#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bhu s PHE 15 N 0.00 2.94 -0.09 0.66 5.36 -1.26 -5.00 117.98 120.58 2bhu s PHE 15 Ca 0.00 1.12 0.03 0.00 -0.96 0.00 0.00 56.93 57.12 2bhu s PHE 15 Cb 0.00 -3.84 -0.01 0.00 -0.34 0.00 0.00 43.02 38.83 2bhu s PHE 15 CO 0.00 -2.60 -0.18 -0.65 -1.46 0.00 0.00 175.22 170.33 2bhu s GLN 16 N -0.99 2.99 0.55 10.12 -0.21 -1.26 -5.04 119.66 125.82 2bhu s GLN 16 Ca 0.56 -0.77 -0.21 0.00 0.02 0.00 0.00 55.36 54.96 2bhu s GLN 16 Cb -0.43 -2.43 -0.05 0.00 1.00 0.00 0.00 33.01 31.11 2bhu s GLN 16 CO 0.49 0.32 1.26 -2.37 -2.12 0.00 0.00 175.29 172.87 2bhu n THR 17 N 3.18 3.78 1.48 -0.19 5.66 -1.26 -4.90 114.28 122.03 2bhu n THR 17 Ca -0.18 -0.50 0.15 0.00 -3.05 0.00 0.00 64.05 60.47 2bhu n THR 17 Cb 0.52 -1.52 0.75 0.00 -1.55 0.00 0.00 70.33 68.54 2bhu n THR 17 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bhu n GLN 18 N -0.98 0.52 -4.09 1.09 6.02 -1.26 -4.88 117.38 113.81 2bhu n GLN 18 Ca 0.11 -0.04 -0.35 0.00 -0.01 0.00 0.00 57.00 56.72 2bhu n GLN 18 Cb 0.45 -1.50 -0.09 0.00 1.02 0.00 0.00 30.24 30.12 2bhu n GLN 18 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2bhu s HIS 19 N -2.50 3.28 -0.04 1.08 3.76 -1.26 -5.08 115.29 114.52 2bhu s HIS 19 Ca 0.30 0.16 0.01 0.00 -0.15 0.00 0.00 55.06 55.38 2bhu s HIS 19 Cb 0.20 -1.98 0.02 0.00 1.11 0.00 0.00 32.58 31.93 2bhu s HIS 19 CO 0.46 0.31 -0.02 0.34 -0.85 0.00 0.00 174.74 174.98 2bhu s ASP 20 N -0.14 0.79 0.50 1.40 -1.08 -1.26 -5.03 116.67 111.84 2bhu s ASP 20 Ca 0.07 -0.08 0.23 0.00 -0.52 0.00 0.00 52.55 52.25 2bhu s ASP 20 Cb -0.12 -0.35 1.31 0.00 -1.46 0.00 0.00 42.92 42.30 2bhu s ASP 20 CO 0.01 -0.08 1.96 -0.65 0.52 0.00 0.00 175.17 176.92 2bhu h PRO 21 N 7.31 0.12 0.00 4.34 0.11 -1.98 -1.06 132.00 140.83 2bhu h PRO 21 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2bhu h PRO 21 Cb 1.14 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2bhu h PRO 21 CO 0.45 0.08 0.00 0.00 -0.21 0.00 0.00 178.00 178.32 2bhu h ARG 22 N 0.12 0.00 -0.05 1.05 3.08 -2.01 -2.83 114.38 113.74 2bhu h ARG 22 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 2bhu h ARG 22 Cb 1.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.13 2bhu h ARG 22 CO -0.04 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.11 2bhu n THR 23 N -2.48 1.66 -1.91 2.04 -2.24 -0.43 -5.05 114.28 105.88 2bhu n THR 23 Ca 0.01 -1.83 -0.42 0.00 -2.27 0.00 0.00 64.05 59.55 2bhu n THR 23 Cb 0.23 -0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 2bhu n THR 23 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 2bhu s ARG 24 N -2.29 4.20 0.50 -0.78 3.52 -1.02 -4.94 118.95 118.14 2bhu s ARG 24 Ca 0.25 2.40 -0.20 0.00 -0.13 0.00 0.00 55.73 58.04 2bhu s ARG 24 Cb 0.21 -3.13 -0.08 0.00 -1.56 0.00 0.00 34.95 30.39 2bhu s ARG 24 CO 0.04 -0.60 1.07 -0.51 -0.81 0.00 0.00 175.30 174.49 2bhu s LEU 25 N 0.77 3.83 0.00 -0.88 1.43 -1.26 -4.54 118.68 118.03 2bhu s LEU 25 Ca 0.68 2.02 0.00 0.00 -1.03 0.00 0.00 54.13 55.80 2bhu s LEU 25 Cb -0.44 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.23 2bhu s LEU 25 CO 0.35 -0.91 0.00 0.61 0.23 0.00 0.00 176.35 176.63 2bhu n GLY 26 N -0.08 0.41 3.18 -3.19 0.00 -0.18 -4.92 105.19 100.42 2bhu n GLY 26 Ca 0.10 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.00 2bhu n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhu s ALA 27 N -2.00 2.47 -0.08 4.61 0.00 -1.26 -0.81 121.76 124.69 2bhu s ALA 27 Ca 0.00 -1.19 -0.00 0.00 0.00 0.00 0.00 51.96 50.77 2bhu s ALA 27 Cb 0.00 -1.32 0.02 0.00 0.00 0.00 0.00 23.12 21.83 2bhu s ALA 27 CO 0.00 -0.34 -0.06 0.99 0.00 0.00 0.00 175.76 176.35 2bhu s THR 28 N 1.29 0.78 0.33 0.00 2.01 -0.22 -4.69 115.64 115.13 2bhu s THR 28 Ca 0.04 -0.17 -0.27 0.00 0.31 0.00 0.00 61.69 61.59 2bhu s THR 28 Cb -0.14 -0.82 -0.13 0.00 0.01 0.00 0.00 72.50 71.43 2bhu s THR 28 CO -0.09 0.31 1.10 -2.65 -0.69 0.00 0.00 174.62 172.60 2bhu n PRO 29 N 4.69 1.62 -3.04 4.92 -0.02 -1.26 -0.94 135.00 140.96 2bhu n PRO 29 Ca -0.15 0.57 -0.29 0.00 -2.02 0.00 0.00 63.50 61.61 2bhu n PRO 29 Cb 0.50 -2.04 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 2bhu n PRO 29 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2bhu s LEU 30 N -0.18 3.91 0.86 2.45 1.43 0.66 -4.81 118.68 123.01 2bhu s LEU 30 Ca 0.58 0.95 -0.11 0.00 -1.03 0.00 0.00 54.13 54.51 2bhu s LEU 30 Cb -0.64 -3.81 0.11 0.00 0.03 0.00 0.00 46.19 41.89 2bhu s LEU 30 CO 0.60 -0.33 1.09 -2.16 0.23 0.00 0.00 176.35 175.79 2bhu s PRO 31 N -3.78 1.52 -1.63 1.29 0.04 -1.26 -3.89 135.00 127.29 2bhu s PRO 31 Ca 0.48 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.36 2bhu s PRO 31 Cb -0.10 -1.84 0.00 0.00 0.04 0.00 0.00 34.50 32.60 2bhu s PRO 31 CO 0.31 -2.06 0.00 0.41 0.04 0.00 0.00 177.00 175.70 2bhu n GLY 32 N -1.29 1.10 2.41 0.56 0.00 -1.26 -2.48 105.19 104.22 2bhu n GLY 32 Ca 0.07 -0.24 -0.17 0.00 0.00 0.00 0.00 46.02 45.68 2bhu n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhu n GLY 33 N -1.00 0.58 0.00 -0.02 0.00 -1.25 -4.88 105.19 98.62 2bhu n GLY 33 Ca -0.17 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 45.81 2bhu n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhu n ALA 34 N -0.42 2.27 0.00 4.61 0.00 -1.04 -5.02 120.51 120.91 2bhu n ALA 34 Ca -0.19 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.15 2bhu n ALA 34 Cb 0.62 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2bhu n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhu n GLY 35 N 1.30 0.08 2.94 0.00 0.00 -1.26 -3.94 105.19 104.31 2bhu n GLY 35 Ca 0.07 -1.58 -0.16 0.00 0.00 0.00 0.00 46.02 44.35 2bhu n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bhu s THR 36 N -0.02 0.40 -0.25 2.61 2.01 -0.07 -0.24 115.64 120.08 2bhu s THR 36 Ca 0.00 -0.19 -0.10 0.00 0.31 0.00 0.00 61.69 61.70 2bhu s THR 36 Cb 0.00 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 72.10 2bhu s THR 36 CO 0.00 0.13 0.16 -0.60 -0.69 0.00 0.00 174.62 173.61 2bhu s ARG 37 N 0.03 4.01 -0.16 4.92 3.52 -0.12 -1.47 118.95 129.69 2bhu s ARG 37 Ca 0.00 -0.30 -0.06 0.00 -0.13 0.00 0.00 55.73 55.24 2bhu s ARG 37 Cb -0.04 -3.54 -0.04 0.00 -1.56 0.00 0.00 34.95 29.77 2bhu s ARG 37 CO -0.00 -0.01 0.05 -0.06 -0.81 0.00 0.00 175.30 174.47 2bhu s PHE 38 N 1.24 3.26 0.01 5.12 0.08 0.49 -1.06 117.98 127.12 2bhu s PHE 38 Ca 0.07 0.12 -0.03 0.00 0.12 0.00 0.00 56.93 57.21 2bhu s PHE 38 Cb -0.14 -2.00 -0.01 0.00 -0.57 0.00 0.00 43.02 40.30 2bhu s PHE 38 CO 0.06 0.26 0.05 1.03 -0.10 0.00 0.00 175.22 176.52 2bhu s ARG 39 N -0.01 0.34 0.15 0.44 0.52 0.01 -1.07 118.95 119.34 2bhu s ARG 39 Ca 0.06 -0.43 -0.12 0.00 -0.52 0.00 0.00 55.73 54.72 2bhu s ARG 39 Cb -0.12 0.13 0.01 0.00 0.52 0.00 0.00 34.95 35.49 2bhu s ARG 39 CO 0.01 -0.07 0.33 -0.48 0.02 0.00 0.00 175.30 175.12 2bhu s LEU 40 N -1.23 0.78 -0.11 2.53 0.05 -0.67 -1.01 118.68 119.02 2bhu s LEU 40 Ca -0.13 -0.68 0.04 0.00 0.05 0.00 0.00 54.13 53.40 2bhu s LEU 40 Cb -0.08 1.45 0.00 0.00 -2.05 0.00 0.00 46.19 45.52 2bhu s LEU 40 CO 0.00 -0.89 -0.23 0.86 -0.55 0.00 0.00 176.35 175.54 2bhu s TRP 41 N -3.91 2.54 -0.01 3.48 -0.00 -1.26 -1.18 118.94 118.60 2bhu s TRP 41 Ca 0.12 -1.09 0.01 0.00 -0.00 0.00 0.00 56.10 55.13 2bhu s TRP 41 Cb 0.02 -1.71 0.01 0.00 -0.00 0.00 0.00 33.47 31.80 2bhu s TRP 41 CO -0.04 -0.46 -0.02 -0.08 -0.00 0.00 0.00 176.95 176.36 2bhu s THR 42 N 0.46 0.18 -0.50 5.86 -1.32 0.03 -4.58 115.64 115.76 2bhu s THR 42 Ca -0.16 -0.05 0.23 0.00 -1.21 0.00 0.00 61.69 60.50 2bhu s THR 42 Cb -0.17 -0.19 -0.12 0.00 -1.51 0.00 0.00 72.50 70.50 2bhu s THR 42 CO 0.06 0.08 0.97 -1.54 -2.21 0.00 0.00 174.62 171.98 2bhu n SER 43 N 3.32 0.58 0.00 8.08 3.41 -0.56 -4.36 113.62 124.09 2bhu n SER 43 Ca -0.16 -0.12 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 2bhu n SER 43 Cb 0.57 0.88 0.00 0.00 -0.26 0.00 0.00 64.21 65.40 2bhu n SER 43 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2bhu n THR 44 N -2.09 0.00 -2.35 6.66 -2.24 -1.25 -5.05 114.28 107.96 2bhu n THR 44 Ca 0.01 -0.02 -0.37 0.00 -2.27 0.00 0.00 64.05 61.40 2bhu n THR 44 Cb 0.47 0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 2bhu n THR 44 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bhu s ALA 45 N -1.18 3.08 -0.19 6.98 0.00 -1.26 -4.95 121.76 124.24 2bhu s ALA 45 Ca 0.00 0.88 0.17 0.00 0.00 0.00 0.00 51.96 53.01 2bhu s ALA 45 Cb 0.00 -3.35 -0.24 0.00 0.00 0.00 0.00 23.12 19.52 2bhu s ALA 45 CO 0.00 -0.48 0.11 0.54 0.00 0.00 0.00 175.76 175.93 2bhu n ARG 46 N -0.12 0.68 -5.06 0.00 1.74 -1.26 -4.93 116.66 107.72 2bhu n ARG 46 Ca 0.05 0.03 -0.28 0.00 -0.77 0.00 0.00 57.85 56.88 2bhu n ARG 46 Cb 0.48 -1.54 -0.16 0.00 -1.02 0.00 0.00 32.46 30.21 2bhu n ARG 46 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2bhu s THR 47 N -2.50 1.71 -0.04 0.55 -4.23 -1.26 -4.99 115.64 104.88 2bhu s THR 47 Ca -0.11 -0.91 -0.02 0.00 -1.18 0.00 0.00 61.69 59.48 2bhu s THR 47 Cb 0.06 -1.44 0.03 0.00 1.34 0.00 0.00 72.50 72.49 2bhu s THR 47 CO 0.82 0.48 0.05 -0.69 -0.54 0.00 0.00 174.62 174.74 2bhu s VAL 48 N -0.31 -0.07 0.11 2.29 1.01 -1.26 -1.14 120.40 121.03 2bhu s VAL 48 Ca 0.03 0.37 0.01 0.00 0.00 0.00 0.00 61.98 62.39 2bhu s VAL 48 Cb -0.10 -0.16 -0.04 0.00 0.00 0.00 0.00 36.38 36.08 2bhu s VAL 48 CO 0.01 0.17 -0.02 0.00 0.00 0.00 0.00 175.10 175.25 2bhu s ALA 49 N 1.96 0.94 -0.06 5.51 0.00 -0.62 -1.41 121.76 128.07 2bhu s ALA 49 Ca 0.02 -1.39 0.04 0.00 0.00 0.00 0.00 51.96 50.64 2bhu s ALA 49 Cb -0.12 0.38 -0.02 0.00 0.00 0.00 0.00 23.12 23.36 2bhu s ALA 49 CO -0.03 -0.32 -0.19 0.54 0.00 0.00 0.00 175.76 175.76 2bhu s VAL 50 N -3.76 2.65 -0.33 0.00 0.11 0.25 -0.35 120.40 118.96 2bhu s VAL 50 Ca 0.15 -0.86 -0.07 0.00 -2.93 0.00 0.00 61.98 58.27 2bhu s VAL 50 Cb 0.06 -2.02 0.03 0.00 -1.53 0.00 0.00 36.38 32.92 2bhu s VAL 50 CO -0.03 0.57 0.11 -0.60 -3.33 0.00 0.00 175.10 171.82 2bhu s ARG 51 N -0.36 2.79 -0.20 1.54 3.52 -0.17 -0.33 118.95 125.74 2bhu s ARG 51 Ca 0.03 -1.07 -0.01 0.00 -0.13 0.00 0.00 55.73 54.55 2bhu s ARG 51 Cb -0.12 -3.47 0.01 0.00 -1.56 0.00 0.00 34.95 29.81 2bhu s ARG 51 CO 0.02 -0.60 -0.13 0.08 -0.81 0.00 0.00 175.30 173.86 2bhu s VAL 52 N 1.45 2.62 -1.54 7.11 1.01 -0.11 -2.09 120.40 128.86 2bhu s VAL 52 Ca 0.00 -0.77 -0.14 0.00 0.00 0.00 0.00 61.98 61.07 2bhu s VAL 52 Cb -0.19 -2.16 0.10 0.00 0.00 0.00 0.00 36.38 34.13 2bhu s VAL 52 CO 0.03 0.47 0.84 0.59 0.00 0.00 0.00 175.10 177.04 2bhu n ASN 53 N 4.69 -4.36 0.00 3.32 3.02 0.67 -1.28 115.26 121.33 2bhu n ASN 53 Ca -0.20 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 2bhu n ASN 53 Cb 0.50 -3.51 0.00 0.00 -0.61 0.00 0.00 39.78 36.16 2bhu n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bhu n GLY 54 N -1.52 1.62 3.52 7.41 0.00 -1.26 -5.04 105.19 109.91 2bhu n GLY 54 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2bhu n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2bhu s THR 55 N -2.37 4.56 0.36 2.61 2.01 -0.40 -5.06 115.64 117.34 2bhu s THR 55 Ca 0.00 -0.10 -0.25 0.00 0.31 0.00 0.00 61.69 61.65 2bhu s THR 55 Cb 0.00 -3.11 -0.09 0.00 0.01 0.00 0.00 72.50 69.31 2bhu s THR 55 CO 0.00 0.37 1.01 -1.61 -0.69 0.00 0.00 174.62 173.70 2bhu s GLU 56 N 1.23 4.37 -0.04 4.92 2.02 -1.26 -0.93 118.70 129.01 2bhu s GLU 56 Ca 0.05 1.46 -0.00 0.00 0.02 0.00 0.00 54.97 56.49 2bhu s GLU 56 Cb -0.14 -2.69 0.03 0.00 0.10 0.00 0.00 34.13 31.42 2bhu s GLU 56 CO 0.04 0.06 0.01 -1.01 0.02 0.00 0.00 175.26 174.38 2bhu s HIS 57 N -1.61 0.39 0.26 1.61 3.76 0.55 -4.98 115.29 115.28 2bhu s HIS 57 Ca 0.54 -0.01 -0.30 0.00 -0.15 0.00 0.00 55.06 55.14 2bhu s HIS 57 Cb -0.21 -0.54 -0.10 0.00 1.11 0.00 0.00 32.58 32.84 2bhu s HIS 57 CO 0.27 -0.20 1.39 0.08 -0.85 0.00 0.00 174.74 175.44 2bhu s VAL 58 N 1.48 2.73 0.32 -0.90 1.01 -1.26 -0.58 120.40 123.19 2bhu s VAL 58 Ca -0.03 0.64 -0.03 0.00 0.00 0.00 0.00 61.98 62.56 2bhu s VAL 58 Cb -0.13 -3.41 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 2bhu s VAL 58 CO -0.03 0.11 0.55 -0.04 0.00 0.00 0.00 175.10 175.70 2bhu s MET 59 N -0.70 3.56 -0.08 2.72 -1.94 -0.50 -4.87 119.30 117.50 2bhu s MET 59 Ca 0.56 -0.14 -0.22 0.00 -1.71 0.00 0.00 55.69 54.19 2bhu s MET 59 Cb -0.41 -2.65 -0.04 0.00 2.01 0.00 0.00 34.83 33.74 2bhu s MET 59 CO 0.45 0.18 0.62 0.99 -0.01 0.00 0.00 175.02 177.26 2bhu s THR 60 N -2.19 5.08 -0.16 2.05 2.01 0.02 -4.84 115.64 117.59 2bhu s THR 60 Ca 0.42 1.28 -0.27 0.00 0.31 0.00 0.00 61.69 63.43 2bhu s THR 60 Cb -0.10 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.43 2bhu s THR 60 CO 0.33 0.29 0.90 -0.55 -0.69 0.00 0.00 174.62 174.91 2bhu s SER 61 N 0.65 7.04 0.00 3.53 0.15 -1.26 -1.41 113.70 122.40 2bhu s SER 61 Ca 0.33 1.29 0.18 0.00 0.70 0.00 0.00 55.95 58.46 2bhu s SER 61 Cb -0.17 -2.49 -0.11 0.00 -1.71 0.00 0.00 66.02 61.54 2bhu s SER 61 CO 0.16 -0.45 0.86 0.18 1.20 0.00 0.00 173.24 175.18 2bhu n LEU 62 N 5.35 1.31 0.00 3.45 4.77 0.06 -5.01 117.00 126.94 2bhu n LEU 62 Ca 0.07 -0.62 0.00 0.00 -0.03 0.00 0.00 56.01 55.42 2bhu n LEU 62 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 2bhu n LEU 62 CO 0.50 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 2bhu n GLY 63 N 1.36 0.73 2.41 -0.72 0.00 -1.25 -4.93 105.19 102.79 2bhu n GLY 63 Ca 0.06 -1.74 -0.06 0.00 0.00 0.00 0.00 46.02 44.27 2bhu n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhu n GLY 64 N 0.78 0.81 2.22 -0.02 0.00 -1.26 -2.31 105.19 105.42 2bhu n GLY 64 Ca 0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 46.02 45.72 2bhu n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhu n GLY 65 N -1.30 0.43 3.74 -0.02 0.00 -1.26 -4.83 105.19 101.95 2bhu n GLY 65 Ca -0.06 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.47 2bhu n GLY 65 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bhu s ILE 66 N -1.82 5.07 0.02 -0.61 -1.09 -0.98 -0.79 121.20 121.01 2bhu s ILE 66 Ca 0.00 1.15 0.06 0.00 -2.23 0.00 0.00 60.65 59.64 2bhu s ILE 66 Cb 0.00 -3.90 -0.02 0.00 -1.58 0.00 0.00 42.46 36.96 2bhu s ILE 66 CO 0.00 0.34 -0.18 -0.31 -1.23 0.00 0.00 174.94 173.56 2bhu s TYR 67 N 0.40 1.60 0.01 3.97 2.02 -0.32 -0.76 117.35 124.27 2bhu s TYR 67 Ca 0.30 -0.34 -0.06 0.00 -0.37 0.00 0.00 57.07 56.59 2bhu s TYR 67 Cb -0.17 -0.98 -0.00 0.00 -0.40 0.00 0.00 41.96 40.41 2bhu s TYR 67 CO 0.14 0.04 0.12 -2.00 -1.57 0.00 0.00 175.55 172.28 2bhu s GLU 68 N -0.92 0.46 -0.20 -0.62 2.12 -0.50 -1.68 118.70 117.36 2bhu s GLU 68 Ca 0.06 -0.43 -0.19 0.00 0.36 0.00 0.00 54.97 54.78 2bhu s GLU 68 Cb -0.08 0.19 0.05 0.00 0.26 0.00 0.00 34.13 34.55 2bhu s GLU 68 CO 0.01 -0.11 0.54 -1.17 -0.54 0.00 0.00 175.26 173.99 2bhu s LEU 69 N -1.40 -0.09 -0.15 2.70 2.96 -0.23 -0.80 118.68 121.67 2bhu s LEU 69 Ca -0.15 1.10 -0.03 0.00 -0.22 0.00 0.00 54.13 54.83 2bhu s LEU 69 Cb -0.08 1.86 -0.03 0.00 0.50 0.00 0.00 46.19 48.45 2bhu s LEU 69 CO 0.01 -0.19 -0.04 -1.61 -1.32 0.00 0.00 176.35 173.20 2bhu s GLU 70 N 0.34 3.58 0.04 1.98 2.02 -1.26 -0.38 118.70 125.02 2bhu s GLU 70 Ca -0.00 -0.52 0.02 0.00 0.02 0.00 0.00 54.97 54.48 2bhu s GLU 70 Cb -0.04 -2.88 -0.02 0.00 0.10 0.00 0.00 34.13 31.29 2bhu s GLU 70 CO 0.00 0.29 -0.07 -0.51 0.02 0.00 0.00 175.26 174.99 2bhu s LEU 71 N 0.23 2.27 -0.49 1.80 1.43 -0.54 -4.99 118.68 118.39 2bhu s LEU 71 Ca -0.03 -0.57 -0.07 0.00 -1.03 0.00 0.00 54.13 52.44 2bhu s LEU 71 Cb -0.14 -0.12 -0.20 0.00 0.03 0.00 0.00 46.19 45.77 2bhu s LEU 71 CO 0.03 -0.24 3.22 -2.65 0.23 0.00 0.00 176.35 176.94 2bhu n PRO 72 N 1.39 2.37 -4.22 1.29 -0.02 -1.25 -0.89 135.00 133.67 2bhu n PRO 72 Ca -0.22 -1.30 -0.28 0.00 -2.02 0.00 0.00 63.50 59.68 2bhu n PRO 72 Cb 0.55 -2.21 -0.09 0.00 -0.02 0.00 0.00 33.50 31.73 2bhu n PRO 72 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2bhu s VAL 73 N 1.54 3.56 0.28 -1.45 -7.23 -1.26 -4.86 120.40 110.98 2bhu s VAL 73 Ca 0.63 -1.38 0.01 0.00 -1.81 0.00 0.00 61.98 59.44 2bhu s VAL 73 Cb 0.25 -2.74 0.01 0.00 0.56 0.00 0.00 36.38 34.47 2bhu s VAL 73 CO -0.02 -0.02 0.11 0.61 -0.31 0.00 0.00 175.10 175.47 2bhu n GLY 74 N 0.21 3.37 3.66 2.32 0.00 -1.26 -2.41 105.19 111.08 2bhu n GLY 74 Ca -0.11 -2.27 -0.45 0.00 0.00 0.00 0.00 46.02 43.19 2bhu n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2bhu n PRO 75 N -0.93 1.87 0.00 1.61 -0.02 -1.26 -1.86 135.00 134.41 2bhu n PRO 75 Ca -0.06 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2bhu n PRO 75 Cb 0.34 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2bhu n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bhu n GLY 76 N 1.77 3.07 3.75 -1.23 0.00 -0.25 -4.97 105.19 107.34 2bhu n GLY 76 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2bhu n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhu n ALA 77 N -1.18 1.58 -2.70 4.61 0.00 -0.78 -4.64 120.51 117.41 2bhu n ALA 77 Ca 0.00 0.11 -0.35 0.00 0.00 0.00 0.00 53.44 53.21 2bhu n ALA 77 Cb 0.00 -2.36 -0.09 0.00 0.00 0.00 0.00 19.45 17.00 2bhu n ALA 77 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2bhu s ARG 78 N -2.95 3.03 0.14 0.00 1.81 -1.26 -0.91 118.95 118.81 2bhu s ARG 78 Ca 0.73 -0.40 -0.18 0.00 -1.72 0.00 0.00 55.73 54.16 2bhu s ARG 78 Cb -0.41 -2.82 0.05 0.00 -0.45 0.00 0.00 34.95 31.32 2bhu s ARG 78 CO 0.48 0.69 0.47 1.52 -0.68 0.00 0.00 175.30 177.79 2bhu s TYR 79 N -0.85 -0.31 0.33 -0.53 -0.85 -0.36 -0.24 117.35 114.54 2bhu s TYR 79 Ca 0.13 0.03 -0.07 0.00 -0.52 0.00 0.00 57.07 56.64 2bhu s TYR 79 Cb -0.11 0.36 0.01 0.00 0.38 0.00 0.00 41.96 42.60 2bhu s TYR 79 CO 0.02 -0.76 0.52 -0.48 -1.52 0.00 0.00 175.55 173.33 2bhu s LEU 80 N -2.79 0.69 0.16 -3.49 0.05 -0.89 -0.58 118.68 111.83 2bhu s LEU 80 Ca 0.03 -1.30 0.05 0.00 0.05 0.00 0.00 54.13 52.95 2bhu s LEU 80 Cb 0.01 1.74 -0.04 0.00 -2.05 0.00 0.00 46.19 45.85 2bhu s LEU 80 CO -0.12 -1.32 0.16 -0.36 -0.55 0.00 0.00 176.35 174.16 2bhu s PHE 81 N -3.18 3.20 -0.21 3.48 0.08 -0.64 -1.00 117.98 119.71 2bhu s PHE 81 Ca 0.26 0.00 0.01 0.00 0.12 0.00 0.00 56.93 57.33 2bhu s PHE 81 Cb -0.01 -1.53 0.05 0.00 -0.57 0.00 0.00 43.02 40.95 2bhu s PHE 81 CO 0.16 0.52 -0.11 0.08 -0.10 0.00 0.00 175.22 175.77 2bhu s VAL 82 N -1.75 1.80 -0.28 -0.44 1.01 0.52 0.00 120.40 121.26 2bhu s VAL 82 Ca 0.31 -1.17 -0.04 0.00 0.00 0.00 0.00 61.98 61.09 2bhu s VAL 82 Cb -0.10 -1.87 0.03 0.00 0.00 0.00 0.00 36.38 34.43 2bhu s VAL 82 CO 0.24 0.14 0.02 -0.76 0.00 0.00 0.00 175.10 174.73 2bhu s LEU 83 N 1.32 3.67 -1.57 3.92 1.43 -0.63 -1.59 118.68 125.22 2bhu s LEU 83 Ca -0.03 -0.92 -0.12 0.00 -1.03 0.00 0.00 54.13 52.03 2bhu s LEU 83 Cb -0.17 -1.77 0.10 0.00 0.03 0.00 0.00 46.19 44.38 2bhu s LEU 83 CO -0.08 -0.20 0.76 0.47 0.23 0.00 0.00 176.35 177.54 2bhu n ASP 84 N 4.74 -3.00 0.00 2.29 8.00 -0.29 -1.15 116.55 127.13 2bhu n ASP 84 Ca -0.15 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.42 2bhu n ASP 84 Cb 0.46 -3.22 0.00 0.00 -0.02 0.00 0.00 41.12 38.34 2bhu n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhu n GLY 85 N -1.62 1.40 3.48 0.44 0.00 -1.26 -5.02 105.19 102.61 2bhu n GLY 85 Ca -0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 2bhu n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bhu s VAL 86 N -3.58 4.93 0.16 1.61 1.01 -0.30 -5.05 120.40 119.18 2bhu s VAL 86 Ca 0.00 -0.31 -0.32 0.00 0.00 0.00 0.00 61.98 61.36 2bhu s VAL 86 Cb 0.00 -3.52 -0.10 0.00 0.00 0.00 0.00 36.38 32.76 2bhu s VAL 86 CO 0.00 0.04 1.65 -2.84 0.00 0.00 0.00 175.10 173.95 2bhu s PRO 87 N 1.67 4.18 -0.04 2.72 0.02 -1.26 -1.61 135.00 140.68 2bhu s PRO 87 Ca 0.05 2.45 -0.00 0.00 0.02 0.00 0.00 61.00 63.52 2bhu s PRO 87 Cb -0.17 -3.22 0.03 0.00 0.02 0.00 0.00 34.50 31.16 2bhu s PRO 87 CO 0.08 -0.69 0.01 0.99 -0.33 0.00 0.00 177.00 177.07 2bhu s THR 88 N 1.46 0.17 0.82 0.99 2.01 0.10 -4.97 115.64 116.21 2bhu s THR 88 Ca 0.73 0.13 -0.14 0.00 0.31 0.00 0.00 61.69 62.72 2bhu s THR 88 Cb -0.45 -0.29 0.05 0.00 0.01 0.00 0.00 72.50 71.82 2bhu s THR 88 CO 0.32 0.17 0.95 -2.65 -0.69 0.00 0.00 174.62 172.71 2bhu n PRO 89 N 4.42 0.12 -2.78 4.92 -0.02 -1.26 -1.62 135.00 138.77 2bhu n PRO 89 Ca -0.21 0.11 -0.42 0.00 -2.02 0.00 0.00 63.50 60.95 2bhu n PRO 89 Cb 0.50 -2.23 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 2bhu n PRO 89 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2bhu s ASP 90 N -1.99 6.79 0.64 2.55 2.15 -1.26 -4.76 116.67 120.78 2bhu s ASP 90 Ca 0.69 0.82 0.39 0.00 0.43 0.00 0.00 52.55 54.88 2bhu s ASP 90 Cb -0.29 -2.48 2.20 0.00 -0.30 0.00 0.00 42.92 42.05 2bhu s ASP 90 CO 0.55 -0.78 2.33 -0.65 -0.17 0.00 0.00 175.17 176.45 2bhu h PRO 91 N 8.17 0.00 -0.61 4.34 0.11 -1.92 -0.66 132.00 141.42 2bhu h PRO 91 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 2bhu h PRO 91 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2bhu h PRO 91 CO 0.97 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.42 2bhu n TYR 92 N -3.37 0.93 -1.63 0.65 4.01 -1.26 -4.40 117.16 112.09 2bhu n TYR 92 Ca -0.03 -0.43 -0.45 0.00 -0.16 0.00 0.00 57.90 56.84 2bhu n TYR 92 Cb 0.08 -0.06 -0.02 0.00 -0.31 0.00 0.00 39.34 39.03 2bhu n TYR 92 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bhu n ALA 93 N 1.15 0.37 0.99 -0.72 0.00 -0.26 -4.73 120.51 117.30 2bhu n ALA 93 Ca 0.20 0.40 0.11 0.00 0.00 0.00 0.00 53.44 54.16 2bhu n ALA 93 Cb 0.58 -2.14 0.13 0.00 0.00 0.00 0.00 19.45 18.02 2bhu n ALA 93 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2bhu n ARG 94 N 1.17 0.01 -3.61 0.00 5.12 -1.26 -2.92 116.66 115.16 2bhu n ARG 94 Ca 0.10 0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.90 2bhu n ARG 94 Cb 0.32 -1.50 -0.07 0.00 -1.16 0.00 0.00 32.46 30.05 2bhu n ARG 94 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2bhu s PHE 95 N -3.00 -0.58 -0.54 -1.55 5.36 -1.26 -4.13 117.98 112.29 2bhu s PHE 95 Ca 0.10 1.28 0.04 0.00 -0.96 0.00 0.00 56.93 57.40 2bhu s PHE 95 Cb 0.17 0.36 0.17 0.00 -0.34 0.00 0.00 43.02 43.38 2bhu s PHE 95 CO 0.76 -0.35 0.41 -0.51 -1.46 0.00 0.00 175.22 174.06 2bhu s LEU 96 N -0.19 2.93 0.51 6.12 1.43 -1.26 -1.47 118.68 126.75 2bhu s LEU 96 Ca -0.01 -3.41 0.19 0.00 -1.03 0.00 0.00 54.13 49.87 2bhu s LEU 96 Cb -0.03 -0.97 1.29 0.00 0.03 0.00 0.00 46.19 46.50 2bhu s LEU 96 CO -0.00 -0.13 2.11 1.55 0.23 0.00 0.00 176.35 180.11 2bhu h PRO 97 N 5.55 0.00 -0.51 1.29 0.13 -1.94 -1.45 132.00 135.08 2bhu h PRO 97 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 2bhu h PRO 97 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 2bhu h PRO 97 CO 0.53 0.07 0.00 -0.25 -0.23 0.00 0.00 178.00 178.11 2bhu n ASP 98 N -4.29 4.97 0.00 1.44 8.00 -1.26 -4.95 116.55 120.46 2bhu n ASP 98 Ca -0.03 -2.81 0.00 0.00 0.71 0.00 0.00 54.79 52.66 2bhu n ASP 98 Cb 0.15 -0.61 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 2bhu n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhu n GLY 99 N 0.45 -2.86 0.10 0.44 0.00 -0.55 -4.46 105.19 98.32 2bhu n GLY 99 Ca 0.25 -1.78 0.12 0.00 0.00 0.00 0.00 46.02 44.61 2bhu n GLY 99 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bhu n VAL 100 N -0.39 0.74 0.41 1.61 0.24 -1.26 -2.24 118.33 117.45 2bhu n VAL 100 Ca 0.00 0.09 0.11 0.00 -2.04 0.00 0.00 64.34 62.50 2bhu n VAL 100 Cb 0.00 -0.96 0.17 0.00 -1.47 0.00 0.00 33.84 31.58 2bhu n VAL 100 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2bhu n HIS 101 N -2.11 0.34 -3.22 6.34 8.25 -1.26 -4.77 115.22 118.80 2bhu n HIS 101 Ca 0.03 -0.19 -0.14 0.00 -0.26 0.00 0.00 57.72 57.16 2bhu n HIS 101 Cb 0.28 -0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.42 2bhu n HIS 101 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bhu n GLY 102 N 1.28 2.19 3.77 -1.41 0.00 -0.95 -4.82 105.19 105.25 2bhu n GLY 102 Ca 0.16 -2.21 -0.38 0.00 0.00 0.00 0.00 46.02 43.59 2bhu n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bhu s GLU 103 N -3.66 3.91 0.61 1.61 2.02 -1.26 -4.66 118.70 117.26 2bhu s GLU 103 Ca 0.35 1.89 -0.09 0.00 0.02 0.00 0.00 54.97 57.14 2bhu s GLU 103 Cb -0.03 -2.59 -0.01 0.00 0.10 0.00 0.00 34.13 31.60 2bhu s GLU 103 CO 0.22 -0.46 0.97 0.00 0.02 0.00 0.00 175.26 176.01 2bhu s ALA 104 N -1.42 3.15 -0.07 5.21 0.00 0.25 -4.18 121.76 124.70 2bhu s ALA 104 Ca 0.60 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 52.18 2bhu s ALA 104 Cb -0.32 -2.85 -0.03 0.00 0.00 0.00 0.00 23.12 19.93 2bhu s ALA 104 CO 0.39 -0.78 -0.11 -2.00 0.00 0.00 0.00 175.76 173.26 2bhu s GLU 105 N -5.10 2.75 0.06 0.00 2.12 -0.54 -1.22 118.70 116.77 2bhu s GLU 105 Ca 0.54 -0.63 -0.31 0.00 0.36 0.00 0.00 54.97 54.93 2bhu s GLU 105 Cb -0.11 -2.51 -0.06 0.00 0.26 0.00 0.00 34.13 31.71 2bhu s GLU 105 CO 0.49 0.57 1.31 0.08 -0.54 0.00 0.00 175.26 177.18 2bhu s VAL 106 N -0.59 3.70 -0.07 3.70 1.01 -0.09 -4.07 120.40 123.99 2bhu s VAL 106 Ca 0.09 1.19 0.04 0.00 0.00 0.00 0.00 61.98 63.30 2bhu s VAL 106 Cb -0.11 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 2bhu s VAL 106 CO 0.02 0.07 -0.20 -0.69 0.00 0.00 0.00 175.10 174.29 2bhu s VAL 107 N 1.41 2.49 -0.32 2.92 1.01 -1.26 -1.09 120.40 125.57 2bhu s VAL 107 Ca 0.62 -0.91 -0.06 0.00 0.00 0.00 0.00 61.98 61.63 2bhu s VAL 107 Cb -0.32 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.13 2bhu s VAL 107 CO 0.29 0.57 0.08 -0.62 0.00 0.00 0.00 175.10 175.41 2bhu s ASP 108 N -0.22 5.18 0.06 3.32 -1.08 -1.26 -4.58 116.67 118.10 2bhu s ASP 108 Ca -0.01 -1.01 0.21 0.00 -0.52 0.00 0.00 52.55 51.23 2bhu s ASP 108 Cb -0.13 -1.85 0.88 0.00 -1.46 0.00 0.00 42.92 40.36 2bhu s ASP 108 CO 0.03 -0.27 1.67 0.49 0.52 0.00 0.00 175.17 177.61 2bhu n PHE 109 N 4.81 0.23 0.62 -5.34 3.72 -1.26 -3.15 117.46 117.08 2bhu n PHE 109 Ca -0.13 0.08 0.13 0.00 -0.05 0.00 0.00 57.45 57.47 2bhu n PHE 109 Cb 0.46 -0.63 0.36 0.00 -0.94 0.00 0.00 39.48 38.73 2bhu n PHE 109 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bhu n GLY 110 N 0.58 -1.66 0.06 1.37 0.00 -1.26 -4.24 105.19 100.04 2bhu n GLY 110 Ca 0.05 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2bhu n GLY 110 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2bhu h THR 111 N 0.00 1.26 -3.15 2.61 2.02 -1.99 -3.46 112.91 110.20 2bhu h THR 111 Ca 0.00 -0.78 -0.57 0.00 0.77 0.00 0.00 66.41 65.83 2bhu h THR 111 Cb 0.74 1.74 0.10 0.00 -1.74 0.00 0.00 68.15 68.99 2bhu h THR 111 CO 0.00 0.21 0.55 0.33 0.37 0.00 0.00 175.52 176.98 2bhu n PHE 112 N -4.90 2.28 -3.12 3.16 7.35 -1.26 -4.91 117.46 116.06 2bhu n PHE 112 Ca -0.07 0.51 -0.45 0.00 -0.76 0.00 0.00 57.45 56.68 2bhu n PHE 112 Cb 0.19 -2.44 -0.01 0.00 0.35 0.00 0.00 39.48 37.57 2bhu n PHE 112 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2bhu s ASP 113 N -0.12 7.02 0.49 -2.13 -1.08 -1.26 -5.03 116.67 114.57 2bhu s ASP 113 Ca 0.59 -2.96 -0.22 0.00 -0.52 0.00 0.00 52.55 49.44 2bhu s ASP 113 Cb -0.59 -2.32 -0.06 0.00 -1.46 0.00 0.00 42.92 38.49 2bhu s ASP 113 CO 0.58 -0.64 1.22 0.26 0.52 0.00 0.00 175.17 177.11 2bhu s TRP 114 N 0.72 2.68 -0.05 -5.34 0.52 -1.26 -4.94 118.94 111.27 2bhu s TRP 114 Ca 0.34 1.49 0.08 0.00 0.02 0.00 0.00 56.10 58.02 2bhu s TRP 114 Cb -0.06 -3.50 0.12 0.00 -1.15 0.00 0.00 33.47 28.87 2bhu s TRP 114 CO -0.05 -1.93 1.04 0.25 0.02 0.00 0.00 176.95 176.28 2bhu n THR 115 N -0.71 1.30 -1.29 2.01 -2.24 -1.26 -4.84 114.28 107.26 2bhu n THR 115 Ca 0.08 -1.46 -0.20 0.00 -2.27 0.00 0.00 64.05 60.21 2bhu n THR 115 Cb 0.47 0.21 0.18 0.00 -2.10 0.00 0.00 70.33 69.10 2bhu n THR 115 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2bhu n ASP 116 N -0.85 3.51 0.29 3.42 5.75 -1.26 -4.61 116.55 122.80 2bhu n ASP 116 Ca 0.07 -3.66 0.15 0.00 -0.01 0.00 0.00 54.79 51.34 2bhu n ASP 116 Cb 0.43 -0.79 0.87 0.00 -1.03 0.00 0.00 41.12 40.60 2bhu n ASP 116 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2bhu h ALA 117 N 1.02 1.33 -0.25 2.12 0.00 -2.01 -1.71 119.26 119.76 2bhu h ALA 117 Ca 0.54 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.41 2bhu h ALA 117 Cb 2.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 20.34 2bhu h ALA 117 CO 0.95 0.06 0.00 -0.25 0.00 0.00 0.00 179.25 180.01 2bhu n ASP 118 N -3.62 1.85 -4.79 0.00 8.00 -1.26 -4.80 116.55 111.93 2bhu n ASP 118 Ca -0.02 -1.82 -0.37 0.00 0.71 0.00 0.00 54.79 53.29 2bhu n ASP 118 Cb 0.16 -0.16 -0.07 0.00 -0.02 0.00 0.00 41.12 41.03 2bhu n ASP 118 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 2bhu s TRP 119 N -1.68 3.55 -0.14 1.24 -0.11 -0.65 -5.00 118.94 116.16 2bhu s TRP 119 Ca 0.30 0.64 0.17 0.00 1.22 0.00 0.00 56.10 58.43 2bhu s TRP 119 Cb 0.16 -2.21 0.43 0.00 -1.50 0.00 0.00 33.47 30.35 2bhu s TRP 119 CO 0.23 0.46 1.20 0.72 -4.62 0.00 0.00 176.95 174.94 2bhu n HIS 120 N 2.78 0.18 -3.11 5.86 8.25 -1.26 -5.06 115.22 122.86 2bhu n HIS 120 Ca -0.15 -1.19 0.00 0.00 -0.26 0.00 0.00 57.72 56.12 2bhu n HIS 120 Cb 0.53 -0.22 0.00 0.00 1.12 0.00 0.00 29.99 31.42 2bhu n HIS 120 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2bhu n GLY 121 N -0.49 -2.14 2.95 -1.41 0.00 -1.26 -4.83 105.19 98.01 2bhu n GLY 121 Ca 0.15 -1.49 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 2bhu n GLY 121 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2bhu s ILE 122 N -0.17 -0.01 0.29 -0.61 2.07 -1.26 -5.00 121.20 116.50 2bhu s ILE 122 Ca 0.00 0.03 -0.16 0.00 -1.41 0.00 0.00 60.65 59.11 2bhu s ILE 122 Cb 0.00 -0.14 -0.09 0.00 0.13 0.00 0.00 42.46 42.37 2bhu s ILE 122 CO 0.00 0.01 0.72 -0.54 -1.91 0.00 0.00 174.94 173.23 2bhu s LYS 123 N 0.21 4.07 0.26 3.50 1.02 -1.26 -4.90 119.74 122.65 2bhu s LYS 123 Ca -0.01 0.72 -0.01 0.00 0.02 0.00 0.00 55.97 56.68 2bhu s LYS 123 Cb -0.02 -2.58 0.47 0.00 -0.52 0.00 0.00 37.83 35.18 2bhu s LYS 123 CO -0.01 0.24 1.83 1.25 -0.92 0.00 0.00 175.35 177.74 2bhu h LEU 124 N 2.64 0.83 -1.49 3.17 5.85 -1.97 0.17 115.31 124.52 2bhu h LEU 124 Ca -0.48 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.29 2bhu h LEU 124 Cb 1.18 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.09 2bhu h LEU 124 CO 0.65 0.46 0.00 0.00 -0.34 0.00 0.00 178.44 179.22 2bhu h ALA 125 N 1.50 1.00 -0.26 1.25 0.00 -1.93 -0.69 119.26 120.12 2bhu h ALA 125 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2bhu h ALA 125 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 2bhu h ALA 125 CO -0.25 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 178.75 2bhu n ASP 126 N -2.37 3.04 -4.74 0.00 8.00 0.59 -4.98 116.55 116.09 2bhu n ASP 126 Ca -0.01 -1.89 -0.39 0.00 0.71 0.00 0.00 54.79 53.21 2bhu n ASP 126 Cb 0.08 -0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 40.96 2bhu n ASP 126 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2bhu s VAL 128 N 0.20 1.93 0.32 0.00 1.01 -1.26 -4.16 120.40 118.44 2bhu s VAL 128 Ca 0.36 -1.58 -0.21 0.00 0.00 0.00 0.00 61.98 60.54 2bhu s VAL 128 Cb -0.19 -2.15 -0.10 0.00 0.00 0.00 0.00 36.38 33.95 2bhu s VAL 128 CO 0.19 -0.15 0.85 -0.36 0.00 0.00 0.00 175.10 175.63 2bhu s PHE 129 N 1.19 3.52 -0.23 5.22 0.08 -0.18 -1.71 117.98 125.87 2bhu s PHE 129 Ca -0.05 1.53 -0.01 0.00 0.12 0.00 0.00 56.93 58.52 2bhu s PHE 129 Cb -0.19 -2.75 0.07 0.00 -0.57 0.00 0.00 43.02 39.57 2bhu s PHE 129 CO -0.06 0.14 0.00 -0.47 -0.10 0.00 0.00 175.22 174.73 2bhu s TYR 130 N -1.80 1.78 -0.15 0.36 5.04 -0.02 -0.58 117.35 121.98 2bhu s TYR 130 Ca 0.52 -1.41 -0.25 0.00 -2.44 0.00 0.00 57.07 53.49 2bhu s TYR 130 Cb -0.14 -1.40 -0.02 0.00 0.35 0.00 0.00 41.96 40.75 2bhu s TYR 130 CO 0.19 -0.72 0.83 -2.00 -1.34 0.00 0.00 175.55 172.51 2bhu s GLU 131 N 1.60 4.32 -0.02 4.97 2.12 0.67 -0.57 118.70 131.80 2bhu s GLU 131 Ca -0.02 1.03 0.04 0.00 0.36 0.00 0.00 54.97 56.38 2bhu s GLU 131 Cb -0.18 -3.56 -0.01 0.00 0.26 0.00 0.00 34.13 30.65 2bhu s GLU 131 CO -0.09 -0.28 -0.15 0.14 -0.54 0.00 0.00 175.26 174.34 2bhu s VAL 132 N 1.97 1.19 -0.37 3.70 -7.23 0.02 -1.16 120.40 118.52 2bhu s VAL 132 Ca 0.39 -0.62 -0.12 0.00 -1.81 0.00 0.00 61.98 59.82 2bhu s VAL 132 Cb -0.17 -1.01 0.02 0.00 0.56 0.00 0.00 36.38 35.78 2bhu s VAL 132 CO 0.14 0.34 0.22 -2.28 -0.31 0.00 0.00 175.10 173.21 2bhu s HIS 133 N -0.17 3.23 0.34 2.82 2.46 -1.26 -1.62 115.29 121.09 2bhu s HIS 133 Ca 0.02 -0.79 0.01 0.00 0.47 0.00 0.00 55.06 54.77 2bhu s HIS 133 Cb -0.08 -2.46 0.59 0.00 -0.13 0.00 0.00 32.58 30.51 2bhu s HIS 133 CO 0.00 -0.59 2.00 0.28 -2.47 0.00 0.00 174.74 173.96 2bhu h VAL 134 N 5.78 1.17 -0.17 0.89 2.07 -1.92 -0.72 116.25 123.36 2bhu h VAL 134 Ca -0.27 -0.32 -0.06 0.00 0.82 0.00 0.00 66.70 66.87 2bhu h VAL 134 Cb 1.12 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 2bhu h VAL 134 CO 0.67 0.17 -0.17 1.23 0.02 0.00 0.00 177.57 179.48 2bhu h GLY 135 N 0.92 0.30 0.00 2.17 0.00 -1.92 -3.20 103.07 101.34 2bhu h GLY 135 Ca 0.25 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2bhu h GLY 135 CO -0.05 0.19 -1.08 -1.30 0.00 0.00 0.00 176.54 174.29 2bhu n THR 136 N -4.22 0.00 0.14 4.70 -2.24 -0.93 -4.20 114.28 107.53 2bhu n THR 136 Ca -0.01 -0.22 0.04 0.00 -2.27 0.00 0.00 64.05 61.60 2bhu n THR 136 Cb 0.31 0.69 0.45 0.00 -2.10 0.00 0.00 70.33 69.69 2bhu n THR 136 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 2bhu h PHE 137 N 0.00 0.22 -3.96 4.78 3.57 -1.14 -1.81 116.94 118.60 2bhu h PHE 137 Ca 0.00 -0.01 -0.23 0.00 3.53 0.00 0.00 57.97 61.25 2bhu h PHE 137 Cb 0.49 -0.07 -0.15 0.00 2.79 0.00 0.00 35.95 39.02 2bhu h PHE 137 CO 0.00 0.28 -0.67 0.95 -2.23 0.00 0.00 178.31 176.64 2bhu s THR 138 N -4.89 0.52 0.22 4.41 -4.23 -1.26 -4.64 115.64 105.77 2bhu s THR 138 Ca -0.06 -1.94 -0.08 0.00 -1.18 0.00 0.00 61.69 58.43 2bhu s THR 138 Cb 0.16 -1.94 0.17 0.00 1.34 0.00 0.00 72.50 72.23 2bhu s THR 138 CO 0.72 -0.62 1.84 -0.65 -0.54 0.00 0.00 174.62 175.36 2bhu h PRO 139 N 2.84 0.83 -0.29 3.99 0.10 -1.85 -2.07 132.00 135.55 2bhu h PRO 139 Ca -0.36 -0.05 -0.08 0.00 0.10 0.00 0.00 66.00 65.62 2bhu h PRO 139 Cb 1.19 -0.19 -0.02 0.00 0.10 0.00 0.00 31.00 32.08 2bhu h PRO 139 CO 0.63 0.55 -0.14 0.93 0.10 0.00 0.00 178.00 180.07 2bhu h GLU 140 N 0.86 0.50 -2.22 1.05 3.07 -1.95 -3.47 114.58 112.42 2bhu h GLU 140 Ca 0.31 -0.15 -0.18 0.00 -0.50 0.00 0.00 59.36 58.84 2bhu h GLU 140 Cb 0.10 -0.05 0.03 0.00 -0.84 0.00 0.00 28.75 27.98 2bhu h GLU 140 CO -0.14 0.64 -0.27 0.41 -1.40 0.00 0.00 179.01 178.25 2bhu n GLY 141 N -0.59 0.14 3.31 -3.84 0.00 -0.78 -5.03 105.19 98.40 2bhu n GLY 141 Ca 0.00 -0.38 -0.17 0.00 0.00 0.00 0.00 46.02 45.48 2bhu n GLY 141 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bhu s THR 142 N -2.80 1.34 0.24 2.61 -4.23 -1.25 -4.14 115.64 107.41 2bhu s THR 142 Ca 0.13 -2.10 -0.07 0.00 -1.18 0.00 0.00 61.69 58.47 2bhu s THR 142 Cb -0.06 -2.07 0.22 0.00 1.34 0.00 0.00 72.50 71.94 2bhu s THR 142 CO 0.16 -0.57 1.91 1.88 -0.54 0.00 0.00 174.62 177.45 2bhu h TYR 143 N 2.60 1.14 -0.68 3.99 0.99 -1.47 -1.72 116.97 121.83 2bhu h TYR 143 Ca -0.38 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.36 2bhu h TYR 143 Cb 1.21 -0.39 -0.03 0.00 1.00 0.00 0.00 36.73 38.52 2bhu h TYR 143 CO 0.65 0.71 0.35 0.00 -0.00 0.00 0.00 178.16 179.87 2bhu h ARG 144 N 1.22 0.96 -0.33 4.88 2.47 -1.83 -0.27 114.38 121.49 2bhu h ARG 144 Ca 0.34 -0.12 -0.13 0.00 -1.26 0.00 0.00 59.98 58.81 2bhu h ARG 144 Cb -0.11 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 28.02 2bhu h ARG 144 CO -0.08 0.74 -0.31 0.00 0.56 0.00 0.00 179.97 180.87 2bhu h ALA 145 N 1.17 0.83 -0.98 0.04 0.00 -1.92 -2.97 119.26 115.44 2bhu h ALA 145 Ca 0.24 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2bhu h ALA 145 Cb 0.07 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 2bhu h ALA 145 CO -0.03 0.64 0.65 0.00 0.00 0.00 0.00 179.25 180.50 2bhu h ALA 146 N 1.05 1.25 -0.17 0.00 0.00 -0.77 -2.44 119.26 118.18 2bhu h ALA 146 Ca 0.07 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2bhu h ALA 146 Cb 0.83 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2bhu h ALA 146 CO 0.07 0.61 0.07 0.00 0.00 0.00 0.00 179.25 180.00 2bhu h ALA 147 N 1.37 1.80 0.00 0.00 0.00 -0.90 -0.76 119.26 120.77 2bhu h ALA 147 Ca 0.36 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.22 2bhu h ALA 147 Cb -0.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.59 2bhu h ALA 147 CO -0.09 0.16 0.00 0.39 0.00 0.00 0.00 179.25 179.72 2bhu n GLU 148 N -4.46 0.21 0.00 0.00 -0.58 -0.92 -2.08 120.64 112.80 2bhu n GLU 148 Ca -0.00 0.41 0.13 0.00 -0.42 0.00 0.00 57.16 57.28 2bhu n GLU 148 Cb 0.11 -1.88 0.41 0.00 -0.57 0.00 0.00 31.44 29.52 2bhu n GLU 148 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2bhu n LYS 149 N -2.26 1.39 -0.22 3.49 4.76 -0.29 -4.41 118.16 120.61 2bhu n LYS 149 Ca 0.02 -0.87 -0.06 0.00 -2.87 0.00 0.00 58.31 54.54 2bhu n LYS 149 Cb 0.25 -1.48 0.04 0.00 -1.84 0.00 0.00 35.03 32.00 2bhu n LYS 149 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 2bhu h LEU 150 N 2.11 0.74 -1.23 -0.35 3.38 -1.44 -2.00 115.31 116.53 2bhu h LEU 150 Ca 0.00 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 57.96 2bhu h LEU 150 Cb 0.55 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 2bhu h LEU 150 CO 0.00 0.56 0.53 -0.65 0.09 0.00 0.00 178.44 178.97 2bhu h PRO 151 N 0.85 0.99 -0.55 1.13 0.11 -1.80 -0.36 132.00 132.38 2bhu h PRO 151 Ca 0.23 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.30 2bhu h PRO 151 Cb -0.06 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 30.79 2bhu h PRO 151 CO -0.05 0.66 0.34 -0.92 -0.21 0.00 0.00 178.00 177.82 2bhu h TYR 152 N 1.02 0.63 -0.50 0.65 3.20 -1.75 -0.43 116.97 119.80 2bhu h TYR 152 Ca 0.32 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.11 2bhu h TYR 152 Cb -0.00 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 2bhu h TYR 152 CO -0.00 0.37 -0.06 -0.07 -1.64 0.00 0.00 178.16 176.76 2bhu h LEU 153 N 0.67 0.86 -0.13 2.82 3.38 -0.64 0.14 115.31 122.41 2bhu h LEU 153 Ca 0.22 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2bhu h LEU 153 Cb 0.00 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2bhu h LEU 153 CO -0.09 0.96 0.06 0.50 0.09 0.00 0.00 178.44 179.96 2bhu h LYS 154 N 0.80 0.19 -0.56 1.13 1.63 -0.81 -2.38 116.57 116.58 2bhu h LYS 154 Ca 0.14 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.91 2bhu h LYS 154 Cb 0.56 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.13 2bhu h LYS 154 CO 0.03 0.26 0.36 1.49 -3.45 0.00 0.00 179.45 178.14 2bhu h GLU 155 N 0.07 0.74 -0.73 1.90 4.57 -0.91 -2.83 114.58 117.39 2bhu h GLU 155 Ca 0.04 -0.05 0.16 0.00 -1.18 0.00 0.00 59.36 58.33 2bhu h GLU 155 Cb 0.14 -0.16 -0.11 0.00 -0.16 0.00 0.00 28.75 28.46 2bhu h GLU 155 CO -0.00 0.50 0.18 1.25 -1.18 0.00 0.00 179.01 179.75 2bhu h LEU 156 N 0.75 0.01 0.00 1.64 5.85 -0.68 -3.46 115.31 119.43 2bhu h LEU 156 Ca 0.20 0.14 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2bhu h LEU 156 Cb -0.07 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2bhu h LEU 156 CO -0.04 -0.03 0.00 0.61 -0.34 0.00 0.00 178.44 178.63 2bhu n GLY 157 N -1.35 1.27 3.82 3.75 0.00 -0.92 -4.42 105.19 107.33 2bhu n GLY 157 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 2bhu n GLY 157 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2bhu s VAL 158 N -2.00 3.73 0.00 1.61 -7.23 -1.20 -4.90 120.40 110.41 2bhu s VAL 158 Ca 0.00 0.56 0.00 0.00 -1.81 0.00 0.00 61.98 60.73 2bhu s VAL 158 Cb 0.00 -3.31 0.00 0.00 0.56 0.00 0.00 36.38 33.63 2bhu s VAL 158 CO 0.00 -0.74 0.00 0.35 -0.31 0.00 0.00 175.10 174.40 2bhu n THR 159 N -3.22 0.00 -3.73 5.32 -2.24 -0.70 -4.69 114.28 105.03 2bhu n THR 159 Ca 0.07 -0.27 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 2bhu n THR 159 Cb 0.54 0.81 -0.12 0.00 -2.10 0.00 0.00 70.33 69.46 2bhu n THR 159 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2bhu s ALA 160 N -1.04 -0.70 -0.23 6.98 0.00 -0.90 -1.15 121.76 124.72 2bhu s ALA 160 Ca 0.00 1.09 -0.11 0.00 0.00 0.00 0.00 51.96 52.94 2bhu s ALA 160 Cb 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 23.12 22.40 2bhu s ALA 160 CO 0.00 -0.20 0.18 -1.50 0.00 0.00 0.00 175.76 174.24 2bhu s ILE 161 N 1.10 5.35 -0.42 0.00 2.07 0.22 -0.84 121.20 128.67 2bhu s ILE 161 Ca -0.08 0.24 -0.13 0.00 -1.41 0.00 0.00 60.65 59.27 2bhu s ILE 161 Cb -0.08 -3.52 0.05 0.00 0.13 0.00 0.00 42.46 39.03 2bhu s ILE 161 CO -0.08 0.35 0.30 -1.58 -1.91 0.00 0.00 174.94 172.02 2bhu s GLN 162 N 0.99 2.87 -0.15 3.50 2.00 0.27 -0.39 119.66 128.75 2bhu s GLN 162 Ca 0.09 -1.22 -0.17 0.00 -2.00 0.00 0.00 55.36 52.06 2bhu s GLN 162 Cb -0.13 -3.93 -0.04 0.00 0.80 0.00 0.00 33.01 29.70 2bhu s GLN 162 CO 0.04 -0.86 0.42 0.08 -0.50 0.00 0.00 175.29 174.47 2bhu s VAL 163 N 1.59 5.21 0.90 1.34 1.01 0.13 -0.80 120.40 129.78 2bhu s VAL 163 Ca 0.04 0.81 -0.11 0.00 0.00 0.00 0.00 61.98 62.72 2bhu s VAL 163 Cb -0.21 -3.76 0.13 0.00 0.00 0.00 0.00 36.38 32.54 2bhu s VAL 163 CO 0.07 0.31 1.10 -0.04 0.00 0.00 0.00 175.10 176.54 2bhu s MET 164 N 0.82 1.20 0.48 2.72 -1.94 -0.64 -0.99 119.30 120.95 2bhu s MET 164 Ca 0.22 1.18 -0.24 0.00 -1.71 0.00 0.00 55.69 55.14 2bhu s MET 164 Cb -0.15 -1.77 -0.07 0.00 2.01 0.00 0.00 34.83 34.85 2bhu s MET 164 CO 0.08 -2.39 1.36 -2.30 -0.01 0.00 0.00 175.02 171.77 2bhu n PRO 165 N -4.03 1.97 0.00 2.03 -0.02 -1.25 -4.63 135.00 129.06 2bhu n PRO 165 Ca 0.09 0.71 0.04 0.00 -2.02 0.00 0.00 63.50 62.32 2bhu n PRO 165 Cb 0.53 -2.55 -0.04 0.00 -0.02 0.00 0.00 33.50 31.43 2bhu n PRO 165 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2bhu n LEU 166 N -0.39 0.61 -4.78 2.45 4.77 -1.26 -4.49 117.00 113.91 2bhu n LEU 166 Ca 0.07 -0.57 -0.41 0.00 -0.03 0.00 0.00 56.01 55.08 2bhu n LEU 166 Cb 0.42 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 2bhu n LEU 166 CO 0.57 0.14 1.13 0.00 -1.33 0.00 0.00 177.39 177.89 2bhu s ALA 167 N -1.67 3.50 0.28 -1.18 0.00 -1.26 -0.30 121.76 121.13 2bhu s ALA 167 Ca 0.04 1.56 -0.30 0.00 0.00 0.00 0.00 51.96 53.26 2bhu s ALA 167 Cb 0.07 -3.61 -0.11 0.00 0.00 0.00 0.00 23.12 19.47 2bhu s ALA 167 CO 0.32 -1.09 1.51 0.00 0.00 0.00 0.00 175.76 176.50 2bhu s ALA 168 N -1.14 3.67 0.26 0.00 0.00 0.28 -4.42 121.76 120.42 2bhu s ALA 168 Ca 0.55 1.46 0.02 0.00 0.00 0.00 0.00 51.96 53.99 2bhu s ALA 168 Cb -0.46 -3.60 -0.05 0.00 0.00 0.00 0.00 23.12 19.01 2bhu s ALA 168 CO 0.62 -0.88 0.07 -0.59 0.00 0.00 0.00 175.76 174.98 2bhu s PHE 169 N -0.15 1.60 0.34 0.00 -0.12 -1.26 -0.55 117.98 117.84 2bhu s PHE 169 Ca 0.60 -1.09 -0.18 0.00 -0.05 0.00 0.00 56.93 56.22 2bhu s PHE 169 Cb -0.45 -0.96 -0.09 0.00 -0.63 0.00 0.00 43.02 40.89 2bhu s PHE 169 CO 0.48 -0.22 0.80 0.34 -0.05 0.00 0.00 175.22 176.57 2bhu s ASP 170 N -3.34 6.88 0.00 1.98 2.15 -1.26 -4.69 116.67 118.39 2bhu s ASP 170 Ca 0.35 1.43 0.00 0.00 0.43 0.00 0.00 52.55 54.76 2bhu s ASP 170 Cb 0.08 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.26 2bhu s ASP 170 CO 0.13 -0.21 0.00 0.61 -0.17 0.00 0.00 175.17 175.52 2bhu n GLY 171 N -0.27 -0.33 0.49 2.66 0.00 -1.25 -4.61 105.19 101.88 2bhu n GLY 171 Ca 0.04 -1.81 0.11 0.00 0.00 0.00 0.00 46.02 44.35 2bhu n GLY 171 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2bhu n GLN 172 N -0.37 1.20 -3.57 1.61 1.13 -1.26 -4.93 117.38 111.19 2bhu n GLN 172 Ca 0.00 -0.98 -0.11 0.00 -1.94 0.00 0.00 57.00 53.97 2bhu n GLN 172 Cb 0.00 -1.48 -0.04 0.00 0.11 0.00 0.00 30.24 28.83 2bhu n GLN 172 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 2bhu s ARG 173 N -2.48 1.18 0.00 -1.09 3.03 -1.26 -5.00 118.95 113.34 2bhu s ARG 173 Ca 0.19 -0.65 0.00 0.00 2.03 0.00 0.00 55.73 57.30 2bhu s ARG 173 Cb 0.18 0.52 0.00 0.00 -1.03 0.00 0.00 34.95 34.62 2bhu s ARG 173 CO 0.57 -0.49 0.00 0.41 -1.13 0.00 0.00 175.30 174.66 2bhu n GLY 174 N -0.29 1.27 0.24 3.88 0.00 -1.26 -3.33 105.19 105.68 2bhu n GLY 174 Ca -0.16 -0.82 -0.07 0.00 0.00 0.00 0.00 46.02 44.98 2bhu n GLY 174 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2bhu h TRP 175 N 0.00 0.70 0.00 1.61 4.06 -1.96 -3.47 115.95 116.89 2bhu h TRP 175 Ca 0.00 -0.19 0.00 0.00 2.06 0.00 0.00 58.89 60.76 2bhu h TRP 175 Cb 0.00 -0.16 0.00 0.00 -1.00 0.00 0.00 29.16 28.00 2bhu h TRP 175 CO 0.00 0.87 0.00 0.41 -3.56 0.00 0.00 178.44 176.16 2bhu n GLY 176 N -0.10 1.43 0.05 1.49 0.00 -1.26 -4.11 105.19 102.70 2bhu n GLY 176 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 2bhu n GLY 176 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bhu n TYR 177 N 0.00 0.01 -0.28 1.61 4.01 -1.26 -1.92 117.16 119.32 2bhu n TYR 177 Ca 0.00 -0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.83 2bhu n TYR 177 Cb 0.00 0.00 0.31 0.00 -0.31 0.00 0.00 39.34 39.34 2bhu n TYR 177 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2bhu n ASP 178 N -0.83 4.02 -4.57 7.72 8.00 -1.26 -4.58 116.55 125.06 2bhu n ASP 178 Ca 0.21 -2.21 -0.48 0.00 0.71 0.00 0.00 54.79 53.02 2bhu n ASP 178 Cb 0.12 -0.50 -0.03 0.00 -0.02 0.00 0.00 41.12 40.69 2bhu n ASP 178 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bhu n GLY 179 N 1.32 -0.12 0.00 0.44 0.00 -0.81 -3.65 105.19 102.36 2bhu n GLY 179 Ca 0.23 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.72 2bhu n GLY 179 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhu n ALA 180 N 1.08 1.72 -3.81 4.61 0.00 0.28 -0.92 120.51 123.47 2bhu n ALA 180 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.23 2bhu n ALA 180 Cb 0.27 0.17 -0.12 0.00 0.00 0.00 0.00 19.45 19.77 2bhu n ALA 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bhu s ALA 181 N -1.72 3.39 0.30 0.00 0.00 -1.05 -4.55 121.76 118.13 2bhu s ALA 181 Ca 0.00 -3.09 0.31 0.00 0.00 0.00 0.00 51.96 49.18 2bhu s ALA 181 Cb 0.00 -2.43 1.44 0.00 0.00 0.00 0.00 23.12 22.13 2bhu s ALA 181 CO 0.00 -2.00 2.03 0.74 0.00 0.00 0.00 175.76 176.53 2bhu h PHE 182 N 7.10 0.00 -0.01 0.00 -1.00 -1.88 -2.49 116.94 118.65 2bhu h PHE 182 Ca -0.05 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.73 2bhu h PHE 182 Cb 0.96 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.52 2bhu h PHE 182 CO 0.61 0.09 -0.25 0.66 -1.61 0.00 0.00 178.31 177.82 2bhu n TYR 183 N -3.36 0.00 -3.80 -0.55 4.01 -1.26 -4.64 117.16 107.56 2bhu n TYR 183 Ca -0.01 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.36 2bhu n TYR 183 Cb 0.28 -0.11 -0.13 0.00 -0.31 0.00 0.00 39.34 39.07 2bhu n TYR 183 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bhu s ALA 184 N -2.46 2.98 0.29 -0.72 0.00 -0.95 -4.39 121.76 116.50 2bhu s ALA 184 Ca 0.25 -1.77 -0.30 0.00 0.00 0.00 0.00 51.96 50.15 2bhu s ALA 184 Cb 0.19 -2.17 -0.10 0.00 0.00 0.00 0.00 23.12 21.04 2bhu s ALA 184 CO 0.51 -1.33 1.45 -2.14 0.00 0.00 0.00 175.76 174.26 2bhu s PRO 185 N 1.35 4.23 -0.01 0.00 0.02 -1.26 -0.56 135.00 138.78 2bhu s PRO 185 Ca -0.03 2.38 -0.30 0.00 0.02 0.00 0.00 61.00 63.07 2bhu s PRO 185 Cb -0.20 -3.07 -0.08 0.00 0.02 0.00 0.00 34.50 31.17 2bhu s PRO 185 CO 0.02 -0.44 2.02 0.98 -0.33 0.00 0.00 177.00 179.24 2bhu n TYR 186 N 1.81 2.42 -0.05 6.54 9.36 0.58 -4.67 117.16 133.15 2bhu n TYR 186 Ca 0.05 -0.34 0.02 0.00 3.32 0.00 0.00 57.90 60.96 2bhu n TYR 186 Cb 0.40 -2.79 0.35 0.00 -0.63 0.00 0.00 39.34 36.67 2bhu n TYR 186 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2bhu h ALA 187 N 11.33 1.57 0.00 2.98 0.00 -1.81 -1.83 119.26 131.50 2bhu h ALA 187 Ca -0.48 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 2bhu h ALA 187 Cb 1.24 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2bhu h ALA 187 CO 0.94 0.36 -0.01 -1.35 0.00 0.00 0.00 179.25 179.20 2bhu h PRO 188 N 0.65 0.00 0.00 0.00 0.11 -1.94 -1.08 132.00 129.74 2bhu h PRO 188 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 2bhu h PRO 188 Cb 0.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.13 2bhu h PRO 188 CO -0.03 0.01 0.00 1.88 -0.21 0.00 0.00 178.00 179.65 2bhu h TYR 189 N 0.00 0.00 0.00 0.65 0.99 -1.55 -3.44 116.97 113.61 2bhu h TYR 189 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2bhu h TYR 189 Cb 0.01 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.74 2bhu h TYR 189 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2bhu n GLY 190 N 0.96 2.50 3.90 3.88 0.00 -0.41 -1.15 105.19 114.88 2bhu n GLY 190 Ca 0.04 -1.62 -0.28 0.00 0.00 0.00 0.00 46.02 44.15 2bhu n GLY 190 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bhu s ARG 191 N -1.86 2.78 0.27 1.61 0.52 -1.26 -4.48 118.95 116.53 2bhu s ARG 191 Ca 0.00 0.22 -0.01 0.00 -0.52 0.00 0.00 55.73 55.43 2bhu s ARG 191 Cb 0.00 -2.12 0.56 0.00 0.52 0.00 0.00 34.95 33.91 2bhu s ARG 191 CO 0.00 -0.96 1.74 -1.35 0.02 0.00 0.00 175.30 174.75 2bhu h PRO 192 N -0.50 0.52 0.00 3.54 0.11 -1.92 -0.04 132.00 133.71 2bhu h PRO 192 Ca -0.45 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2bhu h PRO 192 Cb 1.26 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 2bhu h PRO 192 CO 0.63 0.35 -0.12 1.05 -0.21 0.00 0.00 178.00 179.69 2bhu h GLU 193 N 0.54 0.00 -0.19 1.05 4.11 -1.99 -0.87 114.58 117.23 2bhu h GLU 193 Ca 0.48 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.73 2bhu h GLU 193 Cb 0.74 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 2bhu h GLU 193 CO -0.41 0.12 -0.59 -0.44 0.07 0.00 0.00 179.01 177.76 2bhu h ASP 194 N 0.00 0.68 -0.25 3.06 3.32 -1.37 -0.61 116.42 121.25 2bhu h ASP 194 Ca -0.00 -0.38 -0.09 0.00 0.02 0.00 0.00 57.03 56.58 2bhu h ASP 194 Cb 0.24 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 2bhu h ASP 194 CO 0.02 1.12 -0.18 0.25 -1.72 0.00 0.00 179.24 178.72 2bhu h LEU 195 N 0.46 0.60 -0.78 1.55 5.85 -0.94 -2.20 115.31 119.84 2bhu h LEU 195 Ca -0.00 -0.44 0.08 0.00 0.84 0.00 0.00 57.88 58.35 2bhu h LEU 195 Cb 1.15 -0.17 -0.07 0.00 0.37 0.00 0.00 40.66 41.95 2bhu h LEU 195 CO 0.11 0.92 0.45 0.24 -0.34 0.00 0.00 178.44 179.82 2bhu h MET 196 N 0.29 0.77 -0.55 1.25 2.86 -1.14 -1.27 114.93 117.14 2bhu h MET 196 Ca 0.05 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2bhu h MET 196 Cb 0.72 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 2bhu h MET 196 CO 0.05 0.51 0.23 0.00 1.06 0.00 0.00 176.91 178.75 2bhu h ALA 197 N 1.41 1.37 -0.27 6.32 0.00 -0.95 0.64 119.26 127.78 2bhu h ALA 197 Ca 0.36 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 2bhu h ALA 197 Cb 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2bhu h ALA 197 CO -0.21 0.48 0.04 1.25 0.00 0.00 0.00 179.25 180.80 2bhu h LEU 198 N 0.78 0.44 -0.54 0.00 5.85 -0.70 -0.78 115.31 120.36 2bhu h LEU 198 Ca 0.19 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 58.58 2bhu h LEU 198 Cb 0.14 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2bhu h LEU 198 CO -0.02 0.59 0.09 0.58 -0.34 0.00 0.00 178.44 179.34 2bhu h VAL 199 N 0.27 1.25 -0.78 1.05 2.07 -0.95 -0.96 116.25 118.20 2bhu h VAL 199 Ca 0.08 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.66 2bhu h VAL 199 Cb 0.34 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2bhu h VAL 199 CO 0.01 0.34 0.49 -0.78 0.02 0.00 0.00 177.57 177.65 2bhu h ASP 200 N 0.77 0.92 -0.60 0.57 3.58 -0.78 -1.00 116.42 119.89 2bhu h ASP 200 Ca 0.16 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.54 2bhu h ASP 200 Cb 0.40 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.19 2bhu h ASP 200 CO 0.01 0.69 0.26 0.00 -2.88 0.00 0.00 179.24 177.32 2bhu h ALA 201 N 1.26 0.78 -0.32 -0.78 0.00 -0.88 -0.71 119.26 118.61 2bhu h ALA 201 Ca 0.28 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2bhu h ALA 201 Cb -0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 2bhu h ALA 201 CO -0.06 0.37 0.20 0.00 0.00 0.00 0.00 179.25 179.77 2bhu h ALA 202 N 1.10 0.41 -0.48 0.00 0.00 -0.80 -2.51 119.26 116.98 2bhu h ALA 202 Ca 0.20 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 2bhu h ALA 202 Cb 0.17 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2bhu h ALA 202 CO -0.02 -0.11 0.07 0.45 0.00 0.00 0.00 179.25 179.64 2bhu h HIS 203 N 0.42 0.78 -0.92 0.00 -0.00 -0.92 0.22 115.15 114.73 2bhu h HIS 203 Ca 0.11 -0.08 0.07 0.00 -0.00 0.00 0.00 60.37 60.48 2bhu h HIS 203 Cb -0.01 -0.22 -0.06 0.00 -0.00 0.00 0.00 27.41 27.12 2bhu h HIS 203 CO -0.05 0.69 0.59 -0.09 -0.00 0.00 0.00 177.93 179.08 2bhu h ARG 204 N 0.71 0.98 -0.02 2.45 2.43 -0.88 -0.33 114.38 119.72 2bhu h ARG 204 Ca 0.15 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2bhu h ARG 204 Cb 0.34 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 2bhu h ARG 204 CO 0.01 0.65 0.00 1.28 -1.51 0.00 0.00 179.97 180.40 2bhu n LEU 205 N -4.50 0.45 -0.20 3.80 4.77 -0.62 -4.91 117.00 115.78 2bhu n LEU 205 Ca 0.14 -0.17 -0.02 0.00 -0.03 0.00 0.00 56.01 55.94 2bhu n LEU 205 Cb 0.23 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2bhu n LEU 205 CO 0.32 0.08 -0.02 0.61 -1.33 0.00 0.00 177.39 177.05 2bhu n GLY 206 N 0.98 0.38 3.66 -0.72 0.00 -0.13 -5.02 105.19 104.33 2bhu n GLY 206 Ca 0.19 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.99 2bhu n GLY 206 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bhu s LEU 207 N -0.54 3.47 0.61 0.99 1.43 -0.03 -4.98 118.68 119.64 2bhu s LEU 207 Ca 0.00 0.09 -0.08 0.00 -1.03 0.00 0.00 54.13 53.12 2bhu s LEU 207 Cb 0.00 -1.80 0.00 0.00 0.03 0.00 0.00 46.19 44.42 2bhu s LEU 207 CO 0.00 0.37 0.95 -0.83 0.23 0.00 0.00 176.35 177.07 2bhu s GLY 208 N -0.91 1.60 -0.05 -3.19 0.00 -0.30 -3.50 107.32 100.97 2bhu s GLY 208 Ca 0.13 -0.53 -0.00 0.00 0.00 0.00 0.00 44.72 44.32 2bhu s GLY 208 CO 0.03 -0.24 0.00 0.14 0.00 0.00 0.00 173.10 173.03 2bhu s VAL 209 N -3.08 0.27 0.15 1.40 1.01 -1.26 -0.61 120.40 118.27 2bhu s VAL 209 Ca 0.54 0.11 0.10 0.00 0.00 0.00 0.00 61.98 62.74 2bhu s VAL 209 Cb -0.11 -0.40 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2bhu s VAL 209 CO 0.48 0.21 -0.24 -0.36 0.00 0.00 0.00 175.10 175.18 2bhu s PHE 210 N 1.53 2.19 -0.07 5.22 0.08 0.48 -0.20 117.98 127.21 2bhu s PHE 210 Ca -0.02 -0.39 0.04 0.00 0.12 0.00 0.00 56.93 56.68 2bhu s PHE 210 Cb -0.13 -1.15 -0.00 0.00 -0.57 0.00 0.00 43.02 41.17 2bhu s PHE 210 CO -0.03 0.37 -0.20 -1.17 -0.10 0.00 0.00 175.22 174.09 2bhu s LEU 211 N -2.28 1.96 -0.11 -0.37 2.96 -0.65 -0.69 118.68 119.50 2bhu s LEU 211 Ca 0.15 -0.44 -0.30 0.00 -0.22 0.00 0.00 54.13 53.32 2bhu s LEU 211 Cb -0.09 -1.17 -0.01 0.00 0.50 0.00 0.00 46.19 45.41 2bhu s LEU 211 CO 0.07 0.16 1.06 -0.62 -1.32 0.00 0.00 176.35 175.70 2bhu s ASP 212 N 0.19 7.18 0.11 3.68 -1.08 -0.16 -0.77 116.67 125.83 2bhu s ASP 212 Ca -0.10 1.58 0.07 0.00 -0.52 0.00 0.00 52.55 53.58 2bhu s ASP 212 Cb -0.15 -2.55 -0.04 0.00 -1.46 0.00 0.00 42.92 38.72 2bhu s ASP 212 CO 0.05 -0.51 -0.18 0.68 0.52 0.00 0.00 175.17 175.73 2bhu s VAL 213 N 2.21 1.55 -0.36 1.11 -7.23 -0.40 -3.88 120.40 113.40 2bhu s VAL 213 Ca 0.50 -1.61 0.03 0.00 -1.81 0.00 0.00 61.98 59.09 2bhu s VAL 213 Cb -0.19 -1.52 0.10 0.00 0.56 0.00 0.00 36.38 35.33 2bhu s VAL 213 CO 0.18 -0.21 0.08 -0.69 -0.31 0.00 0.00 175.10 174.14 2bhu s VAL 214 N -1.56 2.15 -0.18 1.32 1.01 -1.26 -0.93 120.40 120.94 2bhu s VAL 214 Ca 0.07 -2.36 0.16 0.00 0.00 0.00 0.00 61.98 59.85 2bhu s VAL 214 Cb -0.08 -2.58 0.45 0.00 0.00 0.00 0.00 36.38 34.17 2bhu s VAL 214 CO 0.04 -0.63 1.34 -1.22 0.00 0.00 0.00 175.10 174.63 2bhu n TYR 215 N 4.18 0.65 0.37 5.22 4.01 -1.26 -4.45 117.16 125.87 2bhu n TYR 215 Ca 0.04 -1.06 0.05 0.00 -0.16 0.00 0.00 57.90 56.77 2bhu n TYR 215 Cb 0.41 -0.29 -0.07 0.00 -0.31 0.00 0.00 39.34 39.08 2bhu n TYR 215 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2bhu n ASN 216 N -0.91 1.05 -3.49 7.72 0.23 -1.26 -4.81 115.26 113.79 2bhu n ASN 216 Ca 0.22 -0.54 -0.09 0.00 -0.53 0.00 0.00 54.58 53.63 2bhu n ASN 216 Cb 0.83 1.15 -0.02 0.00 -2.08 0.00 0.00 39.78 39.66 2bhu n ASN 216 CO 0.00 0.00 0.00 -1.38 -0.93 0.00 0.00 177.26 174.95 2bhu s HIS 217 N -2.25 -0.39 0.08 -2.53 -3.43 -1.26 -4.63 115.29 100.89 2bhu s HIS 217 Ca 0.02 0.25 0.03 0.00 -0.80 0.00 0.00 55.06 54.55 2bhu s HIS 217 Cb 0.08 0.54 -0.04 0.00 -1.43 0.00 0.00 32.58 31.73 2bhu s HIS 217 CO 0.46 -0.60 0.08 -0.06 -2.00 0.00 0.00 174.74 172.62 2bhu s PHE 218 N -3.21 3.20 1.04 0.38 0.08 -1.26 -4.94 117.98 113.27 2bhu s PHE 218 Ca 0.04 0.08 -0.12 0.00 0.12 0.00 0.00 56.93 57.05 2bhu s PHE 218 Cb -0.01 -1.62 0.21 0.00 -0.57 0.00 0.00 43.02 41.03 2bhu s PHE 218 CO -0.10 0.52 1.07 0.20 -0.10 0.00 0.00 175.22 176.82 2bhu s GLY 219 N -2.40 1.58 0.00 4.36 0.00 -0.10 -4.73 107.32 106.03 2bhu s GLY 219 Ca 0.29 -0.14 0.30 0.00 0.00 0.00 0.00 44.72 45.17 2bhu s GLY 219 CO 0.22 0.47 2.03 -1.55 0.00 0.00 0.00 173.10 174.28 2bhu n PRO 220 N -4.42 0.97 -3.76 2.90 -0.04 -1.26 -4.54 135.00 124.84 2bhu n PRO 220 Ca 0.05 -0.22 -0.14 0.00 -0.04 0.00 0.00 63.50 63.15 2bhu n PRO 220 Cb 0.55 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.37 2bhu n PRO 220 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2bhu s SER 221 N -2.19 -0.09 0.00 3.54 0.15 -1.26 -4.91 113.70 108.94 2bhu s SER 221 Ca 0.39 0.26 0.00 0.00 0.70 0.00 0.00 55.95 57.30 2bhu s SER 221 Cb 0.21 0.16 0.00 0.00 -1.71 0.00 0.00 66.02 64.68 2bhu s SER 221 CO 0.40 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.32 2bhu n GLY 222 N 4.01 0.56 3.47 9.45 0.00 -1.26 -4.38 105.19 117.03 2bhu n GLY 222 Ca -0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.34 2bhu n GLY 222 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2bhu s ASN 223 N -2.04 6.23 -0.10 1.61 2.47 -1.26 -4.57 114.94 117.29 2bhu s ASN 223 Ca 0.00 -0.76 0.16 0.00 0.42 0.00 0.00 52.86 52.68 2bhu s ASN 223 Cb 0.00 -2.27 0.59 0.00 -1.45 0.00 0.00 41.25 38.12 2bhu s ASN 223 CO 0.00 -0.78 1.51 -1.22 -3.72 0.00 0.00 177.10 172.89 2bhu n TYR 224 N 5.99 1.15 -0.34 0.43 4.01 -1.26 -4.63 117.16 122.50 2bhu n TYR 224 Ca -0.06 -0.64 0.04 0.00 -0.16 0.00 0.00 57.90 57.08 2bhu n TYR 224 Cb 0.46 -0.21 0.21 0.00 -0.31 0.00 0.00 39.34 39.50 2bhu n TYR 224 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2bhu h LEU 225 N 3.19 0.97 -0.33 7.72 3.38 -1.93 -0.75 115.31 127.55 2bhu h LEU 225 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2bhu h LEU 225 Cb 1.28 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2bhu h LEU 225 CO 0.17 0.60 0.00 -0.24 0.09 0.00 0.00 178.44 179.07 2bhu n SER 226 N -4.51 0.39 0.15 -0.43 2.88 -1.26 -1.46 113.62 109.38 2bhu n SER 226 Ca 0.15 0.59 -0.00 0.00 -1.33 0.00 0.00 58.87 58.28 2bhu n SER 226 Cb 0.22 -0.67 0.21 0.00 -0.75 0.00 0.00 64.21 63.22 2bhu n SER 226 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2bhu h SER 227 N 0.00 0.00 0.00 -3.46 0.02 -1.48 -3.25 113.55 105.38 2bhu h SER 227 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 2bhu h SER 227 Cb 0.37 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 2bhu h SER 227 CO 0.00 0.56 -0.41 1.88 -1.14 0.00 0.00 176.83 177.73 2bhu h TYR 228 N 0.00 0.00 -1.84 3.45 0.05 -1.30 -3.46 116.97 113.88 2bhu h TYR 228 Ca -0.01 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.69 2bhu h TYR 228 Cb 1.03 0.00 -0.27 0.00 1.01 0.00 0.00 36.73 38.50 2bhu h TYR 228 CO 0.00 1.07 -0.40 0.00 -1.05 0.00 0.00 178.16 177.78 2bhu s ALA 229 N -2.30 -1.39 0.58 3.88 0.00 -0.54 -1.50 121.76 120.50 2bhu s ALA 229 Ca -0.21 1.28 0.27 0.00 0.00 0.00 0.00 51.96 53.31 2bhu s ALA 229 Cb 0.00 -1.71 1.61 0.00 0.00 0.00 0.00 23.12 23.02 2bhu s ALA 229 CO 0.61 -1.16 2.10 -1.35 0.00 0.00 0.00 175.76 175.96 2bhu h PRO 230 N 8.14 0.00 0.00 0.00 0.11 -1.80 -2.45 132.00 136.00 2bhu h PRO 230 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 2bhu h PRO 230 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2bhu h PRO 230 CO 0.23 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 176.89 2bhu n SER 231 N -3.93 0.00 0.25 -2.05 3.41 -1.26 -1.76 113.62 108.28 2bhu n SER 231 Ca 0.02 -1.17 0.08 0.00 -0.26 0.00 0.00 58.87 57.54 2bhu n SER 231 Cb 0.32 0.00 0.61 0.00 -0.26 0.00 0.00 64.21 64.88 2bhu n SER 231 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2bhu h TYR 232 N 0.00 0.00 -2.09 7.33 0.05 -1.78 -3.45 116.97 117.03 2bhu h TYR 232 Ca 0.00 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 58.18 2bhu h TYR 232 Cb 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 36.73 37.61 2bhu h TYR 232 CO 0.00 0.10 -0.70 -0.06 -1.05 0.00 0.00 178.16 176.45 2bhu s PHE 233 N -4.75 2.42 0.04 4.88 0.08 -0.72 -1.13 117.98 118.80 2bhu s PHE 233 Ca -0.04 -0.38 0.02 0.00 0.12 0.00 0.00 56.93 56.65 2bhu s PHE 233 Cb 0.16 -1.20 -0.03 0.00 -0.57 0.00 0.00 43.02 41.38 2bhu s PHE 233 CO 0.66 0.63 -0.07 -0.08 -0.10 0.00 0.00 175.22 176.26 2bhu s THR 234 N -2.51 0.49 -2.17 0.64 -1.32 -0.01 -4.68 115.64 106.07 2bhu s THR 234 Ca 0.32 -1.16 0.19 0.00 -1.21 0.00 0.00 61.69 59.82 2bhu s THR 234 Cb -0.02 -0.69 0.44 0.00 -1.51 0.00 0.00 72.50 70.72 2bhu s THR 234 CO 0.17 -0.46 1.54 -0.90 -2.21 0.00 0.00 174.62 172.76 2bhu n ASP 235 N 1.30 1.23 -0.24 8.08 5.75 -1.26 -3.32 116.55 128.10 2bhu n ASP 235 Ca -0.22 -1.68 -0.00 0.00 -0.01 0.00 0.00 54.79 52.88 2bhu n ASP 235 Cb 0.55 -0.09 0.11 0.00 -1.03 0.00 0.00 41.12 40.67 2bhu n ASP 235 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 2bhu h ARG 236 N 1.60 0.64 -3.75 0.11 2.43 -1.94 -3.46 114.38 110.00 2bhu h ARG 236 Ca 0.00 -0.04 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 2bhu h ARG 236 Cb 0.35 -0.14 -0.10 0.00 -0.42 0.00 0.00 29.97 29.66 2bhu h ARG 236 CO 0.00 0.42 -0.18 -0.59 -1.51 0.00 0.00 179.97 178.11 2bhu s PHE 237 N -6.08 0.42 0.08 2.20 -0.12 -1.26 -5.13 117.98 108.09 2bhu s PHE 237 Ca -0.13 -0.77 -0.13 0.00 -0.05 0.00 0.00 56.93 55.85 2bhu s PHE 237 Cb 0.17 0.10 0.02 0.00 -0.63 0.00 0.00 43.02 42.67 2bhu s PHE 237 CO 0.76 -0.92 0.30 -1.12 -0.05 0.00 0.00 175.22 174.19 2bhu s SER 238 N -3.02 -0.10 0.81 1.98 0.01 -1.26 -2.54 113.70 109.58 2bhu s SER 238 Ca 0.23 -0.34 -0.05 0.00 1.31 0.00 0.00 55.95 57.10 2bhu s SER 238 Cb 0.01 0.39 0.16 0.00 0.21 0.00 0.00 66.02 66.78 2bhu s SER 238 CO 0.08 -0.71 1.03 -1.20 0.41 0.00 0.00 173.24 172.84 2bhu n SER 239 N 0.19 0.87 0.29 2.44 7.64 -0.57 -4.92 113.62 119.56 2bhu n SER 239 Ca -0.17 -1.85 0.19 0.00 1.01 0.00 0.00 58.87 58.05 2bhu n SER 239 Cb 0.61 -0.71 0.89 0.00 -1.01 0.00 0.00 64.21 63.99 2bhu n SER 239 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2bhu h ALA 240 N -1.00 1.00 -0.00 -0.43 0.00 -1.99 -3.33 119.26 113.51 2bhu h ALA 240 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2bhu h ALA 240 Cb 1.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2bhu h ALA 240 CO 0.31 0.00 -0.35 0.91 0.00 0.00 0.00 179.25 180.12 2bhu n TRP 241 N -3.03 0.00 0.00 0.00 8.01 -1.26 -5.08 117.44 116.08 2bhu n TRP 241 Ca -0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.18 2bhu n TRP 241 Cb 0.20 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.50 2bhu n TRP 241 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2bhu n GLY 242 N 1.13 -0.05 3.22 6.99 0.00 -1.25 -4.83 105.19 110.40 2bhu n GLY 242 Ca 0.02 -0.99 -0.40 0.00 0.00 0.00 0.00 46.02 44.65 2bhu n GLY 242 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2bhu n MET 243 N -0.27 0.00 -2.64 1.61 1.56 -1.26 -1.51 117.12 114.60 2bhu n MET 243 Ca 0.00 0.00 -0.41 0.00 -0.27 0.00 0.00 57.70 57.02 2bhu n MET 243 Cb 0.00 -0.98 -0.05 0.00 2.15 0.00 0.00 33.22 34.34 2bhu n MET 243 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 2bhu s GLY 244 N -0.98 2.97 -0.07 -5.12 0.00 -1.05 -4.59 107.32 98.47 2bhu s GLY 244 Ca 0.57 0.69 -0.30 0.00 0.00 0.00 0.00 44.72 45.68 2bhu s GLY 244 CO 0.63 1.48 1.14 1.08 0.00 0.00 0.00 173.10 177.42 2bhu s LEU 245 N -0.43 4.27 -0.76 0.66 1.02 -1.26 -0.83 118.68 121.34 2bhu s LEU 245 Ca 0.46 1.72 -0.21 0.00 0.02 0.00 0.00 54.13 56.13 2bhu s LEU 245 Cb -0.26 -3.56 0.10 0.00 0.02 0.00 0.00 46.19 42.49 2bhu s LEU 245 CO 0.33 -0.54 1.00 -0.62 0.02 0.00 0.00 176.35 176.54 2bhu s ASP 246 N 1.35 6.36 0.00 2.29 -1.08 -0.29 -4.77 116.67 120.53 2bhu s ASP 246 Ca 0.53 -1.46 0.24 0.00 -0.52 0.00 0.00 52.55 51.35 2bhu s ASP 246 Cb -0.23 -2.40 1.45 0.00 -1.46 0.00 0.00 42.92 40.28 2bhu s ASP 246 CO 0.21 -1.26 1.85 -1.22 0.52 0.00 0.00 175.17 175.27 2bhu n TYR 247 N 7.12 0.00 0.67 -5.34 4.01 -1.26 -1.39 117.16 120.97 2bhu n TYR 247 Ca 0.07 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.94 2bhu n TYR 247 Cb 0.47 0.00 0.45 0.00 -0.31 0.00 0.00 39.34 39.94 2bhu n TYR 247 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2bhu n ALA 248 N -0.94 2.25 -2.56 -0.72 0.00 -1.26 -4.72 120.51 112.55 2bhu n ALA 248 Ca 0.18 -0.03 -0.41 0.00 0.00 0.00 0.00 53.44 53.18 2bhu n ALA 248 Cb 0.08 -1.46 -0.08 0.00 0.00 0.00 0.00 19.45 17.99 2bhu n ALA 248 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2bhu s GLU 249 N -3.10 3.62 0.33 0.00 2.56 -0.48 -4.97 118.70 116.66 2bhu s GLU 249 Ca 0.11 -0.19 0.08 0.00 0.00 0.00 0.00 54.97 54.97 2bhu s GLU 249 Cb 0.13 -3.80 0.77 0.00 2.00 0.00 0.00 34.13 33.23 2bhu s GLU 249 CO 0.57 -0.62 1.82 -1.35 -0.56 0.00 0.00 175.26 175.13 2bhu h PRO 250 N 8.45 0.72 -0.02 4.30 0.11 -1.86 -0.63 132.00 143.07 2bhu h PRO 250 Ca -0.28 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.74 2bhu h PRO 250 Cb 1.13 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 2bhu h PRO 250 CO 0.76 0.48 -0.21 0.45 -0.21 0.00 0.00 178.00 179.26 2bhu h HIS 251 N 0.74 0.04 -0.25 0.65 3.86 -1.93 -0.20 115.15 118.07 2bhu h HIS 251 Ca 0.52 -0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.62 2bhu h HIS 251 Cb 0.82 -0.01 -0.00 0.00 1.06 0.00 0.00 27.41 29.27 2bhu h HIS 251 CO -0.00 0.25 -0.25 1.98 0.86 0.00 0.00 177.93 180.77 2bhu h MET 252 N 0.03 0.60 -0.41 2.45 -1.53 -1.40 -1.30 114.93 113.38 2bhu h MET 252 Ca 0.00 -0.32 0.05 0.00 -3.44 0.00 0.00 59.70 56.00 2bhu h MET 252 Cb 0.40 0.01 -0.05 0.00 -0.55 0.00 0.00 31.60 31.41 2bhu h MET 252 CO 0.03 0.92 0.13 0.00 0.14 0.00 0.00 176.91 178.13 2bhu h ARG 253 N 0.31 0.27 0.00 0.39 3.08 -1.01 -2.50 114.38 114.93 2bhu h ARG 253 Ca 0.04 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.00 2bhu h ARG 253 Cb 0.81 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 2bhu h ARG 253 CO 0.06 0.18 -0.34 0.00 -1.07 0.00 0.00 179.97 178.80 2bhu h ARG 254 N 0.28 0.00 -0.35 0.04 3.08 -1.00 -0.49 114.38 115.94 2bhu h ARG 254 Ca 0.19 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.26 2bhu h ARG 254 Cb 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 2bhu h ARG 254 CO -0.21 0.34 0.18 -0.92 -1.07 0.00 0.00 179.97 178.29 2bhu h TYR 255 N 0.00 0.34 0.20 3.04 3.20 -0.77 0.12 116.97 123.09 2bhu h TYR 255 Ca -0.00 0.01 -0.31 0.00 3.14 0.00 0.00 58.73 61.57 2bhu h TYR 255 Cb 0.79 -0.10 0.03 0.00 1.54 0.00 0.00 36.73 38.99 2bhu h TYR 255 CO 0.00 0.19 -1.37 -0.39 -1.64 0.00 0.00 178.16 174.94 2bhu h VAL 256 N 0.38 1.33 -0.03 1.81 -1.51 -1.35 -2.61 116.25 114.27 2bhu h VAL 256 Ca 0.15 -2.73 -0.14 0.00 -1.23 0.00 0.00 66.70 62.75 2bhu h VAL 256 Cb 0.04 2.94 -0.02 0.00 -2.13 0.00 0.00 31.29 32.13 2bhu h VAL 256 CO -0.09 0.82 -0.62 0.71 -1.23 0.00 0.00 177.57 177.16 2bhu h THR 257 N 0.16 1.42 -0.11 7.19 1.35 -1.03 -1.04 112.91 120.85 2bhu h THR 257 Ca -0.21 -2.07 -0.09 0.00 -0.55 0.00 0.00 66.41 63.48 2bhu h THR 257 Cb 2.07 2.09 -0.01 0.00 -1.73 0.00 0.00 68.15 70.57 2bhu h THR 257 CO 0.25 0.60 -0.36 1.23 -0.25 0.00 0.00 175.52 176.99 2bhu h GLY 258 N 1.70 0.24 0.84 5.82 0.00 -0.84 -1.95 103.07 108.88 2bhu h GLY 258 Ca -0.01 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 2bhu h GLY 258 CO 0.09 0.19 -0.09 -0.57 0.00 0.00 0.00 176.54 176.16 2bhu h ASN 259 N 0.19 0.49 -0.77 0.19 -0.73 -1.03 -0.87 115.58 113.05 2bhu h ASN 259 Ca 0.02 -0.39 0.04 0.00 1.87 0.00 0.00 56.30 57.84 2bhu h ASN 259 Cb 0.73 -0.14 -0.05 0.00 0.27 0.00 0.00 38.32 39.13 2bhu h ASN 259 CO 0.06 0.77 0.48 0.00 -0.37 0.00 0.00 177.43 178.37 2bhu h ALA 260 N 0.73 1.02 -0.46 1.57 0.00 -1.04 -1.69 119.26 119.40 2bhu h ALA 260 Ca 0.06 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 2bhu h ALA 260 Cb 0.58 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2bhu h ALA 260 CO 0.03 0.27 -0.14 0.00 0.00 0.00 0.00 179.25 179.41 2bhu h ARG 261 N 0.94 0.86 0.15 0.00 3.08 -1.20 -2.29 114.38 115.91 2bhu h ARG 261 Ca 0.31 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 2bhu h ARG 261 Cb 0.04 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.03 2bhu h ARG 261 CO -0.12 0.94 -0.10 1.98 -1.07 0.00 0.00 179.97 181.60 2bhu h MET 262 N 0.76 -0.24 -0.57 0.04 4.05 -0.46 0.75 114.93 119.26 2bhu h MET 262 Ca 0.12 0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.60 2bhu h MET 262 Cb 0.66 0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 31.47 2bhu h MET 262 CO 0.05 -0.16 0.31 -1.49 0.23 0.00 0.00 176.91 175.85 2bhu h TRP 263 N -0.25 0.58 -0.03 1.39 -0.00 -1.15 0.66 115.95 117.14 2bhu h TRP 263 Ca -0.01 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 58.88 2bhu h TRP 263 Cb 0.22 -0.18 0.00 0.00 -0.00 0.00 0.00 29.16 29.20 2bhu h TRP 263 CO -0.09 0.30 -0.07 -0.07 -0.00 0.00 0.00 178.44 178.50 2bhu h LEU 264 N 0.60 0.12 0.03 -4.49 3.38 -1.35 -2.55 115.31 111.06 2bhu h LEU 264 Ca 0.24 -0.59 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 2bhu h LEU 264 Cb 0.11 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2bhu h LEU 264 CO -0.14 0.68 -0.02 -0.09 0.09 0.00 0.00 178.44 178.97 2bhu h ARG 265 N -0.44 -0.04 0.00 1.13 2.43 -0.81 -2.37 114.38 114.28 2bhu h ARG 265 Ca -0.00 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.00 2bhu h ARG 265 Cb 0.67 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 2bhu h ARG 265 CO 0.02 0.62 -0.90 -0.44 -1.51 0.00 0.00 179.97 177.76 2bhu h ASP 266 N -0.93 0.00 -0.01 -3.80 3.32 -1.01 -3.32 116.42 110.67 2bhu h ASP 266 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2bhu h ASP 266 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 2bhu h ASP 266 CO 0.01 0.81 -0.29 -1.22 -1.72 0.00 0.00 179.24 176.83 2bhu n TYR 267 N -3.26 0.00 -1.68 4.55 4.01 -1.07 -5.01 117.16 114.69 2bhu n TYR 267 Ca -0.01 0.00 -0.14 0.00 -0.16 0.00 0.00 57.90 57.59 2bhu n TYR 267 Cb 0.87 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.86 2bhu n TYR 267 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 2bhu n HIS 268 N -0.03 -0.22 -1.88 -0.72 8.25 -0.89 -4.85 115.22 114.88 2bhu n HIS 268 Ca 0.07 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.16 2bhu n HIS 268 Cb 0.34 -2.67 0.05 0.00 1.12 0.00 0.00 29.99 28.82 2bhu n HIS 268 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2bhu s PHE 269 N -2.58 2.25 -0.68 4.41 0.08 -0.98 -4.90 117.98 115.58 2bhu s PHE 269 Ca 0.00 1.50 0.23 0.00 0.12 0.00 0.00 56.93 58.79 2bhu s PHE 269 Cb 0.00 -3.57 0.16 0.00 -0.57 0.00 0.00 43.02 39.04 2bhu s PHE 269 CO 0.00 -2.52 1.14 -0.25 -0.10 0.00 0.00 175.22 173.48 2bhu n ASP 270 N -1.76 0.63 -3.57 1.36 8.00 0.72 -4.56 116.55 117.37 2bhu n ASP 270 Ca 0.15 -0.17 0.03 0.00 0.71 0.00 0.00 54.79 55.51 2bhu n ASP 270 Cb 0.49 0.59 -0.00 0.00 -0.02 0.00 0.00 41.12 42.18 2bhu n ASP 270 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2bhu s GLY 271 N -3.55 -0.48 0.04 0.44 0.00 -1.23 -1.50 107.32 101.04 2bhu s GLY 271 Ca 0.05 0.99 0.07 0.00 0.00 0.00 0.00 44.72 45.84 2bhu s GLY 271 CO 0.77 0.20 -0.21 1.08 0.00 0.00 0.00 173.10 174.95 2bhu s LEU 272 N -2.93 2.16 -0.30 0.66 1.43 -0.41 -1.63 118.68 117.65 2bhu s LEU 272 Ca 0.15 -0.52 -0.07 0.00 -1.03 0.00 0.00 54.13 52.65 2bhu s LEU 272 Cb 0.07 -0.97 0.01 0.00 0.03 0.00 0.00 46.19 45.33 2bhu s LEU 272 CO -0.06 0.16 0.10 -0.60 0.23 0.00 0.00 176.35 176.18 2bhu s ARG 273 N -1.16 3.11 -0.34 1.70 3.00 0.06 -0.54 118.95 124.77 2bhu s ARG 273 Ca 0.07 -0.85 -0.23 0.00 -1.00 0.00 0.00 55.73 53.72 2bhu s ARG 273 Cb -0.09 -3.43 0.00 0.00 0.00 0.00 0.00 34.95 31.44 2bhu s ARG 273 CO 0.02 -0.46 0.77 -0.51 0.00 0.00 0.00 175.30 175.12 2bhu s LEU 274 N 1.52 4.12 0.36 -0.88 1.43 -0.47 -1.28 118.68 123.48 2bhu s LEU 274 Ca 0.03 0.46 -0.28 0.00 -1.03 0.00 0.00 54.13 53.31 2bhu s LEU 274 Cb -0.17 -3.02 -0.10 0.00 0.03 0.00 0.00 46.19 42.93 2bhu s LEU 274 CO 0.03 -0.67 1.34 -0.62 0.23 0.00 0.00 176.35 176.66 2bhu s ASP 275 N 1.75 6.55 -1.36 2.29 2.15 -0.11 -1.06 116.67 126.87 2bhu s ASP 275 Ca 0.31 2.75 -0.16 0.00 0.43 0.00 0.00 52.55 55.88 2bhu s ASP 275 Cb -0.14 -2.65 0.02 0.00 -0.30 0.00 0.00 42.92 39.85 2bhu s ASP 275 CO 0.15 -0.70 0.41 0.00 -0.17 0.00 0.00 175.17 174.86 2bhu n ALA 276 N 0.52 -2.30 0.32 3.66 0.00 -1.14 -4.52 120.51 117.06 2bhu n ALA 276 Ca 0.01 -0.44 0.20 0.00 0.00 0.00 0.00 53.44 53.21 2bhu n ALA 276 Cb 0.42 -1.94 1.10 0.00 0.00 0.00 0.00 19.45 19.02 2bhu n ALA 276 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2bhu h THR 277 N -2.14 0.22 -0.02 0.00 1.35 -1.52 -2.02 112.91 108.78 2bhu h THR 277 Ca -0.68 -0.01 0.01 0.00 -0.55 0.00 0.00 66.41 65.18 2bhu h THR 277 Cb 1.39 1.00 -0.00 0.00 -1.73 0.00 0.00 68.15 68.82 2bhu h THR 277 CO 0.60 0.00 0.04 -0.65 -0.25 0.00 0.00 175.52 175.26 2bhu h PRO 278 N 0.00 0.00 -0.60 4.72 0.11 -1.89 -2.35 132.00 131.99 2bhu h PRO 278 Ca -0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2bhu h PRO 278 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2bhu h PRO 278 CO 0.00 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.45 2bhu n TYR 279 N -3.54 0.79 -2.68 0.65 4.01 -0.76 -4.61 117.16 111.02 2bhu n TYR 279 Ca -0.02 -0.40 -0.43 0.00 -0.16 0.00 0.00 57.90 56.89 2bhu n TYR 279 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 2bhu n TYR 279 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2bhu n MET 280 N 1.52 3.35 -2.70 -0.72 2.81 -0.89 -4.80 117.12 115.70 2bhu n MET 280 Ca 0.22 -3.60 -0.42 0.00 -1.81 0.00 0.00 57.70 52.09 2bhu n MET 280 Cb 0.59 -3.13 -0.03 0.00 -0.71 0.00 0.00 33.22 29.95 2bhu n MET 280 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2bhu s THR 281 N 1.97 4.83 -0.23 2.03 2.01 -1.26 -4.96 115.64 120.02 2bhu s THR 281 Ca 0.45 2.04 -0.11 0.00 0.31 0.00 0.00 61.69 64.37 2bhu s THR 281 Cb 0.02 -4.31 0.08 0.00 0.01 0.00 0.00 72.50 68.31 2bhu s THR 281 CO 0.01 0.14 0.54 -0.62 -0.69 0.00 0.00 174.62 174.00 2bhu s ASP 282 N 1.02 -0.70 0.00 3.53 2.15 -1.26 -4.51 116.67 116.91 2bhu s ASP 282 Ca 0.52 1.22 0.22 0.00 0.43 0.00 0.00 52.55 54.93 2bhu s ASP 282 Cb -0.21 1.32 0.47 0.00 -0.30 0.00 0.00 42.92 44.20 2bhu s ASP 282 CO 0.27 -0.22 1.41 0.47 -0.17 0.00 0.00 175.17 176.93 2bhu n ASP 283 N 4.68 3.54 -4.73 -0.34 8.00 -1.26 -4.90 116.55 121.55 2bhu n ASP 283 Ca -0.18 -1.98 -0.33 0.00 0.71 0.00 0.00 54.79 53.01 2bhu n ASP 283 Cb 0.54 -0.31 0.10 0.00 -0.02 0.00 0.00 41.12 41.42 2bhu n ASP 283 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2bhu s SER 284 N -1.28 4.20 0.13 -2.24 0.01 -1.26 -4.93 113.70 108.34 2bhu s SER 284 Ca 0.40 2.22 -0.32 0.00 1.31 0.00 0.00 55.95 59.56 2bhu s SER 284 Cb 0.22 -2.57 -0.09 0.00 0.21 0.00 0.00 66.02 63.79 2bhu s SER 284 CO 0.30 -2.25 1.55 -0.08 0.41 0.00 0.00 173.24 173.18 2bhu h GLU 285 N -0.53 -0.38 -4.90 12.44 4.81 -1.99 -3.33 114.58 120.69 2bhu h GLU 285 Ca -0.46 0.03 -0.67 0.00 -0.13 0.00 0.00 59.36 58.13 2bhu h GLU 285 Cb 1.28 0.09 -0.17 0.00 0.63 0.00 0.00 28.75 30.57 2bhu h GLU 285 CO 0.49 -0.25 -0.33 0.99 -0.73 0.00 0.00 179.01 179.19 2bhu s THR 286 N -5.67 5.19 0.53 0.32 2.01 -1.26 -5.06 115.64 111.70 2bhu s THR 286 Ca -0.14 -0.01 -0.22 0.00 0.31 0.00 0.00 61.69 61.63 2bhu s THR 286 Cb 0.09 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.74 2bhu s THR 286 CO 0.62 -0.08 1.27 -2.28 -0.69 0.00 0.00 174.62 173.46 2bhu s HIS 287 N 1.96 2.50 0.49 4.92 2.46 -1.25 -4.83 115.29 121.52 2bhu s HIS 287 Ca 0.11 1.45 0.20 0.00 0.47 0.00 0.00 55.06 57.29 2bhu s HIS 287 Cb -0.17 -3.61 1.24 0.00 -0.13 0.00 0.00 32.58 29.92 2bhu s HIS 287 CO 0.11 -2.32 1.99 0.97 -2.47 0.00 0.00 174.74 173.02 2bhu h ILE 288 N 1.48 0.80 -0.59 0.89 6.09 -1.92 -0.48 117.51 123.78 2bhu h ILE 288 Ca -0.50 -0.06 -0.06 0.00 -1.37 0.00 0.00 64.86 62.87 2bhu h ILE 288 Cb 1.28 0.61 -0.02 0.00 0.47 0.00 0.00 36.82 39.16 2bhu h ILE 288 CO 0.58 0.03 0.15 -0.07 -3.07 0.00 0.00 178.15 175.77 2bhu h LEU 289 N 0.17 0.89 -0.63 2.19 3.38 -1.93 0.13 115.31 119.51 2bhu h LEU 289 Ca 0.27 -0.23 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 2bhu h LEU 289 Cb 0.82 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 2bhu h LEU 289 CO -0.04 0.89 0.19 0.74 0.09 0.00 0.00 178.44 180.30 2bhu h THR 290 N 0.85 1.25 -0.14 0.22 2.02 -1.30 -2.05 112.91 113.76 2bhu h THR 290 Ca 0.19 -0.86 -0.11 0.00 0.77 0.00 0.00 66.41 66.39 2bhu h THR 290 Cb 0.34 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2bhu h THR 290 CO 0.00 0.33 -0.42 -0.08 0.37 0.00 0.00 175.52 175.72 2bhu h GLU 291 N 0.91 0.32 -0.32 6.66 4.81 -1.01 -0.57 114.58 125.37 2bhu h GLU 291 Ca 0.20 -0.16 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 2bhu h GLU 291 Cb 0.30 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.67 2bhu h GLU 291 CO -0.00 0.69 0.20 -0.07 -0.73 0.00 0.00 179.01 179.09 2bhu h LEU 292 N 0.27 0.34 -0.73 1.64 3.38 -0.58 0.91 115.31 120.53 2bhu h LEU 292 Ca 0.02 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2bhu h LEU 292 Cb 0.85 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 2bhu h LEU 292 CO 0.07 0.25 0.35 0.00 0.09 0.00 0.00 178.44 179.19 2bhu h ALA 293 N 1.13 0.95 -0.57 1.53 0.00 -0.94 -0.98 119.26 120.37 2bhu h ALA 293 Ca 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2bhu h ALA 293 Cb -0.03 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 2bhu h ALA 293 CO -0.04 0.52 0.24 1.96 0.00 0.00 0.00 179.25 181.93 2bhu h GLN 294 N 1.03 0.85 -0.21 0.00 4.20 -0.59 0.95 115.11 121.34 2bhu h GLN 294 Ca 0.25 -0.15 -0.10 0.00 0.06 0.00 0.00 58.65 58.71 2bhu h GLN 294 Cb 0.13 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2bhu h GLN 294 CO -0.03 0.73 -0.32 0.93 -0.67 0.00 0.00 178.83 179.47 2bhu h GLU 295 N 0.79 0.42 -0.08 1.46 4.39 -0.50 -1.18 114.58 119.88 2bhu h GLU 295 Ca 0.19 -0.18 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 2bhu h GLU 295 Cb 0.19 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2bhu h GLU 295 CO -0.02 0.70 -0.11 0.82 -1.16 0.00 0.00 179.01 179.24 2bhu h ILE 296 N 0.36 1.38 -0.08 3.13 5.03 -1.02 -3.17 117.51 123.14 2bhu h ILE 296 Ca 0.05 -1.31 0.02 0.00 -0.12 0.00 0.00 64.86 63.50 2bhu h ILE 296 Cb 0.74 2.06 -0.00 0.00 -3.03 0.00 0.00 36.82 36.59 2bhu h ILE 296 CO 0.06 0.37 0.07 0.45 -0.68 0.00 0.00 178.15 178.41 2bhu h HIS 297 N -0.22 0.00 0.00 1.37 3.86 -0.52 -1.87 115.15 117.77 2bhu h HIS 297 Ca 0.01 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.19 2bhu h HIS 297 Cb 0.64 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.11 2bhu h HIS 297 CO 0.10 0.00 -0.13 1.49 0.86 0.00 0.00 177.93 180.25 2bhu h GLU 298 N 0.00 0.00 0.00 2.45 4.22 -1.19 -1.89 114.58 118.17 2bhu h GLU 298 Ca 0.04 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.48 2bhu h GLU 298 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 2bhu h GLU 298 CO -0.00 0.13 0.00 -0.07 -2.18 0.00 0.00 179.01 176.89 2bhu h LEU 299 N 0.00 0.00 0.41 1.64 3.38 -1.43 -3.46 115.31 115.84 2bhu h LEU 299 Ca -0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2bhu h LEU 299 Cb 0.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 2bhu h LEU 299 CO 0.02 0.00 -0.11 0.61 0.09 0.00 0.00 178.44 179.05 2bhu n GLY 300 N -0.65 0.25 0.00 0.83 0.00 -0.71 -5.02 105.19 99.89 2bhu n GLY 300 Ca -0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2bhu n GLY 300 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhu n GLY 301 N -0.98 5.37 0.28 -0.02 0.00 -1.26 -5.06 105.19 103.52 2bhu n GLY 301 Ca -0.04 -1.91 0.08 0.00 0.00 0.00 0.00 46.02 44.15 2bhu n GLY 301 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bhu n THR 302 N 0.00 1.84 -2.04 2.61 -2.24 -1.26 -5.04 114.28 108.15 2bhu n THR 302 Ca 0.00 -2.41 -0.37 0.00 -2.27 0.00 0.00 64.05 59.00 2bhu n THR 302 Cb 0.00 -0.17 0.02 0.00 -2.10 0.00 0.00 70.33 68.08 2bhu n THR 302 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 2bhu s HIS 303 N -2.77 2.51 0.32 4.78 4.02 -1.26 -4.71 115.29 118.18 2bhu s HIS 303 Ca 0.32 1.49 0.09 0.00 1.02 0.00 0.00 55.06 57.98 2bhu s HIS 303 Cb 0.29 -3.51 -0.04 0.00 -1.02 0.00 0.00 32.58 28.30 2bhu s HIS 303 CO -0.01 -2.14 0.09 -0.51 1.02 0.00 0.00 174.74 173.20 2bhu s LEU 304 N -3.64 3.21 -0.19 0.89 1.43 -0.56 -4.95 118.68 114.86 2bhu s LEU 304 Ca 0.72 -0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 53.02 2bhu s LEU 304 Cb -0.32 -1.68 0.06 0.00 0.03 0.00 0.00 46.19 44.28 2bhu s LEU 304 CO 0.36 -0.22 0.05 -0.22 0.23 0.00 0.00 176.35 176.55 2bhu s LEU 305 N -3.79 1.03 0.20 1.79 2.96 -1.26 -1.29 118.68 118.31 2bhu s LEU 305 Ca 0.36 -0.81 -0.05 0.00 -0.22 0.00 0.00 54.13 53.41 2bhu s LEU 305 Cb -0.03 -0.53 -0.05 0.00 0.50 0.00 0.00 46.19 46.08 2bhu s LEU 305 CO 0.22 -0.32 0.44 -0.76 -1.32 0.00 0.00 176.35 174.61 2bhu s LEU 306 N 1.91 4.20 -0.15 -0.68 2.01 0.30 -1.05 118.68 125.22 2bhu s LEU 306 Ca 0.00 0.63 -0.04 0.00 0.01 0.00 0.00 54.13 54.73 2bhu s LEU 306 Cb -0.17 -3.39 -0.03 0.00 0.01 0.00 0.00 46.19 42.62 2bhu s LEU 306 CO -0.09 -0.04 -0.04 0.00 1.01 0.00 0.00 176.35 177.20 2bhu s ALA 307 N -1.81 3.00 -0.73 4.21 0.00 -0.45 -1.36 121.76 124.62 2bhu s ALA 307 Ca 0.42 -0.82 -0.21 0.00 0.00 0.00 0.00 51.96 51.35 2bhu s ALA 307 Cb -0.11 -1.55 0.09 0.00 0.00 0.00 0.00 23.12 21.55 2bhu s ALA 307 CO 0.26 0.22 0.99 -2.00 0.00 0.00 0.00 175.76 175.23 2bhu s GLU 308 N 0.33 3.25 -0.03 0.00 2.12 -0.23 -0.66 118.70 123.49 2bhu s GLU 308 Ca -0.04 -1.16 -0.01 0.00 0.36 0.00 0.00 54.97 54.12 2bhu s GLU 308 Cb -0.14 -4.45 0.03 0.00 0.26 0.00 0.00 34.13 29.83 2bhu s GLU 308 CO 0.03 -1.78 0.03 0.34 -0.54 0.00 0.00 175.26 173.34 2bhu s ASP 309 N 3.68 0.54 0.00 -1.70 -1.08 -1.25 -1.84 116.67 115.03 2bhu s ASP 309 Ca 0.24 0.03 0.27 0.00 -0.52 0.00 0.00 52.55 52.57 2bhu s ASP 309 Cb -0.14 -0.14 0.76 0.00 -1.46 0.00 0.00 42.92 41.94 2bhu s ASP 309 CO 0.04 -0.16 1.58 0.00 0.52 0.00 0.00 175.17 177.14 2bhu n HIS 310 N 4.55 0.00 1.06 -5.34 1.44 -1.26 -4.44 115.22 111.23 2bhu n HIS 310 Ca -0.19 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.65 2bhu n HIS 310 Cb 0.50 -0.02 0.62 0.00 0.12 0.00 0.00 29.99 31.21 2bhu n HIS 310 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2bhu n ARG 311 N 0.27 0.12 -3.51 -1.40 1.74 -1.26 -4.93 116.66 107.70 2bhu n ARG 311 Ca 0.16 0.03 -0.23 0.00 -0.77 0.00 0.00 57.85 57.04 2bhu n ARG 311 Cb 0.41 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.41 2bhu n ARG 311 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2bhu n ASN 312 N -1.43 -4.88 -4.00 0.55 3.02 -1.26 -3.54 115.26 103.71 2bhu n ASN 312 Ca 0.09 -0.85 -0.31 0.00 -0.03 0.00 0.00 54.58 53.48 2bhu n ASN 312 Cb 0.29 -4.28 -0.14 0.00 -0.61 0.00 0.00 39.78 35.05 2bhu n ASN 312 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2bhu s LEU 313 N -6.10 4.62 0.21 3.41 2.96 -1.26 -1.58 118.68 120.94 2bhu s LEU 313 Ca 0.36 -2.58 0.15 0.00 -0.22 0.00 0.00 54.13 51.84 2bhu s LEU 313 Cb -0.09 -1.66 0.78 0.00 0.50 0.00 0.00 46.19 45.72 2bhu s LEU 313 CO 0.80 -0.32 1.45 -2.65 -1.32 0.00 0.00 176.35 174.31 2bhu n PRO 314 N 3.71 0.09 0.29 0.98 -0.02 -1.26 -2.56 135.00 136.23 2bhu n PRO 314 Ca 0.04 0.57 0.15 0.00 -2.02 0.00 0.00 63.50 62.25 2bhu n PRO 314 Cb 0.37 -1.80 0.87 0.00 -0.02 0.00 0.00 33.50 32.92 2bhu n PRO 314 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2bhu h ASP 315 N 0.00 0.00 -0.73 2.55 5.19 -1.95 -1.44 116.42 120.04 2bhu h ASP 315 Ca 0.00 0.00 0.07 0.00 -0.62 0.00 0.00 57.03 56.48 2bhu h ASP 315 Cb 0.03 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 39.49 2bhu h ASP 315 CO 0.00 0.05 0.48 -0.07 -3.12 0.00 0.00 179.24 176.58 2bhu h LEU 316 N 0.00 0.65 0.01 1.55 3.38 -1.90 0.71 115.31 119.71 2bhu h LEU 316 Ca -0.00 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 2bhu h LEU 316 Cb 0.18 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2bhu h LEU 316 CO 0.01 0.41 -0.78 0.58 0.09 0.00 0.00 178.44 178.74 2bhu h VAL 317 N 0.73 1.27 0.00 1.22 2.07 -1.55 -1.21 116.25 118.78 2bhu h VAL 317 Ca 0.32 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 65.57 2bhu h VAL 317 Cb 0.31 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 32.80 2bhu h VAL 317 CO -0.11 0.46 -0.28 0.71 0.02 0.00 0.00 177.57 178.37 2bhu h THR 318 N -0.94 0.00 0.00 2.57 1.35 -1.12 -2.64 112.91 112.14 2bhu h THR 318 Ca -0.21 -0.90 -0.09 0.00 -0.55 0.00 0.00 66.41 64.66 2bhu h THR 318 Cb 1.23 1.76 -0.01 0.00 -1.73 0.00 0.00 68.15 69.39 2bhu h THR 318 CO -0.10 0.00 -1.23 0.52 -0.25 0.00 0.00 175.52 174.46 2bhu n VAL 319 N -2.83 0.40 0.53 6.82 0.31 0.11 -4.71 118.33 118.95 2bhu n VAL 319 Ca 0.03 -0.04 0.13 0.00 -0.01 0.00 0.00 64.34 64.45 2bhu n VAL 319 Cb 0.52 -1.59 0.36 0.00 -0.91 0.00 0.00 33.84 32.21 2bhu n VAL 319 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 2bhu h ASN 320 N -0.21 0.00 -1.19 4.52 -0.26 -1.26 -3.48 115.58 113.71 2bhu h ASN 320 Ca -0.13 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.42 2bhu h ASN 320 Cb 1.05 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.29 2bhu h ASN 320 CO -0.08 0.00 -0.23 1.41 -1.06 0.00 0.00 177.43 177.47 2bhu n HIS 321 N -2.46 -0.38 -1.58 1.19 8.25 -0.99 -4.22 115.22 115.03 2bhu n HIS 321 Ca 0.05 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.21 2bhu n HIS 321 Cb 0.45 -2.23 0.08 0.00 1.12 0.00 0.00 29.99 29.41 2bhu n HIS 321 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2bhu s LEU 322 N -2.55 2.71 0.01 2.41 1.43 -0.47 -4.93 118.68 117.29 2bhu s LEU 322 Ca 0.00 1.34 0.16 0.00 -1.03 0.00 0.00 54.13 54.60 2bhu s LEU 322 Cb 0.00 -4.02 -0.17 0.00 0.03 0.00 0.00 46.19 42.03 2bhu s LEU 322 CO 0.00 -1.83 0.73 0.47 0.23 0.00 0.00 176.35 175.95 2bhu n ASP 323 N -3.35 0.81 -3.76 2.29 8.00 -0.22 -4.35 116.55 115.97 2bhu n ASP 323 Ca 0.07 0.37 0.02 0.00 0.71 0.00 0.00 54.79 55.96 2bhu n ASP 323 Cb 0.56 0.16 0.01 0.00 -0.02 0.00 0.00 41.12 41.83 2bhu n ASP 323 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2bhu s GLY 324 N -4.92 -0.15 -0.02 0.44 0.00 -1.22 -4.52 107.32 96.93 2bhu s GLY 324 Ca -0.04 0.10 -0.00 0.00 0.00 0.00 0.00 44.72 44.78 2bhu s GLY 324 CO 0.82 4.56 0.03 -0.42 0.00 0.00 0.00 173.10 178.09 2bhu s ILE 325 N -2.09 -0.04 -0.37 0.90 1.01 -0.08 -1.34 121.20 119.19 2bhu s ILE 325 Ca 0.27 0.14 -0.29 0.00 0.00 0.00 0.00 60.65 60.76 2bhu s ILE 325 Cb 0.00 -0.07 -0.00 0.00 0.01 0.00 0.00 42.46 42.40 2bhu s ILE 325 CO -0.01 0.06 1.56 0.26 0.00 0.00 0.00 174.94 176.81 2bhu s TRP 326 N 0.69 2.17 -0.12 3.97 0.52 0.17 -0.70 118.94 125.64 2bhu s TRP 326 Ca -0.06 0.65 0.01 0.00 0.02 0.00 0.00 56.10 56.73 2bhu s TRP 326 Cb -0.08 -4.23 -0.01 0.00 -1.15 0.00 0.00 33.47 28.00 2bhu s TRP 326 CO -0.02 -2.38 -0.17 0.99 0.02 0.00 0.00 176.95 175.39 2bhu s THR 327 N 5.94 2.68 -1.93 2.01 2.01 -0.79 -3.74 115.64 121.82 2bhu s THR 327 Ca 0.69 -0.79 0.16 0.00 0.31 0.00 0.00 61.69 62.05 2bhu s THR 327 Cb -0.17 -2.10 0.14 0.00 0.01 0.00 0.00 72.50 70.38 2bhu s THR 327 CO 0.33 0.54 1.02 0.47 -0.69 0.00 0.00 174.62 176.28 2bhu n ASP 328 N 3.56 2.37 -0.37 3.53 8.00 -1.26 -4.37 116.55 128.01 2bhu n ASP 328 Ca -0.18 -1.68 0.04 0.00 0.71 0.00 0.00 54.79 53.68 2bhu n ASP 328 Cb 0.53 -0.02 0.20 0.00 -0.02 0.00 0.00 41.12 41.81 2bhu n ASP 328 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 2bhu h ASP 329 N 3.07 0.99 0.03 -2.24 3.32 -1.94 -0.28 116.42 119.38 2bhu h ASP 329 Ca 0.00 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.08 2bhu h ASP 329 Cb 0.67 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 2bhu h ASP 329 CO 0.00 0.59 -0.06 0.15 -1.72 0.00 0.00 179.24 178.20 2bhu h PHE 330 N 1.10 -0.14 -0.50 4.55 3.57 -1.84 -0.07 116.94 123.61 2bhu h PHE 330 Ca 0.46 0.00 0.08 0.00 3.53 0.00 0.00 57.97 62.05 2bhu h PHE 330 Cb 0.30 0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.03 2bhu h PHE 330 CO -0.00 -0.09 0.11 1.25 -2.23 0.00 0.00 178.31 177.35 2bhu h HIS 331 N -0.12 0.18 -0.56 0.41 2.76 -1.40 -0.47 115.15 115.95 2bhu h HIS 331 Ca 0.01 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.11 2bhu h HIS 331 Cb 0.13 -0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.06 2bhu h HIS 331 CO -0.11 0.00 -0.04 0.45 -1.30 0.00 0.00 177.93 176.93 2bhu h HIS 332 N 0.25 1.12 -0.50 5.26 3.86 -0.78 -0.63 115.15 123.73 2bhu h HIS 332 Ca 0.25 -0.21 -0.03 0.00 -1.16 0.00 0.00 60.37 59.22 2bhu h HIS 332 Cb 0.33 -0.29 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2bhu h HIS 332 CO -0.22 1.02 0.22 1.49 0.86 0.00 0.00 177.93 181.30 2bhu h GLU 333 N 0.90 0.74 -0.30 2.45 4.57 -0.77 -1.64 114.58 120.54 2bhu h GLU 333 Ca 0.15 -0.13 -0.03 0.00 -1.18 0.00 0.00 59.36 58.18 2bhu h GLU 333 Cb 0.60 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 2bhu h GLU 333 CO 0.04 0.64 0.08 1.15 -1.18 0.00 0.00 179.01 179.74 2bhu h THR 334 N 0.67 1.21 -0.42 0.32 2.02 -0.70 -0.73 112.91 115.27 2bhu h THR 334 Ca 0.17 -0.69 -0.03 0.00 0.77 0.00 0.00 66.41 66.63 2bhu h THR 334 Cb 0.17 1.09 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 2bhu h THR 334 CO -0.02 0.23 0.16 -0.09 0.37 0.00 0.00 175.52 176.18 2bhu h ARG 335 N 0.33 0.64 -0.26 6.66 2.43 -1.08 -2.26 114.38 120.85 2bhu h ARG 335 Ca 0.10 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 59.07 2bhu h ARG 335 Cb 0.27 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 2bhu h ARG 335 CO -0.00 0.60 -0.17 0.28 -1.51 0.00 0.00 179.97 179.17 2bhu h VAL 336 N 0.54 1.24 -0.68 0.20 2.07 -1.23 0.06 116.25 118.45 2bhu h VAL 336 Ca 0.14 -1.07 0.07 0.00 0.82 0.00 0.00 66.70 66.66 2bhu h VAL 336 Cb 0.20 1.22 -0.06 0.00 -1.52 0.00 0.00 31.29 31.13 2bhu h VAL 336 CO -0.01 0.34 0.37 0.74 0.02 0.00 0.00 177.57 179.03 2bhu h THR 337 N 0.41 0.94 0.00 2.57 2.02 -0.72 0.20 112.91 118.33 2bhu h THR 337 Ca 0.07 -0.23 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 2bhu h THR 337 Cb 0.53 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2bhu h THR 337 CO 0.03 0.12 -0.76 -0.07 0.37 0.00 0.00 175.52 175.22 2bhu h LEU 338 N 0.67 0.00 0.00 2.58 3.38 -0.76 -3.41 115.31 117.77 2bhu h LEU 338 Ca 0.31 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.26 2bhu h LEU 338 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2bhu h LEU 338 CO -0.20 0.42 -1.11 0.35 0.09 0.00 0.00 178.44 177.99 2bhu n THR 339 N -3.06 0.06 -0.95 0.22 -2.24 -0.08 -4.59 114.28 103.65 2bhu n THR 339 Ca -0.01 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 2bhu n THR 339 Cb 0.72 -0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2bhu n THR 339 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bhu n GLY 340 N 2.62 0.44 3.75 3.38 0.00 0.69 -4.99 105.19 111.08 2bhu n GLY 340 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 2bhu n GLY 340 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bhu s GLU 341 N -0.56 2.41 0.00 1.61 -1.05 -1.26 -4.97 118.70 114.89 2bhu s GLU 341 Ca 0.00 1.44 0.00 0.00 -0.15 0.00 0.00 54.97 56.26 2bhu s GLU 341 Cb 0.00 -1.90 0.00 0.00 -0.44 0.00 0.00 34.13 31.79 2bhu s GLU 341 CO 0.00 -1.56 0.62 1.04 0.95 0.00 0.00 175.26 176.31 2bhu n GLN 342 N -2.84 0.00 -2.66 -4.83 1.13 -1.26 -4.66 117.38 102.26 2bhu n GLN 342 Ca 0.11 -0.57 -0.31 0.00 -1.94 0.00 0.00 57.00 54.29 2bhu n GLN 342 Cb 0.52 -0.40 -0.03 0.00 0.11 0.00 0.00 30.24 30.44 2bhu n GLN 342 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2bhu s GLU 343 N 0.00 3.80 4.59 -1.09 0.41 -1.26 -3.18 118.70 121.97 2bhu s GLU 343 Ca 0.00 0.60 0.00 0.00 -0.41 0.00 0.00 54.97 55.16 2bhu s GLU 343 Cb 0.00 -2.30 0.00 0.00 -1.78 0.00 0.00 34.13 30.05 2bhu s GLU 343 CO 0.00 -0.14 0.00 0.41 -0.49 0.00 0.00 175.26 175.04 2bhu n GLY 344 N -1.52 2.91 0.22 -1.39 0.00 -1.26 -1.69 105.19 102.46 2bhu n GLY 344 Ca 0.04 -0.16 0.15 0.00 0.00 0.00 0.00 46.02 46.05 2bhu n GLY 344 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2bhu h TYR 345 N 0.00 0.00 0.00 1.61 -0.00 -1.99 -2.39 116.97 114.20 2bhu h TYR 345 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 58.72 2bhu h TYR 345 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 36.73 2bhu h TYR 345 CO 0.00 0.00 -0.04 1.88 -0.00 0.00 0.00 178.16 180.00 2bhu h TYR 346 N 0.00 0.00 0.00 0.10 0.05 -1.60 -1.20 116.97 114.33 2bhu h TYR 346 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2bhu h TYR 346 Cb 0.40 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.14 2bhu h TYR 346 CO 0.00 0.04 0.00 0.00 -1.05 0.00 0.00 178.16 177.15 2bhu n ALA 347 N -2.17 1.18 1.30 3.88 0.00 -0.90 -2.12 120.51 121.68 2bhu n ALA 347 Ca -0.02 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.61 2bhu n ALA 347 Cb 0.19 -1.18 0.65 0.00 0.00 0.00 0.00 19.45 19.11 2bhu n ALA 347 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhu n GLY 348 N -1.06 -0.95 2.98 0.00 0.00 -0.45 -4.84 105.19 100.86 2bhu n GLY 348 Ca 0.00 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 2bhu n GLY 348 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2bhu s TYR 349 N -2.34 0.55 -0.01 1.61 2.02 -0.90 -5.03 117.35 113.25 2bhu s TYR 349 Ca 0.28 -0.15 -0.11 0.00 -0.37 0.00 0.00 57.07 56.73 2bhu s TYR 349 Cb 0.16 -0.35 -0.32 0.00 -0.40 0.00 0.00 41.96 41.06 2bhu s TYR 349 CO 0.33 -0.02 0.81 -0.09 -1.57 0.00 0.00 175.55 175.01 2bhu h ARG 350 N 5.82 0.41 -1.31 -0.62 2.43 -1.88 -3.50 114.38 115.73 2bhu h ARG 350 Ca -0.29 -0.71 0.15 0.00 -0.81 0.00 0.00 59.98 58.32 2bhu h ARG 350 Cb 1.19 0.26 -0.05 0.00 -0.42 0.00 0.00 29.97 30.95 2bhu h ARG 350 CO 0.49 1.32 -0.30 0.41 -1.51 0.00 0.00 179.97 180.38 2bhu n GLY 351 N 1.78 -1.98 0.00 2.80 0.00 -1.26 -4.72 105.19 101.81 2bhu n GLY 351 Ca -0.21 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2bhu n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bhu n GLY 352 N -2.89 1.72 0.19 -0.02 0.00 -1.26 -4.46 105.19 98.47 2bhu n GLY 352 Ca -0.01 -2.08 -0.09 0.00 0.00 0.00 0.00 46.02 43.83 2bhu n GLY 352 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bhu h ALA 353 N 0.00 0.49 -0.59 4.61 0.00 -1.84 -0.61 119.26 121.32 2bhu h ALA 353 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2bhu h ALA 353 Cb 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 2bhu h ALA 353 CO 0.00 0.12 0.30 1.49 0.00 0.00 0.00 179.25 181.16 2bhu h GLU 354 N 0.45 0.83 -0.47 0.00 4.81 -1.88 -0.64 114.58 117.68 2bhu h GLU 354 Ca 0.12 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2bhu h GLU 354 Cb 0.24 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 2bhu h GLU 354 CO -0.01 0.66 0.21 0.00 -0.73 0.00 0.00 179.01 179.14 2bhu h ALA 355 N 1.13 0.61 -0.35 2.92 0.00 -1.71 -1.59 119.26 120.27 2bhu h ALA 355 Ca 0.20 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.99 2bhu h ALA 355 Cb 0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2bhu h ALA 355 CO -0.03 0.20 0.21 -0.07 0.00 0.00 0.00 179.25 179.56 2bhu h LEU 356 N 0.62 0.35 -0.98 0.00 3.38 -0.94 -1.60 115.31 116.14 2bhu h LEU 356 Ca 0.16 0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.23 2bhu h LEU 356 Cb 0.15 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.75 2bhu h LEU 356 CO -0.02 0.25 0.62 0.00 0.09 0.00 0.00 178.44 179.39 2bhu h ALA 357 N 1.15 1.43 -0.12 1.53 0.00 -0.82 -0.80 119.26 121.64 2bhu h ALA 357 Ca 0.14 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 2bhu h ALA 357 Cb -0.01 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2bhu h ALA 357 CO -0.06 0.29 -0.11 -0.92 0.00 0.00 0.00 179.25 178.45 2bhu h TYR 358 N 1.04 0.34 -0.81 0.00 3.20 -1.03 -1.72 116.97 117.99 2bhu h TYR 358 Ca 0.46 -0.10 -0.04 0.00 3.14 0.00 0.00 58.73 62.19 2bhu h TYR 358 Cb 0.36 -0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 2bhu h TYR 358 CO -0.01 0.69 0.35 1.15 -1.64 0.00 0.00 178.16 178.69 2bhu h THR 359 N -0.10 1.26 -0.18 1.81 2.02 -0.88 -0.64 112.91 116.21 2bhu h THR 359 Ca 0.02 -0.79 -0.02 0.00 0.77 0.00 0.00 66.41 66.39 2bhu h THR 359 Cb 0.62 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 2bhu h THR 359 CO 0.03 0.33 0.05 0.40 0.37 0.00 0.00 175.52 176.70 2bhu h ILE 360 N 1.17 1.20 0.00 3.11 2.04 -1.14 0.41 117.51 124.30 2bhu h ILE 360 Ca 0.27 -0.62 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 2bhu h ILE 360 Cb 0.19 1.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.53 2bhu h ILE 360 CO -0.03 0.19 -0.14 0.08 0.00 0.00 0.00 178.15 178.25 2bhu h ARG 361 N 0.10 0.00 -0.01 2.37 0.11 -0.88 -2.27 114.38 113.80 2bhu h ARG 361 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 2bhu h ARG 361 Cb 0.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.33 2bhu h ARG 361 CO -0.00 0.14 -0.40 0.54 0.10 0.00 0.00 179.97 180.35 2bhu n ARG 362 N -3.44 0.88 0.00 0.08 5.12 -0.28 -4.98 116.66 114.03 2bhu n ARG 362 Ca -0.01 -0.63 0.00 0.00 -1.93 0.00 0.00 57.85 55.29 2bhu n ARG 362 Cb 0.32 -1.49 0.00 0.00 -1.16 0.00 0.00 32.46 30.13 2bhu n ARG 362 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2bhu n GLY 363 N 1.39 1.50 3.25 -0.13 0.00 0.12 -4.68 105.19 106.65 2bhu n GLY 363 Ca 0.10 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 2bhu n GLY 363 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2bhu s TRP 364 N 0.00 1.33 -0.08 1.61 -2.14 -1.23 -4.69 118.94 113.74 2bhu s TRP 364 Ca 0.00 -0.66 -0.26 0.00 2.66 0.00 0.00 56.10 57.84 2bhu s TRP 364 Cb 0.00 -0.68 -0.25 0.00 -3.10 0.00 0.00 33.47 29.44 2bhu s TRP 364 CO 0.00 0.13 0.94 -0.09 -2.66 0.00 0.00 176.95 175.26 2bhu h ARG 365 N 3.09 0.10 -5.54 3.25 2.43 -1.86 -3.44 114.38 112.41 2bhu h ARG 365 Ca -0.38 -0.12 -0.64 0.00 -0.81 0.00 0.00 59.98 58.03 2bhu h ARG 365 Cb 1.20 0.04 -0.14 0.00 -0.42 0.00 0.00 29.97 30.64 2bhu h ARG 365 CO 0.58 0.94 0.28 0.71 -1.51 0.00 0.00 179.97 180.97 2bhu s TYR 366 N -2.82 2.98 -0.20 2.20 2.02 -1.26 -4.85 117.35 115.41 2bhu s TYR 366 Ca -0.17 -0.08 0.15 0.00 -0.37 0.00 0.00 57.07 56.60 2bhu s TYR 366 Cb -0.01 -3.65 0.45 0.00 -0.40 0.00 0.00 41.96 38.35 2bhu s TYR 366 CO 0.72 -1.05 1.34 0.39 -1.57 0.00 0.00 175.55 175.38 2bhu n GLU 367 N 6.66 2.02 0.00 -0.62 1.02 -1.23 -3.72 120.64 124.78 2bhu n GLU 367 Ca -0.01 -2.92 0.00 0.00 -0.02 0.00 0.00 57.16 54.21 2bhu n GLU 367 Cb 0.47 -1.72 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2bhu n GLU 367 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2bhu n GLY 368 N -1.00 1.14 3.79 0.62 0.00 0.41 -3.42 105.19 106.73 2bhu n GLY 368 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 2bhu n GLY 368 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bhu s GLN 369 N 0.00 1.83 0.14 1.61 0.00 -1.23 -4.04 119.66 117.97 2bhu s GLN 369 Ca 0.00 0.57 -0.31 0.00 -0.00 0.00 0.00 55.36 55.62 2bhu s GLN 369 Cb 0.00 -1.89 -0.09 0.00 0.00 0.00 0.00 33.01 31.03 2bhu s GLN 369 CO 0.00 -1.78 1.47 0.12 0.00 0.00 0.00 175.29 175.10 2bhu s PHE 370 N -3.17 3.16 -0.41 9.60 5.36 -1.26 -1.40 117.98 129.86 2bhu s PHE 370 Ca 0.62 0.80 -0.17 0.00 -0.96 0.00 0.00 56.93 57.22 2bhu s PHE 370 Cb -0.15 -3.80 0.02 0.00 -0.34 0.00 0.00 43.02 38.75 2bhu s PHE 370 CO 0.54 -2.87 0.40 -0.46 -1.46 0.00 0.00 175.22 171.37 2bhu s TRP 371 N 1.12 3.19 -2.26 10.12 -0.11 0.50 -4.88 118.94 126.62 2bhu s TRP 371 Ca 0.67 -0.38 0.22 0.00 1.22 0.00 0.00 56.10 57.83 2bhu s TRP 371 Cb -0.40 -2.82 0.53 0.00 -1.50 0.00 0.00 33.47 29.28 2bhu s TRP 371 CO 0.31 -0.66 1.46 0.00 -4.62 0.00 0.00 176.95 173.44 2bhu n ALA 372 N 5.50 2.42 -1.74 5.86 0.00 -1.26 -2.60 120.51 128.68 2bhu n ALA 372 Ca -0.08 -1.04 -0.42 0.00 0.00 0.00 0.00 53.44 51.90 2bhu n ALA 372 Cb 0.47 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.97 2bhu n ALA 372 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2bhu s VAL 373 N -1.35 2.53 0.24 0.00 1.01 -1.26 -4.85 120.40 116.73 2bhu s VAL 373 Ca 0.41 0.10 -0.31 0.00 0.00 0.00 0.00 61.98 62.18 2bhu s VAL 373 Cb 0.23 -3.06 -0.11 0.00 0.00 0.00 0.00 36.38 33.43 2bhu s VAL 373 CO 0.31 0.00 1.62 -0.54 0.00 0.00 0.00 175.10 176.49 2bhu s LYS 374 N 2.54 4.15 0.00 2.72 1.02 -1.26 -1.14 119.74 127.76 2bhu s LYS 374 Ca 0.79 2.54 0.00 0.00 0.02 0.00 0.00 55.97 59.32 2bhu s LYS 374 Cb -0.46 -3.07 0.00 0.00 -0.52 0.00 0.00 37.83 33.79 2bhu s LYS 374 CO 0.35 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.54 2bhu n GLY 375 N 3.03 1.76 0.03 -3.33 0.00 -1.26 -4.84 105.19 100.58 2bhu n GLY 375 Ca 0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.14 2bhu n GLY 375 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2bhu n GLU 376 N -2.00 1.43 -1.96 1.61 1.02 -0.29 -5.09 120.64 115.36 2bhu n GLU 376 Ca 0.00 -1.11 -0.42 0.00 -0.02 0.00 0.00 57.16 55.62 2bhu n GLU 376 Cb 0.00 -0.79 -0.03 0.00 -0.02 0.00 0.00 31.44 30.61 2bhu n GLU 376 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2bhu s GLU 377 N -0.63 4.23 0.02 3.49 8.01 -1.18 -4.82 118.70 127.83 2bhu s GLU 377 Ca 0.02 2.34 -0.29 0.00 0.01 0.00 0.00 54.97 57.05 2bhu s GLU 377 Cb 0.02 -3.15 0.11 0.00 -4.31 0.00 0.00 34.13 26.79 2bhu s GLU 377 CO 0.00 -0.57 1.23 -3.38 0.01 0.00 0.00 175.26 172.56 2bhu s HIS 378 N 0.92 -0.03 -0.39 1.61 -3.43 -1.07 -5.02 115.29 107.89 2bhu s HIS 378 Ca 0.68 -0.12 -0.26 0.00 -0.80 0.00 0.00 55.06 54.56 2bhu s HIS 378 Cb -0.43 0.57 0.02 0.00 -1.43 0.00 0.00 32.58 31.31 2bhu s HIS 378 CO 0.33 -0.38 0.91 -1.21 -2.00 0.00 0.00 174.74 172.39 2bhu s GLU 379 N -2.42 3.78 -0.19 -0.38 2.02 -1.26 -0.37 118.70 119.87 2bhu s GLU 379 Ca 0.17 0.48 -0.06 0.00 0.02 0.00 0.00 54.97 55.58 2bhu s GLU 379 Cb 0.03 -3.83 -0.03 0.00 0.10 0.00 0.00 34.13 30.40 2bhu s GLU 379 CO -0.02 -0.99 0.04 0.50 0.02 0.00 0.00 175.26 174.80 2bhu s ARG 380 N 3.50 3.79 0.02 1.61 3.52 -0.49 -4.89 118.95 126.01 2bhu s ARG 380 Ca 0.37 -0.43 0.00 0.00 -0.13 0.00 0.00 55.73 55.54 2bhu s ARG 380 Cb -0.12 -3.16 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 2bhu s ARG 380 CO 0.20 0.13 0.00 0.41 -0.81 0.00 0.00 175.30 175.23 2bhu n GLY 381 N 3.95 -3.77 3.17 8.12 0.00 -1.23 -0.45 105.19 114.97 2bhu n GLY 381 Ca -0.17 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 43.79 2bhu n GLY 381 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2bhu s HIS 382 N -0.93 0.54 0.30 1.61 3.76 -0.61 -2.36 115.29 117.59 2bhu s HIS 382 Ca 0.00 -0.98 -0.30 0.00 -0.15 0.00 0.00 55.06 53.63 2bhu s HIS 382 Cb 0.00 -0.30 -0.12 0.00 1.11 0.00 0.00 32.58 33.26 2bhu s HIS 382 CO 0.00 -0.51 1.46 -2.30 -0.85 0.00 0.00 174.74 172.54 2bhu n PRO 383 N -0.04 2.39 0.00 8.40 -0.02 -1.22 -4.38 135.00 140.12 2bhu n PRO 383 Ca -0.10 0.84 0.14 0.00 -2.02 0.00 0.00 63.50 62.36 2bhu n PRO 383 Cb 0.62 -2.54 0.44 0.00 -0.02 0.00 0.00 33.50 32.00 2bhu n PRO 383 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bhu n SER 384 N 1.60 1.76 -0.28 2.55 3.41 -1.26 -4.61 113.62 116.79 2bhu n SER 384 Ca 0.07 -1.57 0.12 0.00 -0.26 0.00 0.00 58.87 57.23 2bhu n SER 384 Cb 0.35 0.01 0.37 0.00 -0.26 0.00 0.00 64.21 64.68 2bhu n SER 384 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2bhu h ASP 385 N 2.74 0.68 0.50 4.04 5.19 -1.90 -1.18 116.42 126.49 2bhu h ASP 385 Ca 0.00 0.04 -0.04 0.00 -0.62 0.00 0.00 57.03 56.41 2bhu h ASP 385 Cb 0.59 -0.09 -0.01 0.00 0.18 0.00 0.00 39.33 40.01 2bhu h ASP 385 CO 0.00 0.34 -0.20 0.00 -3.12 0.00 0.00 179.24 176.26 2bhu h ALA 386 N 1.59 1.24 -2.61 3.45 0.00 -1.99 -3.44 119.26 117.50 2bhu h ALA 386 Ca 0.46 -0.18 -0.52 0.00 0.00 0.00 0.00 54.91 54.67 2bhu h ALA 386 Cb 0.71 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2bhu h ALA 386 CO -0.22 0.25 0.16 -0.51 0.00 0.00 0.00 179.25 178.94 2bhu s LEU 387 N -7.36 4.46 0.31 0.00 1.43 -0.45 -5.07 118.68 112.01 2bhu s LEU 387 Ca -0.02 1.56 0.06 0.00 -1.03 0.00 0.00 54.13 54.70 2bhu s LEU 387 Cb 0.13 -3.49 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 2bhu s LEU 387 CO 0.63 0.10 0.45 -0.70 0.23 0.00 0.00 176.35 177.06 2bhu s GLU 388 N -1.60 3.23 0.23 1.70 2.56 -1.26 -4.98 118.70 118.58 2bhu s GLU 388 Ca 0.40 -0.89 -0.07 0.00 0.00 0.00 0.00 54.97 54.42 2bhu s GLU 388 Cb -0.20 -2.83 0.41 0.00 2.00 0.00 0.00 34.13 33.52 2bhu s GLU 388 CO 0.24 0.16 1.68 0.00 -0.56 0.00 0.00 175.26 176.78 2bhu h ALA 389 N 0.95 0.84 0.00 6.30 0.00 -1.88 -0.43 119.26 125.04 2bhu h ALA 389 Ca -0.48 0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2bhu h ALA 389 Cb 1.25 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 2bhu h ALA 389 CO 0.56 -0.35 -0.08 -1.35 0.00 0.00 0.00 179.25 178.03 2bhu h PRO 390 N 0.22 0.00 0.00 0.00 0.11 -1.78 -2.31 132.00 128.24 2bhu h PRO 390 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 2bhu h PRO 390 Cb 0.65 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.76 2bhu h PRO 390 CO -0.51 0.08 0.00 -0.91 -0.21 0.00 0.00 178.00 176.44 2bhu h ASN 391 N 0.00 0.00 -3.65 -2.05 2.35 -1.30 -3.39 115.58 107.54 2bhu h ASN 391 Ca -0.00 0.00 -0.62 0.00 -0.55 0.00 0.00 56.30 55.13 2bhu h ASN 391 Cb 0.24 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.46 2bhu h ASN 391 CO 0.01 0.00 -0.38 -0.36 -1.65 0.00 0.00 177.43 175.05 2bhu s PHE 392 N -3.64 3.30 -0.34 1.19 0.08 -0.87 -0.90 117.98 116.79 2bhu s PHE 392 Ca -0.01 0.33 -0.12 0.00 0.12 0.00 0.00 56.93 57.26 2bhu s PHE 392 Cb 0.09 -2.41 -0.01 0.00 -0.57 0.00 0.00 43.02 40.12 2bhu s PHE 392 CO 0.36 -0.06 0.22 0.08 -0.10 0.00 0.00 175.22 175.72 2bhu s VAL 393 N 1.47 5.02 0.11 -0.44 1.01 0.13 -1.20 120.40 126.48 2bhu s VAL 393 Ca 0.12 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2bhu s VAL 393 Cb -0.15 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2bhu s VAL 393 CO 0.08 -0.03 0.18 -0.31 0.00 0.00 0.00 175.10 175.02 2bhu s TYR 394 N 1.67 3.36 0.20 5.22 1.51 -0.06 -1.89 117.35 127.36 2bhu s TYR 394 Ca 0.05 0.12 -0.16 0.00 -1.01 0.00 0.00 57.07 56.08 2bhu s TYR 394 Cb -0.18 -1.66 0.02 0.00 -0.11 0.00 0.00 41.96 40.04 2bhu s TYR 394 CO 0.09 0.54 0.50 0.00 -1.11 0.00 0.00 175.55 175.57 2bhu n ILE 396 N -0.34 0.00 -3.75 0.00 -5.35 -1.26 -3.71 119.36 104.96 2bhu n ILE 396 Ca -0.08 -0.28 -0.13 0.00 -0.27 0.00 0.00 62.75 61.99 2bhu n ILE 396 Cb 0.62 0.99 -0.10 0.00 -1.74 0.00 0.00 39.64 39.42 2bhu n ILE 396 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 2bhu s GLN 397 N -1.88 0.51 0.39 6.28 -1.52 -1.26 -4.89 119.66 117.29 2bhu s GLN 397 Ca 0.03 0.27 -0.12 0.00 -1.95 0.00 0.00 55.36 53.59 2bhu s GLN 397 Cb 0.07 0.24 0.05 0.00 -0.22 0.00 0.00 33.01 33.15 2bhu s GLN 397 CO 0.38 -0.10 0.73 0.54 -0.25 0.00 0.00 175.29 176.59 2bhu s ASN 398 N -0.33 0.26 0.32 5.90 2.20 -1.26 -3.91 114.94 118.12 2bhu s ASN 398 Ca -0.05 -1.27 0.02 0.00 -0.94 0.00 0.00 52.86 50.62 2bhu s ASN 398 Cb -0.03 0.82 0.58 0.00 -2.00 0.00 0.00 41.25 40.62 2bhu s ASN 398 CO 0.02 -1.63 1.95 1.12 -2.94 0.00 0.00 177.10 175.62 2bhu h HIS 399 N 2.02 0.93 -0.03 1.54 2.07 -1.97 -1.92 115.15 117.79 2bhu h HIS 399 Ca -0.32 0.02 -0.19 0.00 -2.85 0.00 0.00 60.37 57.04 2bhu h HIS 399 Cb 1.25 -0.31 0.01 0.00 2.57 0.00 0.00 27.41 30.93 2bhu h HIS 399 CO 1.49 0.52 -0.71 -0.44 -3.07 0.00 0.00 177.93 175.72 2bhu h ASP 400 N 0.95 0.68 0.76 3.10 3.32 -1.96 0.11 116.42 123.37 2bhu h ASP 400 Ca 0.33 -0.72 0.00 0.00 0.02 0.00 0.00 57.03 56.66 2bhu h ASP 400 Cb 0.11 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.46 2bhu h ASP 400 CO -0.11 1.31 0.00 0.00 -1.72 0.00 0.00 179.24 178.72 2bhu n GLN 401 N -4.11 0.14 -0.10 3.56 1.13 -0.95 -0.82 117.38 116.24 2bhu n GLN 401 Ca -0.10 0.34 -0.14 0.00 -1.94 0.00 0.00 57.00 55.16 2bhu n GLN 401 Cb 0.72 -1.75 -0.05 0.00 0.11 0.00 0.00 30.24 29.27 2bhu n GLN 401 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 2bhu n ILE 402 N -2.02 1.49 0.25 5.09 5.41 -0.77 -4.75 119.36 124.07 2bhu n ILE 402 Ca 0.03 0.03 0.14 0.00 1.00 0.00 0.00 62.75 63.95 2bhu n ILE 402 Cb 0.24 -2.23 0.60 0.00 -0.71 0.00 0.00 39.64 37.54 2bhu n ILE 402 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2bhu h GLY 403 N -1.00 0.00 -1.73 7.39 0.00 -0.66 -2.58 103.07 104.49 2bhu h GLY 403 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2bhu h GLY 403 CO -0.11 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.13 2bhu n ASN 404 N -3.24 2.53 -4.85 0.19 3.02 0.00 -4.09 115.26 108.82 2bhu n ASN 404 Ca 0.00 -2.19 -0.35 0.00 -0.03 0.00 0.00 54.58 52.02 2bhu n ASN 404 Cb 0.35 -0.39 -0.06 0.00 -0.61 0.00 0.00 39.78 39.08 2bhu n ASN 404 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2bhu s ARG 405 N -1.66 3.93 0.29 3.52 0.52 -0.97 -5.01 118.95 119.57 2bhu s ARG 405 Ca 0.26 0.43 0.04 0.00 -0.52 0.00 0.00 55.73 55.93 2bhu s ARG 405 Cb 0.16 -2.88 0.68 0.00 0.52 0.00 0.00 34.95 33.43 2bhu s ARG 405 CO 0.13 0.45 1.77 -1.35 0.02 0.00 0.00 175.30 176.32 2bhu h PRO 406 N 3.37 0.69 -0.25 3.54 0.11 -1.88 -0.89 132.00 136.69 2bhu h PRO 406 Ca -0.48 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2bhu h PRO 406 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2bhu h PRO 406 CO 0.66 0.45 0.00 1.28 -0.21 0.00 0.00 178.00 180.19 2bhu n LEU 407 N -4.81 2.90 -2.03 2.35 4.77 -1.26 -4.36 117.00 114.56 2bhu n LEU 407 Ca 0.22 -1.42 -0.18 0.00 -0.03 0.00 0.00 56.01 54.60 2bhu n LEU 407 Cb 0.54 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 2bhu n LEU 407 CO 0.21 0.62 -0.22 0.61 -1.33 0.00 0.00 177.39 177.27 2bhu n GLY 408 N 1.05 -0.36 3.81 -0.72 0.00 -0.34 -4.76 105.19 103.87 2bhu n GLY 408 Ca 0.14 -0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2bhu n GLY 408 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2bhu s GLU 409 N -4.89 4.29 0.81 1.61 1.03 -1.26 -0.89 118.70 119.40 2bhu s GLU 409 Ca 0.01 1.04 -0.12 0.00 0.03 0.00 0.00 54.97 55.92 2bhu s GLU 409 Cb -0.00 -2.57 0.08 0.00 -0.80 0.00 0.00 34.13 30.84 2bhu s GLU 409 CO 0.01 0.19 1.11 1.03 -1.33 0.00 0.00 175.26 176.27 2bhu s ARG 410 N -2.54 1.98 0.20 -4.83 0.52 -1.26 -4.71 118.95 108.30 2bhu s ARG 410 Ca 0.53 0.48 -0.11 0.00 -0.52 0.00 0.00 55.73 56.11 2bhu s ARG 410 Cb -0.14 -1.92 0.15 0.00 0.52 0.00 0.00 34.95 33.57 2bhu s ARG 410 CO 0.19 -1.66 1.84 1.25 0.02 0.00 0.00 175.30 176.94 2bhu h LEU 411 N -1.11 0.67 -0.26 2.53 5.85 -1.93 0.52 115.31 121.57 2bhu h LEU 411 Ca -0.47 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2bhu h LEU 411 Cb 1.29 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2bhu h LEU 411 CO 0.61 0.47 0.00 0.00 -0.34 0.00 0.00 178.44 179.18 2bhu n HIS 412 N -4.69 0.31 1.02 1.25 1.44 -1.26 -2.43 115.22 110.87 2bhu n HIS 412 Ca 0.06 0.12 0.11 0.00 -2.01 0.00 0.00 57.72 56.00 2bhu n HIS 412 Cb 0.07 -0.70 0.04 0.00 0.12 0.00 0.00 29.99 29.52 2bhu n HIS 412 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 2bhu n GLN 413 N -1.78 0.30 -2.44 -1.40 6.02 0.14 -4.80 117.38 113.41 2bhu n GLN 413 Ca 0.03 -0.23 -0.40 0.00 -0.01 0.00 0.00 57.00 56.39 2bhu n GLN 413 Cb 0.19 -1.50 -0.04 0.00 1.02 0.00 0.00 30.24 29.92 2bhu n GLN 413 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2bhu s SER 414 N -2.86 7.21 0.05 1.08 0.01 -1.02 -4.89 113.70 113.28 2bhu s SER 414 Ca 0.12 2.31 -0.34 0.00 1.31 0.00 0.00 55.95 59.34 2bhu s SER 414 Cb 0.17 -2.63 -0.13 0.00 0.21 0.00 0.00 66.02 63.64 2bhu s SER 414 CO 0.74 -0.19 1.68 -0.67 0.41 0.00 0.00 173.24 175.21 2bhu n ASP 415 N 1.12 3.11 0.00 2.44 2.03 -1.26 -2.27 116.55 121.72 2bhu n ASP 415 Ca -0.01 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.35 2bhu n ASP 415 Cb 0.45 -1.38 0.00 0.00 -0.72 0.00 0.00 41.12 39.46 2bhu n ASP 415 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2bhu n GLY 416 N 3.74 3.01 3.69 0.27 0.00 -1.26 -4.96 105.19 109.68 2bhu n GLY 416 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2bhu n GLY 416 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bhu s VAL 417 N -2.66 2.79 0.36 1.61 1.01 -0.96 -5.00 120.40 117.55 2bhu s VAL 417 Ca 0.00 0.33 -0.01 0.00 0.00 0.00 0.00 61.98 62.30 2bhu s VAL 417 Cb 0.00 -3.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 2bhu s VAL 417 CO 0.00 0.00 0.59 0.42 0.00 0.00 0.00 175.10 176.11 2bhu s THR 418 N 2.42 5.06 0.45 3.92 -4.23 -1.26 -4.80 115.64 117.21 2bhu s THR 418 Ca 0.76 -0.29 0.19 0.00 -1.18 0.00 0.00 61.69 61.17 2bhu s THR 418 Cb -0.43 -3.85 0.23 0.00 1.34 0.00 0.00 72.50 69.80 2bhu s THR 418 CO 0.33 -0.59 2.04 -0.07 -0.54 0.00 0.00 174.62 175.80 2bhu h LEU 419 N 0.76 0.00 -0.40 4.79 3.38 -1.94 -1.13 115.31 120.77 2bhu h LEU 419 Ca -0.49 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.47 2bhu h LEU 419 Cb 1.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 2bhu h LEU 419 CO 0.62 0.14 0.20 0.45 0.09 0.00 0.00 178.44 179.95 2bhu h HIS 420 N 0.00 0.56 -0.65 1.13 3.86 -1.90 -0.74 115.15 117.41 2bhu h HIS 420 Ca -0.00 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 2bhu h HIS 420 Cb 0.29 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.55 2bhu h HIS 420 CO 0.00 0.45 0.43 0.93 0.86 0.00 0.00 177.93 180.60 2bhu h GLU 421 N 0.51 0.84 -0.63 2.45 5.08 -1.51 -0.54 114.58 120.77 2bhu h GLU 421 Ca 0.14 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2bhu h GLU 421 Cb 0.09 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 2bhu h GLU 421 CO -0.02 0.56 0.40 -0.92 -1.00 0.00 0.00 179.01 178.03 2bhu h TYR 422 N 0.87 0.81 -0.26 4.33 3.20 -1.02 -0.65 116.97 124.25 2bhu h TYR 422 Ca 0.24 0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.98 2bhu h TYR 422 Cb -0.09 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 37.90 2bhu h TYR 422 CO -0.03 0.53 -0.40 0.00 -1.64 0.00 0.00 178.16 176.61 2bhu h ARG 423 N 0.86 0.62 -0.86 1.82 3.08 -0.77 -2.37 114.38 116.76 2bhu h ARG 423 Ca 0.23 -0.32 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 2bhu h ARG 423 Cb -0.07 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 2bhu h ARG 423 CO -0.05 0.92 0.42 0.78 -1.07 0.00 0.00 179.97 180.97 2bhu h GLY 424 N 1.01 1.32 1.15 0.04 0.00 -0.74 -2.28 103.07 103.57 2bhu h GLY 424 Ca 0.04 -0.65 -0.00 0.00 0.00 0.00 0.00 47.33 46.72 2bhu h GLY 424 CO 0.08 0.62 0.51 0.00 0.00 0.00 0.00 176.54 177.75 2bhu h ALA 425 N 1.23 1.33 -0.51 3.60 0.00 -0.84 -1.53 119.26 122.53 2bhu h ALA 425 Ca 0.30 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2bhu h ALA 425 Cb 0.11 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2bhu h ALA 425 CO -0.04 0.59 0.30 0.00 0.00 0.00 0.00 179.25 180.09 2bhu h ALA 426 N 1.41 0.65 -0.92 0.00 0.00 -1.11 -1.42 119.26 117.88 2bhu h ALA 426 Ca 0.30 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 2bhu h ALA 426 Cb -0.06 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 2bhu h ALA 426 CO -0.06 0.16 0.57 0.00 0.00 0.00 0.00 179.25 179.91 2bhu h ALA 427 N 1.14 1.17 0.27 0.00 0.00 -0.83 -0.62 119.26 120.40 2bhu h ALA 427 Ca 0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2bhu h ALA 427 Cb 0.02 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.44 2bhu h ALA 427 CO -0.03 0.62 -0.13 1.25 0.00 0.00 0.00 179.25 180.95 2bhu h LEU 428 N 1.26 -0.31 -0.41 0.00 5.85 -1.03 -2.40 115.31 118.27 2bhu h LEU 428 Ca 0.33 -0.07 0.04 0.00 0.84 0.00 0.00 57.88 59.03 2bhu h LEU 428 Cb -0.07 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2bhu h LEU 428 CO -0.06 -0.13 0.18 0.25 -0.34 0.00 0.00 178.44 178.33 2bhu h LEU 429 N -0.48 0.23 -0.28 2.25 5.85 -1.06 -2.77 115.31 119.04 2bhu h LEU 429 Ca -0.04 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2bhu h LEU 429 Cb 0.36 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 2bhu h LEU 429 CO 0.06 0.17 -0.10 0.18 -0.34 0.00 0.00 178.44 178.41 2bhu n LEU 430 N -4.96 0.54 -0.00 2.25 4.77 -0.26 -3.20 117.00 116.15 2bhu n LEU 430 Ca 0.02 -0.04 0.08 0.00 -0.03 0.00 0.00 56.01 56.04 2bhu n LEU 430 Cb 0.13 -0.15 -0.10 0.00 -2.33 0.00 0.00 43.42 40.97 2bhu n LEU 430 CO 0.28 0.10 -0.07 0.35 -1.33 0.00 0.00 177.39 176.72 2bhu n THR 431 N -0.86 0.00 -2.22 -5.08 -2.24 -0.91 -4.70 114.28 98.28 2bhu n THR 431 Ca 0.15 -0.11 -0.34 0.00 -2.27 0.00 0.00 64.05 61.48 2bhu n THR 431 Cb 0.28 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 2bhu n THR 431 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2bhu s LEU 432 N -2.88 3.67 0.21 3.22 1.43 -1.07 -4.96 118.68 118.30 2bhu s LEU 432 Ca 0.06 2.01 0.26 0.00 -1.03 0.00 0.00 54.13 55.42 2bhu s LEU 432 Cb 0.13 -4.56 0.86 0.00 0.03 0.00 0.00 46.19 42.65 2bhu s LEU 432 CO 0.70 -1.15 1.77 -0.81 0.23 0.00 0.00 176.35 177.09 2bhu n PRO 433 N -1.52 0.23 -0.71 1.29 -0.04 -1.26 -4.79 135.00 128.20 2bhu n PRO 433 Ca 0.10 0.24 -0.31 0.00 -0.04 0.00 0.00 63.50 63.50 2bhu n PRO 433 Cb 0.52 -1.80 0.16 0.00 -0.04 0.00 0.00 33.50 32.34 2bhu n PRO 433 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 2bhu s MET 434 N -3.14 1.05 -0.31 0.54 -1.94 -1.26 -4.13 119.30 110.12 2bhu s MET 434 Ca 0.10 1.55 -0.24 0.00 -1.71 0.00 0.00 55.69 55.38 2bhu s MET 434 Cb 0.12 -1.73 0.00 0.00 2.01 0.00 0.00 34.83 35.23 2bhu s MET 434 CO 0.55 -2.61 0.83 0.99 -0.01 0.00 0.00 175.02 174.77 2bhu s THR 435 N -2.65 4.75 0.29 2.05 2.01 -0.34 -4.90 115.64 116.84 2bhu s THR 435 Ca 0.67 1.23 -0.11 0.00 0.31 0.00 0.00 61.69 63.79 2bhu s THR 435 Cb -0.23 -4.19 -0.07 0.00 0.01 0.00 0.00 72.50 68.02 2bhu s THR 435 CO 0.58 -0.30 0.64 -2.16 -0.69 0.00 0.00 174.62 172.69 2bhu s PRO 436 N 3.06 3.84 -0.03 4.92 0.04 -1.26 -0.89 135.00 144.69 2bhu s PRO 436 Ca 0.34 0.40 0.04 0.00 0.04 0.00 0.00 61.00 61.82 2bhu s PRO 436 Cb -0.14 -2.54 -0.00 0.00 0.04 0.00 0.00 34.50 31.86 2bhu s PRO 436 CO 0.13 0.20 -0.14 -1.17 0.04 0.00 0.00 177.00 176.06 2bhu s LEU 437 N -3.11 1.90 0.08 -3.56 0.20 -0.09 -1.02 118.68 113.09 2bhu s LEU 437 Ca 0.50 -0.28 0.07 0.00 0.69 0.00 0.00 54.13 55.11 2bhu s LEU 437 Cb -0.11 -0.78 -0.04 0.00 -0.43 0.00 0.00 46.19 44.84 2bhu s LEU 437 CO 0.22 0.13 -0.12 -0.76 -0.29 0.00 0.00 176.35 175.54 2bhu s LEU 438 N -0.02 2.95 -0.00 -0.68 1.43 0.26 -4.34 118.68 118.27 2bhu s LEU 438 Ca -0.01 -0.38 -0.07 0.00 -1.03 0.00 0.00 54.13 52.64 2bhu s LEU 438 Cb -0.09 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.34 2bhu s LEU 438 CO 0.01 0.21 0.27 0.12 0.23 0.00 0.00 176.35 177.18 2bhu s PHE 439 N -1.12 3.59 -0.00 0.29 5.36 -1.25 -0.24 117.98 124.60 2bhu s PHE 439 Ca 0.19 0.59 -0.39 0.00 -0.96 0.00 0.00 56.93 56.37 2bhu s PHE 439 Cb -0.11 -2.00 -0.18 0.00 -0.34 0.00 0.00 43.02 40.38 2bhu s PHE 439 CO 0.11 0.62 1.26 0.00 -1.46 0.00 0.00 175.22 175.75 2bhu n GLN 440 N 1.23 0.58 0.00 10.12 10.64 -0.31 -0.96 117.38 138.68 2bhu n GLN 440 Ca -0.12 0.21 0.00 0.00 -1.83 0.00 0.00 57.00 55.26 2bhu n GLN 440 Cb 0.53 -1.78 0.00 0.00 -0.86 0.00 0.00 30.24 28.13 2bhu n GLN 440 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2bhu n GLY 441 N 2.23 2.66 0.27 2.61 0.00 -1.26 -4.88 105.19 106.83 2bhu n GLY 441 Ca 0.20 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.37 2bhu n GLY 441 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2bhu h GLN 442 N 2.13 0.00 0.00 1.61 3.07 -1.45 -2.12 115.11 118.35 2bhu h GLN 442 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2bhu h GLN 442 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2bhu h GLN 442 CO 0.00 0.09 0.00 1.05 0.09 0.00 0.00 178.83 180.06 2bhu h GLU 443 N 0.00 0.00 -0.23 0.06 9.09 -1.90 -2.46 114.58 119.14 2bhu h GLU 443 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2bhu h GLU 443 Cb 0.44 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.54 2bhu h GLU 443 CO 0.01 0.00 0.00 -2.67 0.05 0.00 0.00 179.01 176.40 2bhu n TRP 444 N -2.68 0.49 -3.61 2.06 2.14 -0.99 -2.24 117.44 112.61 2bhu n TRP 444 Ca 0.01 -0.66 -0.27 0.00 2.07 0.00 0.00 57.50 58.65 2bhu n TRP 444 Cb 0.25 -0.13 0.04 0.00 -0.81 0.00 0.00 31.31 30.67 2bhu n TRP 444 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2bhu n ALA 445 N -0.15 -2.44 -1.60 -1.67 0.00 -0.93 -4.26 120.51 109.46 2bhu n ALA 445 Ca 0.13 -0.16 -0.40 0.00 0.00 0.00 0.00 53.44 53.01 2bhu n ALA 445 Cb 0.56 -4.05 0.03 0.00 0.00 0.00 0.00 19.45 15.98 2bhu n ALA 445 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bhu n ALA 446 N -4.03 0.08 0.96 0.00 0.00 -0.83 -4.89 120.51 111.81 2bhu n ALA 446 Ca -0.13 0.14 0.13 0.00 0.00 0.00 0.00 53.44 53.59 2bhu n ALA 446 Cb 0.61 -2.07 0.42 0.00 0.00 0.00 0.00 19.45 18.41 2bhu n ALA 446 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2bhu n SER 447 N 0.14 0.29 -4.87 0.00 3.41 -1.26 -4.87 113.62 106.47 2bhu n SER 447 Ca 0.11 0.15 -0.35 0.00 -0.26 0.00 0.00 58.87 58.51 2bhu n SER 447 Cb 0.42 -0.14 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 2bhu n SER 447 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2bhu s THR 448 N -3.01 5.18 0.95 6.66 -4.23 -1.26 -5.07 115.64 114.86 2bhu s THR 448 Ca 0.12 0.41 -0.14 0.00 -1.18 0.00 0.00 61.69 60.90 2bhu s THR 448 Cb 0.18 -3.61 0.16 0.00 1.34 0.00 0.00 72.50 70.57 2bhu s THR 448 CO 0.62 0.38 1.16 -2.16 -0.54 0.00 0.00 174.62 174.08 2bhu s PRO 449 N -1.66 0.78 -0.32 3.99 0.04 -1.26 -4.79 135.00 131.77 2bhu s PRO 449 Ca 0.28 0.15 0.02 0.00 0.04 0.00 0.00 61.00 61.49 2bhu s PRO 449 Cb -0.14 -1.81 0.10 0.00 0.04 0.00 0.00 34.50 32.69 2bhu s PRO 449 CO 0.16 -2.42 0.06 0.12 0.04 0.00 0.00 177.00 174.97 2bhu s PHE 450 N -3.33 2.88 0.22 0.56 5.36 -0.07 -4.25 117.98 119.35 2bhu s PHE 450 Ca 0.66 -2.44 0.05 0.00 -0.96 0.00 0.00 56.93 54.24 2bhu s PHE 450 Cb -0.13 -2.38 -0.03 0.00 -0.34 0.00 0.00 43.02 40.15 2bhu s PHE 450 CO 0.54 -0.91 0.34 -0.65 -1.46 0.00 0.00 175.22 173.07 2bhu s GLN 451 N 1.21 3.42 -0.05 10.12 -0.21 -1.26 -3.27 119.66 129.61 2bhu s GLN 451 Ca 0.10 -0.74 -0.30 0.00 0.02 0.00 0.00 55.36 54.44 2bhu s GLN 451 Cb -0.18 -2.89 -0.04 0.00 1.00 0.00 0.00 33.01 30.90 2bhu s GLN 451 CO -0.15 0.45 1.31 0.12 -2.12 0.00 0.00 175.29 174.90 2bhu s PHE 452 N -1.94 2.95 0.05 0.91 5.36 -1.26 -4.95 117.98 119.10 2bhu s PHE 452 Ca 0.34 0.98 0.03 0.00 -0.96 0.00 0.00 56.93 57.32 2bhu s PHE 452 Cb -0.09 -3.55 -0.03 0.00 -0.34 0.00 0.00 43.02 39.01 2bhu s PHE 452 CO 0.29 -1.93 -0.09 -0.59 -1.46 0.00 0.00 175.22 171.43 2bhu s PHE 453 N 2.58 0.82 0.28 10.12 -0.12 -1.26 -4.20 117.98 126.19 2bhu s PHE 453 Ca 0.60 -0.51 -0.14 0.00 -0.05 0.00 0.00 56.93 56.83 2bhu s PHE 453 Cb -0.27 -0.48 0.01 0.00 -0.63 0.00 0.00 43.02 41.65 2bhu s PHE 453 CO 0.23 -0.05 0.57 -1.54 -0.05 0.00 0.00 175.22 174.38 2bhu s SER 454 N -1.69 -0.01 -0.36 1.98 1.04 -0.05 -3.89 113.70 110.73 2bhu s SER 454 Ca -0.07 -0.94 0.13 0.00 0.48 0.00 0.00 55.95 55.55 2bhu s SER 454 Cb -0.09 0.66 0.42 0.00 0.10 0.00 0.00 66.02 67.10 2bhu s SER 454 CO 0.01 -1.27 1.13 -0.67 0.98 0.00 0.00 173.24 173.42 2bhu n ASP 455 N -0.63 -0.20 -4.81 7.02 2.03 -1.21 -4.02 116.55 114.72 2bhu n ASP 455 Ca -0.03 -2.65 -0.32 0.00 0.52 0.00 0.00 54.79 52.32 2bhu n ASP 455 Cb 0.61 0.24 0.04 0.00 -0.72 0.00 0.00 41.12 41.30 2bhu n ASP 455 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2bhu s HIS 456 N -1.50 3.00 0.37 -0.67 3.76 -1.26 -3.84 115.29 115.14 2bhu s HIS 456 Ca 0.25 1.47 -0.07 0.00 -0.15 0.00 0.00 55.06 56.56 2bhu s HIS 456 Cb 0.42 -2.95 -0.05 0.00 1.11 0.00 0.00 32.58 31.11 2bhu s HIS 456 CO -0.03 -1.28 0.68 0.00 -0.85 0.00 0.00 174.74 173.26 2bhu s ALA 457 N -2.84 3.48 0.00 -1.40 0.00 -1.26 -4.08 121.76 115.66 2bhu s ALA 457 Ca 0.60 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.14 2bhu s ALA 457 Cb -0.15 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.47 2bhu s ALA 457 CO 0.50 0.03 0.00 0.41 0.00 0.00 0.00 175.76 176.70 2bhu n GLY 458 N -1.34 2.77 0.23 0.00 0.00 -1.26 -1.80 105.19 103.80 2bhu n GLY 458 Ca 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2bhu n GLY 458 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bhu h GLU 459 N 0.00 0.52 -0.48 1.61 5.08 -1.99 -2.00 114.58 117.32 2bhu h GLU 459 Ca 0.00 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 58.15 2bhu h GLU 459 Cb 0.00 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2bhu h GLU 459 CO 0.00 0.77 0.30 1.25 -1.00 0.00 0.00 179.01 180.34 2bhu h LEU 460 N 0.44 0.51 -0.64 1.33 5.85 -1.89 -0.48 115.31 120.43 2bhu h LEU 460 Ca 0.05 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.78 2bhu h LEU 460 Cb 0.77 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.65 2bhu h LEU 460 CO 0.06 0.36 0.41 1.23 -0.34 0.00 0.00 178.44 180.17 2bhu h GLY 461 N 0.61 0.91 1.33 3.75 0.00 -0.77 -1.66 103.07 107.24 2bhu h GLY 461 Ca 0.19 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.17 2bhu h GLY 461 CO -0.07 0.30 0.26 1.46 0.00 0.00 0.00 176.54 178.50 2bhu h GLN 462 N 0.84 0.87 -0.02 4.80 4.20 -0.87 -2.33 115.11 122.59 2bhu h GLN 462 Ca 0.24 -0.12 -0.10 0.00 0.06 0.00 0.00 58.65 58.73 2bhu h GLN 462 Cb -0.06 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.55 2bhu h GLN 462 CO -0.07 0.69 -0.48 0.00 -0.67 0.00 0.00 178.83 178.31 2bhu h ALA 463 N 1.43 1.18 -0.16 3.87 0.00 -0.68 -0.77 119.26 124.12 2bhu h ALA 463 Ca 0.21 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 2bhu h ALA 463 Cb 0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2bhu h ALA 463 CO -0.02 0.60 -0.00 0.28 0.00 0.00 0.00 179.25 180.11 2bhu h VAL 464 N 0.03 1.25 -0.49 0.00 2.07 -0.79 0.98 116.25 119.30 2bhu h VAL 464 Ca -0.00 -0.84 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 2bhu h VAL 464 Cb 0.86 1.49 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 2bhu h VAL 464 CO 0.06 0.25 0.24 0.28 0.02 0.00 0.00 177.57 178.42 2bhu h SER 465 N 0.03 0.65 -0.57 0.57 0.02 -1.20 -1.72 113.55 111.34 2bhu h SER 465 Ca 0.05 -0.13 -0.04 0.00 -0.84 0.00 0.00 61.79 60.83 2bhu h SER 465 Cb 0.38 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.73 2bhu h SER 465 CO 0.01 0.59 0.19 -0.33 -1.14 0.00 0.00 176.83 176.16 2bhu h GLU 466 N 0.65 0.87 -0.84 3.45 5.08 -1.07 -2.38 114.58 120.35 2bhu h GLU 466 Ca 0.17 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2bhu h GLU 466 Cb 0.12 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 2bhu h GLU 466 CO -0.02 0.77 0.45 0.78 -1.00 0.00 0.00 179.01 179.99 2bhu h GLY 467 N 0.79 1.25 1.20 -3.84 0.00 -0.51 -1.56 103.07 100.40 2bhu h GLY 467 Ca 0.18 -0.57 -0.17 0.00 0.00 0.00 0.00 47.33 46.78 2bhu h GLY 467 CO -0.01 0.55 -0.47 -0.09 0.00 0.00 0.00 176.54 176.52 2bhu h ARG 468 N 1.17 0.86 -0.31 4.80 9.65 -1.17 -0.84 114.38 128.54 2bhu h ARG 468 Ca 0.29 -0.49 0.00 0.00 -1.10 0.00 0.00 59.98 58.68 2bhu h ARG 468 Cb 0.04 0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 2bhu h ARG 468 CO -0.05 1.13 0.21 -0.22 2.80 0.00 0.00 179.97 183.84 2bhu h LYS 469 N 0.68 0.41 -0.22 0.20 3.64 -1.12 -3.04 116.57 117.12 2bhu h LYS 469 Ca 0.04 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 2bhu h LYS 469 Cb 1.06 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.78 2bhu h LYS 469 CO 0.11 0.27 -0.17 0.87 -2.27 0.00 0.00 179.45 178.26 2bhu h LYS 470 N 0.42 0.50 -0.00 1.90 1.57 -1.17 -3.18 116.57 116.62 2bhu h LYS 470 Ca 0.12 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.65 2bhu h LYS 470 Cb -0.05 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 2bhu h LYS 470 CO -0.03 0.81 0.00 1.05 -0.57 0.00 0.00 179.45 180.72 2bhu h GLU 471 N 0.19 0.00 0.00 3.15 4.11 -1.12 -3.51 114.58 117.40 2bhu h GLU 471 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2bhu h GLU 471 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2bhu h GLU 471 CO 0.04 0.00 0.00 1.19 0.07 0.00 0.00 179.01 180.31 2bhu n PHE 472 N -4.54 0.00 -2.72 2.06 3.01 -1.15 -5.11 117.46 109.00 2bhu n PHE 472 Ca -0.03 0.00 -0.27 0.00 1.01 0.00 0.00 57.45 58.16 2bhu n PHE 472 Cb 0.09 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.56 2bhu n PHE 472 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2bhu s ASP 482 N 0.30 6.24 -0.02 4.37 -1.08 -1.26 -5.01 116.67 120.22 2bhu s ASP 482 Ca 0.00 0.86 -0.30 0.00 -0.52 0.00 0.00 52.55 52.58 2bhu s ASP 482 Cb 0.00 -2.20 -0.04 0.00 -1.46 0.00 0.00 42.92 39.23 2bhu s ASP 482 CO 0.00 -0.56 1.16 -0.69 0.52 0.00 0.00 175.17 175.60 2bhu s VAL 483 N -2.70 4.30 0.25 1.11 1.01 -1.26 -4.96 120.40 118.16 2bhu s VAL 483 Ca 0.47 1.63 -0.30 0.00 0.00 0.00 0.00 61.98 63.78 2bhu s VAL 483 Cb -0.10 -4.05 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 2bhu s VAL 483 CO 0.44 0.06 1.51 -2.16 0.00 0.00 0.00 175.10 174.94 2bhu s PRO 484 N 1.69 4.21 -0.12 2.72 0.04 -1.26 -4.92 135.00 137.36 2bhu s PRO 484 Ca 0.56 2.40 -0.29 0.00 0.04 0.00 0.00 61.00 63.71 2bhu s PRO 484 Cb -0.25 -3.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 2bhu s PRO 484 CO 0.25 -0.51 1.65 0.34 0.04 0.00 0.00 177.00 178.76 2bhu s ASP 485 N 0.50 6.54 0.56 6.66 -1.08 -1.26 -4.88 116.67 123.71 2bhu s ASP 485 Ca 0.62 2.01 0.24 0.00 -0.52 0.00 0.00 52.55 54.90 2bhu s ASP 485 Cb -0.44 -2.53 1.57 0.00 -1.46 0.00 0.00 42.92 40.06 2bhu s ASP 485 CO 0.43 -1.07 2.20 1.55 0.52 0.00 0.00 175.17 178.81 2bhu h PRO 486 N 10.09 0.00 -0.00 4.34 0.13 -1.91 -1.97 132.00 142.67 2bhu h PRO 486 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 2bhu h PRO 486 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2bhu h PRO 486 CO 0.97 0.00 -0.08 1.04 -0.23 0.00 0.00 178.00 179.70 2bhu n GLN 487 N -4.15 0.00 -2.54 0.86 1.13 -1.26 -0.87 117.38 110.56 2bhu n GLN 487 Ca -0.03 -0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.62 2bhu n GLN 487 Cb 0.11 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.92 2bhu n GLN 487 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2bhu s ALA 488 N -3.00 3.36 0.37 -1.58 0.00 -0.74 -4.84 121.76 115.33 2bhu s ALA 488 Ca 0.14 0.79 0.10 0.00 0.00 0.00 0.00 51.96 52.99 2bhu s ALA 488 Cb 0.19 -3.34 0.86 0.00 0.00 0.00 0.00 23.12 20.83 2bhu s ALA 488 CO 0.56 -0.18 1.87 0.93 0.00 0.00 0.00 175.76 178.94 2bhu h GLU 489 N 5.07 0.62 0.00 0.00 5.08 -1.88 -1.24 114.58 122.23 2bhu h GLU 489 Ca -0.44 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 57.84 2bhu h GLU 489 Cb 1.21 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 2bhu h GLU 489 CO 0.72 0.41 -0.19 0.37 -1.00 0.00 0.00 179.01 179.32 2bhu h GLN 490 N 0.64 0.00 -0.49 2.33 5.75 -1.92 -1.15 115.11 120.27 2bhu h GLN 490 Ca 0.44 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.83 2bhu h GLN 490 Cb 0.76 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 29.30 2bhu h GLN 490 CO -0.19 0.19 -0.15 1.15 -2.65 0.00 0.00 178.83 177.18 2bhu h THR 491 N 0.00 1.27 0.09 2.39 2.02 -1.47 0.36 112.91 117.56 2bhu h THR 491 Ca -0.00 -1.28 -0.00 0.00 0.77 0.00 0.00 66.41 65.89 2bhu h THR 491 Cb 0.35 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 2bhu h THR 491 CO 0.03 0.44 -0.04 0.15 0.37 0.00 0.00 175.52 176.46 2bhu h PHE 492 N 0.83 -0.12 -0.47 3.16 3.57 -1.47 -3.15 116.94 119.29 2bhu h PHE 492 Ca 0.12 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 2bhu h PHE 492 Cb 0.69 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 2bhu h PHE 492 CO 0.04 0.13 0.07 -0.07 -2.23 0.00 0.00 178.31 176.25 2bhu h LEU 493 N -0.35 0.68 -0.97 0.59 3.38 -0.99 -1.38 115.31 116.27 2bhu h LEU 493 Ca -0.01 -0.13 0.31 0.00 0.09 0.00 0.00 57.88 58.14 2bhu h LEU 493 Cb 0.29 -0.18 -0.15 0.00 0.09 0.00 0.00 40.66 40.71 2bhu h LEU 493 CO 0.02 0.70 0.43 0.78 0.09 0.00 0.00 178.44 180.46 2bhu h ASN 494 N 0.69 0.28 0.42 -0.43 2.35 -0.30 -2.11 115.58 116.48 2bhu h ASN 494 Ca 0.15 0.21 0.00 0.00 -0.55 0.00 0.00 56.30 56.11 2bhu h ASN 494 Cb 0.32 0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.90 2bhu h ASN 494 CO 0.00 -0.19 -0.30 -1.20 -1.65 0.00 0.00 177.43 174.09 2bhu n SER 495 N -5.16 0.65 -4.76 5.81 7.64 -0.53 -4.27 113.62 113.01 2bhu n SER 495 Ca 0.29 -0.49 -0.41 0.00 1.01 0.00 0.00 58.87 59.27 2bhu n SER 495 Cb 0.92 0.09 -0.01 0.00 -1.01 0.00 0.00 64.21 64.20 2bhu n SER 495 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2bhu s LYS 496 N -2.72 4.17 0.37 1.43 -0.14 -0.80 -4.82 119.74 117.22 2bhu s LYS 496 Ca 0.19 2.49 -0.27 0.00 -1.36 0.00 0.00 55.97 57.02 2bhu s LYS 496 Cb 0.19 -3.03 -0.10 0.00 -1.68 0.00 0.00 37.83 33.21 2bhu s LYS 496 CO 0.58 -0.53 1.30 -0.51 -0.76 0.00 0.00 175.35 175.43 2bhu s LEU 497 N -0.90 4.32 -0.41 3.17 1.43 -0.68 -4.88 118.68 120.72 2bhu s LEU 497 Ca 0.59 2.66 -0.15 0.00 -1.03 0.00 0.00 54.13 56.21 2bhu s LEU 497 Cb -0.46 -3.78 0.02 0.00 0.03 0.00 0.00 46.19 42.00 2bhu s LEU 497 CO 0.50 -0.69 0.30 0.21 0.23 0.00 0.00 176.35 176.91 2bhu s ASN 498 N -0.62 6.11 0.00 2.29 3.84 -1.26 -4.76 114.94 120.53 2bhu s ASN 498 Ca 0.53 -0.92 0.30 0.00 0.21 0.00 0.00 52.86 52.98 2bhu s ASN 498 Cb -0.39 -2.16 1.46 0.00 -0.55 0.00 0.00 41.25 39.61 2bhu s ASN 498 CO 0.51 -0.46 1.98 0.79 -2.79 0.00 0.00 177.10 177.13 2bhu n TRP 499 N 5.16 0.00 0.02 0.43 7.02 -1.26 -3.28 117.44 125.53 2bhu n TRP 499 Ca -0.11 0.00 -0.19 0.00 -1.02 0.00 0.00 57.50 56.18 2bhu n TRP 499 Cb 0.47 -0.03 -0.14 0.00 -2.42 0.00 0.00 31.31 29.19 2bhu n TRP 499 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2bhu h ALA 500 N 4.08 0.43 0.00 6.99 0.00 -2.04 -3.41 119.26 125.31 2bhu h ALA 500 Ca 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 54.91 53.54 2bhu h ALA 500 Cb 0.26 0.60 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 2bhu h ALA 500 CO 0.00 1.29 -0.14 1.05 0.00 0.00 0.00 179.25 181.46 2bhu h GLU 501 N 0.07 0.00 0.00 0.00 4.11 -1.96 -2.69 114.58 114.11 2bhu h GLU 501 Ca -0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.05 2bhu h GLU 501 Cb 2.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.29 2bhu h GLU 501 CO 0.11 0.14 0.00 2.89 0.07 0.00 0.00 179.01 182.22 2bhu n ARG 502 N -3.38 0.18 -0.11 1.06 1.85 -1.26 -2.78 116.66 112.22 2bhu n ARG 502 Ca -0.00 0.52 0.06 0.00 -1.00 0.00 0.00 57.85 57.42 2bhu n ARG 502 Cb 0.33 -1.92 0.19 0.00 -1.05 0.00 0.00 32.46 30.01 2bhu n ARG 502 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2bhu n GLU 503 N -2.27 1.57 -3.80 2.89 1.02 -1.01 -3.04 120.64 115.99 2bhu n GLU 503 Ca 0.01 -0.88 -0.10 0.00 -0.02 0.00 0.00 57.16 56.17 2bhu n GLU 503 Cb 0.15 -1.24 -0.05 0.00 -0.02 0.00 0.00 31.44 30.28 2bhu n GLU 503 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2bhu s GLY 504 N -1.14 0.07 0.00 0.62 0.00 -1.12 -4.89 107.32 100.87 2bhu s GLY 504 Ca 0.20 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.48 2bhu s GLY 504 CO 0.15 -0.53 0.00 0.61 0.00 0.00 0.00 173.10 173.33 2bhu n GLY 505 N -0.24 2.83 0.25 0.20 0.00 -1.26 -1.59 105.19 105.38 2bhu n GLY 505 Ca -0.11 -0.38 0.14 0.00 0.00 0.00 0.00 46.02 45.67 2bhu n GLY 505 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2bhu h GLU 506 N 0.00 0.00 -0.13 1.61 4.39 -1.96 -1.96 114.58 116.53 2bhu h GLU 506 Ca 0.00 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 2bhu h GLU 506 Cb 0.00 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.65 2bhu h GLU 506 CO 0.00 0.05 0.00 0.45 -1.16 0.00 0.00 179.01 178.35 2bhu h HIS 507 N 0.00 0.25 -0.38 4.33 3.86 -1.65 -1.04 115.15 120.52 2bhu h HIS 507 Ca -0.00 -0.04 -0.06 0.00 -1.16 0.00 0.00 60.37 59.11 2bhu h HIS 507 Cb 0.72 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 29.11 2bhu h HIS 507 CO 0.00 0.46 -0.00 0.00 0.86 0.00 0.00 177.93 179.24 2bhu h ALA 508 N 0.76 1.29 -0.30 2.45 0.00 -0.97 -1.12 119.26 121.36 2bhu h ALA 508 Ca 0.04 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2bhu h ALA 508 Cb 0.35 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2bhu h ALA 508 CO 0.01 0.48 -0.34 -0.09 0.00 0.00 0.00 179.25 179.31 2bhu h ARG 509 N 0.57 0.67 -0.46 0.00 2.43 -1.24 -0.34 114.38 116.01 2bhu h ARG 509 Ca 0.12 -0.32 -0.12 0.00 -0.81 0.00 0.00 59.98 58.85 2bhu h ARG 509 Cb 0.37 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.90 2bhu h ARG 509 CO 0.01 0.92 -0.17 1.15 -1.51 0.00 0.00 179.97 180.37 2bhu h THR 510 N 0.56 1.27 -0.74 0.20 2.02 -0.91 -2.67 112.91 112.65 2bhu h THR 510 Ca 0.06 -1.31 -0.06 0.00 0.77 0.00 0.00 66.41 65.86 2bhu h THR 510 Cb 0.86 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 68.38 2bhu h THR 510 CO 0.07 0.45 0.22 0.25 0.37 0.00 0.00 175.52 176.89 2bhu h LEU 511 N 0.77 1.07 -0.49 2.58 5.85 -0.75 -1.09 115.31 123.27 2bhu h LEU 511 Ca 0.11 -0.21 0.03 0.00 0.84 0.00 0.00 57.88 58.66 2bhu h LEU 511 Cb 0.73 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 2bhu h LEU 511 CO 0.06 1.00 0.26 -0.09 -0.34 0.00 0.00 178.44 179.33 2bhu h ARG 512 N 1.10 0.51 -0.49 1.25 2.43 -0.95 -0.52 114.38 117.70 2bhu h ARG 512 Ca 0.24 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2bhu h ARG 512 Cb 0.31 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 2bhu h ARG 512 CO -0.01 0.33 0.33 1.25 -1.51 0.00 0.00 179.97 180.36 2bhu h LEU 513 N 0.52 0.56 -0.71 3.80 5.85 -1.03 -0.88 115.31 123.42 2bhu h LEU 513 Ca 0.21 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 2bhu h LEU 513 Cb 0.08 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2bhu h LEU 513 CO -0.12 0.41 0.43 1.88 -0.34 0.00 0.00 178.44 180.70 2bhu h TYR 514 N 0.67 0.94 -0.54 1.25 -1.99 -0.82 0.13 116.97 116.60 2bhu h TYR 514 Ca 0.18 -0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.91 2bhu h TYR 514 Cb -0.08 -0.31 -0.03 0.00 2.00 0.00 0.00 36.73 38.32 2bhu h TYR 514 CO -0.04 0.63 0.35 0.00 -0.00 0.00 0.00 178.16 179.10 2bhu h ARG 515 N 0.97 0.72 -0.57 4.88 3.08 -0.75 -0.41 114.38 122.30 2bhu h ARG 515 Ca 0.26 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.22 2bhu h ARG 515 Cb -0.04 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.83 2bhu h ARG 515 CO -0.05 0.49 0.21 -0.44 -1.07 0.00 0.00 179.97 179.11 2bhu h ASP 516 N 0.73 0.80 -0.42 7.04 3.32 -0.62 -0.21 116.42 127.06 2bhu h ASP 516 Ca 0.20 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 2bhu h ASP 516 Cb -0.06 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 2bhu h ASP 516 CO -0.04 0.77 0.16 -0.07 -1.72 0.00 0.00 179.24 178.33 2bhu h LEU 517 N 0.79 0.59 -0.82 1.55 3.38 -0.52 0.11 115.31 120.38 2bhu h LEU 517 Ca 0.19 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2bhu h LEU 517 Cb 0.23 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2bhu h LEU 517 CO -0.01 0.61 -0.19 -0.07 0.09 0.00 0.00 178.44 178.87 2bhu h LEU 518 N 0.54 0.67 -0.53 1.67 3.38 -0.92 0.54 115.31 120.66 2bhu h LEU 518 Ca 0.14 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 2bhu h LEU 518 Cb 0.22 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2bhu h LEU 518 CO -0.01 0.86 0.07 -0.09 0.09 0.00 0.00 178.44 179.36 2bhu h ARG 519 N 0.60 0.88 -0.79 1.13 2.43 -0.93 -2.43 114.38 115.27 2bhu h ARG 519 Ca 0.09 -0.25 -0.03 0.00 -0.81 0.00 0.00 59.98 58.99 2bhu h ARG 519 Cb 0.66 -0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 2bhu h ARG 519 CO 0.05 0.87 0.39 1.25 -1.51 0.00 0.00 179.97 181.02 2bhu h LEU 520 N 0.76 1.03 -0.67 3.80 5.85 -0.32 -1.39 115.31 124.37 2bhu h LEU 520 Ca 0.16 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.69 2bhu h LEU 520 Cb 0.43 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 2bhu h LEU 520 CO 0.01 0.87 0.20 -0.09 -0.34 0.00 0.00 178.44 179.09 2bhu h ARG 521 N 1.11 1.05 -0.19 1.25 2.43 -0.80 -0.57 114.38 118.66 2bhu h ARG 521 Ca 0.27 -0.23 -0.20 0.00 -0.81 0.00 0.00 59.98 59.01 2bhu h ARG 521 Cb 0.10 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 2bhu h ARG 521 CO -0.04 0.92 -0.67 -0.09 -1.51 0.00 0.00 179.97 178.58 2bhu h ARG 522 N 0.98 0.74 0.00 0.20 2.43 -1.18 -3.38 114.38 114.16 2bhu h ARG 522 Ca 0.21 -0.54 -0.21 0.00 -0.81 0.00 0.00 59.98 58.64 2bhu h ARG 522 Cb 0.32 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.92 2bhu h ARG 522 CO -0.00 1.16 -2.17 0.39 -1.51 0.00 0.00 179.97 177.84 2bhu n GLU 523 N -3.95 0.77 -2.53 0.20 1.02 -0.55 -4.95 120.64 110.66 2bhu n GLU 523 Ca -0.05 -0.08 -0.42 0.00 -0.02 0.00 0.00 57.16 56.58 2bhu n GLU 523 Cb 0.69 -1.49 -0.03 0.00 -0.02 0.00 0.00 31.44 30.59 2bhu n GLU 523 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2bhu s ASP 524 N -4.97 7.11 0.41 1.62 2.15 -0.23 -4.91 116.67 117.86 2bhu s ASP 524 Ca -0.09 1.74 0.29 0.00 0.43 0.00 0.00 52.55 54.92 2bhu s ASP 524 Cb 0.09 -2.56 1.12 0.00 -0.30 0.00 0.00 42.92 41.27 2bhu s ASP 524 CO 0.81 -0.53 1.84 1.55 -0.17 0.00 0.00 175.17 178.67 2bhu h PRO 525 N 7.31 0.00 0.16 4.34 0.13 -1.92 -2.55 132.00 139.47 2bhu h PRO 525 Ca -0.34 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.44 2bhu h PRO 525 Cb 1.16 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 2bhu h PRO 525 CO 0.87 0.00 -1.84 0.28 -0.23 0.00 0.00 178.00 177.07 2bhu h VAL 526 N 0.00 0.82 0.00 1.56 2.07 -1.91 -3.32 116.25 115.47 2bhu h VAL 526 Ca 0.00 -2.44 0.00 0.00 0.82 0.00 0.00 66.70 65.08 2bhu h VAL 526 Cb 0.50 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.94 2bhu h VAL 526 CO 0.00 0.88 0.00 0.18 0.02 0.00 0.00 177.57 178.65 2bhu n LEU 527 N -3.56 0.61 0.28 2.57 4.77 -1.07 -1.19 117.00 119.41 2bhu n LEU 527 Ca -0.28 0.71 0.18 0.00 -0.03 0.00 0.00 56.01 56.60 2bhu n LEU 527 Cb 1.06 -0.70 0.97 0.00 -2.33 0.00 0.00 43.42 42.43 2bhu n LEU 527 CO 0.48 -0.75 1.06 0.45 -1.33 0.00 0.00 177.39 177.30 2bhu h HIS 528 N 0.00 0.00 -2.06 -1.77 3.86 -1.56 -3.45 115.15 110.17 2bhu h HIS 528 Ca 0.00 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.58 2bhu h HIS 528 Cb 0.18 0.00 0.10 0.00 1.06 0.00 0.00 27.41 28.75 2bhu h HIS 528 CO 0.00 0.00 0.09 -1.71 0.86 0.00 0.00 177.93 177.17 2bhu n ASN 529 N -2.77 0.94 -0.77 2.45 5.15 -0.33 -4.90 115.26 115.02 2bhu n ASN 529 Ca -0.02 1.16 0.04 0.00 -0.60 0.00 0.00 54.58 55.15 2bhu n ASN 529 Cb 0.09 -1.21 0.06 0.00 -0.53 0.00 0.00 39.78 38.19 2bhu n ASN 529 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2bhu n ARG 530 N 1.14 0.46 -4.44 1.20 5.12 -1.26 -4.58 116.66 114.29 2bhu n ARG 530 Ca 0.13 -1.94 -0.34 0.00 -1.93 0.00 0.00 57.85 53.77 2bhu n ARG 530 Cb 0.28 -0.68 -0.15 0.00 -1.16 0.00 0.00 32.46 30.76 2bhu n ARG 530 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2bhu s GLN 531 N -0.98 3.32 0.52 5.56 -0.21 -1.26 -3.90 119.66 122.72 2bhu s GLN 531 Ca 0.22 -0.69 0.26 0.00 0.02 0.00 0.00 55.36 55.17 2bhu s GLN 531 Cb 0.23 -2.73 1.46 0.00 1.00 0.00 0.00 33.01 32.97 2bhu s GLN 531 CO -0.06 0.03 2.10 0.00 -2.12 0.00 0.00 175.29 175.24 2bhu h ARG 532 N 7.29 0.00 -0.05 2.91 3.08 -1.93 -1.94 114.38 123.74 2bhu h ARG 532 Ca -0.33 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.73 2bhu h ARG 532 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.24 2bhu h ARG 532 CO 0.58 0.10 0.04 1.49 -1.07 0.00 0.00 179.97 181.11 2bhu h GLU 533 N 0.00 0.00 -0.28 0.04 4.81 -2.00 -2.19 114.58 114.96 2bhu h GLU 533 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2bhu h GLU 533 Cb 0.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.64 2bhu h GLU 533 CO 0.01 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.38 2bhu n ASN 534 N -4.09 2.96 -4.34 1.04 3.02 -0.73 -4.91 115.26 108.22 2bhu n ASN 534 Ca -0.02 -1.92 -0.33 0.00 -0.03 0.00 0.00 54.58 52.28 2bhu n ASN 534 Cb 0.14 -0.18 -0.15 0.00 -0.61 0.00 0.00 39.78 38.98 2bhu n ASN 534 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2bhu s LEU 535 N -1.59 2.67 0.11 3.41 2.96 -0.83 -1.57 118.68 123.84 2bhu s LEU 535 Ca 0.36 -0.37 0.04 0.00 -0.22 0.00 0.00 54.13 53.94 2bhu s LEU 535 Cb 0.21 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 45.26 2bhu s LEU 535 CO 0.30 0.13 -0.11 0.42 -1.32 0.00 0.00 176.35 175.78 2bhu s THR 536 N 0.55 1.05 0.07 3.68 -4.23 -0.05 -4.96 115.64 111.76 2bhu s THR 536 Ca -0.08 -1.71 -0.02 0.00 -1.18 0.00 0.00 61.69 58.70 2bhu s THR 536 Cb -0.16 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.19 2bhu s THR 536 CO 0.04 -0.56 0.02 0.42 -0.54 0.00 0.00 174.62 174.00 2bhu s THR 537 N -2.50 0.18 0.00 3.99 -4.23 -1.26 -0.41 115.64 111.41 2bhu s THR 537 Ca 0.08 -1.77 0.00 0.00 -1.18 0.00 0.00 61.69 58.81 2bhu s THR 537 Cb -0.03 -1.64 0.00 0.00 1.34 0.00 0.00 72.50 72.18 2bhu s THR 537 CO 0.01 -0.83 0.00 0.61 -0.54 0.00 0.00 174.62 173.87 2bhu n GLY 538 N 0.04 1.21 3.27 3.99 0.00 -0.55 -4.99 105.19 108.17 2bhu n GLY 538 Ca -0.12 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 2bhu n GLY 538 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2bhu s HIS 539 N -4.99 0.07 -0.27 1.61 -3.43 -1.26 -1.16 115.29 105.86 2bhu s HIS 539 Ca 0.00 -0.46 -0.03 0.00 -0.80 0.00 0.00 55.06 53.77 2bhu s HIS 539 Cb 0.00 0.06 0.09 0.00 -1.43 0.00 0.00 32.58 31.30 2bhu s HIS 539 CO 0.00 -0.64 0.11 0.34 -2.00 0.00 0.00 174.74 172.55 2bhu s ASP 540 N -2.86 3.43 1.83 7.38 2.15 -0.08 -4.98 116.67 123.53 2bhu s ASP 540 Ca 0.07 -1.23 0.00 0.00 0.43 0.00 0.00 52.55 51.82 2bhu s ASP 540 Cb 0.03 -0.48 0.00 0.00 -0.30 0.00 0.00 42.92 42.18 2bhu s ASP 540 CO -0.09 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.11 2bhu n GLY 541 N 5.14 3.36 0.85 2.66 0.00 -1.26 -1.47 105.19 114.47 2bhu n GLY 541 Ca -0.06 -0.12 0.07 0.00 0.00 0.00 0.00 46.02 45.91 2bhu n GLY 541 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bhu n ASP 542 N 6.41 2.47 -4.57 1.61 8.00 -1.26 -4.61 116.55 124.59 2bhu n ASP 542 Ca 0.00 -2.02 -0.39 0.00 0.71 0.00 0.00 54.79 53.08 2bhu n ASP 542 Cb 0.00 -0.31 -0.10 0.00 -0.02 0.00 0.00 41.12 40.69 2bhu n ASP 542 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2bhu s VAL 543 N -1.43 5.24 0.13 2.53 1.01 -0.54 -0.84 120.40 126.50 2bhu s VAL 543 Ca 0.30 0.17 -0.24 0.00 0.00 0.00 0.00 61.98 62.22 2bhu s VAL 543 Cb 0.16 -3.67 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 2bhu s VAL 543 CO 0.20 0.10 0.72 -0.22 0.00 0.00 0.00 175.10 175.90 2bhu s LEU 544 N 1.89 4.56 0.07 3.92 2.96 -0.29 -0.91 118.68 130.88 2bhu s LEU 544 Ca 0.10 1.52 0.08 0.00 -0.22 0.00 0.00 54.13 55.61 2bhu s LEU 544 Cb -0.16 -3.18 -0.03 0.00 0.50 0.00 0.00 46.19 43.32 2bhu s LEU 544 CO 0.11 0.20 -0.21 -1.66 -1.32 0.00 0.00 176.35 173.47 2bhu s TRP 545 N -0.99 1.86 -0.07 5.38 1.48 -0.31 -0.95 118.94 125.34 2bhu s TRP 545 Ca 0.34 -0.39 -0.02 0.00 -1.06 0.00 0.00 56.10 54.97 2bhu s TRP 545 Cb -0.22 -1.07 0.03 0.00 -1.16 0.00 0.00 33.47 31.05 2bhu s TRP 545 CO 0.24 0.15 0.04 0.08 -4.06 0.00 0.00 176.95 173.39 2bhu s VAL 546 N -0.93 0.13 -0.08 -0.66 1.01 -0.11 -1.48 120.40 118.27 2bhu s VAL 546 Ca 0.08 0.20 0.03 0.00 0.00 0.00 0.00 61.98 62.29 2bhu s VAL 546 Cb -0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 2bhu s VAL 546 CO 0.03 0.16 -0.17 -0.60 0.00 0.00 0.00 175.10 174.52 2bhu s ARG 547 N 2.07 2.88 -0.09 2.72 3.52 0.45 -0.72 118.95 129.78 2bhu s ARG 547 Ca 0.04 -0.75 0.04 0.00 -0.13 0.00 0.00 55.73 54.94 2bhu s ARG 547 Cb -0.13 -2.42 -0.00 0.00 -1.56 0.00 0.00 34.95 30.84 2bhu s ARG 547 CO -0.05 0.39 -0.23 0.99 -0.81 0.00 0.00 175.30 175.60 2bhu s THR 548 N -0.14 1.97 -0.10 4.11 2.01 -0.10 -0.87 115.64 122.51 2bhu s THR 548 Ca -0.02 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.01 2bhu s THR 548 Cb -0.14 -1.70 0.02 0.00 0.01 0.00 0.00 72.50 70.70 2bhu s THR 548 CO 0.04 0.54 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.73 2bhu s VAL 549 N 0.31 1.06 0.26 3.82 1.01 -0.61 -0.95 120.40 125.30 2bhu s VAL 549 Ca -0.17 -0.34 0.04 0.00 0.00 0.00 0.00 61.98 61.51 2bhu s VAL 549 Cb -0.17 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 2bhu s VAL 549 CO 0.08 0.37 0.14 0.35 0.00 0.00 0.00 175.10 176.04 2bhu n THR 550 N 4.66 0.00 0.33 3.92 -2.24 -0.10 -4.72 114.28 116.12 2bhu n THR 550 Ca -0.15 -1.67 0.21 0.00 -2.27 0.00 0.00 64.05 60.16 2bhu n THR 550 Cb 0.50 0.70 1.13 0.00 -2.10 0.00 0.00 70.33 70.57 2bhu n THR 550 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2bhu h GLY 551 N 1.26 0.00 1.61 3.38 0.00 -1.99 -2.25 103.07 105.08 2bhu h GLY 551 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2bhu h GLY 551 CO 0.30 0.00 -0.24 0.00 0.00 0.00 0.00 176.54 176.60 2bhu n ALA 552 N -2.15 2.69 0.00 3.60 0.00 -1.26 -5.05 120.51 118.34 2bhu n ALA 552 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2bhu n ALA 552 Cb 0.08 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.20 2bhu n ALA 552 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhu n GLY 553 N 1.40 0.84 2.88 0.00 0.00 -0.85 -4.80 105.19 104.67 2bhu n GLY 553 Ca 0.05 -1.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.08 2bhu n GLY 553 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2bhu s GLU 554 N -1.66 0.02 0.06 1.61 2.12 -1.26 -0.93 118.70 118.66 2bhu s GLU 554 Ca 0.00 -0.04 0.07 0.00 0.36 0.00 0.00 54.97 55.37 2bhu s GLU 554 Cb 0.00 0.01 -0.03 0.00 0.26 0.00 0.00 34.13 34.37 2bhu s GLU 554 CO 0.00 -0.00 -0.20 1.03 -0.54 0.00 0.00 175.26 175.55 2bhu s ARG 555 N -0.09 1.25 -0.04 4.30 1.81 -0.12 -4.37 118.95 121.68 2bhu s ARG 555 Ca -0.01 -0.98 0.01 0.00 -1.72 0.00 0.00 55.73 53.03 2bhu s ARG 555 Cb -0.01 -1.39 0.02 0.00 -0.45 0.00 0.00 34.95 33.13 2bhu s ARG 555 CO -0.00 0.34 -0.03 0.08 -0.68 0.00 0.00 175.30 175.01 2bhu s VAL 556 N -0.91 0.47 -0.23 3.52 1.01 -0.28 -0.93 120.40 123.06 2bhu s VAL 556 Ca 0.06 -0.07 -0.11 0.00 0.00 0.00 0.00 61.98 61.86 2bhu s VAL 556 Cb -0.09 -0.52 -0.05 0.00 0.00 0.00 0.00 36.38 35.72 2bhu s VAL 556 CO 0.02 0.21 0.16 -0.22 0.00 0.00 0.00 175.10 175.28 2bhu s LEU 557 N 1.01 4.14 -0.08 3.92 2.96 0.10 -0.67 118.68 130.06 2bhu s LEU 557 Ca -0.10 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 2bhu s LEU 557 Cb -0.14 -2.12 -0.03 0.00 0.50 0.00 0.00 46.19 44.40 2bhu s LEU 557 CO -0.01 0.09 -0.06 -0.76 -1.32 0.00 0.00 176.35 174.30 2bhu s LEU 558 N 0.86 3.20 -0.12 -0.68 1.43 -0.09 -0.94 118.68 122.34 2bhu s LEU 558 Ca 0.08 -0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2bhu s LEU 558 Cb -0.13 -1.71 0.04 0.00 0.03 0.00 0.00 46.19 44.42 2bhu s LEU 558 CO 0.03 0.34 0.02 0.86 0.23 0.00 0.00 176.35 177.83 2bhu s TRP 559 N -0.66 0.75 -0.62 0.29 -0.00 -0.12 -1.15 118.94 117.44 2bhu s TRP 559 Ca 0.10 -0.42 -0.24 0.00 -0.00 0.00 0.00 56.10 55.54 2bhu s TRP 559 Cb -0.11 -0.87 0.05 0.00 -0.00 0.00 0.00 33.47 32.53 2bhu s TRP 559 CO 0.02 -0.44 1.02 1.21 -0.00 0.00 0.00 176.95 178.75 2bhu s ASN 560 N 1.95 6.26 0.11 5.86 2.47 -0.02 -1.14 114.94 130.43 2bhu s ASN 560 Ca 0.03 -0.56 0.27 0.00 0.42 0.00 0.00 52.86 53.02 2bhu s ASN 560 Cb -0.14 -2.46 1.01 0.00 -1.45 0.00 0.00 41.25 38.21 2bhu s ASN 560 CO -0.06 -1.41 1.85 0.18 -3.72 0.00 0.00 177.10 173.93 2bhu n LEU 561 N 7.89 0.43 -4.67 3.21 7.99 -0.02 -0.48 117.00 131.35 2bhu n LEU 561 Ca 0.00 0.54 -0.30 0.00 -0.01 0.00 0.00 56.01 56.24 2bhu n LEU 561 Cb 0.47 -0.41 0.23 0.00 -0.11 0.00 0.00 43.42 43.60 2bhu n LEU 561 CO 0.65 -0.10 0.68 -0.83 -1.51 0.00 0.00 177.39 176.29 2bhu s GLY 562 N -3.30 1.63 0.00 -0.72 0.00 -1.25 -4.65 107.32 99.03 2bhu s GLY 562 Ca 0.12 -1.04 0.21 0.00 0.00 0.00 0.00 44.72 44.02 2bhu s GLY 562 CO 0.56 -0.17 1.37 -1.06 0.00 0.00 0.00 173.10 173.81 2bhu n GLN 563 N -4.55 2.45 -3.14 2.90 6.02 -1.26 -3.12 117.38 116.68 2bhu n GLN 563 Ca 0.14 -2.25 -0.19 0.00 -0.01 0.00 0.00 57.00 54.69 2bhu n GLN 563 Cb 0.60 -1.48 0.01 0.00 1.02 0.00 0.00 30.24 30.38 2bhu n GLN 563 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2bhu n ASP 564 N 1.39 2.22 -4.76 1.08 5.75 -1.26 -4.70 116.55 116.27 2bhu n ASP 564 Ca 0.19 -2.37 -0.36 0.00 -0.01 0.00 0.00 54.79 52.23 2bhu n ASP 564 Cb 0.58 -0.06 -0.08 0.00 -1.03 0.00 0.00 41.12 40.52 2bhu n ASP 564 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2bhu s THR 565 N -1.98 4.88 -0.08 2.12 2.01 -1.26 -2.47 115.64 118.86 2bhu s THR 565 Ca 0.26 -0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.24 2bhu s THR 565 Cb -0.02 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.40 2bhu s THR 565 CO 0.16 0.59 -0.09 -0.13 -0.69 0.00 0.00 174.62 174.47 2bhu s ARG 566 N -0.79 1.46 0.14 4.92 1.81 0.02 -4.98 118.95 121.52 2bhu s ARG 566 Ca 0.13 -0.29 -0.30 0.00 -1.72 0.00 0.00 55.73 53.55 2bhu s ARG 566 Cb -0.12 -1.35 -0.07 0.00 -0.45 0.00 0.00 34.95 32.97 2bhu s ARG 566 CO 0.03 -0.10 1.00 0.00 -0.68 0.00 0.00 175.30 175.55 2bhu s ALA 567 N 1.09 3.29 0.33 2.13 0.00 -1.26 -0.37 121.76 126.97 2bhu s ALA 567 Ca -0.07 0.64 0.04 0.00 0.00 0.00 0.00 51.96 52.57 2bhu s ALA 567 Cb -0.14 -3.29 0.66 0.00 0.00 0.00 0.00 23.12 20.34 2bhu s ALA 567 CO -0.01 -0.05 1.93 0.28 0.00 0.00 0.00 175.76 177.90 2bhu h VAL 568 N 3.88 1.02 -0.02 0.00 2.07 -1.60 -2.19 116.25 119.40 2bhu h VAL 568 Ca -0.43 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 66.80 2bhu h VAL 568 Cb 1.21 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2bhu h VAL 568 CO 0.72 0.16 0.04 0.00 0.02 0.00 0.00 177.57 178.51 2bhu h ALA 569 N 1.56 1.38 -0.14 1.67 0.00 -1.93 -1.87 119.26 119.93 2bhu h ALA 569 Ca 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2bhu h ALA 569 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2bhu h ALA 569 CO -0.14 -0.06 0.00 0.39 0.00 0.00 0.00 179.25 179.45 2bhu n GLU 570 N -3.54 2.30 -2.56 0.00 1.02 -0.83 -4.90 120.64 112.13 2bhu n GLU 570 Ca -0.02 -2.01 -0.42 0.00 -0.02 0.00 0.00 57.16 54.69 2bhu n GLU 570 Cb 0.12 -1.46 -0.03 0.00 -0.02 0.00 0.00 31.44 30.05 2bhu n GLU 570 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2bhu s VAL 571 N -1.78 4.45 -0.22 2.62 1.01 -0.71 -4.98 120.40 120.80 2bhu s VAL 571 Ca 0.30 1.76 -0.27 0.00 0.00 0.00 0.00 61.98 63.78 2bhu s VAL 571 Cb 0.20 -4.13 -0.00 0.00 0.00 0.00 0.00 36.38 32.45 2bhu s VAL 571 CO 0.30 0.09 0.92 -0.54 0.00 0.00 0.00 175.10 175.86 2bhu s LYS 572 N 1.42 4.24 0.07 2.72 1.02 -1.26 -5.02 119.74 122.92 2bhu s LYS 572 Ca 0.55 1.13 0.05 0.00 0.02 0.00 0.00 55.97 57.72 2bhu s LYS 572 Cb -0.24 -3.63 -0.03 0.00 -0.52 0.00 0.00 37.83 33.41 2bhu s LYS 572 CO 0.26 -0.53 -0.15 -0.51 -0.92 0.00 0.00 175.35 173.50 2bhu s LEU 573 N 2.85 2.27 -0.03 3.17 1.43 -1.26 -4.67 118.68 122.44 2bhu s LEU 573 Ca 0.39 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 2bhu s LEU 573 Cb -0.15 -0.55 0.12 0.00 0.03 0.00 0.00 46.19 45.64 2bhu s LEU 573 CO 0.08 -0.05 0.73 -0.81 0.23 0.00 0.00 176.35 176.53 2bhu n PRO 574 N 1.34 1.56 -3.97 1.29 -0.04 -1.26 -4.82 135.00 129.09 2bhu n PRO 574 Ca -0.21 -0.47 -0.09 0.00 -0.04 0.00 0.00 63.50 62.69 2bhu n PRO 574 Cb 0.54 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 32.40 2bhu n PRO 574 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2bhu s PHE 575 N -1.33 0.28 -0.12 0.54 -0.12 -1.26 -5.13 117.98 110.83 2bhu s PHE 575 Ca 0.08 -0.66 -0.29 0.00 -0.05 0.00 0.00 56.93 56.00 2bhu s PHE 575 Cb 0.06 0.28 -0.01 0.00 -0.63 0.00 0.00 43.02 42.72 2bhu s PHE 575 CO 0.03 -1.05 1.06 0.99 -0.05 0.00 0.00 175.22 176.19 2bhu s THR 576 N -3.94 4.65 0.25 -4.49 2.01 -1.26 -5.01 115.64 107.85 2bhu s THR 576 Ca 0.21 1.94 -0.30 0.00 0.31 0.00 0.00 61.69 63.85 2bhu s THR 576 Cb -0.02 -4.25 -0.10 0.00 0.01 0.00 0.00 72.50 68.15 2bhu s THR 576 CO 0.09 -0.04 1.34 0.54 -0.69 0.00 0.00 174.62 175.86 2bhu s VAL 577 N 2.35 2.93 0.69 3.82 0.11 -1.26 -4.98 120.40 124.05 2bhu s VAL 577 Ca 0.49 0.81 -0.17 0.00 -2.93 0.00 0.00 61.98 60.19 2bhu s VAL 577 Cb -0.19 -3.52 0.01 0.00 -1.53 0.00 0.00 36.38 31.15 2bhu s VAL 577 CO 0.16 0.15 1.27 -2.84 -3.33 0.00 0.00 175.10 170.50 2bhu s PRO 578 N -0.69 2.34 -0.00 1.54 0.02 -1.26 -4.97 135.00 131.97 2bhu s PRO 578 Ca 0.55 1.97 0.19 0.00 0.02 0.00 0.00 61.00 63.73 2bhu s PRO 578 Cb -0.39 -1.83 -0.20 0.00 0.02 0.00 0.00 34.50 32.11 2bhu s PRO 578 CO 0.44 -1.73 0.60 0.54 -0.33 0.00 0.00 177.00 176.51 2bhu n ARG 579 N -2.25 0.64 -3.65 5.54 1.74 -1.19 -4.67 116.66 112.83 2bhu n ARG 579 Ca 0.15 0.07 -0.38 0.00 -0.77 0.00 0.00 57.85 56.92 2bhu n ARG 579 Cb 0.49 -1.68 -0.06 0.00 -1.02 0.00 0.00 32.46 30.19 2bhu n ARG 579 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2bhu s ARG 580 N -3.00 3.74 -0.06 5.56 0.52 -0.48 -4.93 118.95 120.31 2bhu s ARG 580 Ca -0.05 0.18 -0.27 0.00 -0.52 0.00 0.00 55.73 55.07 2bhu s ARG 580 Cb 0.09 -3.22 -0.03 0.00 0.52 0.00 0.00 34.95 32.32 2bhu s ARG 580 CO 0.84 0.71 0.88 -1.17 0.02 0.00 0.00 175.30 176.57 2bhu s LEU 581 N -0.99 4.31 -0.18 2.53 1.98 -1.26 -0.66 118.68 124.42 2bhu s LEU 581 Ca 0.20 1.44 -0.03 0.00 -2.89 0.00 0.00 54.13 52.85 2bhu s LEU 581 Cb -0.15 -3.38 -0.10 0.00 0.66 0.00 0.00 46.19 43.23 2bhu s LEU 581 CO 0.09 -0.26 -0.18 0.18 -1.89 0.00 0.00 176.35 174.29 2bhu n LEU 582 N 4.18 2.35 -3.73 -0.68 4.77 -0.06 -4.91 117.00 118.93 2bhu n LEU 582 Ca 0.04 0.03 -0.13 0.00 -0.03 0.00 0.00 56.01 55.92 2bhu n LEU 582 Cb 0.50 -0.58 -0.10 0.00 -2.33 0.00 0.00 43.42 40.91 2bhu n LEU 582 CO 0.50 0.64 0.08 -0.22 -1.33 0.00 0.00 177.39 177.06 2bhu s LEU 583 N -6.38 0.39 -0.08 2.23 0.20 -1.01 -4.99 118.68 109.04 2bhu s LEU 583 Ca -0.24 0.83 0.03 0.00 0.69 0.00 0.00 54.13 55.44 2bhu s LEU 583 Cb 0.07 1.40 0.00 0.00 -0.43 0.00 0.00 46.19 47.24 2bhu s LEU 583 CO 0.37 -0.15 -0.18 -2.28 -0.29 0.00 0.00 176.35 173.82 2bhu s HIS 584 N 0.31 1.96 0.33 5.38 5.65 -1.26 -0.86 115.29 126.80 2bhu s HIS 584 Ca -0.01 -0.73 0.38 0.00 0.25 0.00 0.00 55.06 54.94 2bhu s HIS 584 Cb -0.03 -1.35 1.89 0.00 -1.18 0.00 0.00 32.58 31.91 2bhu s HIS 584 CO -0.00 -0.31 2.14 1.79 -0.65 0.00 0.00 174.74 177.70 2bhu h THR 585 N 5.73 0.00 -0.22 0.89 1.35 -1.47 -0.85 112.91 118.34 2bhu h THR 585 Ca -0.27 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 2bhu h THR 585 Cb 1.21 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 2bhu h THR 585 CO 0.47 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.12 2bhu n GLU 586 N -2.94 2.69 -1.19 4.72 -0.58 -1.26 -4.96 120.64 117.11 2bhu n GLU 586 Ca -0.01 -2.48 -0.07 0.00 -0.42 0.00 0.00 57.16 54.18 2bhu n GLU 586 Cb 0.15 -1.57 -0.03 0.00 -0.57 0.00 0.00 31.44 29.42 2bhu n GLU 586 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2bhu n GLY 587 N -0.37 0.88 3.79 0.62 0.00 -0.32 -4.97 105.19 104.81 2bhu n GLY 587 Ca 0.16 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 2bhu n GLY 587 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bhu s ARG 588 N -2.31 3.24 0.07 1.61 0.52 -1.26 -4.98 118.95 115.84 2bhu s ARG 588 Ca 0.00 1.37 0.12 0.00 -0.52 0.00 0.00 55.73 56.70 2bhu s ARG 588 Cb 0.00 -2.01 -0.16 0.00 0.52 0.00 0.00 34.95 33.30 2bhu s ARG 588 CO 0.00 -0.90 0.99 0.93 0.02 0.00 0.00 175.30 176.34 2bhu h GLU 589 N 0.63 0.00 -6.20 3.54 5.08 -1.97 -3.44 114.58 112.22 2bhu h GLU 589 Ca -0.48 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.39 2bhu h GLU 589 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.45 2bhu h GLU 589 CO 0.57 0.59 -0.48 -0.51 -1.00 0.00 0.00 179.01 178.17 2bhu s ASP 590 N -6.25 5.79 -1.36 1.42 1.01 -1.26 -5.02 116.67 111.00 2bhu s ASP 590 Ca -0.01 -0.16 -0.10 0.00 0.71 0.00 0.00 52.55 52.98 2bhu s ASP 590 Cb 0.09 -1.52 0.11 0.00 1.01 0.00 0.00 42.92 42.60 2bhu s ASP 590 CO 0.81 -0.08 2.10 0.18 0.21 0.00 0.00 175.17 178.39 2bhu n LEU 591 N -1.28 6.99 -3.98 1.23 4.77 -1.26 -4.86 117.00 118.61 2bhu n LEU 591 Ca -0.08 -4.50 -0.16 0.00 -0.03 0.00 0.00 56.01 51.25 2bhu n LEU 591 Cb 0.58 -1.53 -0.14 0.00 -2.33 0.00 0.00 43.42 40.00 2bhu n LEU 591 CO 0.44 1.41 -0.41 -0.89 -1.33 0.00 0.00 177.39 176.61 2bhu s THR 592 N 1.21 0.48 -0.32 -5.08 2.01 -1.26 -1.40 115.64 111.28 2bhu s THR 592 Ca 0.45 -0.34 -0.02 0.00 0.31 0.00 0.00 61.69 62.09 2bhu s THR 592 Cb 0.12 -0.42 0.06 0.00 0.01 0.00 0.00 72.50 72.27 2bhu s THR 592 CO -0.04 0.08 0.04 -0.76 -0.69 0.00 0.00 174.62 173.24 2bhu s LEU 593 N -0.29 4.13 1.11 4.42 1.43 0.50 -4.96 118.68 125.02 2bhu s LEU 593 Ca 0.01 -1.38 -0.14 0.00 -1.03 0.00 0.00 54.13 51.59 2bhu s LEU 593 Cb -0.03 -1.74 0.25 0.00 0.03 0.00 0.00 46.19 44.70 2bhu s LEU 593 CO -0.00 -0.31 1.06 -0.83 0.23 0.00 0.00 176.35 176.50 2bhu s GLY 594 N 1.33 1.54 -0.09 -3.19 0.00 -1.26 -0.80 107.32 104.86 2bhu s GLY 594 Ca -0.03 -0.41 -0.37 0.00 0.00 0.00 0.00 44.72 43.91 2bhu s GLY 594 CO -0.01 0.31 1.64 0.00 0.00 0.00 0.00 173.10 175.03 2bhu n ALA 595 N -4.61 -0.04 -0.79 3.20 0.00 -1.03 -1.58 120.51 115.67 2bhu n ALA 595 Ca 0.05 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.90 2bhu n ALA 595 Cb 0.57 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2bhu n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bhu n GLY 596 N 3.67 1.22 3.91 0.00 0.00 0.37 -4.68 105.19 109.68 2bhu n GLY 596 Ca 0.22 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.97 2bhu n GLY 596 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bhu s GLU 597 N -0.08 3.61 0.15 1.61 2.02 -0.61 -3.79 118.70 121.60 2bhu s GLU 597 Ca 0.00 0.04 0.06 0.00 0.02 0.00 0.00 54.97 55.09 2bhu s GLU 597 Cb 0.00 -2.57 -0.04 0.00 0.10 0.00 0.00 34.13 31.62 2bhu s GLU 597 CO 0.00 0.09 -0.13 0.00 0.02 0.00 0.00 175.26 175.24 2bhu s ALA 598 N -2.29 1.61 -0.02 5.21 0.00 -1.26 -0.84 121.76 124.16 2bhu s ALA 598 Ca 0.45 -1.44 -0.06 0.00 0.00 0.00 0.00 51.96 50.91 2bhu s ALA 598 Cb -0.10 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 22.98 2bhu s ALA 598 CO 0.34 0.04 0.13 0.54 0.00 0.00 0.00 175.76 176.80 2bhu s VAL 599 N -2.68 0.04 -0.20 0.00 0.11 -0.30 -1.03 120.40 116.34 2bhu s VAL 599 Ca 0.14 -0.36 -0.05 0.00 -2.93 0.00 0.00 61.98 58.79 2bhu s VAL 599 Cb -0.02 -0.30 -0.02 0.00 -1.53 0.00 0.00 36.38 34.51 2bhu s VAL 599 CO 0.03 -0.20 -0.01 -0.22 -3.33 0.00 0.00 175.10 171.37 2bhu s LEU 600 N -0.65 3.20 0.26 2.54 2.96 -0.03 -0.92 118.68 126.04 2bhu s LEU 600 Ca -0.07 -0.22 0.11 0.00 -0.22 0.00 0.00 54.13 53.72 2bhu s LEU 600 Cb -0.04 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.79 2bhu s LEU 600 CO 0.01 0.07 -0.18 0.68 -1.32 0.00 0.00 176.35 175.60 2bhu s VAL 601 N 0.98 2.25 0.00 1.68 -7.23 0.15 -0.88 120.40 117.35 2bhu s VAL 601 Ca 0.01 -2.35 0.00 0.00 -1.81 0.00 0.00 61.98 57.83 2bhu s VAL 601 Cb -0.14 -2.22 0.00 0.00 0.56 0.00 0.00 36.38 34.58 2bhu s VAL 601 CO 0.01 -0.46 0.00 0.61 -0.31 0.00 0.00 175.10 174.95