy n TYR 267 N -3.19 0.00 -1.74 4.55 4.01 -1.13 -5.00 117.16 114.65 2bhy n TYR 267 Ca -0.07 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.50 2bhy n TYR 267 Cb 0.97 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.95 2bhy n TYR 267 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2bhy n HIS 268 N 0.57 -0.25 -1.70 -0.72 8.25 -0.90 -4.86 115.22 115.60 2bhy n HIS 268 Ca 0.09 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.17 2bhy n HIS 268 Cb 0.39 -2.98 0.06 0.00 1.12 0.00 0.00 29.99 28.58 2bhy n HIS 268 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 2bhy n PHE 269 N -3.01 1.71 0.72 4.41 3.72 -0.98 -4.90 117.46 119.12 2bhy n PHE 269 Ca -0.17 0.43 0.12 0.00 -0.05 0.00 0.00 57.45 57.77 2bhy n PHE 269 Cb 0.57 -2.25 0.13 0.00 -0.94 0.00 0.00 39.48 36.99 2bhy n PHE 269 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2bhy n ASP 270 N -1.53 0.62 0.00 4.37 8.00 0.34 -4.56 116.55 123.79 2bhy n ASP 270 Ca 0.15 -0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2bhy n ASP 270 Cb 0.47 0.44 0.00 0.00 -0.02 0.00 0.00 41.12 42.01 2bhy n ASP 270 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhy n GLY 271 N 1.40 0.33 3.17 0.44 0.00 -1.24 -1.58 105.19 107.71 2bhy n GLY 271 Ca 0.04 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 45.00 2bhy n GLY 271 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bhy s LEU 272 N 0.00 2.09 -0.31 0.99 1.43 -0.56 -1.65 118.68 120.67 2bhy s LEU 272 Ca 0.00 -0.38 -0.09 0.00 -1.03 0.00 0.00 54.13 52.64 2bhy s LEU 272 Cb 0.00 -0.83 0.01 0.00 0.03 0.00 0.00 46.19 45.40 2bhy s LEU 272 CO 0.00 0.16 0.13 -0.60 0.23 0.00 0.00 176.35 176.27 2bhy s ARG 273 N -0.71 3.14 -0.45 1.70 3.52 0.06 -0.45 118.95 125.75 2bhy s ARG 273 Ca 0.06 -0.84 -0.25 0.00 -0.13 0.00 0.00 55.73 54.57 2bhy s ARG 273 Cb -0.07 -3.51 0.03 0.00 -1.56 0.00 0.00 34.95 29.84 2bhy s ARG 273 CO 0.00 -0.48 0.87 -0.51 -0.81 0.00 0.00 175.30 174.38 2bhy s LEU 274 N 1.55 4.09 0.31 -0.88 1.43 0.11 -1.33 118.68 123.96 2bhy s LEU 274 Ca 0.03 0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 52.91 2bhy s LEU 274 Cb -0.17 -3.12 -0.10 0.00 0.03 0.00 0.00 46.19 42.82 2bhy s LEU 274 CO 0.05 -0.99 1.42 -0.62 0.23 0.00 0.00 176.35 176.44 2bhy s ASP 275 N 2.19 6.60 -1.29 2.29 2.15 -0.42 -1.02 116.67 127.17 2bhy s ASP 275 Ca 0.35 2.78 -0.22 0.00 0.43 0.00 0.00 52.55 55.89 2bhy s ASP 275 Cb -0.11 -2.64 0.02 0.00 -0.30 0.00 0.00 42.92 39.89 2bhy s ASP 275 CO 0.25 -0.70 0.53 0.00 -0.17 0.00 0.00 175.17 175.08 2bhy n ALA 276 N 1.39 -2.42 0.29 3.66 0.00 -1.17 -4.48 120.51 117.78 2bhy n ALA 276 Ca 0.03 -0.46 0.13 0.00 0.00 0.00 0.00 53.44 53.14 2bhy n ALA 276 Cb 0.40 -2.39 0.84 0.00 0.00 0.00 0.00 19.45 18.30 2bhy n ALA 276 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2bhy h THR 277 N -2.26 0.65 0.00 0.00 1.35 -1.59 -1.33 112.91 109.72 2bhy h THR 277 Ca -0.69 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 2bhy h THR 277 Cb 1.39 1.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 2bhy h THR 277 CO 0.56 0.00 0.00 -0.65 -0.25 0.00 0.00 175.52 175.19 2bhy h PRO 278 N 0.00 0.00 -3.81 4.72 0.11 -1.90 -3.44 132.00 127.68 2bhy h PRO 278 Ca -0.00 0.00 -0.74 0.00 0.11 0.00 0.00 66.00 65.37 2bhy h PRO 278 Cb 0.01 0.00 -0.30 0.00 0.11 0.00 0.00 31.00 30.82 2bhy h PRO 278 CO 0.00 0.00 -0.17 0.71 -0.21 0.00 0.00 178.00 178.33 2bhy s TYR 279 N -3.78 3.55 0.00 0.65 2.02 -0.50 -5.05 117.35 114.24 2bhy s TYR 279 Ca -0.02 -2.25 0.00 0.00 -0.37 0.00 0.00 57.07 54.43 2bhy s TYR 279 Cb 0.10 -3.52 0.00 0.00 -0.40 0.00 0.00 41.96 38.14 2bhy s TYR 279 CO 0.34 -0.93 0.00 2.41 -1.57 0.00 0.00 175.55 175.80 2bhy n THR 281 N 3.95 0.00 -3.64 -0.71 -1.04 -1.26 -4.76 114.28 106.82 2bhy n THR 281 Ca 0.07 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 62.06 2bhy n THR 281 Cb 0.42 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.88 2bhy n THR 281 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2bhy s ASP 282 N 0.00 -1.07 0.00 8.00 2.15 -1.26 -4.40 116.67 120.09 2bhy s ASP 282 Ca 0.00 1.52 0.20 0.00 0.43 0.00 0.00 52.55 54.70 2bhy s ASP 282 Cb 0.00 2.07 0.53 0.00 -0.30 0.00 0.00 42.92 45.22 2bhy s ASP 282 CO 0.00 -0.22 1.44 0.47 -0.17 0.00 0.00 175.17 176.70 2bhy n ASP 283 N 5.17 3.63 -4.71 -0.34 8.00 -1.26 -4.90 116.55 122.14 2bhy n ASP 283 Ca -0.14 -1.99 -0.34 0.00 0.71 0.00 0.00 54.79 53.04 2bhy n ASP 283 Cb 0.51 -0.39 0.11 0.00 -0.02 0.00 0.00 41.12 41.34 2bhy n ASP 283 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2bhy s SER 284 N -1.07 3.86 0.16 -2.24 0.01 -1.26 -4.92 113.70 108.24 2bhy s SER 284 Ca 0.41 2.40 -0.18 0.00 1.31 0.00 0.00 55.95 59.89 2bhy s SER 284 Cb 0.22 -2.59 0.08 0.00 0.21 0.00 0.00 66.02 63.94 2bhy s SER 284 CO 0.29 -2.49 1.66 -0.08 0.41 0.00 0.00 173.24 173.04 2bhy h GLU 285 N -0.58 -0.03 -4.76 12.44 4.81 -2.00 -3.33 114.58 121.14 2bhy h GLU 285 Ca -0.47 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.09 2bhy h GLU 285 Cb 1.30 0.01 -0.20 0.00 0.63 0.00 0.00 28.75 30.49 2bhy h GLU 285 CO 0.48 -0.02 -0.51 0.99 -0.73 0.00 0.00 179.01 179.22 2bhy s THR 286 N -6.20 5.06 0.50 0.32 2.01 -1.26 -5.06 115.64 111.00 2bhy s THR 286 Ca -0.14 -0.24 -0.22 0.00 0.31 0.00 0.00 61.69 61.40 2bhy s THR 286 Cb 0.14 -3.57 -0.06 0.00 0.01 0.00 0.00 72.50 69.02 2bhy s THR 286 CO 0.70 0.05 1.21 -2.28 -0.69 0.00 0.00 174.62 173.61 2bhy s HIS 287 N 1.69 2.70 0.46 4.92 2.46 -1.25 -4.83 115.29 121.43 2bhy s HIS 287 Ca 0.06 1.50 0.18 0.00 0.47 0.00 0.00 55.06 57.27 2bhy s HIS 287 Cb -0.17 -3.47 1.15 0.00 -0.13 0.00 0.00 32.58 29.96 2bhy s HIS 287 CO 0.09 -1.86 1.95 0.97 -2.47 0.00 0.00 174.74 173.42 2bhy h ILE 288 N 1.64 0.79 -0.63 0.89 6.09 -1.91 -0.20 117.51 124.17 2bhy h ILE 288 Ca -0.50 -0.10 -0.03 0.00 -1.37 0.00 0.00 64.86 62.86 2bhy h ILE 288 Cb 1.26 0.46 -0.03 0.00 0.47 0.00 0.00 36.82 38.99 2bhy h ILE 288 CO 0.59 0.05 0.26 -0.07 -3.07 0.00 0.00 178.15 175.91 2bhy h LEU 289 N 0.30 0.86 -0.52 2.19 3.38 -1.95 0.13 115.31 119.70 2bhy h LEU 289 Ca 0.33 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 2bhy h LEU 289 Cb 0.87 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2bhy h LEU 289 CO -0.08 0.79 0.22 0.74 0.09 0.00 0.00 178.44 180.20 2bhy h THR 290 N 0.88 1.21 -0.32 0.22 2.02 -1.27 -2.23 112.91 113.42 2bhy h THR 290 Ca 0.21 -0.63 -0.09 0.00 0.77 0.00 0.00 66.41 66.67 2bhy h THR 290 Cb 0.19 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 2bhy h THR 290 CO -0.02 0.24 -0.17 -0.08 0.37 0.00 0.00 175.52 175.86 2bhy h GLU 291 N 0.69 0.58 -0.52 6.66 4.81 -1.02 -0.61 114.58 125.17 2bhy h GLU 291 Ca 0.17 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2bhy h GLU 291 Cb 0.17 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.48 2bhy h GLU 291 CO -0.02 0.72 0.33 1.25 -0.73 0.00 0.00 179.01 180.57 2bhy h LEU 292 N 0.52 0.61 -0.44 1.64 5.85 -0.60 0.38 115.31 123.27 2bhy h LEU 292 Ca 0.09 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 2bhy h LEU 292 Cb 0.60 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 2bhy h LEU 292 CO 0.04 0.46 0.14 0.00 -0.34 0.00 0.00 178.44 178.74 2bhy h ALA 293 N 1.17 0.58 -0.45 1.25 0.00 -1.01 -1.43 119.26 119.37 2bhy h ALA 293 Ca 0.19 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2bhy h ALA 293 Cb -0.05 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2bhy h ALA 293 CO -0.04 0.23 0.25 1.96 0.00 0.00 0.00 179.25 181.66 2bhy h GLN 294 N 0.58 0.50 -0.19 0.00 4.20 -0.77 0.29 115.11 119.72 2bhy h GLN 294 Ca 0.14 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 2bhy h GLN 294 Cb 0.27 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 2bhy h GLN 294 CO -0.00 0.33 -0.24 0.93 -0.67 0.00 0.00 178.83 179.17 2bhy h GLU 295 N 0.51 0.34 -0.03 1.46 4.39 -0.78 -0.84 114.58 119.63 2bhy h GLU 295 Ca 0.18 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 2bhy h GLU 295 Cb 0.03 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 2bhy h GLU 295 CO -0.09 0.56 -0.11 0.82 -1.16 0.00 0.00 179.01 179.03 2bhy h ILE 296 N 0.30 1.48 -0.69 3.13 2.04 -0.99 -3.19 117.51 119.60 2bhy h ILE 296 Ca 0.05 -1.58 0.16 0.00 1.00 0.00 0.00 64.86 64.49 2bhy h ILE 296 Cb 0.59 2.46 -0.04 0.00 -0.74 0.00 0.00 36.82 39.09 2bhy h ILE 296 CO 0.04 0.43 0.47 0.45 0.00 0.00 0.00 178.15 179.54 2bhy h HIS 297 N -0.47 0.26 0.00 1.37 3.86 -0.17 -2.10 115.15 117.90 2bhy h HIS 297 Ca -0.01 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2bhy h HIS 297 Cb 0.75 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 29.14 2bhy h HIS 297 CO 0.14 0.10 -0.11 1.49 0.86 0.00 0.00 177.93 180.41 2bhy h GLU 298 N 0.22 0.00 0.00 2.45 4.22 -1.14 -1.99 114.58 118.34 2bhy h GLU 298 Ca 0.34 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.78 2bhy h GLU 298 Cb 1.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.26 2bhy h GLU 298 CO -0.07 0.11 0.00 -0.07 -2.18 0.00 0.00 179.01 176.80 2bhy h LEU 299 N 0.00 0.00 0.23 1.64 3.38 -1.49 -3.46 115.31 115.60 2bhy h LEU 299 Ca -0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 2bhy h LEU 299 Cb 0.27 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.03 2bhy h LEU 299 CO 0.01 0.00 -0.17 0.61 0.09 0.00 0.00 178.44 178.98 2bhy n GLY 300 N -0.73 0.26 0.00 0.83 0.00 -0.75 -5.03 105.19 99.77 2bhy n GLY 300 Ca -0.02 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.46 2bhy n GLY 300 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhy n GLY 301 N -0.99 5.01 2.30 -0.02 0.00 -1.26 -5.07 105.19 105.17 2bhy n GLY 301 Ca -0.05 -1.87 -0.22 0.00 0.00 0.00 0.00 46.02 43.88 2bhy n GLY 301 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bhy n THR 302 N 0.00 2.28 -2.83 2.61 -2.24 -1.26 -5.05 114.28 107.79 2bhy n THR 302 Ca 0.00 -4.32 -0.35 0.00 -2.27 0.00 0.00 64.05 57.11 2bhy n THR 302 Cb 0.00 -0.89 -0.07 0.00 -2.10 0.00 0.00 70.33 67.28 2bhy n THR 302 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2bhy s HIS 303 N -3.56 3.51 0.31 4.78 4.02 -1.26 -4.63 115.29 118.46 2bhy s HIS 303 Ca 0.47 1.66 0.08 0.00 1.02 0.00 0.00 55.06 58.29 2bhy s HIS 303 Cb 0.40 -2.86 -0.04 0.00 -1.02 0.00 0.00 32.58 29.07 2bhy s HIS 303 CO -0.05 0.07 0.12 -0.51 1.02 0.00 0.00 174.74 175.39 2bhy s LEU 304 N -2.59 3.32 -0.06 0.89 1.43 -0.62 -4.97 118.68 116.09 2bhy s LEU 304 Ca 0.55 -0.67 0.00 0.00 -1.03 0.00 0.00 54.13 52.98 2bhy s LEU 304 Cb -0.14 -1.83 0.02 0.00 0.03 0.00 0.00 46.19 44.28 2bhy s LEU 304 CO 0.19 -0.21 -0.04 -0.22 0.23 0.00 0.00 176.35 176.30 2bhy s LEU 305 N -3.82 1.17 -0.13 1.79 2.96 -1.26 -1.49 118.68 117.90 2bhy s LEU 305 Ca 0.36 -0.14 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 2bhy s LEU 305 Cb -0.04 -0.50 -0.00 0.00 0.50 0.00 0.00 46.19 46.15 2bhy s LEU 305 CO 0.23 -0.08 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.22 2bhy s LEU 306 N 1.19 2.34 -0.08 -0.68 2.01 0.40 -1.50 118.68 122.36 2bhy s LEU 306 Ca -0.07 -0.50 -0.21 0.00 0.01 0.00 0.00 54.13 53.37 2bhy s LEU 306 Cb -0.14 -1.51 -0.04 0.00 0.01 0.00 0.00 46.19 44.51 2bhy s LEU 306 CO -0.02 0.12 0.59 0.00 1.01 0.00 0.00 176.35 178.05 2bhy s ALA 307 N 0.62 3.41 -0.71 4.21 0.00 -0.49 0.05 121.76 128.85 2bhy s ALA 307 Ca -0.10 -0.02 -0.24 0.00 0.00 0.00 0.00 51.96 51.61 2bhy s ALA 307 Cb -0.16 -2.80 0.06 0.00 0.00 0.00 0.00 23.12 20.22 2bhy s ALA 307 CO 0.03 -0.03 1.07 -2.00 0.00 0.00 0.00 175.76 174.83 2bhy s GLU 308 N 0.61 3.17 -0.02 0.00 2.12 -0.19 -0.71 118.70 123.68 2bhy s GLU 308 Ca 0.32 -0.73 -0.00 0.00 0.36 0.00 0.00 54.97 54.92 2bhy s GLU 308 Cb -0.17 -4.28 0.03 0.00 0.26 0.00 0.00 34.13 29.97 2bhy s GLU 308 CO 0.15 -1.92 0.03 0.34 -0.54 0.00 0.00 175.26 173.32 2bhy s ASP 309 N 3.74 0.16 0.00 -1.70 -1.08 -1.25 -2.14 116.67 114.40 2bhy s ASP 309 Ca 0.27 0.04 0.23 0.00 -0.52 0.00 0.00 52.55 52.58 2bhy s ASP 309 Cb -0.13 -0.07 0.50 0.00 -1.46 0.00 0.00 42.92 41.75 2bhy s ASP 309 CO 0.10 -0.14 1.43 0.00 0.52 0.00 0.00 175.17 177.08 2bhy n HIS 310 N 4.28 0.28 1.30 -5.34 1.44 -1.26 -4.45 115.22 111.47 2bhy n HIS 310 Ca -0.26 -0.14 0.14 0.00 -2.01 0.00 0.00 57.72 55.45 2bhy n HIS 310 Cb 0.50 0.00 0.59 0.00 0.12 0.00 0.00 29.99 31.20 2bhy n HIS 310 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2bhy n ARG 311 N 1.09 0.46 -3.63 -1.40 1.74 -1.26 -4.92 116.66 108.75 2bhy n ARG 311 Ca 0.17 -0.14 -0.26 0.00 -0.77 0.00 0.00 57.85 56.85 2bhy n ARG 311 Cb 0.52 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.51 2bhy n ARG 311 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2bhy n ASN 312 N -1.15 -4.51 -4.04 0.55 3.02 -1.26 -3.55 115.26 104.33 2bhy n ASN 312 Ca 0.12 -0.93 -0.32 0.00 -0.03 0.00 0.00 54.58 53.43 2bhy n ASN 312 Cb 0.29 -3.80 -0.15 0.00 -0.61 0.00 0.00 39.78 35.51 2bhy n ASN 312 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2bhy s LEU 313 N -6.35 4.66 0.61 3.41 2.96 -1.26 -1.76 118.68 120.95 2bhy s LEU 313 Ca 0.36 -2.05 0.38 0.00 -0.22 0.00 0.00 54.13 52.60 2bhy s LEU 313 Cb -0.11 -1.64 1.98 0.00 0.50 0.00 0.00 46.19 46.91 2bhy s LEU 313 CO 0.83 -0.37 2.23 -0.65 -1.32 0.00 0.00 176.35 177.07 2bhy h PRO 314 N 7.67 0.00 -0.37 0.98 0.11 -1.90 -2.84 132.00 135.65 2bhy h PRO 314 Ca -0.07 0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.15 2bhy h PRO 314 Cb 1.03 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2bhy h PRO 314 CO 0.53 0.02 0.37 -0.44 -0.21 0.00 0.00 178.00 178.27 2bhy h ASP 315 N 0.00 0.00 -0.82 -2.05 5.19 -1.95 -0.31 116.42 116.48 2bhy h ASP 315 Ca -0.00 0.00 0.08 0.00 -0.62 0.00 0.00 57.03 56.49 2bhy h ASP 315 Cb 0.18 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.63 2bhy h ASP 315 CO 0.00 0.00 0.53 -0.07 -3.12 0.00 0.00 179.24 176.58 2bhy h LEU 316 N 0.00 0.73 0.01 1.55 3.38 -1.91 0.12 115.31 119.20 2bhy h LEU 316 Ca 0.18 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.01 2bhy h LEU 316 Cb 0.91 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 2bhy h LEU 316 CO -0.00 0.45 -0.83 0.58 0.09 0.00 0.00 178.44 178.73 2bhy h VAL 317 N 0.82 1.23 0.00 1.22 2.07 -1.27 -1.52 116.25 118.80 2bhy h VAL 317 Ca 0.37 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.63 2bhy h VAL 317 Cb 0.35 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 2bhy h VAL 317 CO -0.14 0.45 -0.53 0.71 0.02 0.00 0.00 177.57 178.08 2bhy h THR 318 N -0.94 0.00 0.00 2.57 1.35 -1.21 -2.62 112.91 112.06 2bhy h THR 318 Ca -0.22 -0.93 -0.11 0.00 -0.55 0.00 0.00 66.41 64.59 2bhy h THR 318 Cb 1.24 1.66 -0.02 0.00 -1.73 0.00 0.00 68.15 69.30 2bhy h THR 318 CO -0.12 0.00 -1.39 0.52 -0.25 0.00 0.00 175.52 174.28 2bhy n VAL 319 N -2.78 0.39 0.69 6.82 0.31 0.28 -4.71 118.33 119.33 2bhy n VAL 319 Ca 0.02 -0.12 0.13 0.00 -0.01 0.00 0.00 64.34 64.36 2bhy n VAL 319 Cb 0.53 -1.30 0.38 0.00 -0.91 0.00 0.00 33.84 32.54 2bhy n VAL 319 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2bhy n ASN 320 N -3.10 0.65 -1.61 4.52 4.13 -0.32 -4.94 115.26 114.58 2bhy n ASN 320 Ca -0.13 0.41 -0.13 0.00 1.68 0.00 0.00 54.58 56.41 2bhy n ASN 320 Cb 0.61 -0.47 0.00 0.00 -1.54 0.00 0.00 39.78 38.38 2bhy n ASN 320 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2bhy n HIS 321 N -2.07 -0.76 -1.64 3.10 8.25 -0.99 -4.30 115.22 116.82 2bhy n HIS 321 Ca 0.05 0.07 -0.30 0.00 -0.26 0.00 0.00 57.72 57.29 2bhy n HIS 321 Cb 0.41 -2.95 0.07 0.00 1.12 0.00 0.00 29.99 28.64 2bhy n HIS 321 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2bhy s LEU 322 N -3.92 2.74 0.01 2.41 1.43 -0.59 -4.95 118.68 115.81 2bhy s LEU 322 Ca 0.04 1.31 0.17 0.00 -1.03 0.00 0.00 54.13 54.62 2bhy s LEU 322 Cb -0.02 -4.00 -0.18 0.00 0.03 0.00 0.00 46.19 42.02 2bhy s LEU 322 CO 0.05 -1.74 0.68 0.47 0.23 0.00 0.00 176.35 176.04 2bhy n ASP 323 N -3.29 0.67 -3.70 2.29 8.00 -0.56 -4.31 116.55 115.65 2bhy n ASP 323 Ca 0.07 0.30 0.02 0.00 0.71 0.00 0.00 54.79 55.88 2bhy n ASP 323 Cb 0.56 0.41 0.01 0.00 -0.02 0.00 0.00 41.12 42.07 2bhy n ASP 323 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2bhy s GLY 324 N -4.89 -0.20 -0.03 0.44 0.00 -1.15 -4.50 107.32 97.00 2bhy s GLY 324 Ca -0.04 0.21 0.00 0.00 0.00 0.00 0.00 44.72 44.89 2bhy s GLY 324 CO 0.82 3.38 0.00 -0.42 0.00 0.00 0.00 173.10 176.88 2bhy s ILE 325 N -2.19 0.15 -0.28 0.90 1.01 0.09 -1.40 121.20 119.48 2bhy s ILE 325 Ca 0.23 0.11 -0.29 0.00 0.00 0.00 0.00 60.65 60.70 2bhy s ILE 325 Cb 0.01 -0.26 -0.02 0.00 0.01 0.00 0.00 42.46 42.20 2bhy s ILE 325 CO -0.01 0.14 1.64 0.26 0.00 0.00 0.00 174.94 176.98 2bhy s TRP 326 N 1.09 2.06 -0.17 3.97 0.52 0.11 -0.93 118.94 125.59 2bhy s TRP 326 Ca -0.09 0.59 -0.01 0.00 0.02 0.00 0.00 56.10 56.61 2bhy s TRP 326 Cb -0.13 -4.07 -0.00 0.00 -1.15 0.00 0.00 33.47 28.11 2bhy s TRP 326 CO -0.02 -2.80 -0.12 -0.08 0.02 0.00 0.00 176.95 173.95 2bhy s THR 327 N 5.76 2.87 -0.83 2.01 -1.32 -0.89 -3.76 115.64 119.47 2bhy s THR 327 Ca 0.73 -0.69 0.25 0.00 -1.21 0.00 0.00 61.69 60.76 2bhy s THR 327 Cb -0.22 -2.24 0.01 0.00 -1.51 0.00 0.00 72.50 68.54 2bhy s THR 327 CO 0.31 0.50 1.35 0.47 -2.21 0.00 0.00 174.62 175.04 2bhy n ASP 328 N 4.18 0.57 -0.28 8.08 8.00 -1.26 -4.35 116.55 131.50 2bhy n ASP 328 Ca -0.19 -0.10 0.03 0.00 0.71 0.00 0.00 54.79 55.24 2bhy n ASP 328 Cb 0.52 0.26 0.17 0.00 -0.02 0.00 0.00 41.12 42.05 2bhy n ASP 328 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2bhy h ASP 329 N 0.00 0.60 -0.06 -2.24 3.32 -1.94 0.10 116.42 116.19 2bhy h ASP 329 Ca 0.00 0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.13 2bhy h ASP 329 Cb 0.61 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 40.09 2bhy h ASP 329 CO 0.00 0.32 -0.07 0.15 -1.72 0.00 0.00 179.24 177.92 2bhy h PHE 330 N 0.71 -0.17 -0.41 4.55 3.57 -1.84 -0.41 116.94 122.94 2bhy h PHE 330 Ca 0.40 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.98 2bhy h PHE 330 Cb 0.42 0.09 -0.06 0.00 2.79 0.00 0.00 35.95 39.19 2bhy h PHE 330 CO -0.08 -0.11 0.05 1.25 -2.23 0.00 0.00 178.31 177.19 2bhy h HIS 331 N -0.10 0.08 -0.45 0.41 2.76 -1.42 -1.20 115.15 115.24 2bhy h HIS 331 Ca 0.05 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.14 2bhy h HIS 331 Cb 0.17 0.03 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 2bhy h HIS 331 CO -0.17 -0.02 -0.15 0.45 -1.30 0.00 0.00 177.93 176.74 2bhy h HIS 332 N 0.17 1.01 -0.86 5.26 3.86 -0.81 -0.43 115.15 123.35 2bhy h HIS 332 Ca 0.20 -0.23 -0.03 0.00 -1.16 0.00 0.00 60.37 59.15 2bhy h HIS 332 Cb 0.26 -0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.45 2bhy h HIS 332 CO -0.22 1.01 0.43 1.49 0.86 0.00 0.00 177.93 181.49 2bhy h GLU 333 N 0.72 1.22 -0.19 2.45 4.57 -0.88 -1.54 114.58 120.93 2bhy h GLU 333 Ca 0.11 -0.17 -0.05 0.00 -1.18 0.00 0.00 59.36 58.07 2bhy h GLU 333 Cb 0.71 -0.23 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 2bhy h GLU 333 CO 0.05 0.93 -0.08 1.15 -1.18 0.00 0.00 179.01 179.88 2bhy h THR 334 N 1.21 1.30 -0.31 0.32 2.02 -0.89 -1.68 112.91 114.88 2bhy h THR 334 Ca 0.30 -1.11 -0.00 0.00 0.77 0.00 0.00 66.41 66.37 2bhy h THR 334 Cb 0.09 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.11 2bhy h THR 334 CO -0.04 0.33 0.18 -0.09 0.37 0.00 0.00 175.52 176.28 2bhy h ARG 335 N 0.09 0.43 -0.78 6.66 2.43 -0.94 -2.29 114.38 119.99 2bhy h ARG 335 Ca 0.05 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 2bhy h ARG 335 Cb 0.55 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 2bhy h ARG 335 CO 0.02 0.34 0.34 0.28 -1.51 0.00 0.00 179.97 179.44 2bhy h VAL 336 N 0.39 1.25 -0.69 0.20 2.07 -1.27 0.37 116.25 118.57 2bhy h VAL 336 Ca 0.11 -0.75 0.12 0.00 0.82 0.00 0.00 66.70 67.00 2bhy h VAL 336 Cb 0.03 0.29 -0.09 0.00 -1.52 0.00 0.00 31.29 30.00 2bhy h VAL 336 CO -0.02 0.31 0.26 0.74 0.02 0.00 0.00 177.57 178.88 2bhy h THR 337 N 1.12 0.70 0.00 2.57 2.02 -0.95 0.95 112.91 119.32 2bhy h THR 337 Ca 0.26 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.27 2bhy h THR 337 Cb 0.16 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 66.81 2bhy h THR 337 CO -0.03 0.08 -0.74 -0.07 0.37 0.00 0.00 175.52 175.12 2bhy h LEU 338 N 0.42 0.00 0.00 2.58 3.38 -0.71 -3.40 115.31 117.58 2bhy h LEU 338 Ca 0.37 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.34 2bhy h LEU 338 Cb 0.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 2bhy h LEU 338 CO -0.37 0.10 -1.00 0.35 0.09 0.00 0.00 178.44 177.61 2bhy n THR 339 N -2.85 0.00 -0.99 0.22 -2.24 0.01 -4.48 114.28 103.95 2bhy n THR 339 Ca 0.00 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2bhy n THR 339 Cb 0.59 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 2bhy n THR 339 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bhy n GLY 340 N 2.73 0.94 3.75 3.38 0.00 0.32 -5.01 105.19 111.30 2bhy n GLY 340 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 2bhy n GLY 340 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bhy s GLU 341 N -0.03 2.91 -0.00 1.61 -1.05 -1.26 -4.96 118.70 115.91 2bhy s GLU 341 Ca 0.00 1.82 0.00 0.00 -0.15 0.00 0.00 54.97 56.65 2bhy s GLU 341 Cb 0.00 -1.92 0.01 0.00 -0.44 0.00 0.00 34.13 31.78 2bhy s GLU 341 CO 0.00 -1.25 0.65 1.04 0.95 0.00 0.00 175.26 176.64 2bhy n GLN 342 N -1.68 0.36 -2.74 -4.83 1.13 -1.26 -4.66 117.38 103.70 2bhy n GLN 342 Ca 0.14 -0.73 -0.33 0.00 -1.94 0.00 0.00 57.00 54.13 2bhy n GLN 342 Cb 0.50 -0.58 -0.06 0.00 0.11 0.00 0.00 30.24 30.21 2bhy n GLN 342 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2bhy s GLU 343 N -0.18 4.12 5.69 -1.09 0.41 -1.26 -3.04 118.70 123.35 2bhy s GLU 343 Ca 0.01 1.17 0.00 0.00 -0.41 0.00 0.00 54.97 55.74 2bhy s GLU 343 Cb 0.01 -2.16 0.00 0.00 -1.78 0.00 0.00 34.13 30.20 2bhy s GLU 343 CO 0.00 -0.13 0.00 0.41 -0.49 0.00 0.00 175.26 175.05 2bhy n GLY 344 N -0.57 3.04 0.18 -1.39 0.00 -1.26 -1.88 105.19 103.31 2bhy n GLY 344 Ca 0.08 -0.22 0.14 0.00 0.00 0.00 0.00 46.02 46.02 2bhy n GLY 344 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2bhy h TYR 345 N 0.00 0.00 0.00 1.61 -0.00 -1.98 -2.56 116.97 114.04 2bhy h TYR 345 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.72 2bhy h TYR 345 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.73 2bhy h TYR 345 CO 0.00 0.00 -0.04 1.88 -0.00 0.00 0.00 178.16 180.00 2bhy h TYR 346 N 0.00 0.00 0.00 0.10 0.05 -1.64 -0.56 116.97 114.93 2bhy h TYR 346 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2bhy h TYR 346 Cb 0.37 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.11 2bhy h TYR 346 CO 0.00 0.04 0.00 0.00 -1.05 0.00 0.00 178.16 177.15 2bhy n ALA 347 N -2.19 1.19 1.36 3.88 0.00 -0.96 -2.10 120.51 121.69 2bhy n ALA 347 Ca -0.02 0.10 0.11 0.00 0.00 0.00 0.00 53.44 53.63 2bhy n ALA 347 Cb 0.17 -1.23 0.66 0.00 0.00 0.00 0.00 19.45 19.05 2bhy n ALA 347 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhy n GLY 348 N -1.01 -0.79 2.94 0.00 0.00 -0.22 -4.86 105.19 101.25 2bhy n GLY 348 Ca 0.00 -0.14 -0.14 0.00 0.00 0.00 0.00 46.02 45.75 2bhy n GLY 348 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bhy s TYR 349 N -2.13 0.32 -0.03 1.61 2.02 -0.89 -5.03 117.35 113.22 2bhy s TYR 349 Ca 0.32 -0.13 -0.07 0.00 -0.37 0.00 0.00 57.07 56.81 2bhy s TYR 349 Cb 0.16 -0.21 -0.29 0.00 -0.40 0.00 0.00 41.96 41.22 2bhy s TYR 349 CO 0.28 -0.03 0.75 -0.09 -1.57 0.00 0.00 175.55 174.89 2bhy h ARG 350 N 5.80 0.33 -1.41 -0.62 2.43 -1.89 -3.50 114.38 115.53 2bhy h ARG 350 Ca -0.28 -0.56 0.16 0.00 -0.81 0.00 0.00 59.98 58.49 2bhy h ARG 350 Cb 1.20 0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.91 2bhy h ARG 350 CO 0.49 1.22 -0.33 0.41 -1.51 0.00 0.00 179.97 180.25 2bhy n GLY 351 N 1.78 -1.99 0.00 2.80 0.00 -1.26 -4.68 105.19 101.84 2bhy n GLY 351 Ca -0.21 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.46 2bhy n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhy n GLY 352 N -2.94 1.91 0.06 -0.02 0.00 -1.26 -4.45 105.19 98.48 2bhy n GLY 352 Ca -0.01 -2.05 -0.11 0.00 0.00 0.00 0.00 46.02 43.85 2bhy n GLY 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhy h ALA 353 N 0.00 0.04 -0.78 4.61 0.00 -1.84 0.61 119.26 121.90 2bhy h ALA 353 Ca 0.00 0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2bhy h ALA 353 Cb 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2bhy h ALA 353 CO 0.00 -0.49 0.50 1.49 0.00 0.00 0.00 179.25 180.76 2bhy h GLU 354 N 0.01 0.96 -0.37 0.00 4.81 -1.89 -0.62 114.58 117.49 2bhy h GLU 354 Ca 0.02 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.08 2bhy h GLU 354 Cb 0.03 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 2bhy h GLU 354 CO -0.05 0.63 -0.22 0.00 -0.73 0.00 0.00 179.01 178.64 2bhy h ALA 355 N 1.32 0.52 -0.55 2.92 0.00 -1.69 -2.58 119.26 119.21 2bhy h ALA 355 Ca 0.31 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2bhy h ALA 355 Cb -0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2bhy h ALA 355 CO -0.11 0.50 0.11 -0.07 0.00 0.00 0.00 179.25 179.68 2bhy h LEU 356 N 0.59 0.85 -0.86 0.00 3.38 -0.62 -1.57 115.31 117.08 2bhy h LEU 356 Ca 0.08 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 57.86 2bhy h LEU 356 Cb 0.78 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.25 2bhy h LEU 356 CO 0.06 0.88 0.54 0.00 0.09 0.00 0.00 178.44 180.00 2bhy h ALA 357 N 1.00 1.19 0.06 1.53 0.00 -1.06 -1.08 119.26 120.90 2bhy h ALA 357 Ca 0.17 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 2bhy h ALA 357 Cb 0.37 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2bhy h ALA 357 CO 0.01 0.28 -0.03 -0.92 0.00 0.00 0.00 179.25 178.58 2bhy h TYR 358 N 0.97 -0.07 -0.88 0.00 3.20 -1.23 -1.76 116.97 117.21 2bhy h TYR 358 Ca 0.38 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.26 2bhy h TYR 358 Cb 0.18 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.43 2bhy h TYR 358 CO -0.03 0.22 0.58 1.15 -1.64 0.00 0.00 178.16 178.44 2bhy h THR 359 N -0.36 1.23 -0.32 1.81 2.02 -0.96 -0.95 112.91 115.37 2bhy h THR 359 Ca -0.01 -0.42 -0.03 0.00 0.77 0.00 0.00 66.41 66.72 2bhy h THR 359 Cb 0.32 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2bhy h THR 359 CO 0.01 0.22 0.07 0.40 0.37 0.00 0.00 175.52 176.60 2bhy h ILE 360 N 1.20 1.22 0.00 3.11 2.04 -1.21 0.49 117.51 124.36 2bhy h ILE 360 Ca 0.32 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.43 2bhy h ILE 360 Cb -0.13 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2bhy h ILE 360 CO -0.07 0.25 0.00 0.08 0.00 0.00 0.00 178.15 178.41 2bhy h ARG 361 N 0.36 0.00 -0.01 2.37 0.11 -0.83 -2.28 114.38 114.10 2bhy h ARG 361 Ca 0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.18 2bhy h ARG 361 Cb 0.31 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.39 2bhy h ARG 361 CO 0.00 0.00 -0.51 0.54 0.10 0.00 0.00 179.97 180.10 2bhy n ARG 362 N -2.92 1.21 0.00 0.08 5.12 -0.40 -5.00 116.66 114.75 2bhy n ARG 362 Ca 0.01 -0.83 0.00 0.00 -1.93 0.00 0.00 57.85 55.09 2bhy n ARG 362 Cb 0.28 -1.43 0.00 0.00 -1.16 0.00 0.00 32.46 30.15 2bhy n ARG 362 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2bhy n GLY 363 N 1.37 1.77 3.32 -0.13 0.00 0.15 -4.68 105.19 107.00 2bhy n GLY 363 Ca 0.08 -0.15 -0.17 0.00 0.00 0.00 0.00 46.02 45.77 2bhy n GLY 363 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2bhy s TRP 364 N 0.00 1.59 -0.09 1.61 -2.14 -1.23 -4.71 118.94 113.96 2bhy s TRP 364 Ca 0.00 -0.63 -0.25 0.00 2.66 0.00 0.00 56.10 57.88 2bhy s TRP 364 Cb 0.00 -0.75 -0.29 0.00 -3.10 0.00 0.00 33.47 29.33 2bhy s TRP 364 CO 0.00 0.28 0.83 -0.09 -2.66 0.00 0.00 176.95 175.32 2bhy h ARG 365 N 2.62 0.15 -5.93 3.25 2.43 -1.86 -3.44 114.38 111.60 2bhy h ARG 365 Ca -0.38 -0.25 -0.61 0.00 -0.81 0.00 0.00 59.98 57.93 2bhy h ARG 365 Cb 1.21 0.09 -0.12 0.00 -0.42 0.00 0.00 29.97 30.74 2bhy h ARG 365 CO 0.62 1.12 0.49 0.71 -1.51 0.00 0.00 179.97 181.41 2bhy s TYR 366 N -2.33 2.91 -0.18 2.20 2.02 -1.26 -4.86 117.35 115.84 2bhy s TYR 366 Ca -0.16 0.18 0.14 0.00 -0.37 0.00 0.00 57.07 56.85 2bhy s TYR 366 Cb -0.01 -3.89 0.38 0.00 -0.40 0.00 0.00 41.96 38.04 2bhy s TYR 366 CO 0.76 -1.14 1.22 0.39 -1.57 0.00 0.00 175.55 175.21 2bhy n GLU 367 N 7.09 1.53 0.00 -0.62 1.02 -1.22 -3.73 120.64 124.71 2bhy n GLU 367 Ca 0.03 -3.01 0.00 0.00 -0.02 0.00 0.00 57.16 54.16 2bhy n GLU 367 Cb 0.48 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.31 2bhy n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bhy n GLY 368 N -1.22 1.25 3.80 0.62 0.00 0.75 -3.38 105.19 107.01 2bhy n GLY 368 Ca 0.19 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.91 2bhy n GLY 368 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bhy s GLN 369 N 0.00 1.83 0.13 1.61 0.00 -1.23 -4.03 119.66 117.97 2bhy s GLN 369 Ca 0.00 0.53 -0.31 0.00 -0.00 0.00 0.00 55.36 55.58 2bhy s GLN 369 Cb 0.00 -1.90 -0.08 0.00 0.00 0.00 0.00 33.01 31.03 2bhy s GLN 369 CO 0.00 -1.78 1.42 0.12 0.00 0.00 0.00 175.29 175.05 2bhy s PHE 370 N -3.20 3.21 -0.38 9.60 5.36 -1.26 -1.43 117.98 129.87 2bhy s PHE 370 Ca 0.62 0.91 -0.15 0.00 -0.96 0.00 0.00 56.93 57.35 2bhy s PHE 370 Cb -0.14 -3.72 0.01 0.00 -0.34 0.00 0.00 43.02 38.82 2bhy s PHE 370 CO 0.54 -2.54 0.30 -0.46 -1.46 0.00 0.00 175.22 171.59 2bhy s TRP 371 N 1.01 3.23 -1.74 10.12 -0.11 0.34 -4.88 118.94 126.92 2bhy s TRP 371 Ca 0.65 -0.40 0.20 0.00 1.22 0.00 0.00 56.10 57.77 2bhy s TRP 371 Cb -0.38 -2.59 0.65 0.00 -1.50 0.00 0.00 33.47 29.65 2bhy s TRP 371 CO 0.31 -0.51 1.54 0.00 -4.62 0.00 0.00 176.95 173.68 2bhy n ALA 372 N 5.20 2.61 -1.85 5.86 0.00 -1.26 -2.76 120.51 128.31 2bhy n ALA 372 Ca -0.11 -1.32 -0.42 0.00 0.00 0.00 0.00 53.44 51.59 2bhy n ALA 372 Cb 0.48 -0.97 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 2bhy n ALA 372 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2bhy s VAL 373 N -1.31 2.95 0.27 0.00 1.01 -1.26 -4.89 120.40 117.18 2bhy s VAL 373 Ca 0.48 0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.49 2bhy s VAL 373 Cb 0.27 -3.21 -0.11 0.00 0.00 0.00 0.00 36.38 33.33 2bhy s VAL 373 CO 0.29 -0.01 1.54 -0.54 0.00 0.00 0.00 175.10 176.39 2bhy s LYS 374 N 3.04 4.18 0.00 2.72 1.02 -1.26 -1.26 119.74 128.17 2bhy s LYS 374 Ca 0.78 2.47 0.00 0.00 0.02 0.00 0.00 55.97 59.24 2bhy s LYS 374 Cb -0.41 -3.06 0.00 0.00 -0.52 0.00 0.00 37.83 33.84 2bhy s LYS 374 CO 0.34 -0.56 0.00 0.41 -0.92 0.00 0.00 175.35 174.62 2bhy n GLY 375 N 2.29 1.94 0.20 -3.33 0.00 -1.26 -4.84 105.19 100.19 2bhy n GLY 375 Ca 0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.14 2bhy n GLY 375 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bhy n GLU 376 N -2.00 0.90 -1.98 1.61 1.02 -0.39 -5.10 120.64 114.70 2bhy n GLU 376 Ca 0.00 -1.59 -0.42 0.00 -0.02 0.00 0.00 57.16 55.13 2bhy n GLU 376 Cb 0.00 -0.94 -0.03 0.00 -0.02 0.00 0.00 31.44 30.45 2bhy n GLU 376 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2bhy s GLU 377 N -1.21 4.22 0.05 3.49 8.01 -1.18 -4.79 118.70 127.29 2bhy s GLU 377 Ca 0.12 2.28 -0.28 0.00 0.01 0.00 0.00 54.97 57.10 2bhy s GLU 377 Cb 0.10 -3.43 0.10 0.00 -4.31 0.00 0.00 34.13 26.60 2bhy s GLU 377 CO 0.01 -0.65 1.17 -3.38 0.01 0.00 0.00 175.26 172.42 2bhy s HIS 378 N 2.02 -0.07 -0.52 1.61 -3.43 -1.11 -5.02 115.29 108.78 2bhy s HIS 378 Ca 0.71 -0.11 -0.27 0.00 -0.80 0.00 0.00 55.06 54.58 2bhy s HIS 378 Cb -0.40 0.58 0.03 0.00 -1.43 0.00 0.00 32.58 31.37 2bhy s HIS 378 CO 0.31 -0.48 1.09 -1.21 -2.00 0.00 0.00 174.74 172.45 2bhy s GLU 379 N -2.70 3.57 -0.22 -0.38 2.02 -1.26 -0.50 118.70 119.23 2bhy s GLU 379 Ca 0.14 0.29 -0.09 0.00 0.02 0.00 0.00 54.97 55.33 2bhy s GLU 379 Cb 0.02 -3.96 -0.04 0.00 0.10 0.00 0.00 34.13 30.25 2bhy s GLU 379 CO -0.01 -1.46 0.10 0.50 0.02 0.00 0.00 175.26 174.41 2bhy s ARG 380 N 4.41 3.95 0.00 1.61 3.52 -0.51 -4.88 118.95 127.05 2bhy s ARG 380 Ca 0.42 -0.34 0.00 0.00 -0.13 0.00 0.00 55.73 55.68 2bhy s ARG 380 Cb -0.08 -3.36 0.00 0.00 -1.56 0.00 0.00 34.95 29.94 2bhy s ARG 380 CO 0.27 0.10 0.00 0.41 -0.81 0.00 0.00 175.30 175.28 2bhy n GLY 381 N 4.09 0.20 3.10 8.12 0.00 -1.23 -0.18 105.19 119.29 2bhy n GLY 381 Ca -0.16 -1.97 -0.08 0.00 0.00 0.00 0.00 46.02 43.81 2bhy n GLY 381 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bhy s HIS 382 N -1.24 0.33 0.19 1.61 3.76 -0.72 -2.36 115.29 116.86 2bhy s HIS 382 Ca 0.00 -0.73 -0.33 0.00 -0.15 0.00 0.00 55.06 53.85 2bhy s HIS 382 Cb 0.00 -0.23 -0.15 0.00 1.11 0.00 0.00 32.58 33.31 2bhy s HIS 382 CO 0.00 -0.37 1.34 -2.30 -0.85 0.00 0.00 174.74 172.56 2bhy n PRO 383 N 0.54 1.67 -0.04 8.40 -0.02 -1.22 -4.41 135.00 139.93 2bhy n PRO 383 Ca -0.17 0.60 0.13 0.00 -2.02 0.00 0.00 63.50 62.03 2bhy n PRO 383 Cb 0.59 -2.21 0.43 0.00 -0.02 0.00 0.00 33.50 32.30 2bhy n PRO 383 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bhy n SER 384 N 2.28 1.72 -0.32 2.55 3.41 -1.26 -4.61 113.62 117.38 2bhy n SER 384 Ca 0.14 -1.62 0.16 0.00 -0.26 0.00 0.00 58.87 57.28 2bhy n SER 384 Cb 0.28 -0.05 0.39 0.00 -0.26 0.00 0.00 64.21 64.57 2bhy n SER 384 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2bhy h ASP 385 N 2.51 0.66 0.63 4.04 5.19 -1.90 -1.30 116.42 126.25 2bhy h ASP 385 Ca 0.00 0.08 -0.04 0.00 -0.62 0.00 0.00 57.03 56.45 2bhy h ASP 385 Cb 0.54 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 2bhy h ASP 385 CO 0.00 0.22 -0.20 0.00 -3.12 0.00 0.00 179.24 176.15 2bhy h ALA 386 N 1.64 1.15 -2.71 3.45 0.00 -2.00 -3.44 119.26 117.35 2bhy h ALA 386 Ca 0.56 -0.18 -0.55 0.00 0.00 0.00 0.00 54.91 54.75 2bhy h ALA 386 Cb 1.05 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2bhy h ALA 386 CO -0.33 0.24 0.10 -0.51 0.00 0.00 0.00 179.25 178.76 2bhy s LEU 387 N -7.09 4.55 0.35 0.00 1.43 -0.49 -5.07 118.68 112.36 2bhy s LEU 387 Ca -0.01 1.48 0.04 0.00 -1.03 0.00 0.00 54.13 54.61 2bhy s LEU 387 Cb 0.12 -3.14 -0.01 0.00 0.03 0.00 0.00 46.19 43.19 2bhy s LEU 387 CO 0.62 0.21 0.51 -0.70 0.23 0.00 0.00 176.35 177.22 2bhy s GLU 388 N -0.97 3.17 0.23 1.70 2.56 -1.26 -4.97 118.70 119.15 2bhy s GLU 388 Ca 0.34 -0.79 -0.08 0.00 0.00 0.00 0.00 54.97 54.44 2bhy s GLU 388 Cb -0.21 -2.75 0.39 0.00 2.00 0.00 0.00 34.13 33.56 2bhy s GLU 388 CO 0.23 0.03 1.67 0.00 -0.56 0.00 0.00 175.26 176.63 2bhy h ALA 389 N 0.79 0.79 0.00 6.30 0.00 -1.88 -0.52 119.26 124.74 2bhy h ALA 389 Ca -0.47 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2bhy h ALA 389 Cb 1.25 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 2bhy h ALA 389 CO 0.56 -0.37 -0.06 -1.35 0.00 0.00 0.00 179.25 178.03 2bhy h PRO 390 N 0.19 0.00 0.00 0.00 0.11 -1.78 -2.43 132.00 128.09 2bhy h PRO 390 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2bhy h PRO 390 Cb 0.64 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2bhy h PRO 390 CO -0.54 0.06 0.00 -0.91 -0.21 0.00 0.00 178.00 176.40 2bhy h ASN 391 N 0.00 0.00 -3.65 -2.05 2.35 -1.31 -3.39 115.58 107.53 2bhy h ASN 391 Ca -0.00 0.00 -0.62 0.00 -0.55 0.00 0.00 56.30 55.13 2bhy h ASN 391 Cb 0.26 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.49 2bhy h ASN 391 CO 0.01 0.00 -0.33 -0.36 -1.65 0.00 0.00 177.43 175.10 2bhy s PHE 392 N -3.64 3.29 -0.28 1.19 0.08 -0.91 -0.73 117.98 116.99 2bhy s PHE 392 Ca 0.01 0.38 -0.13 0.00 0.12 0.00 0.00 56.93 57.31 2bhy s PHE 392 Cb 0.09 -2.46 -0.04 0.00 -0.57 0.00 0.00 43.02 40.04 2bhy s PHE 392 CO 0.46 -0.09 0.29 0.08 -0.10 0.00 0.00 175.22 175.86 2bhy s VAL 393 N 1.57 5.23 0.12 -0.44 1.01 -0.11 -1.20 120.40 126.59 2bhy s VAL 393 Ca 0.13 0.37 0.06 0.00 0.00 0.00 0.00 61.98 62.54 2bhy s VAL 393 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2bhy s VAL 393 CO 0.08 0.18 -0.00 -0.31 0.00 0.00 0.00 175.10 175.05 2bhy s TYR 394 N 1.93 2.92 0.18 5.22 1.51 -0.14 -2.09 117.35 126.89 2bhy s TYR 394 Ca 0.11 -0.08 -0.19 0.00 -1.01 0.00 0.00 57.07 55.91 2bhy s TYR 394 Cb -0.16 -1.47 0.04 0.00 -0.11 0.00 0.00 41.96 40.26 2bhy s TYR 394 CO 0.10 0.49 0.54 0.00 -1.11 0.00 0.00 175.55 175.58 2bhy n ILE 396 N -0.35 0.00 -3.71 0.00 -5.35 -1.26 -3.70 119.36 104.99 2bhy n ILE 396 Ca -0.12 -0.38 -0.14 0.00 -0.27 0.00 0.00 62.75 61.84 2bhy n ILE 396 Cb 0.63 1.13 -0.09 0.00 -1.74 0.00 0.00 39.64 39.57 2bhy n ILE 396 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2bhy s GLN 397 N -1.47 0.61 0.38 6.28 -1.52 -1.26 -4.90 119.66 117.78 2bhy s GLN 397 Ca 0.09 0.38 -0.12 0.00 -1.95 0.00 0.00 55.36 53.76 2bhy s GLN 397 Cb 0.09 0.29 0.04 0.00 -0.22 0.00 0.00 33.01 33.21 2bhy s GLN 397 CO 0.28 -0.12 0.70 0.54 -0.25 0.00 0.00 175.29 176.44 2bhy s ASN 398 N -0.30 0.30 0.27 5.90 2.20 -1.26 -3.94 114.94 118.11 2bhy s ASN 398 Ca -0.05 -1.26 -0.03 0.00 -0.94 0.00 0.00 52.86 50.59 2bhy s ASN 398 Cb -0.03 0.80 0.40 0.00 -2.00 0.00 0.00 41.25 40.42 2bhy s ASN 398 CO 0.02 -1.58 1.91 1.12 -2.94 0.00 0.00 177.10 175.63 2bhy h HIS 399 N 2.03 1.17 -0.06 1.54 2.07 -1.98 -2.09 115.15 117.83 2bhy h HIS 399 Ca -0.31 0.03 -0.23 0.00 -2.85 0.00 0.00 60.37 57.01 2bhy h HIS 399 Cb 1.25 -0.39 0.02 0.00 2.57 0.00 0.00 27.41 30.85 2bhy h HIS 399 CO 1.43 0.66 -0.85 -0.44 -3.07 0.00 0.00 177.93 175.66 2bhy h ASP 400 N 1.19 0.85 0.89 3.10 3.32 -1.97 0.18 116.42 123.99 2bhy h ASP 400 Ca 0.40 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2bhy h ASP 400 Cb 0.06 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.35 2bhy h ASP 400 CO -0.13 1.42 0.00 0.00 -1.72 0.00 0.00 179.24 178.81 2bhy n GLN 401 N -3.97 0.10 -0.10 3.56 1.13 -1.00 -0.88 117.38 116.23 2bhy n GLN 401 Ca -0.09 0.01 -0.15 0.00 -1.94 0.00 0.00 57.00 54.82 2bhy n GLN 401 Cb 0.78 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 29.58 2bhy n GLN 401 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 2bhy n ILE 402 N -1.45 1.50 0.39 5.09 5.41 -0.82 -4.75 119.36 124.73 2bhy n ILE 402 Ca 0.09 -0.01 0.14 0.00 1.00 0.00 0.00 62.75 63.96 2bhy n ILE 402 Cb 0.31 -2.19 0.44 0.00 -0.71 0.00 0.00 39.64 37.49 2bhy n ILE 402 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2bhy h GLY 403 N -1.00 0.00 1.94 7.39 0.00 -0.54 -2.85 103.07 108.01 2bhy h GLY 403 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2bhy h GLY 403 CO -0.14 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.56 2bhy n ASN 404 N -2.65 0.00 -4.81 0.19 0.23 -0.06 -4.05 115.26 104.11 2bhy n ASN 404 Ca 0.03 0.42 -0.36 0.00 -0.53 0.00 0.00 54.58 54.14 2bhy n ASN 404 Cb 0.37 -0.47 -0.06 0.00 -2.08 0.00 0.00 39.78 37.54 2bhy n ASN 404 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 2bhy s ARG 405 N -2.94 4.31 0.27 -3.83 0.52 -1.08 -4.97 118.95 111.24 2bhy s ARG 405 Ca 0.13 0.97 -0.01 0.00 -0.52 0.00 0.00 55.73 56.30 2bhy s ARG 405 Cb 0.16 -2.81 0.59 0.00 0.52 0.00 0.00 34.95 33.41 2bhy s ARG 405 CO 0.43 0.34 1.67 -1.35 0.02 0.00 0.00 175.30 176.42 2bhy h PRO 406 N 3.24 0.27 -0.31 3.54 0.11 -1.89 -1.16 132.00 135.80 2bhy h PRO 406 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2bhy h PRO 406 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2bhy h PRO 406 CO 0.65 0.18 0.00 1.28 -0.21 0.00 0.00 178.00 179.90 2bhy n LEU 407 N -5.16 3.09 -2.14 2.35 4.77 -1.26 -4.36 117.00 114.30 2bhy n LEU 407 Ca 0.18 -1.49 -0.19 0.00 -0.03 0.00 0.00 56.01 54.48 2bhy n LEU 407 Cb 0.56 -0.20 -0.01 0.00 -2.33 0.00 0.00 43.42 41.45 2bhy n LEU 407 CO 0.10 0.67 -0.24 0.61 -1.33 0.00 0.00 177.39 177.20 2bhy n GLY 408 N 1.17 -0.34 3.81 -0.72 0.00 -0.44 -4.76 105.19 103.91 2bhy n GLY 408 Ca 0.16 -0.09 -0.35 0.00 0.00 0.00 0.00 46.02 45.74 2bhy n GLY 408 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bhy s GLU 409 N -4.90 4.31 0.78 1.61 1.03 -1.26 -0.91 118.70 119.36 2bhy s GLU 409 Ca 0.00 1.07 -0.12 0.00 0.03 0.00 0.00 54.97 55.95 2bhy s GLU 409 Cb 0.00 -2.53 0.06 0.00 -0.80 0.00 0.00 34.13 30.86 2bhy s GLU 409 CO 0.00 0.17 1.14 1.03 -1.33 0.00 0.00 175.26 176.27 2bhy s ARG 410 N -2.60 2.21 0.20 -4.83 0.52 -1.26 -4.71 118.95 108.48 2bhy s ARG 410 Ca 0.54 0.29 -0.10 0.00 -0.52 0.00 0.00 55.73 55.94 2bhy s ARG 410 Cb -0.13 -1.96 0.21 0.00 0.52 0.00 0.00 34.95 33.58 2bhy s ARG 410 CO 0.18 -1.46 1.81 1.25 0.02 0.00 0.00 175.30 177.10 2bhy h LEU 411 N -0.96 0.54 -0.19 2.53 5.85 -1.94 -0.13 115.31 121.02 2bhy h LEU 411 Ca -0.46 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2bhy h LEU 411 Cb 1.30 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.24 2bhy h LEU 411 CO 0.64 0.36 0.00 0.00 -0.34 0.00 0.00 178.44 179.10 2bhy n HIS 412 N -4.79 0.31 0.12 1.25 1.44 -1.26 -2.52 115.22 109.77 2bhy n HIS 412 Ca 0.07 0.11 0.12 0.00 -2.01 0.00 0.00 57.72 56.01 2bhy n HIS 412 Cb 0.15 -0.68 0.02 0.00 0.12 0.00 0.00 29.99 29.60 2bhy n HIS 412 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 2bhy h GLN 413 N 0.00 0.00 -6.93 -1.40 4.20 -1.34 -3.45 115.11 106.18 2bhy h GLN 413 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 2bhy h GLN 413 Cb 0.37 0.00 0.06 0.00 0.30 0.00 0.00 27.48 28.22 2bhy h GLN 413 CO 0.00 0.00 0.55 -1.12 -0.67 0.00 0.00 178.83 177.59 2bhy s SER 414 N -5.46 6.48 0.10 1.46 0.01 -1.03 -4.85 113.70 110.41 2bhy s SER 414 Ca 0.01 2.48 -0.34 0.00 1.31 0.00 0.00 55.95 59.41 2bhy s SER 414 Cb 0.09 -2.63 -0.13 0.00 0.21 0.00 0.00 66.02 63.56 2bhy s SER 414 CO 0.77 -0.71 1.68 -0.67 0.41 0.00 0.00 173.24 174.72 2bhy n ASP 415 N 0.18 3.31 0.00 2.44 2.03 -1.26 -2.47 116.55 120.78 2bhy n ASP 415 Ca 0.04 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.39 2bhy n ASP 415 Cb 0.45 -1.43 0.00 0.00 -0.72 0.00 0.00 41.12 39.42 2bhy n ASP 415 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bhy n GLY 416 N 3.75 3.24 3.70 0.27 0.00 -1.26 -4.93 105.19 109.96 2bhy n GLY 416 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2bhy n GLY 416 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bhy s VAL 417 N -2.17 3.18 0.37 1.61 1.01 -1.03 -5.01 120.40 118.35 2bhy s VAL 417 Ca 0.00 0.75 -0.01 0.00 0.00 0.00 0.00 61.98 62.72 2bhy s VAL 417 Cb 0.00 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 2bhy s VAL 417 CO 0.00 0.03 0.59 0.42 0.00 0.00 0.00 175.10 176.14 2bhy s THR 418 N 1.78 5.07 0.47 3.92 -4.23 -1.26 -4.83 115.64 116.56 2bhy s THR 418 Ca 0.68 -0.32 0.17 0.00 -1.18 0.00 0.00 61.69 61.04 2bhy s THR 418 Cb -0.38 -3.86 0.22 0.00 1.34 0.00 0.00 72.50 69.83 2bhy s THR 418 CO 0.30 -0.60 2.05 -0.07 -0.54 0.00 0.00 174.62 175.76 2bhy h LEU 419 N 0.72 0.00 -0.30 4.79 3.38 -1.95 -1.34 115.31 120.61 2bhy h LEU 419 Ca -0.49 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.45 2bhy h LEU 419 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2bhy h LEU 419 CO 0.62 0.13 0.07 0.45 0.09 0.00 0.00 178.44 179.80 2bhy h HIS 420 N 0.00 0.50 -0.85 1.13 3.86 -1.90 -0.78 115.15 117.11 2bhy h HIS 420 Ca -0.00 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 2bhy h HIS 420 Cb 0.25 -0.14 -0.04 0.00 1.06 0.00 0.00 27.41 28.53 2bhy h HIS 420 CO 0.00 0.54 0.50 0.93 0.86 0.00 0.00 177.93 180.76 2bhy h GLU 421 N 0.32 1.15 -0.58 2.45 5.08 -1.54 -0.20 114.58 121.26 2bhy h GLU 421 Ca 0.09 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2bhy h GLU 421 Cb 0.29 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 2bhy h GLU 421 CO 0.00 0.82 0.34 -0.92 -1.00 0.00 0.00 179.01 178.25 2bhy h TYR 422 N 1.16 0.79 -0.36 4.33 3.20 -1.05 -0.68 116.97 124.36 2bhy h TYR 422 Ca 0.30 -0.01 -0.13 0.00 3.14 0.00 0.00 58.73 62.03 2bhy h TYR 422 Cb -0.03 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 2bhy h TYR 422 CO -0.00 0.56 -0.32 0.00 -1.64 0.00 0.00 178.16 176.76 2bhy h ARG 423 N 0.79 0.78 -0.86 1.82 3.08 -0.80 -2.52 114.38 116.67 2bhy h ARG 423 Ca 0.21 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 59.89 2bhy h ARG 423 Cb 0.01 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2bhy h ARG 423 CO -0.04 0.99 0.53 0.78 -1.07 0.00 0.00 179.97 181.17 2bhy h GLY 424 N 0.93 1.24 1.14 0.04 0.00 -0.66 -2.45 103.07 103.30 2bhy h GLY 424 Ca 0.07 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.87 2bhy h GLY 424 CO 0.07 0.49 0.37 0.00 0.00 0.00 0.00 176.54 177.47 2bhy h ALA 425 N 1.29 1.19 -0.72 3.60 0.00 -0.93 -1.59 119.26 122.10 2bhy h ALA 425 Ca 0.31 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.10 2bhy h ALA 425 Cb -0.07 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.36 2bhy h ALA 425 CO -0.06 0.62 0.46 0.00 0.00 0.00 0.00 179.25 180.26 2bhy h ALA 426 N 1.30 0.95 -0.74 0.00 0.00 -1.18 -0.85 119.26 118.74 2bhy h ALA 426 Ca 0.27 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2bhy h ALA 426 Cb 0.12 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 2bhy h ALA 426 CO -0.03 0.25 0.28 0.00 0.00 0.00 0.00 179.25 179.75 2bhy h ALA 427 N 1.31 0.96 0.56 0.00 0.00 -0.91 -0.32 119.26 120.86 2bhy h ALA 427 Ca 0.29 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 2bhy h ALA 427 Cb 0.01 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.52 2bhy h ALA 427 CO -0.11 0.60 -0.27 1.25 0.00 0.00 0.00 179.25 180.72 2bhy h LEU 428 N 1.07 -0.64 -0.45 0.00 5.85 -1.01 -2.52 115.31 117.61 2bhy h LEU 428 Ca 0.24 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 59.04 2bhy h LEU 428 Cb 0.23 0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.36 2bhy h LEU 428 CO -0.02 -0.41 0.04 0.25 -0.34 0.00 0.00 178.44 177.97 2bhy h LEU 429 N -0.82 -0.10 -0.54 2.25 5.85 -0.98 -2.94 115.31 118.03 2bhy h LEU 429 Ca -0.08 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2bhy h LEU 429 Cb 0.60 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.78 2bhy h LEU 429 CO 0.13 -0.02 -0.12 0.18 -0.34 0.00 0.00 178.44 178.27 2bhy n LEU 430 N -5.16 0.96 -0.31 2.25 4.77 -0.15 -3.08 117.00 116.28 2bhy n LEU 430 Ca 0.04 -0.25 0.09 0.00 -0.03 0.00 0.00 56.01 55.87 2bhy n LEU 430 Cb 0.23 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2bhy n LEU 430 CO 0.19 0.17 0.19 0.35 -1.33 0.00 0.00 177.39 176.96 2bhy n THR 431 N -0.49 0.00 -2.35 -5.08 -2.24 -0.95 -4.70 114.28 98.46 2bhy n THR 431 Ca 0.16 -0.22 -0.33 0.00 -2.27 0.00 0.00 64.05 61.39 2bhy n THR 431 Cb 0.31 1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 69.68 2bhy n THR 431 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2bhy s LEU 432 N -2.46 3.65 -1.45 3.22 1.43 -1.13 -4.98 118.68 116.96 2bhy s LEU 432 Ca 0.13 1.73 -0.12 0.00 -1.03 0.00 0.00 54.13 54.84 2bhy s LEU 432 Cb 0.15 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.80 2bhy s LEU 432 CO 0.58 -0.79 2.57 -0.81 0.23 0.00 0.00 176.35 178.12 2bhy n PRO 433 N -1.53 3.12 -3.98 1.29 -0.04 -1.26 -4.90 135.00 127.69 2bhy n PRO 433 Ca 0.08 -2.25 -0.34 0.00 -0.04 0.00 0.00 63.50 60.95 2bhy n PRO 433 Cb 0.53 -2.94 -0.14 0.00 -0.04 0.00 0.00 33.50 30.90 2bhy n PRO 433 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2bhy s THR 435 N 2.82 2.71 0.35 0.52 2.01 -0.34 -4.10 115.64 119.60 2bhy s THR 435 Ca 0.58 -1.18 -0.11 0.00 0.31 0.00 0.00 61.69 61.29 2bhy s THR 435 Cb 0.16 -2.43 -0.07 0.00 0.01 0.00 0.00 72.50 70.17 2bhy s THR 435 CO -0.06 0.14 0.71 -2.16 -0.69 0.00 0.00 174.62 172.56 2bhy s PRO 436 N 1.27 3.82 -0.01 4.92 0.04 -1.26 -0.96 135.00 142.81 2bhy s PRO 436 Ca -0.02 0.44 0.03 0.00 0.04 0.00 0.00 61.00 61.49 2bhy s PRO 436 Cb -0.17 -2.46 -0.01 0.00 0.04 0.00 0.00 34.50 31.90 2bhy s PRO 436 CO -0.05 0.08 -0.11 -1.17 0.04 0.00 0.00 177.00 175.79 2bhy s LEU 437 N -3.48 1.97 0.10 -3.56 0.20 -0.23 -1.21 118.68 112.46 2bhy s LEU 437 Ca 0.51 -0.21 0.07 0.00 0.69 0.00 0.00 54.13 55.19 2bhy s LEU 437 Cb -0.10 -0.61 -0.04 0.00 -0.43 0.00 0.00 46.19 45.01 2bhy s LEU 437 CO 0.26 0.13 -0.13 -0.76 -0.29 0.00 0.00 176.35 175.56 2bhy s LEU 438 N -0.16 2.89 -0.01 -0.68 1.43 0.36 -4.40 118.68 118.12 2bhy s LEU 438 Ca 0.03 -0.43 -0.09 0.00 -1.03 0.00 0.00 54.13 52.60 2bhy s LEU 438 Cb -0.06 -1.71 -0.05 0.00 0.03 0.00 0.00 46.19 44.41 2bhy s LEU 438 CO -0.00 0.19 0.30 0.12 0.23 0.00 0.00 176.35 177.19 2bhy s PHE 439 N -1.15 3.62 -0.04 0.29 5.36 -1.25 -0.47 117.98 124.34 2bhy s PHE 439 Ca 0.19 0.71 -0.40 0.00 -0.96 0.00 0.00 56.93 56.48 2bhy s PHE 439 Cb -0.11 -2.09 -0.19 0.00 -0.34 0.00 0.00 43.02 40.30 2bhy s PHE 439 CO 0.11 0.63 1.27 0.00 -1.46 0.00 0.00 175.22 175.77 2bhy n GLN 440 N 1.44 0.49 0.00 10.12 10.64 -0.24 -1.04 117.38 138.79 2bhy n GLN 440 Ca -0.13 0.18 0.00 0.00 -1.83 0.00 0.00 57.00 55.22 2bhy n GLN 440 Cb 0.53 -1.74 0.00 0.00 -0.86 0.00 0.00 30.24 28.17 2bhy n GLN 440 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2bhy n GLY 441 N 2.30 2.54 0.25 2.61 0.00 -1.26 -4.88 105.19 106.75 2bhy n GLY 441 Ca 0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.33 2bhy n GLY 441 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2bhy h GLN 442 N 2.17 0.00 0.00 1.61 3.07 -1.49 -2.12 115.11 118.35 2bhy h GLN 442 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2bhy h GLN 442 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2bhy h GLN 442 CO 0.00 0.15 0.00 1.05 0.09 0.00 0.00 178.83 180.12 2bhy h GLU 443 N 0.00 0.00 -0.10 0.06 9.09 -1.90 -2.42 114.58 119.31 2bhy h GLU 443 Ca -0.00 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.40 2bhy h GLU 443 Cb 0.34 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.44 2bhy h GLU 443 CO 0.02 0.00 -0.02 -2.67 0.05 0.00 0.00 179.01 176.39 2bhy n TRP 444 N -2.84 0.36 -3.81 2.06 2.14 -0.86 -1.97 117.44 112.52 2bhy n TRP 444 Ca -0.00 -1.00 -0.31 0.00 2.07 0.00 0.00 57.50 58.26 2bhy n TRP 444 Cb 0.21 -0.22 0.02 0.00 -0.81 0.00 0.00 31.31 30.51 2bhy n TRP 444 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2bhy n ALA 445 N -1.10 -2.39 -1.63 -1.67 0.00 -0.91 -4.26 120.51 108.55 2bhy n ALA 445 Ca 0.19 -0.28 -0.41 0.00 0.00 0.00 0.00 53.44 52.93 2bhy n ALA 445 Cb 0.74 -3.15 0.01 0.00 0.00 0.00 0.00 19.45 17.06 2bhy n ALA 445 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bhy n ALA 446 N -4.35 0.37 0.78 0.00 0.00 -0.85 -4.88 120.51 111.58 2bhy n ALA 446 Ca -0.16 0.24 0.13 0.00 0.00 0.00 0.00 53.44 53.65 2bhy n ALA 446 Cb 0.62 -2.11 0.46 0.00 0.00 0.00 0.00 19.45 18.42 2bhy n ALA 446 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bhy n SER 447 N 0.48 0.50 -4.89 0.00 3.41 -1.26 -4.88 113.62 106.98 2bhy n SER 447 Ca 0.09 0.48 -0.34 0.00 -0.26 0.00 0.00 58.87 58.84 2bhy n SER 447 Cb 0.39 -0.58 -0.05 0.00 -0.26 0.00 0.00 64.21 63.71 2bhy n SER 447 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2bhy s THR 448 N -3.06 5.27 0.95 6.66 -4.23 -1.26 -5.07 115.64 114.89 2bhy s THR 448 Ca 0.12 0.14 -0.14 0.00 -1.18 0.00 0.00 61.69 60.63 2bhy s THR 448 Cb 0.15 -3.58 0.16 0.00 1.34 0.00 0.00 72.50 70.57 2bhy s THR 448 CO 0.59 0.31 1.17 -2.16 -0.54 0.00 0.00 174.62 173.98 2bhy s PRO 449 N -1.92 0.84 -0.38 3.99 0.04 -1.26 -4.78 135.00 131.52 2bhy s PRO 449 Ca 0.30 0.12 0.02 0.00 0.04 0.00 0.00 61.00 61.48 2bhy s PRO 449 Cb -0.13 -1.82 0.11 0.00 0.04 0.00 0.00 34.50 32.70 2bhy s PRO 449 CO 0.18 -2.37 0.14 0.12 0.04 0.00 0.00 177.00 175.11 2bhy s PHE 450 N -3.37 2.71 0.30 0.56 5.36 -0.09 -4.28 117.98 119.18 2bhy s PHE 450 Ca 0.66 -2.56 0.02 0.00 -0.96 0.00 0.00 56.93 54.09 2bhy s PHE 450 Cb -0.12 -2.35 -0.03 0.00 -0.34 0.00 0.00 43.02 40.18 2bhy s PHE 450 CO 0.53 -0.86 0.47 -0.65 -1.46 0.00 0.00 175.22 173.25 2bhy s GLN 451 N 0.78 3.47 -0.08 10.12 -0.21 -1.26 -3.28 119.66 129.20 2bhy s GLN 451 Ca 0.13 -0.48 -0.30 0.00 0.02 0.00 0.00 55.36 54.74 2bhy s GLN 451 Cb -0.21 -2.76 -0.03 0.00 1.00 0.00 0.00 33.01 31.01 2bhy s GLN 451 CO -0.10 0.27 1.32 0.12 -2.12 0.00 0.00 175.29 174.78 2bhy s PHE 452 N -2.16 2.86 0.08 0.91 5.36 -1.26 -4.95 117.98 118.82 2bhy s PHE 452 Ca 0.38 0.94 0.03 0.00 -0.96 0.00 0.00 56.93 57.32 2bhy s PHE 452 Cb -0.10 -3.56 -0.03 0.00 -0.34 0.00 0.00 43.02 38.99 2bhy s PHE 452 CO 0.33 -1.99 -0.10 -0.59 -1.46 0.00 0.00 175.22 171.41 2bhy s PHE 453 N 2.91 0.98 0.32 10.12 -0.12 -1.26 -4.20 117.98 126.72 2bhy s PHE 453 Ca 0.59 -0.58 -0.13 0.00 -0.05 0.00 0.00 56.93 56.76 2bhy s PHE 453 Cb -0.26 -0.55 0.02 0.00 -0.63 0.00 0.00 43.02 41.60 2bhy s PHE 453 CO 0.21 -0.02 0.61 -1.54 -0.05 0.00 0.00 175.22 174.44 2bhy s SER 454 N -2.08 0.13 -0.37 1.98 1.04 -0.01 -3.84 113.70 110.55 2bhy s SER 454 Ca -0.00 -1.06 0.12 0.00 0.48 0.00 0.00 55.95 55.49 2bhy s SER 454 Cb -0.06 0.71 0.41 0.00 0.10 0.00 0.00 66.02 67.18 2bhy s SER 454 CO 0.00 -1.38 1.19 -0.67 0.98 0.00 0.00 173.24 173.37 2bhy n ASP 455 N -0.93 -0.69 -4.82 7.02 2.03 -1.22 -4.04 116.55 113.90 2bhy n ASP 455 Ca -0.03 -2.60 -0.32 0.00 0.52 0.00 0.00 54.79 52.35 2bhy n ASP 455 Cb 0.61 0.47 0.01 0.00 -0.72 0.00 0.00 41.12 41.48 2bhy n ASP 455 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2bhy s HIS 456 N -1.02 3.12 0.37 -0.67 3.76 -1.26 -3.80 115.29 115.79 2bhy s HIS 456 Ca 0.24 1.48 -0.10 0.00 -0.15 0.00 0.00 55.06 56.54 2bhy s HIS 456 Cb 0.42 -2.94 -0.06 0.00 1.11 0.00 0.00 32.58 31.11 2bhy s HIS 456 CO -0.04 -0.96 0.72 0.00 -0.85 0.00 0.00 174.74 173.61 2bhy s ALA 457 N -2.59 3.40 0.00 -1.40 0.00 -1.26 -4.07 121.76 115.84 2bhy s ALA 457 Ca 0.62 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.32 2bhy s ALA 457 Cb -0.14 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.35 2bhy s ALA 457 CO 0.39 0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.63 2bhy n GLY 458 N -1.13 2.73 0.30 0.00 0.00 -1.26 -1.93 105.19 103.90 2bhy n GLY 458 Ca 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 2bhy n GLY 458 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bhy h GLU 459 N 0.00 0.70 -0.41 1.61 5.08 -1.99 -2.21 114.58 117.35 2bhy h GLU 459 Ca 0.00 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 2bhy h GLU 459 Cb 0.00 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 2bhy h GLU 459 CO 0.00 0.63 0.23 1.25 -1.00 0.00 0.00 179.01 180.11 2bhy h LEU 460 N 0.68 0.50 -0.66 1.33 5.85 -1.89 -0.15 115.31 120.98 2bhy h LEU 460 Ca 0.16 -0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.85 2bhy h LEU 460 Cb 0.24 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 2bhy h LEU 460 CO -0.01 0.44 0.37 1.23 -0.34 0.00 0.00 178.44 180.13 2bhy h GLY 461 N 0.53 0.96 1.43 3.75 0.00 -0.81 -0.79 103.07 108.13 2bhy h GLY 461 Ca 0.14 -0.26 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 2bhy h GLY 461 CO -0.02 0.16 -0.12 1.46 0.00 0.00 0.00 176.54 178.02 2bhy h GLN 462 N 0.68 0.68 -0.34 4.80 4.20 -1.00 -2.38 115.11 121.75 2bhy h GLN 462 Ca 0.29 -0.22 -0.10 0.00 0.06 0.00 0.00 58.65 58.68 2bhy h GLN 462 Cb 0.17 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 2bhy h GLN 462 CO -0.17 0.78 -0.21 0.00 -0.67 0.00 0.00 178.83 178.56 2bhy h ALA 463 N 1.25 0.99 -0.24 3.87 0.00 -0.40 -1.24 119.26 123.48 2bhy h ALA 463 Ca 0.11 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2bhy h ALA 463 Cb 0.57 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2bhy h ALA 463 CO 0.04 0.59 0.11 0.28 0.00 0.00 0.00 179.25 180.27 2bhy h VAL 464 N 0.57 1.15 -0.35 0.00 2.07 -0.78 0.21 116.25 119.12 2bhy h VAL 464 Ca 0.09 -0.44 0.01 0.00 0.82 0.00 0.00 66.70 67.17 2bhy h VAL 464 Cb 0.68 0.99 -0.02 0.00 -1.52 0.00 0.00 31.29 31.42 2bhy h VAL 464 CO 0.05 0.15 0.23 0.28 0.02 0.00 0.00 177.57 178.30 2bhy h SER 465 N 0.26 0.39 -0.48 0.57 0.02 -1.22 -1.73 113.55 111.37 2bhy h SER 465 Ca 0.08 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.99 2bhy h SER 465 Cb 0.13 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2bhy h SER 465 CO -0.01 0.28 0.14 -0.33 -1.14 0.00 0.00 176.83 175.78 2bhy h GLU 466 N 0.47 0.74 -0.77 3.45 5.08 -1.08 -2.64 114.58 119.84 2bhy h GLU 466 Ca 0.13 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 2bhy h GLU 466 Cb -0.05 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 2bhy h GLU 466 CO -0.03 0.71 0.51 0.78 -1.00 0.00 0.00 179.01 179.97 2bhy h GLY 467 N 0.64 1.08 1.02 -3.84 0.00 -0.32 -1.78 103.07 99.87 2bhy h GLY 467 Ca 0.15 -0.37 -0.16 0.00 0.00 0.00 0.00 47.33 46.96 2bhy h GLY 467 CO -0.00 0.31 -0.48 -0.09 0.00 0.00 0.00 176.54 176.27 2bhy h ARG 468 N 0.92 0.72 -0.17 4.80 9.65 -1.16 -1.86 114.38 127.28 2bhy h ARG 468 Ca 0.31 -0.48 0.03 0.00 -1.10 0.00 0.00 59.98 58.74 2bhy h ARG 468 Cb 0.09 0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 28.70 2bhy h ARG 468 CO -0.09 1.10 -0.00 -0.22 2.80 0.00 0.00 179.97 183.55 2bhy h LYS 469 N 0.44 0.05 -0.47 0.20 3.64 -1.12 -3.01 116.57 116.29 2bhy h LYS 469 Ca 0.00 -0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 2bhy h LYS 469 Cb 1.09 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2bhy h LYS 469 CO 0.11 0.03 -0.10 0.87 -2.27 0.00 0.00 179.45 178.09 2bhy h LYS 470 N 0.05 0.86 -0.57 1.90 1.57 -1.30 -2.90 116.57 116.19 2bhy h LYS 470 Ca 0.08 -0.29 0.04 0.00 -1.87 0.00 0.00 60.65 58.60 2bhy h LYS 470 Cb 0.10 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 2bhy h LYS 470 CO -0.14 0.93 0.38 1.49 -0.57 0.00 0.00 179.45 181.53 2bhy h GLU 471 N 0.78 0.62 0.00 3.15 4.81 -1.21 -3.51 114.58 119.22 2bhy h GLU 471 Ca 0.13 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 2bhy h GLU 471 Cb 0.61 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.85 2bhy h GLU 471 CO 0.04 0.41 0.00 1.19 -0.73 0.00 0.00 179.01 179.92 2bhy n PHE 472 N -4.47 0.00 -2.27 0.92 3.01 -1.10 -5.11 117.46 108.44 2bhy n PHE 472 Ca 0.07 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.26 2bhy n PHE 472 Cb 0.15 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.66 2bhy n PHE 472 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2bhy s ASP 482 N 0.92 5.48 0.04 4.37 3.68 -1.26 -5.02 116.67 124.89 2bhy s ASP 482 Ca 0.00 0.78 -0.28 0.00 2.13 0.00 0.00 52.55 55.18 2bhy s ASP 482 Cb 0.00 -1.70 -0.05 0.00 -1.45 0.00 0.00 42.92 39.73 2bhy s ASP 482 CO 0.00 -1.18 0.88 -0.69 0.13 0.00 0.00 175.17 174.31 2bhy s VAL 483 N -3.10 4.75 0.20 1.11 1.01 -1.26 -4.97 120.40 118.14 2bhy s VAL 483 Ca 0.55 1.87 -0.32 0.00 0.00 0.00 0.00 61.98 64.08 2bhy s VAL 483 Cb -0.11 -4.23 -0.11 0.00 0.00 0.00 0.00 36.38 31.93 2bhy s VAL 483 CO 0.47 0.27 1.68 -2.16 0.00 0.00 0.00 175.10 175.36 2bhy s PRO 484 N 0.39 4.15 -0.10 2.72 0.04 -1.26 -4.91 135.00 136.04 2bhy s PRO 484 Ca 0.45 2.54 -0.29 0.00 0.04 0.00 0.00 61.00 63.74 2bhy s PRO 484 Cb -0.21 -3.09 -0.05 0.00 0.04 0.00 0.00 34.50 31.18 2bhy s PRO 484 CO 0.26 -0.71 1.76 0.34 0.04 0.00 0.00 177.00 178.69 2bhy s ASP 485 N 1.14 6.42 0.56 6.66 -1.08 -1.26 -4.87 116.67 124.25 2bhy s ASP 485 Ca 0.73 2.11 0.25 0.00 -0.52 0.00 0.00 52.55 55.12 2bhy s ASP 485 Cb -0.48 -2.53 1.61 0.00 -1.46 0.00 0.00 42.92 40.06 2bhy s ASP 485 CO 0.32 -1.15 2.21 1.55 0.52 0.00 0.00 175.17 178.63 2bhy h PRO 486 N 10.63 0.00 -0.00 4.34 0.13 -1.91 -1.78 132.00 143.41 2bhy h PRO 486 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2bhy h PRO 486 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2bhy h PRO 486 CO 0.97 0.00 -0.19 1.04 -0.23 0.00 0.00 178.00 179.59 2bhy n GLN 487 N -4.11 0.02 -2.51 0.86 1.13 -1.26 -0.83 117.38 110.69 2bhy n GLN 487 Ca -0.03 -0.01 -0.41 0.00 -1.94 0.00 0.00 57.00 54.62 2bhy n GLN 487 Cb 0.10 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.91 2bhy n GLN 487 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bhy s ALA 488 N -2.98 3.37 0.32 -1.58 0.00 -0.67 -4.84 121.76 115.39 2bhy s ALA 488 Ca 0.13 0.82 0.06 0.00 0.00 0.00 0.00 51.96 52.97 2bhy s ALA 488 Cb 0.18 -3.35 0.73 0.00 0.00 0.00 0.00 23.12 20.68 2bhy s ALA 488 CO 0.59 -0.20 1.84 0.93 0.00 0.00 0.00 175.76 178.92 2bhy h GLU 489 N 5.00 0.77 -0.51 0.00 5.08 -1.89 -1.96 114.58 121.08 2bhy h GLU 489 Ca -0.44 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 57.90 2bhy h GLU 489 Cb 1.21 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 2bhy h GLU 489 CO 0.72 0.51 0.34 0.37 -1.00 0.00 0.00 179.01 179.95 2bhy h GLN 490 N 0.80 0.56 -0.65 2.33 5.75 -1.93 -0.46 115.11 121.52 2bhy h GLN 490 Ca 0.50 -0.03 -0.08 0.00 -0.15 0.00 0.00 58.65 58.88 2bhy h GLN 490 Cb 0.71 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 29.11 2bhy h GLN 490 CO -0.26 0.37 0.08 1.15 -2.65 0.00 0.00 178.83 177.51 2bhy h THR 491 N 0.58 1.26 0.25 2.39 2.02 -1.61 0.39 112.91 118.19 2bhy h THR 491 Ca 0.20 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.30 2bhy h THR 491 Cb 0.10 0.69 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2bhy h THR 491 CO -0.05 0.40 -0.12 0.15 0.37 0.00 0.00 175.52 176.27 2bhy h PHE 492 N 1.01 -0.31 -0.71 3.16 3.57 -1.43 -3.16 116.94 119.07 2bhy h PHE 492 Ca 0.19 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 2bhy h PHE 492 Cb 0.48 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.29 2bhy h PHE 492 CO 0.04 -0.04 0.40 -0.07 -2.23 0.00 0.00 178.31 176.40 2bhy h LEU 493 N -0.56 0.87 -0.93 0.59 3.38 -0.88 -1.39 115.31 116.38 2bhy h LEU 493 Ca -0.03 -0.06 0.26 0.00 0.09 0.00 0.00 57.88 58.14 2bhy h LEU 493 Cb 0.41 -0.22 -0.14 0.00 0.09 0.00 0.00 40.66 40.80 2bhy h LEU 493 CO 0.06 0.69 0.39 0.78 0.09 0.00 0.00 178.44 180.44 2bhy h ASN 494 N 0.98 0.26 0.31 -0.43 2.35 -0.25 -2.32 115.58 116.48 2bhy h ASN 494 Ca 0.25 0.19 0.00 0.00 -0.55 0.00 0.00 56.30 56.19 2bhy h ASN 494 Cb 0.00 0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2bhy h ASN 494 CO -0.04 -0.12 -0.10 -1.20 -1.65 0.00 0.00 177.43 174.32 2bhy n SER 495 N -5.13 0.53 -4.75 5.81 7.64 -0.53 -4.30 113.62 112.90 2bhy n SER 495 Ca 0.25 -0.67 -0.41 0.00 1.01 0.00 0.00 58.87 59.05 2bhy n SER 495 Cb 0.79 -0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.91 2bhy n SER 495 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2bhy s LYS 496 N -2.42 4.22 0.39 1.43 -0.14 -0.88 -4.82 119.74 117.52 2bhy s LYS 496 Ca 0.30 2.40 -0.26 0.00 -1.36 0.00 0.00 55.97 57.05 2bhy s LYS 496 Cb 0.20 -3.07 -0.09 0.00 -1.68 0.00 0.00 37.83 33.19 2bhy s LYS 496 CO 0.46 -0.48 1.26 -0.51 -0.76 0.00 0.00 175.35 175.33 2bhy s LEU 497 N -0.65 4.24 -0.48 3.17 1.43 -0.76 -4.88 118.68 120.75 2bhy s LEU 497 Ca 0.59 2.57 -0.11 0.00 -1.03 0.00 0.00 54.13 56.15 2bhy s LEU 497 Cb -0.44 -3.89 0.12 0.00 0.03 0.00 0.00 46.19 42.00 2bhy s LEU 497 CO 0.47 -0.75 0.37 0.21 0.23 0.00 0.00 176.35 176.88 2bhy s ASN 498 N -0.81 5.83 0.24 2.29 3.84 -1.26 -4.75 114.94 120.32 2bhy s ASN 498 Ca 0.56 -1.82 0.00 0.00 0.21 0.00 0.00 52.86 51.81 2bhy s ASN 498 Cb -0.36 -2.06 0.26 0.00 -0.55 0.00 0.00 41.25 38.54 2bhy s ASN 498 CO 0.47 -0.71 1.61 -0.50 -2.79 0.00 0.00 177.10 175.17 2bhy h TRP 499 N 8.56 0.58 0.00 0.43 4.06 -1.95 -3.11 115.95 124.52 2bhy h TRP 499 Ca -0.24 -0.17 -0.07 0.00 2.06 0.00 0.00 58.89 60.48 2bhy h TRP 499 Cb 1.08 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 29.11 2bhy h TRP 499 CO 0.66 0.82 -0.33 0.00 -3.56 0.00 0.00 178.44 176.03 2bhy h ALA 500 N 1.16 1.18 0.00 1.49 0.00 -2.03 -3.14 119.26 117.92 2bhy h ALA 500 Ca 0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 2bhy h ALA 500 Cb 0.89 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2bhy h ALA 500 CO 0.08 0.41 -0.11 1.05 0.00 0.00 0.00 179.25 180.67 2bhy h GLU 501 N 0.00 0.00 0.00 0.00 4.11 -1.95 -2.59 114.58 114.16 2bhy h GLU 501 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2bhy h GLU 501 Cb 0.71 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.96 2bhy h GLU 501 CO 0.04 0.11 0.00 0.07 0.07 0.00 0.00 179.01 179.31 2bhy h ARG 502 N 0.00 0.00 -0.64 1.06 0.11 -1.73 -2.73 114.38 110.44 2bhy h ARG 502 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2bhy h ARG 502 Cb 0.38 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.46 2bhy h ARG 502 CO 0.01 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.47 2bhy n GLU 503 N -2.72 3.03 -3.95 0.08 1.02 -0.97 -2.89 120.64 114.25 2bhy n GLU 503 Ca -0.01 -1.94 -0.08 0.00 -0.02 0.00 0.00 57.16 55.11 2bhy n GLU 503 Cb 0.14 -1.78 -0.08 0.00 -0.02 0.00 0.00 31.44 29.70 2bhy n GLU 503 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2bhy s GLY 504 N -0.68 0.24 0.00 0.62 0.00 -1.03 -4.90 107.32 101.57 2bhy s GLY 504 Ca 0.34 -0.84 0.00 0.00 0.00 0.00 0.00 44.72 44.23 2bhy s GLY 504 CO 0.14 -0.99 0.00 0.61 0.00 0.00 0.00 173.10 172.87 2bhy n GLY 505 N 0.06 2.20 0.26 0.20 0.00 -1.26 -1.63 105.19 105.02 2bhy n GLY 505 Ca -0.15 -0.46 0.15 0.00 0.00 0.00 0.00 46.02 45.56 2bhy n GLY 505 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bhy h GLU 506 N 0.00 0.00 -0.19 1.61 4.39 -1.96 -2.32 114.58 116.12 2bhy h GLU 506 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 2bhy h GLU 506 Cb 0.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.64 2bhy h GLU 506 CO 0.00 0.09 0.00 0.45 -1.16 0.00 0.00 179.01 178.39 2bhy h HIS 507 N 0.00 0.36 -0.61 4.33 3.86 -1.66 -1.35 115.15 120.09 2bhy h HIS 507 Ca -0.00 -0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 59.11 2bhy h HIS 507 Cb 0.54 -0.09 -0.03 0.00 1.06 0.00 0.00 27.41 28.88 2bhy h HIS 507 CO 0.00 0.53 0.21 0.00 0.86 0.00 0.00 177.93 179.53 2bhy h ALA 508 N 0.79 1.24 -0.66 2.45 0.00 -1.02 -1.24 119.26 120.82 2bhy h ALA 508 Ca 0.05 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 2bhy h ALA 508 Cb 0.38 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2bhy h ALA 508 CO 0.01 0.55 0.18 -0.09 0.00 0.00 0.00 179.25 179.90 2bhy h ARG 509 N 0.88 1.04 -0.40 0.00 2.43 -1.33 -0.78 114.38 116.21 2bhy h ARG 509 Ca 0.20 -0.24 -0.07 0.00 -0.81 0.00 0.00 59.98 59.06 2bhy h ARG 509 Cb 0.22 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 2bhy h ARG 509 CO -0.01 0.92 -0.03 1.15 -1.51 0.00 0.00 179.97 180.48 2bhy h THR 510 N 0.97 1.27 -0.61 0.20 2.02 -1.04 -2.39 112.91 113.33 2bhy h THR 510 Ca 0.21 -1.07 0.01 0.00 0.77 0.00 0.00 66.41 66.33 2bhy h THR 510 Cb 0.33 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2bhy h THR 510 CO -0.00 0.36 0.39 0.25 0.37 0.00 0.00 175.52 176.89 2bhy h LEU 511 N 0.55 0.67 -1.16 2.58 5.85 -0.57 -0.52 115.31 122.71 2bhy h LEU 511 Ca 0.11 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 2bhy h LEU 511 Cb 0.52 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 2bhy h LEU 511 CO 0.03 0.48 0.20 -0.09 -0.34 0.00 0.00 178.44 178.72 2bhy h ARG 512 N 0.80 0.79 -0.37 1.25 2.43 -1.02 -0.63 114.38 117.63 2bhy h ARG 512 Ca 0.23 -0.12 -0.02 0.00 -0.81 0.00 0.00 59.98 59.25 2bhy h ARG 512 Cb -0.06 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.33 2bhy h ARG 512 CO -0.06 0.66 0.13 1.25 -1.51 0.00 0.00 179.97 180.44 2bhy h LEU 513 N 0.78 0.52 -0.66 3.80 5.85 -0.84 -0.98 115.31 123.77 2bhy h LEU 513 Ca 0.18 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2bhy h LEU 513 Cb 0.17 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2bhy h LEU 513 CO -0.02 0.56 0.44 1.88 -0.34 0.00 0.00 178.44 180.96 2bhy h TYR 514 N 0.45 0.83 -0.71 1.25 -1.99 -0.64 0.38 116.97 116.53 2bhy h TYR 514 Ca 0.12 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.88 2bhy h TYR 514 Cb 0.21 -0.28 -0.04 0.00 2.00 0.00 0.00 36.73 38.63 2bhy h TYR 514 CO 0.00 0.52 0.47 0.00 -0.00 0.00 0.00 178.16 179.15 2bhy h ARG 515 N 0.89 0.92 -0.40 4.88 3.08 -1.01 0.04 114.38 122.79 2bhy h ARG 515 Ca 0.24 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.18 2bhy h ARG 515 Cb -0.10 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 2bhy h ARG 515 CO -0.05 0.61 0.03 -0.44 -1.07 0.00 0.00 179.97 179.04 2bhy h ASP 516 N 0.95 0.66 -0.35 7.04 3.32 -0.61 -1.13 116.42 126.30 2bhy h ASP 516 Ca 0.27 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 2bhy h ASP 516 Cb -0.09 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 2bhy h ASP 516 CO -0.07 0.78 0.18 -0.07 -1.72 0.00 0.00 179.24 178.34 2bhy h LEU 517 N 0.51 0.45 -1.41 1.55 3.38 -0.72 0.13 115.31 119.20 2bhy h LEU 517 Ca 0.12 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2bhy h LEU 517 Cb 0.43 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2bhy h LEU 517 CO 0.01 0.44 -0.27 -0.07 0.09 0.00 0.00 178.44 178.64 2bhy h LEU 518 N 0.43 0.03 -0.29 1.67 3.38 -0.88 -0.70 115.31 118.95 2bhy h LEU 518 Ca 0.12 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.96 2bhy h LEU 518 Cb 0.10 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2bhy h LEU 518 CO -0.02 0.31 -0.30 -0.09 0.09 0.00 0.00 178.44 178.43 2bhy h ARG 519 N 0.03 0.72 -0.90 1.13 2.43 -0.98 -2.24 114.38 114.56 2bhy h ARG 519 Ca 0.00 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 2bhy h ARG 519 Cb 0.50 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.02 2bhy h ARG 519 CO 0.04 1.00 0.58 1.25 -1.51 0.00 0.00 179.97 181.32 2bhy h LEU 520 N 0.47 1.06 -0.62 3.80 5.85 -0.43 -0.47 115.31 124.97 2bhy h LEU 520 Ca 0.05 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2bhy h LEU 520 Cb 0.87 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.61 2bhy h LEU 520 CO 0.07 0.79 0.28 -0.09 -0.34 0.00 0.00 178.44 179.15 2bhy h ARG 521 N 1.23 0.91 -0.30 1.25 2.43 -1.06 -0.29 114.38 118.55 2bhy h ARG 521 Ca 0.33 -0.15 -0.15 0.00 -0.81 0.00 0.00 59.98 59.20 2bhy h ARG 521 Cb -0.11 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.29 2bhy h ARG 521 CO -0.07 0.75 -0.38 -0.09 -1.51 0.00 0.00 179.97 178.66 2bhy h ARG 522 N 0.86 0.79 0.00 0.20 2.43 -1.10 -3.38 114.38 114.17 2bhy h ARG 522 Ca 0.21 -0.45 -0.31 0.00 -0.81 0.00 0.00 59.98 58.63 2bhy h ARG 522 Cb 0.16 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.68 2bhy h ARG 522 CO -0.02 1.08 -2.22 0.39 -1.51 0.00 0.00 179.97 177.68 2bhy n GLU 523 N -4.16 0.68 -2.48 0.20 1.02 -0.21 -4.93 120.64 110.76 2bhy n GLU 523 Ca -0.04 0.01 -0.43 0.00 -0.02 0.00 0.00 57.16 56.68 2bhy n GLU 523 Cb 0.53 -1.56 -0.02 0.00 -0.02 0.00 0.00 31.44 30.37 2bhy n GLU 523 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2bhy s ASP 524 N -5.44 7.01 0.48 1.62 2.15 -0.13 -4.91 116.67 117.45 2bhy s ASP 524 Ca -0.09 1.66 0.23 0.00 0.43 0.00 0.00 52.55 54.78 2bhy s ASP 524 Cb 0.07 -2.54 1.24 0.00 -0.30 0.00 0.00 42.92 41.39 2bhy s ASP 524 CO 0.84 -0.69 2.00 1.55 -0.17 0.00 0.00 175.17 178.70 2bhy h PRO 525 N 7.86 0.00 0.22 4.34 0.13 -1.91 -2.77 132.00 139.86 2bhy h PRO 525 Ca -0.27 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.56 2bhy h PRO 525 Cb 1.11 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.27 2bhy h PRO 525 CO 0.95 0.18 -1.35 0.28 -0.23 0.00 0.00 178.00 177.82 2bhy h VAL 526 N 0.00 1.29 0.00 1.56 2.07 -1.91 -3.26 116.25 116.01 2bhy h VAL 526 Ca -0.00 -2.63 0.00 0.00 0.82 0.00 0.00 66.70 64.89 2bhy h VAL 526 Cb 0.43 3.04 0.00 0.00 -1.52 0.00 0.00 31.29 33.24 2bhy h VAL 526 CO 0.02 0.79 0.00 0.18 0.02 0.00 0.00 177.57 178.58 2bhy n LEU 527 N -3.82 0.45 0.14 2.57 4.77 -1.07 -1.23 117.00 118.81 2bhy n LEU 527 Ca -0.17 0.66 0.10 0.00 -0.03 0.00 0.00 56.01 56.57 2bhy n LEU 527 Cb 1.03 -0.66 0.51 0.00 -2.33 0.00 0.00 43.42 41.97 2bhy n LEU 527 CO 0.56 -0.67 0.81 1.41 -1.33 0.00 0.00 177.39 178.18 2bhy n HIS 528 N -2.05 0.69 -1.55 -1.77 8.25 -1.07 -4.79 115.22 112.94 2bhy n HIS 528 Ca 0.01 0.32 -0.51 0.00 -0.26 0.00 0.00 57.72 57.28 2bhy n HIS 528 Cb 0.11 -1.02 -0.05 0.00 1.12 0.00 0.00 29.99 30.16 2bhy n HIS 528 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 2bhy n ASN 529 N -2.18 0.96 -0.85 0.41 5.15 -0.37 -4.90 115.26 113.48 2bhy n ASN 529 Ca 0.00 1.14 0.04 0.00 -0.60 0.00 0.00 54.58 55.17 2bhy n ASN 529 Cb 0.11 -1.15 0.08 0.00 -0.53 0.00 0.00 39.78 38.29 2bhy n ASN 529 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2bhy n ARG 530 N 1.74 0.57 -4.51 1.20 5.12 -1.26 -4.59 116.66 114.93 2bhy n ARG 530 Ca 0.16 -2.18 -0.33 0.00 -1.93 0.00 0.00 57.85 53.57 2bhy n ARG 530 Cb 0.22 -0.72 -0.16 0.00 -1.16 0.00 0.00 32.46 30.64 2bhy n ARG 530 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2bhy s GLN 531 N -1.21 3.15 0.52 5.56 -0.21 -1.26 -3.91 119.66 122.30 2bhy s GLN 531 Ca 0.27 -0.78 0.18 0.00 0.02 0.00 0.00 55.36 55.05 2bhy s GLN 531 Cb 0.28 -2.58 1.32 0.00 1.00 0.00 0.00 33.01 33.03 2bhy s GLN 531 CO -0.08 -0.02 2.15 0.00 -2.12 0.00 0.00 175.29 175.22 2bhy h ARG 532 N 7.40 0.00 -0.70 2.91 3.08 -1.93 -1.98 114.38 123.15 2bhy h ARG 532 Ca -0.34 0.00 0.20 0.00 0.07 0.00 0.00 59.98 59.91 2bhy h ARG 532 Cb 1.18 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 2bhy h ARG 532 CO 0.57 0.02 0.53 1.49 -1.07 0.00 0.00 179.97 181.52 2bhy h GLU 533 N 0.00 0.00 -0.17 0.04 4.81 -1.99 -2.11 114.58 115.16 2bhy h GLU 533 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2bhy h GLU 533 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2bhy h GLU 533 CO 0.00 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.37 2bhy n ASN 534 N -4.20 2.96 -4.33 1.04 3.02 -0.75 -4.89 115.26 108.10 2bhy n ASN 534 Ca 0.14 -1.94 -0.33 0.00 -0.03 0.00 0.00 54.58 52.42 2bhy n ASN 534 Cb 0.80 -0.10 -0.14 0.00 -0.61 0.00 0.00 39.78 39.73 2bhy n ASN 534 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2bhy s LEU 535 N -1.78 2.70 0.15 3.41 2.96 -0.79 -1.72 118.68 123.61 2bhy s LEU 535 Ca 0.33 -0.37 0.06 0.00 -0.22 0.00 0.00 54.13 53.93 2bhy s LEU 535 Cb 0.21 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 45.23 2bhy s LEU 535 CO 0.31 0.11 -0.13 0.42 -1.32 0.00 0.00 176.35 175.74 2bhy s THR 536 N 0.70 1.36 0.07 3.68 -4.23 -0.15 -4.96 115.64 112.11 2bhy s THR 536 Ca -0.06 -1.96 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 2bhy s THR 536 Cb -0.15 -1.76 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 2bhy s THR 536 CO 0.02 -0.58 -0.01 0.42 -0.54 0.00 0.00 174.62 173.93 2bhy s THR 537 N -2.77 0.19 0.01 3.99 -4.23 -1.26 -0.30 115.64 111.27 2bhy s THR 537 Ca 0.15 -1.84 -0.03 0.00 -1.18 0.00 0.00 61.69 58.79 2bhy s THR 537 Cb -0.01 -1.67 0.01 0.00 1.34 0.00 0.00 72.50 72.17 2bhy s THR 537 CO 0.03 -0.85 0.15 0.61 -0.54 0.00 0.00 174.62 174.02 2bhy n GLY 538 N 0.05 0.91 3.24 3.99 0.00 -0.61 -4.98 105.19 107.79 2bhy n GLY 538 Ca -0.12 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 2bhy n GLY 538 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2bhy s HIS 539 N -4.28 0.02 -0.24 1.61 -3.43 -1.26 -1.26 115.29 106.46 2bhy s HIS 539 Ca 0.03 -0.39 -0.03 0.00 -0.80 0.00 0.00 55.06 53.87 2bhy s HIS 539 Cb -0.00 0.05 0.08 0.00 -1.43 0.00 0.00 32.58 31.27 2bhy s HIS 539 CO 0.00 -0.58 0.08 0.34 -2.00 0.00 0.00 174.74 172.58 2bhy s ASP 540 N -2.76 3.15 1.92 7.38 2.15 -0.09 -4.98 116.67 123.44 2bhy s ASP 540 Ca 0.03 -1.04 0.00 0.00 0.43 0.00 0.00 52.55 51.97 2bhy s ASP 540 Cb 0.03 -0.49 0.00 0.00 -0.30 0.00 0.00 42.92 42.16 2bhy s ASP 540 CO -0.11 -0.37 0.00 0.61 -0.17 0.00 0.00 175.17 175.13 2bhy n GLY 541 N 5.12 3.81 0.98 2.66 0.00 -1.26 -1.31 105.19 115.19 2bhy n GLY 541 Ca -0.06 -0.01 0.08 0.00 0.00 0.00 0.00 46.02 46.03 2bhy n GLY 541 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bhy n ASP 542 N 7.16 2.83 -4.61 1.61 8.00 -1.26 -4.59 116.55 125.69 2bhy n ASP 542 Ca 0.00 -2.00 -0.38 0.00 0.71 0.00 0.00 54.79 53.11 2bhy n ASP 542 Cb 0.00 -0.35 -0.10 0.00 -0.02 0.00 0.00 41.12 40.65 2bhy n ASP 542 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2bhy s VAL 543 N -1.30 5.24 0.04 2.53 1.01 -0.43 -0.71 120.40 126.78 2bhy s VAL 543 Ca 0.35 0.42 -0.20 0.00 0.00 0.00 0.00 61.98 62.55 2bhy s VAL 543 Cb 0.18 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.88 2bhy s VAL 543 CO 0.24 0.22 0.60 -0.22 0.00 0.00 0.00 175.10 175.94 2bhy s LEU 544 N 1.77 4.47 0.04 3.92 2.96 -0.35 -0.91 118.68 130.59 2bhy s LEU 544 Ca 0.12 1.24 0.08 0.00 -0.22 0.00 0.00 54.13 55.35 2bhy s LEU 544 Cb -0.15 -2.94 -0.03 0.00 0.50 0.00 0.00 46.19 43.57 2bhy s LEU 544 CO 0.09 0.18 -0.22 -1.66 -1.32 0.00 0.00 176.35 173.42 2bhy s TRP 545 N -0.62 1.94 -0.11 5.38 1.48 -0.38 -0.86 118.94 125.76 2bhy s TRP 545 Ca 0.31 -0.38 -0.01 0.00 -1.06 0.00 0.00 56.10 54.95 2bhy s TRP 545 Cb -0.19 -1.16 0.03 0.00 -1.16 0.00 0.00 33.47 30.99 2bhy s TRP 545 CO 0.19 0.09 -0.01 0.08 -4.06 0.00 0.00 176.95 173.23 2bhy s VAL 546 N -0.78 0.60 -0.10 -0.66 1.01 0.15 -1.57 120.40 119.05 2bhy s VAL 546 Ca 0.08 -0.14 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2bhy s VAL 546 Cb -0.09 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 2bhy s VAL 546 CO 0.02 0.20 -0.14 -0.60 0.00 0.00 0.00 175.10 174.58 2bhy s ARG 547 N 1.87 3.04 -0.13 2.72 3.52 0.59 -0.44 118.95 130.12 2bhy s ARG 547 Ca 0.04 -0.69 0.02 0.00 -0.13 0.00 0.00 55.73 54.97 2bhy s ARG 547 Cb -0.13 -2.53 0.00 0.00 -1.56 0.00 0.00 34.95 30.73 2bhy s ARG 547 CO -0.07 0.38 -0.20 0.99 -0.81 0.00 0.00 175.30 175.59 2bhy s THR 548 N -0.07 2.33 -0.12 4.11 2.01 -0.19 -0.98 115.64 122.74 2bhy s THR 548 Ca -0.02 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.08 2bhy s THR 548 Cb -0.14 -1.94 0.02 0.00 0.01 0.00 0.00 72.50 70.45 2bhy s THR 548 CO 0.04 0.54 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.70 2bhy s VAL 549 N 0.63 1.34 0.33 3.82 1.01 -0.70 -1.17 120.40 125.66 2bhy s VAL 549 Ca -0.10 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 61.40 2bhy s VAL 549 Cb -0.16 -1.28 -0.01 0.00 0.00 0.00 0.00 36.38 34.93 2bhy s VAL 549 CO 0.03 0.42 0.14 0.35 0.00 0.00 0.00 175.10 176.04 2bhy n THR 550 N 4.62 0.00 0.33 3.92 -2.24 -0.36 -4.71 114.28 115.85 2bhy n THR 550 Ca -0.16 -1.99 0.21 0.00 -2.27 0.00 0.00 64.05 59.84 2bhy n THR 550 Cb 0.50 0.77 1.10 0.00 -2.10 0.00 0.00 70.33 70.61 2bhy n THR 550 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2bhy h GLY 551 N 1.42 0.00 1.43 3.38 0.00 -2.00 -2.11 103.07 105.20 2bhy h GLY 551 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2bhy h GLY 551 CO 0.39 0.00 -0.32 0.00 0.00 0.00 0.00 176.54 176.61 2bhy n ALA 552 N -2.06 2.94 0.00 3.60 0.00 -1.26 -5.05 120.51 118.68 2bhy n ALA 552 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.19 2bhy n ALA 552 Cb 0.15 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.33 2bhy n ALA 552 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhy n GLY 553 N 1.45 0.88 2.91 0.00 0.00 -0.79 -4.79 105.19 104.85 2bhy n GLY 553 Ca 0.06 -1.91 -0.15 0.00 0.00 0.00 0.00 46.02 44.01 2bhy n GLY 553 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bhy s GLU 554 N -1.68 0.29 0.06 1.61 2.12 -1.26 -1.22 118.70 118.61 2bhy s GLU 554 Ca 0.00 -0.09 0.07 0.00 0.36 0.00 0.00 54.97 55.31 2bhy s GLU 554 Cb 0.00 -0.30 -0.03 0.00 0.26 0.00 0.00 34.13 34.06 2bhy s GLU 554 CO 0.00 0.04 -0.18 1.03 -0.54 0.00 0.00 175.26 175.60 2bhy s ARG 555 N 0.11 1.15 -0.07 4.30 1.81 -0.31 -4.39 118.95 121.54 2bhy s ARG 555 Ca -0.01 -0.94 0.00 0.00 -1.72 0.00 0.00 55.73 53.06 2bhy s ARG 555 Cb -0.03 -1.26 0.02 0.00 -0.45 0.00 0.00 34.95 33.23 2bhy s ARG 555 CO -0.00 0.31 -0.05 0.08 -0.68 0.00 0.00 175.30 174.96 2bhy s VAL 556 N -0.94 0.66 -0.08 3.52 1.01 -0.39 -1.02 120.40 123.16 2bhy s VAL 556 Ca 0.05 -0.13 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 2bhy s VAL 556 Cb -0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 2bhy s VAL 556 CO 0.02 0.28 0.52 -0.22 0.00 0.00 0.00 175.10 175.70 2bhy s LEU 557 N 1.35 4.32 -0.03 3.92 1.98 0.42 -1.20 118.68 129.44 2bhy s LEU 557 Ca -0.04 0.93 0.07 0.00 -2.89 0.00 0.00 54.13 52.21 2bhy s LEU 557 Cb -0.14 -2.77 -0.02 0.00 0.66 0.00 0.00 46.19 43.93 2bhy s LEU 557 CO -0.03 0.04 -0.24 -0.76 -1.89 0.00 0.00 176.35 173.47 2bhy s LEU 558 N 0.33 2.13 -0.09 -0.68 1.43 -0.33 -0.68 118.68 120.79 2bhy s LEU 558 Ca 0.28 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2bhy s LEU 558 Cb -0.16 -1.37 0.03 0.00 0.03 0.00 0.00 46.19 44.72 2bhy s LEU 558 CO 0.13 0.31 0.00 0.86 0.23 0.00 0.00 176.35 177.88 2bhy s TRP 559 N -0.53 0.76 -0.66 0.29 -0.00 -0.04 -1.36 118.94 117.40 2bhy s TRP 559 Ca 0.07 -0.31 -0.23 0.00 -0.00 0.00 0.00 56.10 55.63 2bhy s TRP 559 Cb -0.11 -0.86 0.06 0.00 -0.00 0.00 0.00 33.47 32.57 2bhy s TRP 559 CO 0.00 -0.39 1.01 1.21 -0.00 0.00 0.00 176.95 178.78 2bhy s ASN 560 N 1.94 6.18 0.05 5.86 2.47 -0.05 -1.21 114.94 130.19 2bhy s ASN 560 Ca 0.04 -0.88 0.28 0.00 0.42 0.00 0.00 52.86 52.72 2bhy s ASN 560 Cb -0.13 -2.44 1.11 0.00 -1.45 0.00 0.00 41.25 38.34 2bhy s ASN 560 CO -0.06 -1.48 1.87 0.18 -3.72 0.00 0.00 177.10 173.89 2bhy n LEU 561 N 7.92 0.20 0.00 3.21 7.99 0.11 -0.35 117.00 136.08 2bhy n LEU 561 Ca -0.03 0.52 -0.28 0.00 -0.01 0.00 0.00 56.01 56.22 2bhy n LEU 561 Cb 0.46 -0.46 0.22 0.00 -0.11 0.00 0.00 43.42 43.53 2bhy n LEU 561 CO 0.65 -0.06 0.63 0.61 -1.51 0.00 0.00 177.39 177.72 2bhy n GLY 562 N 1.38 -2.40 0.31 -0.72 0.00 -1.24 -4.68 105.19 97.83 2bhy n GLY 562 Ca 0.06 -1.55 0.11 0.00 0.00 0.00 0.00 46.02 44.64 2bhy n GLY 562 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bhy n GLN 563 N -4.34 0.77 -3.81 1.61 1.13 -1.26 -3.48 117.38 108.00 2bhy n GLN 563 Ca 0.14 -0.62 -0.25 0.00 -1.94 0.00 0.00 57.00 54.33 2bhy n GLN 563 Cb 0.54 -1.49 -0.01 0.00 0.11 0.00 0.00 30.24 29.39 2bhy n GLN 563 CO 0.00 0.00 0.00 -0.40 -1.44 0.00 0.00 177.06 175.22 2bhy n ASP 564 N -0.57 2.76 -4.79 1.08 5.75 -1.26 -4.68 116.55 114.84 2bhy n ASP 564 Ca 0.08 -2.80 -0.37 0.00 -0.01 0.00 0.00 54.79 51.70 2bhy n ASP 564 Cb 0.41 0.05 -0.07 0.00 -1.03 0.00 0.00 41.12 40.48 2bhy n ASP 564 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2bhy s THR 565 N -2.53 5.34 -0.09 2.12 2.01 -1.26 -2.59 115.64 118.64 2bhy s THR 565 Ca 0.22 0.42 0.02 0.00 0.31 0.00 0.00 61.69 62.66 2bhy s THR 565 Cb -0.02 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 68.96 2bhy s THR 565 CO 0.14 0.50 -0.14 -0.13 -0.69 0.00 0.00 174.62 174.29 2bhy s ARG 566 N -0.24 2.03 0.12 4.92 1.81 -0.27 -4.99 118.95 122.33 2bhy s ARG 566 Ca 0.15 -0.51 -0.27 0.00 -1.72 0.00 0.00 55.73 53.39 2bhy s ARG 566 Cb -0.13 -1.70 -0.07 0.00 -0.45 0.00 0.00 34.95 32.61 2bhy s ARG 566 CO 0.04 -0.01 0.84 0.00 -0.68 0.00 0.00 175.30 175.49 2bhy s ALA 567 N 0.83 3.36 0.36 2.13 0.00 -1.26 -0.44 121.76 126.73 2bhy s ALA 567 Ca -0.11 0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.32 2bhy s ALA 567 Cb -0.15 -3.09 0.70 0.00 0.00 0.00 0.00 23.12 20.57 2bhy s ALA 567 CO 0.01 0.13 2.00 0.28 0.00 0.00 0.00 175.76 178.18 2bhy h VAL 568 N 3.73 1.10 0.00 0.00 2.07 -1.60 -1.55 116.25 120.00 2bhy h VAL 568 Ca -0.45 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2bhy h VAL 568 Cb 1.21 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2bhy h VAL 568 CO 0.69 0.14 0.00 0.00 0.02 0.00 0.00 177.57 178.43 2bhy h ALA 569 N 1.62 1.00 -0.17 1.67 0.00 -1.93 -2.15 119.26 119.30 2bhy h ALA 569 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2bhy h ALA 569 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2bhy h ALA 569 CO -0.07 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.57 2bhy n GLU 570 N -3.07 2.36 -2.57 0.00 1.02 -0.59 -4.90 120.64 112.88 2bhy n GLU 570 Ca -0.01 -2.00 -0.42 0.00 -0.02 0.00 0.00 57.16 54.70 2bhy n GLU 570 Cb 0.17 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.08 2bhy n GLU 570 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2bhy s VAL 571 N -1.81 4.50 -0.21 2.62 1.01 -0.81 -4.99 120.40 120.71 2bhy s VAL 571 Ca 0.33 1.79 -0.29 0.00 0.00 0.00 0.00 61.98 63.81 2bhy s VAL 571 Cb 0.21 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.44 2bhy s VAL 571 CO 0.31 0.06 1.02 -0.54 0.00 0.00 0.00 175.10 175.94 2bhy s LYS 572 N 1.68 4.28 0.05 2.72 1.02 -1.26 -5.02 119.74 123.20 2bhy s LYS 572 Ca 0.53 1.33 0.05 0.00 0.02 0.00 0.00 55.97 57.90 2bhy s LYS 572 Cb -0.23 -3.63 -0.02 0.00 -0.52 0.00 0.00 37.83 33.43 2bhy s LYS 572 CO 0.24 -0.57 -0.13 -0.51 -0.92 0.00 0.00 175.35 173.45 2bhy s LEU 573 N 3.00 2.21 -0.01 3.17 1.43 -1.26 -4.68 118.68 122.54 2bhy s LEU 573 Ca 0.44 -0.50 0.01 0.00 -1.03 0.00 0.00 54.13 53.05 2bhy s LEU 573 Cb -0.15 -0.52 0.04 0.00 0.03 0.00 0.00 46.19 45.59 2bhy s LEU 573 CO 0.08 -0.02 0.65 -0.81 0.23 0.00 0.00 176.35 176.48 2bhy n PRO 574 N 1.71 1.19 -3.98 1.29 -0.04 -1.26 -4.80 135.00 129.11 2bhy n PRO 574 Ca -0.19 -0.16 -0.09 0.00 -0.04 0.00 0.00 63.50 63.02 2bhy n PRO 574 Cb 0.55 -1.45 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 2bhy n PRO 574 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2bhy s PHE 575 N -1.25 0.28 -0.16 0.54 -0.12 -1.26 -5.13 117.98 110.88 2bhy s PHE 575 Ca 0.03 -0.66 -0.28 0.00 -0.05 0.00 0.00 56.93 55.98 2bhy s PHE 575 Cb 0.02 0.27 -0.01 0.00 -0.63 0.00 0.00 43.02 42.67 2bhy s PHE 575 CO 0.01 -1.03 0.93 0.99 -0.05 0.00 0.00 175.22 176.07 2bhy s THR 576 N -4.00 4.81 0.24 -4.49 2.01 -1.26 -5.00 115.64 107.95 2bhy s THR 576 Ca 0.21 1.86 -0.30 0.00 0.31 0.00 0.00 61.69 63.77 2bhy s THR 576 Cb -0.01 -4.23 -0.10 0.00 0.01 0.00 0.00 72.50 68.17 2bhy s THR 576 CO 0.09 -0.02 1.36 0.54 -0.69 0.00 0.00 174.62 175.90 2bhy s VAL 577 N 2.28 2.90 0.79 3.82 0.11 -1.26 -4.99 120.40 124.05 2bhy s VAL 577 Ca 0.43 0.77 -0.14 0.00 -2.93 0.00 0.00 61.98 60.11 2bhy s VAL 577 Cb -0.17 -3.49 0.07 0.00 -1.53 0.00 0.00 36.38 31.26 2bhy s VAL 577 CO 0.13 0.13 1.20 -2.65 -3.33 0.00 0.00 175.10 170.58 2bhy n PRO 578 N 2.22 0.28 -0.03 1.54 -0.02 -1.26 -4.98 135.00 132.75 2bhy n PRO 578 Ca 0.05 0.17 0.04 0.00 -2.02 0.00 0.00 63.50 61.74 2bhy n PRO 578 Cb 0.41 -2.44 -0.15 0.00 -0.02 0.00 0.00 33.50 31.31 2bhy n PRO 578 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2bhy n ARG 579 N -3.09 0.74 -3.21 -0.52 1.74 -1.21 -4.67 116.66 106.44 2bhy n ARG 579 Ca 0.14 -0.12 -0.39 0.00 -0.77 0.00 0.00 57.85 56.71 2bhy n ARG 579 Cb 0.50 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 30.43 2bhy n ARG 579 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2bhy s ARG 580 N -3.05 4.30 -0.22 5.56 0.52 -0.60 -4.92 118.95 120.54 2bhy s ARG 580 Ca -0.08 0.56 -0.29 0.00 -0.52 0.00 0.00 55.73 55.40 2bhy s ARG 580 Cb 0.10 -3.49 -0.00 0.00 0.52 0.00 0.00 34.95 32.08 2bhy s ARG 580 CO 0.78 0.00 1.18 -1.17 0.02 0.00 0.00 175.30 176.11 2bhy s LEU 581 N 1.10 4.09 -0.23 2.53 0.20 -1.26 -1.11 118.68 124.00 2bhy s LEU 581 Ca 0.28 1.46 0.08 0.00 0.69 0.00 0.00 54.13 56.65 2bhy s LEU 581 Cb -0.16 -3.54 -0.20 0.00 -0.43 0.00 0.00 46.19 41.87 2bhy s LEU 581 CO 0.12 -0.79 -0.10 0.18 -0.29 0.00 0.00 176.35 175.47 2bhy n LEU 582 N 6.70 1.71 -3.66 -0.68 4.77 0.02 -4.96 117.00 120.91 2bhy n LEU 582 Ca 0.13 -0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 55.91 2bhy n LEU 582 Cb 0.46 -0.30 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2bhy n LEU 582 CO 0.56 0.73 0.32 -0.22 -1.33 0.00 0.00 177.39 177.45 2bhy s LEU 583 N -6.02 -0.52 -0.07 2.23 0.20 -1.04 -4.99 118.68 108.47 2bhy s LEU 583 Ca -0.23 1.31 0.05 0.00 0.69 0.00 0.00 54.13 55.94 2bhy s LEU 583 Cb 0.07 2.18 -0.00 0.00 -0.43 0.00 0.00 46.19 48.01 2bhy s LEU 583 CO 0.67 -0.22 -0.22 -2.28 -0.29 0.00 0.00 176.35 174.00 2bhy s HIS 584 N 0.66 2.30 -0.01 5.38 5.65 -1.26 -0.61 115.29 127.40 2bhy s HIS 584 Ca -0.03 -0.81 0.31 0.00 0.25 0.00 0.00 55.06 54.79 2bhy s HIS 584 Cb -0.05 -1.54 1.43 0.00 -1.18 0.00 0.00 32.58 31.24 2bhy s HIS 584 CO -0.04 -0.30 1.93 1.79 -0.65 0.00 0.00 174.74 177.47 2bhy h THR 585 N 5.43 0.00 -0.18 0.89 1.35 -1.50 -0.99 112.91 117.91 2bhy h THR 585 Ca -0.27 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.33 2bhy h THR 585 Cb 1.20 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 68.74 2bhy h THR 585 CO 0.47 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.12 2bhy n GLU 586 N -2.72 2.51 -1.53 4.72 -0.58 -1.26 -4.96 120.64 116.82 2bhy n GLU 586 Ca 0.00 -2.47 -0.11 0.00 -0.42 0.00 0.00 57.16 54.16 2bhy n GLU 586 Cb 0.20 -1.55 -0.03 0.00 -0.57 0.00 0.00 31.44 29.48 2bhy n GLU 586 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2bhy n GLY 587 N -0.55 0.87 3.81 0.62 0.00 -0.38 -4.99 105.19 104.58 2bhy n GLY 587 Ca 0.16 -0.52 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 2bhy n GLY 587 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bhy s ARG 588 N -3.31 3.39 0.04 1.61 0.52 -1.26 -4.98 118.95 114.95 2bhy s ARG 588 Ca 0.00 1.14 0.13 0.00 -0.52 0.00 0.00 55.73 56.47 2bhy s ARG 588 Cb 0.00 -2.05 -0.18 0.00 0.52 0.00 0.00 34.95 33.24 2bhy s ARG 588 CO 0.00 -0.75 0.88 0.93 0.02 0.00 0.00 175.30 176.38 2bhy h GLU 589 N 0.40 0.00 -6.17 3.54 5.08 -1.96 -3.44 114.58 112.02 2bhy h GLU 589 Ca -0.47 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.39 2bhy h GLU 589 Cb 1.21 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 2bhy h GLU 589 CO 0.58 0.54 -0.49 -0.51 -1.00 0.00 0.00 179.01 178.13 2bhy s ASP 590 N -6.16 5.96 -1.41 1.42 1.01 -1.26 -5.01 116.67 111.22 2bhy s ASP 590 Ca -0.02 -0.04 -0.13 0.00 0.71 0.00 0.00 52.55 53.07 2bhy s ASP 590 Cb 0.08 -1.67 0.07 0.00 1.01 0.00 0.00 42.92 42.42 2bhy s ASP 590 CO 0.81 -0.02 2.14 0.18 0.21 0.00 0.00 175.17 178.50 2bhy n LEU 591 N -1.02 6.81 -3.76 1.23 4.77 -1.26 -4.84 117.00 118.92 2bhy n LEU 591 Ca -0.08 -4.27 -0.19 0.00 -0.03 0.00 0.00 56.01 51.44 2bhy n LEU 591 Cb 0.56 -1.61 -0.17 0.00 -2.33 0.00 0.00 43.42 39.87 2bhy n LEU 591 CO 0.45 1.17 -0.36 -0.89 -1.33 0.00 0.00 177.39 176.43 2bhy s THR 592 N 2.50 0.11 -0.42 -5.08 2.01 -1.26 -1.37 115.64 112.13 2bhy s THR 592 Ca 0.45 0.21 -0.10 0.00 0.31 0.00 0.00 61.69 62.56 2bhy s THR 592 Cb 0.13 -0.27 0.07 0.00 0.01 0.00 0.00 72.50 72.45 2bhy s THR 592 CO -0.07 0.17 0.26 -0.76 -0.69 0.00 0.00 174.62 173.54 2bhy s LEU 593 N 1.55 5.14 1.10 4.42 1.43 0.42 -4.98 118.68 127.75 2bhy s LEU 593 Ca -0.02 -1.46 -0.12 0.00 -1.03 0.00 0.00 54.13 51.49 2bhy s LEU 593 Cb -0.13 -2.00 0.23 0.00 0.03 0.00 0.00 46.19 44.33 2bhy s LEU 593 CO -0.03 -0.53 0.96 0.61 0.23 0.00 0.00 176.35 177.59 2bhy n GLY 594 N 4.93 -1.60 3.67 -3.19 0.00 -1.26 -1.12 105.19 106.62 2bhy n GLY 594 Ca -0.10 -1.01 -0.53 0.00 0.00 0.00 0.00 46.02 44.38 2bhy n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhy n ALA 595 N -4.71 -0.11 -0.21 4.61 0.00 -1.07 -1.56 120.51 117.47 2bhy n ALA 595 Ca 0.05 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2bhy n ALA 595 Cb 0.54 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2bhy n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhy n GLY 596 N 3.67 1.78 3.90 0.00 0.00 0.52 -4.67 105.19 110.39 2bhy n GLY 596 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.96 2bhy n GLY 596 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bhy s GLU 597 N -0.28 3.64 0.11 1.61 2.02 -0.60 -3.77 118.70 121.43 2bhy s GLU 597 Ca 0.00 0.21 0.04 0.00 0.02 0.00 0.00 54.97 55.24 2bhy s GLU 597 Cb 0.00 -2.46 -0.04 0.00 0.10 0.00 0.00 34.13 31.73 2bhy s GLU 597 CO 0.00 -0.03 -0.10 0.00 0.02 0.00 0.00 175.26 175.15 2bhy s ALA 598 N -2.44 1.22 0.00 5.21 0.00 -1.26 -0.87 121.76 123.62 2bhy s ALA 598 Ca 0.47 -1.32 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 2bhy s ALA 598 Cb -0.10 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 23.06 2bhy s ALA 598 CO 0.36 -0.08 0.03 0.54 0.00 0.00 0.00 175.76 176.61 2bhy s VAL 599 N -2.90 0.06 -0.20 0.00 0.11 -0.46 -1.09 120.40 115.91 2bhy s VAL 599 Ca 0.10 -0.48 -0.05 0.00 -2.93 0.00 0.00 61.98 58.62 2bhy s VAL 599 Cb 0.00 -0.20 -0.03 0.00 -1.53 0.00 0.00 36.38 34.62 2bhy s VAL 599 CO -0.00 -0.26 0.01 -0.22 -3.33 0.00 0.00 175.10 171.29 2bhy s LEU 600 N -0.79 3.30 0.22 2.54 2.96 0.22 -1.19 118.68 125.93 2bhy s LEU 600 Ca -0.09 -0.18 0.12 0.00 -0.22 0.00 0.00 54.13 53.76 2bhy s LEU 600 Cb -0.05 -1.84 -0.05 0.00 0.50 0.00 0.00 46.19 44.75 2bhy s LEU 600 CO -0.00 0.07 -0.23 0.68 -1.32 0.00 0.00 176.35 175.55 2bhy s VAL 601 N 0.98 2.40 0.00 1.68 -7.23 -0.34 -0.80 120.40 117.09 2bhy s VAL 601 Ca 0.02 -2.15 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 2bhy s VAL 601 Cb -0.14 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.61 2bhy s VAL 601 CO 0.02 -0.20 0.00 0.61 -0.31 0.00 0.00 175.10 175.21