#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bwc n GLU 13 N 0.00 0.00 -1.71 -1.46 1.02 -1.26 -5.06 120.64 112.17 3bwc n GLU 13 Ca 0.00 0.00 -0.62 0.00 -0.02 0.00 0.00 57.16 56.52 3bwc n GLU 13 Cb 0.00 -0.04 -0.08 0.00 -0.02 0.00 0.00 31.44 31.30 3bwc n GLU 13 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3bwc n LEU 14 N -2.60 1.66 -4.35 -4.62 7.99 -1.26 -4.95 117.00 108.87 3bwc n LEU 14 Ca 0.00 1.13 -0.30 0.00 -0.01 0.00 0.00 56.01 56.83 3bwc n LEU 14 Cb 0.00 -1.02 -0.15 0.00 -0.11 0.00 0.00 43.42 42.15 3bwc n LEU 14 CO 0.00 -0.75 -0.56 -0.51 -1.51 0.00 0.00 177.39 174.06 3bwc s ILE 15 N 2.87 2.19 0.05 -0.08 2.07 -1.26 -4.88 121.20 122.15 3bwc s ILE 15 Ca 1.00 -1.28 -0.30 0.00 -1.41 0.00 0.00 60.65 58.65 3bwc s ILE 15 Cb -1.26 -1.83 -0.08 0.00 0.13 0.00 0.00 42.46 39.42 3bwc s ILE 15 CO 0.71 0.43 1.70 -0.44 -1.91 0.00 0.00 174.94 175.43 3bwc s SER 16 N -1.07 6.58 0.00 4.50 0.01 -1.26 -0.92 113.70 121.54 3bwc s SER 16 Ca 0.11 2.48 0.00 0.00 1.31 0.00 0.00 55.95 59.86 3bwc s SER 16 Cb -0.10 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.58 3bwc s SER 16 CO 0.01 -0.92 0.00 0.61 0.41 0.00 0.00 173.24 173.35 3bwc n GLY 17 N 4.10 3.16 2.19 3.44 0.00 0.10 -4.99 105.19 113.19 3bwc n GLY 17 Ca 0.17 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 3bwc n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bwc n GLY 18 N -1.71 -1.65 3.22 -0.02 0.00 -0.10 -4.75 105.19 100.18 3bwc n GLY 18 Ca 0.00 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 3bwc n GLY 18 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3bwc s TRP 19 N -2.56 2.49 -0.04 1.61 0.52 -1.26 -0.64 118.94 119.07 3bwc s TRP 19 Ca 0.43 -0.98 -0.29 0.00 0.02 0.00 0.00 56.10 55.28 3bwc s TRP 19 Cb -0.02 -1.67 -0.03 0.00 -1.15 0.00 0.00 33.47 30.61 3bwc s TRP 19 CO 0.31 -0.39 0.94 0.12 0.02 0.00 0.00 176.95 177.95 3bwc s PHE 20 N 0.29 3.60 -0.23 -1.98 5.36 0.63 -4.93 117.98 120.73 3bwc s PHE 20 Ca -0.17 1.59 0.01 0.00 -0.96 0.00 0.00 56.93 57.40 3bwc s PHE 20 Cb -0.17 -3.08 0.03 0.00 -0.34 0.00 0.00 43.02 39.46 3bwc s PHE 20 CO 0.08 -0.05 -0.13 0.50 -1.46 0.00 0.00 175.22 174.16 3bwc s ARG 21 N 1.24 2.71 -0.11 10.12 3.52 -1.26 -0.96 118.95 134.22 3bwc s ARG 21 Ca 0.48 -1.03 -0.16 0.00 -0.13 0.00 0.00 55.73 54.89 3bwc s ARG 21 Cb -0.20 -2.80 -0.05 0.00 -1.56 0.00 0.00 34.95 30.35 3bwc s ARG 21 CO 0.24 -0.38 0.40 -2.00 -0.81 0.00 0.00 175.30 172.74 3bwc s GLU 22 N 1.24 4.21 -0.15 5.12 2.12 -1.26 -5.02 118.70 124.96 3bwc s GLU 22 Ca -0.01 0.31 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 3bwc s GLU 22 Cb -0.16 -3.38 0.10 0.00 0.26 0.00 0.00 34.13 30.95 3bwc s GLU 22 CO -0.08 0.31 0.88 -2.00 -0.54 0.00 0.00 175.26 173.83 3bwc s GLU 23 N 0.19 0.75 0.29 4.30 2.12 -1.26 -4.54 118.70 120.54 3bwc s GLU 23 Ca 0.22 0.33 -0.20 0.00 0.36 0.00 0.00 54.97 55.68 3bwc s GLU 23 Cb -0.15 0.35 0.04 0.00 0.26 0.00 0.00 34.13 34.64 3bwc s GLU 23 CO 0.09 -0.20 0.81 0.54 -0.54 0.00 0.00 175.26 175.96 3bwc s ASN 24 N -0.80 -0.13 0.99 -1.70 6.03 -1.26 -5.01 114.94 113.06 3bwc s ASN 24 Ca -0.04 -0.77 -0.12 0.00 -1.03 0.00 0.00 52.86 50.91 3bwc s ASN 24 Cb -0.01 0.71 0.16 0.00 -3.03 0.00 0.00 41.25 39.08 3bwc s ASN 24 CO 0.03 -1.36 0.94 0.47 -2.03 0.00 0.00 177.10 175.15 3bwc n ASP 25 N -0.86 0.10 0.00 3.54 10.43 -1.26 -3.92 116.55 124.58 3bwc n ASP 25 Ca -0.06 -1.36 0.00 0.00 2.57 0.00 0.00 54.79 55.95 3bwc n ASP 25 Cb 0.60 -0.72 0.00 0.00 1.84 0.00 0.00 41.12 42.84 3bwc n ASP 25 CO 0.00 0.00 0.00 1.67 -1.07 0.00 0.00 177.20 177.80 3bwc n GLN 26 N -2.99 0.00 -3.18 -1.24 7.27 -1.26 -4.61 117.38 111.37 3bwc n GLN 26 Ca 0.12 0.00 -0.20 0.00 0.07 0.00 0.00 57.00 56.98 3bwc n GLN 26 Cb 0.41 -0.76 -0.04 0.00 2.41 0.00 0.00 30.24 32.26 3bwc n GLN 26 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 3bwc n TRP 27 N -0.11 0.39 -2.04 3.69 -0.00 -1.26 -4.98 117.44 113.13 3bwc n TRP 27 Ca 0.00 -3.77 -0.29 0.00 -0.00 0.00 0.00 57.50 53.44 3bwc n TRP 27 Cb 0.00 -0.41 0.05 0.00 -0.00 0.00 0.00 31.31 30.95 3bwc n TRP 27 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 3bwc s PRO 28 N -2.16 2.70 -0.84 5.87 0.04 -1.25 -4.14 135.00 135.21 3bwc s PRO 28 Ca 0.39 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.67 3bwc s PRO 28 Cb 0.29 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.74 3bwc s PRO 28 CO -0.09 -1.04 0.00 0.41 0.04 0.00 0.00 177.00 176.32 3bwc n GLY 29 N -2.94 0.66 2.99 0.56 0.00 -1.26 -5.02 105.19 100.17 3bwc n GLY 29 Ca 0.07 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 3bwc n GLY 29 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3bwc s GLN 30 N -3.36 0.28 0.00 1.61 0.74 -1.26 -5.22 119.66 112.45 3bwc s GLN 30 Ca 0.00 -0.42 0.00 0.00 0.05 0.00 0.00 55.36 54.99 3bwc s GLN 30 Cb 0.00 0.11 0.00 0.00 1.10 0.00 0.00 33.01 34.22 3bwc s GLN 30 CO 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 175.29 174.69 3bwc n ALA 31 N 1.91 0.00 0.00 1.58 0.00 -1.26 -4.63 120.51 118.10 3bwc n ALA 31 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.23 3bwc n ALA 31 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 3bwc n ALA 31 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3bwc n SER 33 N -1.17 0.00 -4.08 0.00 7.64 -1.26 -5.01 113.62 109.74 3bwc n SER 33 Ca 0.00 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.67 3bwc n SER 33 Cb 0.00 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 63.05 3bwc n SER 33 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3bwc s LEU 34 N 0.00 2.03 0.28 -3.43 1.43 -0.14 -5.01 118.68 113.84 3bwc s LEU 34 Ca 0.00 -0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 52.58 3bwc s LEU 34 Cb 0.00 -0.63 -0.09 0.00 0.03 0.00 0.00 46.19 45.49 3bwc s LEU 34 CO 0.00 0.15 1.08 -0.60 0.23 0.00 0.00 176.35 177.21 3bwc s ARG 35 N -0.30 4.66 -0.36 1.70 3.52 -1.26 -0.27 118.95 126.64 3bwc s ARG 35 Ca 0.05 1.75 -0.14 0.00 -0.13 0.00 0.00 55.73 57.27 3bwc s ARG 35 Cb -0.05 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.15 3bwc s ARG 35 CO -0.00 0.25 0.26 0.08 -0.81 0.00 0.00 175.30 175.08 3bwc s VAL 36 N -1.18 5.27 0.01 7.11 1.01 0.19 -3.10 120.40 129.72 3bwc s VAL 36 Ca 0.44 -0.32 -0.16 0.00 0.00 0.00 0.00 61.98 61.95 3bwc s VAL 36 Cb -0.31 -3.78 -0.35 0.00 0.00 0.00 0.00 36.38 31.94 3bwc s VAL 36 CO 0.40 -0.10 0.94 -0.08 0.00 0.00 0.00 175.10 176.26 3bwc h GLU 37 N 8.53 0.51 -2.09 2.72 4.57 -1.03 0.29 114.58 128.09 3bwc h GLU 37 Ca -0.30 -0.88 0.03 0.00 -1.18 0.00 0.00 59.36 57.04 3bwc h GLU 37 Cb 1.15 0.33 -0.21 0.00 -0.16 0.00 0.00 28.75 29.85 3bwc h GLU 37 CO 0.66 1.42 -0.12 0.21 -1.18 0.00 0.00 179.01 180.01 3bwc s LYS 38 N -2.59 0.58 -0.31 1.92 2.20 -1.10 -4.25 119.74 116.20 3bwc s LYS 38 Ca -0.10 1.31 -0.29 0.00 -0.36 0.00 0.00 55.97 56.53 3bwc s LYS 38 Cb 0.04 0.56 0.01 0.00 -1.51 0.00 0.00 37.83 36.93 3bwc s LYS 38 CO 0.93 -0.19 1.13 0.08 -0.36 0.00 0.00 175.35 176.94 3bwc s VAL 39 N 2.42 4.42 -0.09 4.02 1.01 -1.26 0.10 120.40 131.02 3bwc s VAL 39 Ca -0.07 1.63 0.05 0.00 0.00 0.00 0.00 61.98 63.59 3bwc s VAL 39 Cb -0.10 -4.34 -0.24 0.00 0.00 0.00 0.00 36.38 31.70 3bwc s VAL 39 CO -0.18 -0.46 0.48 0.18 0.00 0.00 0.00 175.10 175.11 3bwc n LEU 40 N 7.01 1.63 -3.64 3.92 4.77 0.29 -4.97 117.00 126.01 3bwc n LEU 40 Ca 0.13 0.29 -0.14 0.00 -0.03 0.00 0.00 56.01 56.26 3bwc n LEU 40 Cb 0.47 -0.38 -0.07 0.00 -2.33 0.00 0.00 43.42 41.10 3bwc n LEU 40 CO 0.60 0.61 0.37 -0.47 -1.33 0.00 0.00 177.39 177.16 3bwc s TYR 41 N -2.57 -0.73 -0.31 -1.77 5.04 0.06 -4.96 117.35 112.11 3bwc s TYR 41 Ca -0.13 1.77 0.03 0.00 -2.44 0.00 0.00 57.07 56.30 3bwc s TYR 41 Cb 0.07 0.25 0.19 0.00 0.35 0.00 0.00 41.96 42.83 3bwc s TYR 41 CO 0.79 -0.36 0.68 0.34 -1.34 0.00 0.00 175.55 175.66 3bwc s ASP 42 N 0.30 -1.41 -0.08 4.32 2.15 -1.25 0.51 116.67 121.21 3bwc s ASP 42 Ca -0.00 -0.02 -0.30 0.00 0.43 0.00 0.00 52.55 52.66 3bwc s ASP 42 Cb -0.05 1.86 0.11 0.00 -0.30 0.00 0.00 42.92 44.55 3bwc s ASP 42 CO 0.01 -0.24 0.91 0.00 -0.17 0.00 0.00 175.17 175.69 3bwc s ALA 43 N 2.64 -1.87 -0.09 3.66 0.00 -0.84 -3.45 121.76 121.81 3bwc s ALA 43 Ca 0.14 1.32 -0.30 0.00 0.00 0.00 0.00 51.96 53.12 3bwc s ALA 43 Cb -0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 3bwc s ALA 43 CO -0.22 -0.47 1.08 -1.25 0.00 0.00 0.00 175.76 174.91 3bwc s PRO 44 N -1.94 4.39 0.37 0.00 0.04 -1.26 -1.60 135.00 135.00 3bwc s PRO 44 Ca -0.00 1.50 -0.04 0.00 0.04 0.00 0.00 61.00 62.49 3bwc s PRO 44 Cb -0.01 -3.55 0.08 0.00 0.04 0.00 0.00 34.50 31.06 3bwc s PRO 44 CO -0.02 -0.38 0.50 0.25 0.04 0.00 0.00 177.00 177.39 3bwc n THR 45 N 4.61 0.00 0.25 1.26 -2.24 0.85 -4.94 114.28 114.07 3bwc n THR 45 Ca 0.10 -0.50 0.10 0.00 -2.27 0.00 0.00 64.05 61.49 3bwc n THR 45 Cb 0.48 -1.57 0.67 0.00 -2.10 0.00 0.00 70.33 67.81 3bwc n THR 45 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3bwc h LYS 46 N 0.00 0.00 0.00 -0.78 1.57 -1.99 -3.33 116.57 112.04 3bwc h LYS 46 Ca -0.16 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.55 3bwc h LYS 46 Cb 0.50 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3bwc h LYS 46 CO 0.13 0.13 -1.25 1.19 -0.57 0.00 0.00 179.45 179.09 3bwc n PHE 47 N -3.89 0.00 -3.67 -1.35 3.72 -1.26 -5.11 117.46 105.90 3bwc n PHE 47 Ca -0.02 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.29 3bwc n PHE 47 Cb 0.22 -0.18 -0.02 0.00 -0.94 0.00 0.00 39.48 38.57 3bwc n PHE 47 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 3bwc s GLN 48 N -2.10 1.55 -0.25 -1.08 -2.07 -1.25 -5.12 119.66 109.34 3bwc s GLN 48 Ca -0.02 -0.77 -0.25 0.00 -1.82 0.00 0.00 55.36 52.51 3bwc s GLN 48 Cb 0.01 0.59 -0.00 0.00 -1.09 0.00 0.00 33.01 32.52 3bwc s GLN 48 CO 0.15 -0.69 0.83 -1.58 -1.32 0.00 0.00 175.29 172.68 3bwc s HIS 49 N -3.85 3.30 -0.26 9.60 5.65 -1.26 -0.11 115.29 128.37 3bwc s HIS 49 Ca 0.07 1.11 -0.09 0.00 0.25 0.00 0.00 55.06 56.40 3bwc s HIS 49 Cb -0.04 -3.07 -0.04 0.00 -1.18 0.00 0.00 32.58 28.25 3bwc s HIS 49 CO -0.02 -0.42 0.12 -1.17 -0.65 0.00 0.00 174.74 172.60 3bwc s LEU 50 N 2.86 3.72 -0.08 8.88 2.96 -0.63 -0.57 118.68 135.82 3bwc s LEU 50 Ca 0.35 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.19 3bwc s LEU 50 Cb -0.15 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.53 3bwc s LEU 50 CO 0.08 -0.02 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.01 3bwc s THR 51 N 1.56 1.67 -0.06 3.68 2.01 -0.16 -1.98 115.64 122.37 3bwc s THR 51 Ca 0.06 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.27 3bwc s THR 51 Cb -0.15 -1.46 0.02 0.00 0.01 0.00 0.00 72.50 70.92 3bwc s THR 51 CO 0.06 0.47 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.80 3bwc s ILE 52 N 0.44 0.56 0.05 1.82 1.01 0.18 0.02 121.20 125.28 3bwc s ILE 52 Ca -0.16 -0.09 -0.10 0.00 0.00 0.00 0.00 60.65 60.30 3bwc s ILE 52 Cb -0.17 -0.60 0.00 0.00 0.01 0.00 0.00 42.46 41.70 3bwc s ILE 52 CO 0.07 0.25 0.20 0.72 0.00 0.00 0.00 174.94 176.17 3bwc s PHE 53 N 1.18 0.06 -0.15 3.97 -0.12 -0.49 -0.55 117.98 121.88 3bwc s PHE 53 Ca -0.07 -0.31 -0.25 0.00 -0.05 0.00 0.00 56.93 56.25 3bwc s PHE 53 Cb -0.14 -0.03 -0.02 0.00 -0.63 0.00 0.00 43.02 42.21 3bwc s PHE 53 CO -0.01 -0.45 0.83 -2.00 -0.05 0.00 0.00 175.22 173.53 3bwc s GLU 54 N -2.78 4.33 1.05 1.99 2.56 0.12 -0.34 118.70 125.62 3bwc s GLU 54 Ca -0.03 1.03 -0.18 0.00 0.00 0.00 0.00 54.97 55.79 3bwc s GLU 54 Cb -0.00 -3.55 0.24 0.00 2.00 0.00 0.00 34.13 32.82 3bwc s GLU 54 CO -0.05 -0.27 1.29 -1.54 -0.56 0.00 0.00 175.26 174.13 3bwc s SER 55 N 1.11 2.30 0.02 -1.70 1.04 0.10 -0.59 113.70 115.98 3bwc s SER 55 Ca 0.39 0.27 -0.33 0.00 0.48 0.00 0.00 55.95 56.76 3bwc s SER 55 Cb -0.17 -0.29 -0.12 0.00 0.10 0.00 0.00 66.02 65.54 3bwc s SER 55 CO 0.14 -3.24 1.79 -0.67 0.98 0.00 0.00 173.24 172.24 3bwc n ASP 56 N -4.11 3.45 0.27 7.02 4.64 -1.18 -4.30 116.55 122.35 3bwc n ASP 56 Ca 0.16 1.00 0.10 0.00 -1.38 0.00 0.00 54.79 54.67 3bwc n ASP 56 Cb 0.59 -1.42 0.70 0.00 -1.04 0.00 0.00 41.12 39.95 3bwc n ASP 56 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 3bwc h PRO 57 N 8.23 0.00 0.00 -0.67 0.11 -1.95 -0.51 132.00 137.21 3bwc h PRO 57 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3bwc h PRO 57 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3bwc h PRO 57 CO 0.93 0.02 0.00 1.63 -0.21 0.00 0.00 178.00 180.37 3bwc n LYS 58 N -4.33 0.16 -2.70 1.05 4.76 -1.26 -4.77 118.16 111.06 3bwc n LYS 58 Ca -0.03 0.18 -0.20 0.00 -2.87 0.00 0.00 58.31 55.39 3bwc n LYS 58 Cb 0.11 -1.70 0.03 0.00 -1.84 0.00 0.00 35.03 31.63 3bwc n LYS 58 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3bwc s GLY 59 N -3.37 1.85 0.00 0.72 0.00 -0.20 -5.05 107.32 101.27 3bwc s GLY 59 Ca 0.11 -1.41 0.24 0.00 0.00 0.00 0.00 44.72 43.66 3bwc s GLY 59 CO 0.53 -1.13 1.29 -1.55 0.00 0.00 0.00 173.10 172.24 3bwc n PRO 60 N -2.27 0.59 0.11 2.90 -0.04 -1.26 -4.53 135.00 130.50 3bwc n PRO 60 Ca 0.08 -0.42 -0.04 0.00 -0.04 0.00 0.00 63.50 63.09 3bwc n PRO 60 Cb 0.60 -1.49 0.12 0.00 -0.04 0.00 0.00 33.50 32.68 3bwc n PRO 60 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3bwc h TRP 61 N 1.03 0.11 0.00 0.54 6.55 -1.96 -3.38 115.95 118.84 3bwc h TRP 61 Ca 0.00 -0.05 0.00 0.00 0.95 0.00 0.00 58.89 59.79 3bwc h TRP 61 Cb 0.57 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 28.85 3bwc h TRP 61 CO 0.00 0.73 0.00 0.41 -1.05 0.00 0.00 178.44 178.53 3bwc n GLY 62 N 0.40 1.99 3.73 1.49 0.00 -1.26 -2.38 105.19 109.16 3bwc n GLY 62 Ca -0.02 -0.51 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 3bwc n GLY 62 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bwc s THR 63 N 0.00 3.87 0.01 2.61 2.01 -1.26 -0.72 115.64 122.16 3bwc s THR 63 Ca 0.00 1.47 0.00 0.00 0.31 0.00 0.00 61.69 63.47 3bwc s THR 63 Cb 0.00 -3.94 -0.00 0.00 0.01 0.00 0.00 72.50 68.57 3bwc s THR 63 CO 0.00 0.19 0.00 0.52 -0.69 0.00 0.00 174.62 174.64 3bwc n VAL 64 N 3.11 0.00 0.00 3.82 0.31 0.54 -2.06 118.33 124.05 3bwc n VAL 64 Ca 0.06 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3bwc n VAL 64 Cb 0.46 0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.40 3bwc n VAL 64 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3bwc n ALA 66 N -2.96 0.00 -3.83 3.52 0.00 0.10 -1.40 120.51 115.94 3bwc n ALA 66 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.11 3bwc n ALA 66 Cb 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.30 3bwc n ALA 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3bwc s LEU 67 N 0.00 2.05 -1.53 0.00 1.43 0.70 -0.98 118.68 120.34 3bwc s LEU 67 Ca 0.00 -0.59 -0.11 0.00 -1.03 0.00 0.00 54.13 52.40 3bwc s LEU 67 Cb 0.00 -1.40 0.08 0.00 0.03 0.00 0.00 46.19 44.90 3bwc s LEU 67 CO 0.00 0.04 0.78 0.47 0.23 0.00 0.00 176.35 177.87 3bwc n ASP 68 N 4.30 -3.03 0.00 2.29 8.00 0.26 -1.64 116.55 126.73 3bwc n ASP 68 Ca -0.20 -0.90 0.00 0.00 0.71 0.00 0.00 54.79 54.40 3bwc n ASP 68 Cb 0.51 -3.42 0.00 0.00 -0.02 0.00 0.00 41.12 38.19 3bwc n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3bwc n GLY 69 N -1.65 1.15 3.43 0.44 0.00 -1.26 -5.01 105.19 102.30 3bwc n GLY 69 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 3bwc n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bwc s ILE 71 N 1.11 3.20 -0.11 0.00 1.01 -1.26 -0.22 121.20 124.94 3bwc s ILE 71 Ca 0.03 0.39 0.08 0.00 0.00 0.00 0.00 60.65 61.14 3bwc s ILE 71 Cb -0.14 -3.25 -0.12 0.00 0.01 0.00 0.00 42.46 38.95 3bwc s ILE 71 CO 0.01 -0.02 0.01 0.00 0.00 0.00 0.00 174.94 174.94 3bwc n GLN 72 N 6.79 2.05 -3.78 2.79 1.13 -1.26 -4.92 117.38 120.17 3bwc n GLN 72 Ca 0.18 0.01 -0.13 0.00 -1.94 0.00 0.00 57.00 55.11 3bwc n GLN 72 Cb 0.41 -1.26 -0.14 0.00 0.11 0.00 0.00 30.24 29.36 3bwc n GLN 72 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3bwc s VAL 73 N -2.25 -0.03 0.02 5.09 1.01 -1.26 -5.04 120.40 117.93 3bwc s VAL 73 Ca -0.07 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.06 3bwc s VAL 73 Cb 0.03 -0.18 -0.02 0.00 0.00 0.00 0.00 36.38 36.22 3bwc s VAL 73 CO 0.41 0.05 -0.07 0.42 0.00 0.00 0.00 175.10 175.90 3bwc s THR 74 N 0.78 0.55 0.44 3.92 -4.23 -1.26 -4.40 115.64 111.44 3bwc s THR 74 Ca -0.06 -0.72 0.17 0.00 -1.18 0.00 0.00 61.69 59.90 3bwc s THR 74 Cb -0.08 -0.55 0.37 0.00 1.34 0.00 0.00 72.50 73.58 3bwc s THR 74 CO -0.03 -0.13 1.92 0.44 -0.54 0.00 0.00 174.62 176.27 3bwc h ASP 75 N 5.17 0.35 0.43 3.99 3.32 -1.04 -2.05 116.42 126.59 3bwc h ASP 75 Ca -0.33 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.72 3bwc h ASP 75 Cb 1.20 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.70 3bwc h ASP 75 CO 0.45 0.18 -0.21 0.22 -1.72 0.00 0.00 179.24 178.16 3bwc h TYR 76 N 0.37 -0.54 -0.03 4.55 3.20 -1.72 -3.37 116.97 119.44 3bwc h TYR 76 Ca 0.38 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.23 3bwc h TYR 76 Cb 0.92 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.37 3bwc h TYR 76 CO -0.00 -0.33 -0.08 -0.40 -1.64 0.00 0.00 178.16 175.70 3bwc n ASP 77 N -4.33 2.73 -0.31 -2.11 5.75 -1.23 -4.57 116.55 112.48 3bwc n ASP 77 Ca -0.07 -1.88 0.20 0.00 -0.01 0.00 0.00 54.79 53.03 3bwc n ASP 77 Cb 0.23 0.08 0.37 0.00 -1.03 0.00 0.00 41.12 40.77 3bwc n ASP 77 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 3bwc n GLU 78 N 1.03 -0.07 0.21 0.11 0.00 -0.77 -1.07 120.64 120.08 3bwc n GLU 78 Ca 0.13 1.33 0.05 0.00 0.00 0.00 0.00 57.16 58.67 3bwc n GLU 78 Cb 0.56 -2.22 0.48 0.00 0.00 0.00 0.00 31.44 30.26 3bwc n GLU 78 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 3bwc h PHE 79 N 0.00 0.02 0.82 4.31 -5.15 -1.86 -3.15 116.94 111.93 3bwc h PHE 79 Ca 0.64 -0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 58.37 3bwc h PHE 79 Cb 1.50 -0.01 -0.00 0.00 0.22 0.00 0.00 35.95 37.66 3bwc h PHE 79 CO -0.29 0.22 -0.47 0.28 -2.00 0.00 0.00 178.31 176.04 3bwc h VAL 80 N 0.02 0.00 -0.46 0.88 2.07 -1.46 -0.28 116.25 117.02 3bwc h VAL 80 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 3bwc h VAL 80 Cb 0.36 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 3bwc h VAL 80 CO 0.03 0.00 0.04 0.22 0.02 0.00 0.00 177.57 177.88 3bwc h TYR 81 N -1.20 0.77 -0.05 1.57 3.20 -1.70 -1.39 116.97 118.16 3bwc h TYR 81 Ca -0.11 -0.09 -0.25 0.00 3.14 0.00 0.00 58.73 61.42 3bwc h TYR 81 Cb 0.95 -0.22 0.02 0.00 1.54 0.00 0.00 36.73 39.02 3bwc h TYR 81 CO -0.07 0.70 -0.95 0.45 -1.64 0.00 0.00 178.16 176.65 3bwc h HIS 82 N 0.70 1.05 -0.50 -3.82 3.86 -1.50 -2.30 115.15 112.64 3bwc h HIS 82 Ca 0.15 -0.53 -0.10 0.00 -1.16 0.00 0.00 60.37 58.72 3bwc h HIS 82 Cb 0.37 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 3bwc h HIS 82 CO 0.02 1.37 -0.08 0.93 0.86 0.00 0.00 177.93 181.03 3bwc h GLU 83 N 0.42 0.93 0.14 2.45 5.08 -0.94 -1.60 114.58 121.07 3bwc h GLU 83 Ca -0.10 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 3bwc h GLU 83 Cb 1.59 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.78 3bwc h GLU 83 CO 0.19 0.99 -0.07 0.28 -1.00 0.00 0.00 179.01 179.40 3bwc h VAL 84 N 0.79 0.95 -0.09 3.13 2.07 -1.27 0.59 116.25 122.42 3bwc h VAL 84 Ca 0.13 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 3bwc h VAL 84 Cb 0.62 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3bwc h VAL 84 CO 0.04 0.10 0.05 -0.07 0.02 0.00 0.00 177.57 177.71 3bwc h LEU 85 N -0.39 0.11 0.18 2.57 4.07 -1.48 -1.91 115.31 118.45 3bwc h LEU 85 Ca -0.02 -0.07 -0.01 0.00 0.08 0.00 0.00 57.88 57.87 3bwc h LEU 85 Cb 0.31 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.02 3bwc h LEU 85 CO 0.03 0.14 -0.08 1.23 -1.08 0.00 0.00 178.44 178.68 3bwc h GLY 86 N 0.07 -0.25 0.87 0.83 0.00 -1.27 -3.22 103.07 100.11 3bwc h GLY 86 Ca 0.03 0.09 -0.34 0.00 0.00 0.00 0.00 47.33 47.11 3bwc h GLY 86 CO -0.01 -0.09 -1.80 0.45 0.00 0.00 0.00 176.54 175.10 3bwc h HIS 87 N -0.38 0.50 -0.60 5.60 3.86 -0.94 -2.66 115.15 120.53 3bwc h HIS 87 Ca -0.02 -0.36 0.05 0.00 -1.16 0.00 0.00 60.37 58.88 3bwc h HIS 87 Cb 0.30 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 28.71 3bwc h HIS 87 CO -0.02 1.59 0.40 1.15 0.86 0.00 0.00 177.93 181.90 3bwc h THR 88 N 0.07 1.02 0.03 2.45 2.02 -1.47 0.85 112.91 117.89 3bwc h THR 88 Ca -0.35 -0.21 -0.00 0.00 0.77 0.00 0.00 66.41 66.62 3bwc h THR 88 Cb 2.05 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 3bwc h THR 88 CO 0.13 0.11 -0.02 0.77 0.37 0.00 0.00 175.52 176.89 3bwc h SER 89 N 0.61 -0.04 -0.44 4.18 4.64 -1.64 -3.20 113.55 117.66 3bwc h SER 89 Ca 0.25 -0.57 -0.11 0.00 -0.47 0.00 0.00 61.79 60.89 3bwc h SER 89 Cb 0.23 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 3bwc h SER 89 CO -0.07 0.72 -0.14 -0.07 -0.87 0.00 0.00 176.83 176.39 3bwc h LEU 90 N -0.96 0.93 -0.05 5.97 4.07 -1.40 -2.18 115.31 121.69 3bwc h LEU 90 Ca -0.00 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.64 3bwc h LEU 90 Cb 0.60 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.09 3bwc h LEU 90 CO 0.01 1.07 0.00 0.00 -1.08 0.00 0.00 178.44 178.44 3bwc n SER 92 N -1.56 1.33 -4.68 0.00 7.64 -0.83 -2.10 113.62 113.43 3bwc n SER 92 Ca 0.03 -1.26 -0.35 0.00 1.01 0.00 0.00 58.87 58.30 3bwc n SER 92 Cb 0.17 0.06 -0.09 0.00 -1.01 0.00 0.00 64.21 63.33 3bwc n SER 92 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3bwc s HIS 93 N -2.21 3.16 0.24 1.43 5.04 -0.59 -4.81 115.29 117.56 3bwc s HIS 93 Ca 0.32 0.19 -0.07 0.00 -1.54 0.00 0.00 55.06 53.97 3bwc s HIS 93 Cb 0.20 -1.79 0.23 0.00 0.04 0.00 0.00 32.58 31.27 3bwc s HIS 93 CO 0.41 0.47 1.91 -1.35 -2.34 0.00 0.00 174.74 173.85 3bwc h PRO 94 N 5.16 1.25 -1.00 2.88 0.11 -1.87 -3.40 132.00 135.12 3bwc h PRO 94 Ca -0.51 -0.08 -0.14 0.00 0.11 0.00 0.00 66.00 65.39 3bwc h PRO 94 Cb 1.19 -0.28 -0.16 0.00 0.11 0.00 0.00 31.00 31.86 3bwc h PRO 94 CO 0.54 0.83 -0.48 0.21 -0.21 0.00 0.00 178.00 178.89 3bwc s LYS 95 N -6.11 1.04 -0.50 1.05 2.20 -1.26 -5.03 119.74 111.13 3bwc s LYS 95 Ca -0.13 -0.95 -0.28 0.00 -0.36 0.00 0.00 55.97 54.25 3bwc s LYS 95 Cb 0.17 -0.03 0.01 0.00 -1.51 0.00 0.00 37.83 36.48 3bwc s LYS 95 CO 0.81 -1.30 1.42 -1.25 -0.36 0.00 0.00 175.35 174.67 3bwc s PRO 96 N 1.01 3.40 -0.19 4.03 0.04 -1.26 -4.82 135.00 137.21 3bwc s PRO 96 Ca 0.28 0.65 -0.04 0.00 0.04 0.00 0.00 61.00 61.93 3bwc s PRO 96 Cb -0.01 -4.09 -0.11 0.00 0.04 0.00 0.00 34.50 30.34 3bwc s PRO 96 CO -0.05 -1.80 -0.21 0.39 0.04 0.00 0.00 177.00 175.37 3bwc n GLU 97 N 8.42 0.45 -4.21 4.56 1.02 -1.26 -2.50 120.64 127.12 3bwc n GLU 97 Ca 0.14 0.14 -0.34 0.00 -0.02 0.00 0.00 57.16 57.08 3bwc n GLU 97 Cb 0.49 -1.30 -0.14 0.00 -0.02 0.00 0.00 31.44 30.47 3bwc n GLU 97 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 3bwc s ARG 98 N -2.37 3.37 0.00 3.49 3.52 -1.26 -0.45 118.95 125.25 3bwc s ARG 98 Ca -0.26 -0.65 0.06 0.00 -0.13 0.00 0.00 55.73 54.74 3bwc s ARG 98 Cb 0.08 -2.86 -0.02 0.00 -1.56 0.00 0.00 34.95 30.60 3bwc s ARG 98 CO 0.39 -0.05 -0.17 0.08 -0.81 0.00 0.00 175.30 174.75 3bwc s VAL 99 N 1.05 1.37 -0.07 7.11 1.01 -0.73 -0.23 120.40 129.90 3bwc s VAL 99 Ca 0.00 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.18 3bwc s VAL 99 Cb -0.15 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 3bwc s VAL 99 CO -0.01 0.31 -0.17 -0.22 0.00 0.00 0.00 175.10 175.01 3bwc s LEU 100 N -0.60 2.51 -0.20 3.92 2.96 0.30 -0.72 118.68 126.85 3bwc s LEU 100 Ca 0.06 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 53.65 3bwc s LEU 100 Cb -0.07 -1.51 0.04 0.00 0.50 0.00 0.00 46.19 45.15 3bwc s LEU 100 CO -0.00 0.26 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.52 3bwc s ILE 101 N -0.25 1.85 -0.20 6.68 1.01 0.81 -0.07 121.20 131.03 3bwc s ILE 101 Ca 0.01 -1.05 -0.17 0.00 0.00 0.00 0.00 60.65 59.43 3bwc s ILE 101 Cb -0.13 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.48 3bwc s ILE 101 CO 0.03 0.29 0.47 -0.63 0.00 0.00 0.00 174.94 175.09 3bwc s ILE 102 N 1.32 5.15 0.00 2.92 1.09 0.39 -0.51 121.20 131.55 3bwc s ILE 102 Ca 0.00 0.86 0.00 0.00 -1.10 0.00 0.00 60.65 60.41 3bwc s ILE 102 Cb -0.15 -3.80 0.00 0.00 -1.06 0.00 0.00 42.46 37.45 3bwc s ILE 102 CO -0.09 0.21 0.00 0.61 -0.10 0.00 0.00 174.94 175.57 3bwc n GLY 103 N 3.87 -0.07 2.63 6.18 0.00 0.59 0.06 105.19 118.46 3bwc n GLY 103 Ca -0.06 -1.13 -0.17 0.00 0.00 0.00 0.00 46.02 44.66 3bwc n GLY 103 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3bwc n GLY 104 N 0.00 -0.24 0.26 -0.02 0.00 -1.25 -4.26 105.19 99.68 3bwc n GLY 104 Ca 0.00 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.00 3bwc n GLY 104 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3bwc h GLY 105 N -0.86 0.00 2.00 -0.02 0.00 -1.93 -1.63 103.07 100.63 3bwc h GLY 105 Ca -0.40 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 3bwc h GLY 105 CO 0.44 0.00 -0.08 1.29 0.00 0.00 0.00 176.54 178.19 3bwc h ASP 106 N 0.00 0.00 0.00 0.19 3.04 -1.91 -3.47 116.42 114.27 3bwc h ASP 106 Ca -0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3bwc h ASP 106 Cb 0.11 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.40 3bwc h ASP 106 CO 0.01 0.08 0.00 0.61 -2.04 0.00 0.00 179.24 177.89 3bwc n GLY 107 N -1.12 0.69 0.05 7.15 0.00 -0.61 -2.80 105.19 108.56 3bwc n GLY 107 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.87 3bwc n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3bwc h GLY 108 N 0.00 0.00 1.00 -0.02 0.00 -1.79 -0.77 103.07 101.50 3bwc h GLY 108 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3bwc h GLY 108 CO 0.00 0.00 0.26 -2.08 0.00 0.00 0.00 176.54 174.72 3bwc h VAL 109 N -0.44 1.23 -0.45 4.60 2.07 -1.87 -2.71 116.25 118.68 3bwc h VAL 109 Ca 0.00 -0.72 0.06 0.00 0.82 0.00 0.00 66.70 66.86 3bwc h VAL 109 Cb 0.44 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.68 3bwc h VAL 109 CO 0.00 0.28 0.15 0.25 0.02 0.00 0.00 177.57 178.27 3bwc h LEU 110 N 0.89 0.14 -0.82 2.57 5.85 -1.85 -0.28 115.31 121.81 3bwc h LEU 110 Ca 0.21 0.06 0.09 0.00 0.84 0.00 0.00 57.88 59.08 3bwc h LEU 110 Cb 0.20 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 3bwc h LEU 110 CO -0.02 0.11 0.46 -0.09 -0.34 0.00 0.00 178.44 178.57 3bwc h ARG 111 N 0.31 0.75 -0.33 1.25 2.43 -0.93 -0.33 114.38 117.54 3bwc h ARG 111 Ca 0.21 -0.05 -0.17 0.00 -0.81 0.00 0.00 59.98 59.17 3bwc h ARG 111 Cb 0.22 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3bwc h ARG 111 CO -0.23 0.50 -0.45 0.93 -1.51 0.00 0.00 179.97 179.21 3bwc h GLU 112 N 0.78 0.89 -0.47 0.20 4.39 -1.06 -3.03 114.58 116.28 3bwc h GLU 112 Ca 0.39 -0.51 -0.06 0.00 0.34 0.00 0.00 59.36 59.52 3bwc h GLU 112 Cb 0.37 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.03 3bwc h GLU 112 CO -0.25 1.16 0.06 -0.39 -1.16 0.00 0.00 179.01 178.43 3bwc h VAL 113 N 0.68 1.22 0.00 3.13 -1.51 -0.62 -2.78 116.25 116.38 3bwc h VAL 113 Ca 0.04 -0.86 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 3bwc h VAL 113 Cb 1.05 0.80 0.00 0.00 -2.13 0.00 0.00 31.29 31.02 3bwc h VAL 113 CO 0.11 0.31 0.00 -0.07 -1.23 0.00 0.00 177.57 176.68 3bwc h LEU 114 N 0.70 0.00 -1.95 4.19 3.38 -0.99 -2.57 115.31 118.07 3bwc h LEU 114 Ca 0.15 0.00 0.01 0.00 0.09 0.00 0.00 57.88 58.13 3bwc h LEU 114 Cb 0.35 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 3bwc h LEU 114 CO 0.01 0.00 0.05 0.03 0.09 0.00 0.00 178.44 178.62 3bwc h ARG 115 N 0.00 0.07 -6.20 1.13 3.08 -1.37 -3.42 114.38 107.67 3bwc h ARG 115 Ca 0.00 -0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.48 3bwc h ARG 115 Cb 0.46 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.46 3bwc h ARG 115 CO 0.00 0.04 0.86 -1.01 -1.07 0.00 0.00 179.97 178.79 3bwc s HIS 116 N -5.12 2.90 0.23 3.04 3.76 -0.97 -4.89 115.29 114.23 3bwc s HIS 116 Ca -0.05 1.02 0.27 0.00 -0.15 0.00 0.00 55.06 56.15 3bwc s HIS 116 Cb 0.17 -3.50 1.19 0.00 1.11 0.00 0.00 32.58 31.55 3bwc s HIS 116 CO 0.68 -1.70 1.94 0.78 -0.85 0.00 0.00 174.74 175.59 3bwc h GLY 117 N 9.35 0.00 1.99 -2.22 0.00 -1.88 -2.76 103.07 107.55 3bwc h GLY 117 Ca -0.29 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 3bwc h GLY 117 CO 0.95 0.00 -0.27 -0.91 0.00 0.00 0.00 176.54 176.31 3bwc h THR 118 N 0.00 1.19 -2.59 4.70 1.35 -1.91 -3.42 112.91 112.22 3bwc h THR 118 Ca -0.00 -0.92 -0.57 0.00 -0.55 0.00 0.00 66.41 64.37 3bwc h THR 118 Cb 0.57 1.49 -0.02 0.00 -1.73 0.00 0.00 68.15 68.46 3bwc h THR 118 CO 0.02 0.26 1.25 -0.69 -0.25 0.00 0.00 175.52 176.11 3bwc s VAL 119 N -4.44 3.46 -0.06 6.82 1.01 -1.04 -4.10 120.40 122.04 3bwc s VAL 119 Ca -0.03 0.50 0.04 0.00 0.00 0.00 0.00 61.98 62.48 3bwc s VAL 119 Cb 0.15 -3.54 -0.25 0.00 0.00 0.00 0.00 36.38 32.75 3bwc s VAL 119 CO 0.71 -0.29 0.58 -0.33 0.00 0.00 0.00 175.10 175.78 3bwc h GLU 120 N 12.23 0.12 -2.83 2.72 5.08 -1.01 -3.48 114.58 127.41 3bwc h GLU 120 Ca -0.36 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 57.68 3bwc h GLU 120 Cb 1.18 0.08 -0.22 0.00 0.50 0.00 0.00 28.75 30.28 3bwc h GLU 120 CO 1.00 0.82 -0.24 -1.58 -1.00 0.00 0.00 179.01 178.02 3bwc s HIS 121 N -2.59 -0.35 -0.07 4.33 5.04 -0.75 -4.78 115.29 116.12 3bwc s HIS 121 Ca -0.11 0.77 0.00 0.00 -1.54 0.00 0.00 55.06 54.18 3bwc s HIS 121 Cb 0.07 0.14 0.02 0.00 0.04 0.00 0.00 32.58 32.86 3bwc s HIS 121 CO 0.81 -0.30 -0.05 0.00 -2.34 0.00 0.00 174.74 172.86 3bwc s ASP 123 N 1.30 6.34 -0.17 0.00 1.01 0.10 -1.45 116.67 123.80 3bwc s ASP 123 Ca -0.04 0.39 0.01 0.00 0.71 0.00 0.00 52.55 53.61 3bwc s ASP 123 Cb -0.14 -2.15 0.01 0.00 1.01 0.00 0.00 42.92 41.65 3bwc s ASP 123 CO -0.02 0.09 -0.20 -0.22 0.21 0.00 0.00 175.17 175.03 3bwc s LEU 124 N 0.62 2.17 -0.28 1.23 0.20 -0.54 -0.13 118.68 121.95 3bwc s LEU 124 Ca 0.13 -0.62 0.02 0.00 0.69 0.00 0.00 54.13 54.36 3bwc s LEU 124 Cb -0.13 -1.48 0.08 0.00 -0.43 0.00 0.00 46.19 44.22 3bwc s LEU 124 CO 0.03 0.03 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.40 3bwc s VAL 125 N 1.12 1.87 -0.05 1.68 1.01 0.33 0.23 120.40 126.59 3bwc s VAL 125 Ca 0.01 -1.69 0.05 0.00 0.00 0.00 0.00 61.98 60.35 3bwc s VAL 125 Cb -0.14 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.03 3bwc s VAL 125 CO -0.08 -0.28 -0.20 -0.62 0.00 0.00 0.00 175.10 173.92 3bwc s ASP 126 N 1.18 3.54 0.35 3.32 -1.08 -0.80 -0.30 116.67 122.88 3bwc s ASP 126 Ca -0.00 -0.36 0.19 0.00 -0.52 0.00 0.00 52.55 51.85 3bwc s ASP 126 Cb -0.19 -0.79 0.47 0.00 -1.46 0.00 0.00 42.92 40.95 3bwc s ASP 126 CO -0.08 0.30 1.63 -0.29 0.52 0.00 0.00 175.17 177.24 3bwc h ILE 127 N 4.67 0.77 -3.51 4.11 2.10 -1.79 -0.13 117.51 123.72 3bwc h ILE 127 Ca -0.40 -1.71 -0.71 0.00 1.08 0.00 0.00 64.86 63.13 3bwc h ILE 127 Cb 1.16 2.10 -0.29 0.00 -1.09 0.00 0.00 36.82 38.70 3bwc h ILE 127 CO 0.49 0.37 -0.52 -0.62 -1.08 0.00 0.00 178.15 176.80 3bwc s ASP 128 N -6.38 5.49 0.47 2.19 -1.08 -1.26 -4.43 116.67 111.67 3bwc s ASP 128 Ca 0.02 -1.49 0.25 0.00 -0.52 0.00 0.00 52.55 50.81 3bwc s ASP 128 Cb 0.09 -1.93 1.06 0.00 -1.46 0.00 0.00 42.92 40.69 3bwc s ASP 128 CO 0.70 -0.48 1.89 1.23 0.52 0.00 0.00 175.17 179.02 3bwc h GLY 129 N 8.30 0.00 2.00 2.66 0.00 -1.95 -2.93 103.07 111.15 3bwc h GLY 129 Ca -0.21 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.04 3bwc h GLY 129 CO 0.71 0.00 -0.35 0.83 0.00 0.00 0.00 176.54 177.72 3bwc h GLU 130 N 0.00 0.00 -0.09 4.80 5.08 -1.98 -2.45 114.58 119.94 3bwc h GLU 130 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3bwc h GLU 130 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3bwc h GLU 130 CO 0.02 0.35 0.00 0.28 -1.00 0.00 0.00 179.01 178.67 3bwc n VAL 131 N -3.44 0.00 0.00 3.13 0.31 -1.11 -1.31 118.33 115.91 3bwc n VAL 131 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 3bwc n VAL 131 Cb 0.52 -0.14 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 3bwc n VAL 131 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3bwc n GLU 133 N 0.23 0.00 0.19 5.55 -0.58 -0.92 -1.25 120.64 123.86 3bwc n GLU 133 Ca 0.00 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 56.80 3bwc n GLU 133 Cb 0.02 0.00 0.34 0.00 -0.57 0.00 0.00 31.44 31.23 3bwc n GLU 133 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 3bwc h GLN 134 N 0.00 0.00 -0.27 3.49 1.08 -1.49 -2.77 115.11 115.15 3bwc h GLN 134 Ca 0.00 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.02 3bwc h GLN 134 Cb 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.43 3bwc h GLN 134 CO 0.00 0.37 -0.56 0.77 -0.95 0.00 0.00 178.83 178.46 3bwc h SER 135 N 0.00 0.93 -0.92 1.46 0.02 -1.41 -1.32 113.55 112.32 3bwc h SER 135 Ca -0.00 -0.50 0.03 0.00 -0.84 0.00 0.00 61.79 60.47 3bwc h SER 135 Cb 0.89 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 63.11 3bwc h SER 135 CO 0.05 1.29 0.60 0.11 -1.14 0.00 0.00 176.83 177.74 3bwc h LYS 136 N 0.64 1.13 0.01 3.45 1.57 -1.77 0.18 116.57 121.78 3bwc h LYS 136 Ca 0.01 -0.07 -0.09 0.00 -1.87 0.00 0.00 60.65 58.63 3bwc h LYS 136 Cb 1.16 -0.26 0.01 0.00 0.08 0.00 0.00 32.23 33.22 3bwc h LYS 136 CO 0.12 0.75 -0.36 0.37 -0.57 0.00 0.00 179.45 179.76 3bwc h GLN 137 N 1.17 0.23 0.00 3.15 4.15 -1.44 -3.35 115.11 119.02 3bwc h GLN 137 Ca 0.36 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.52 3bwc h GLN 137 Cb -0.02 0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.75 3bwc h GLN 137 CO -0.11 0.99 -0.72 0.72 -1.93 0.00 0.00 178.83 177.77 3bwc n HIS 138 N -4.42 0.00 -3.17 3.99 8.25 -0.50 -4.58 115.22 114.79 3bwc n HIS 138 Ca -0.10 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.13 3bwc n HIS 138 Cb 0.56 -0.04 -0.05 0.00 1.12 0.00 0.00 29.99 31.58 3bwc n HIS 138 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3bwc n PHE 139 N -1.38 1.53 0.17 4.41 3.72 0.62 -4.97 117.46 121.57 3bwc n PHE 139 Ca 0.02 -3.85 0.04 0.00 -0.05 0.00 0.00 57.45 53.60 3bwc n PHE 139 Cb 0.21 -0.44 0.44 0.00 -0.94 0.00 0.00 39.48 38.76 3bwc n PHE 139 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3bwc h PRO 140 N 3.46 0.11 0.00 -1.08 0.13 -1.69 -1.45 132.00 131.48 3bwc h PRO 140 Ca 0.12 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 3bwc h PRO 140 Cb 0.79 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3bwc h PRO 140 CO 0.62 0.28 0.00 1.96 -0.23 0.00 0.00 178.00 180.63 3bwc h GLN 141 N 0.11 0.00 0.05 0.86 1.08 -1.92 -2.51 115.11 112.78 3bwc h GLN 141 Ca 0.02 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 56.88 3bwc h GLN 141 Cb 0.36 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.75 3bwc h GLN 141 CO 0.02 0.00 -1.94 -0.89 -0.95 0.00 0.00 178.83 175.08 3bwc n ILE 142 N -3.05 1.64 1.41 2.54 5.41 -0.90 -4.45 119.36 121.96 3bwc n ILE 142 Ca 0.03 -0.43 0.15 0.00 1.00 0.00 0.00 62.75 63.49 3bwc n ILE 142 Cb 0.43 -1.79 0.71 0.00 -0.71 0.00 0.00 39.64 38.28 3bwc n ILE 142 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 3bwc n SER 143 N -3.81 0.13 -0.23 4.38 3.41 -0.60 -3.83 113.62 113.08 3bwc n SER 143 Ca -0.37 -0.26 0.19 0.00 -0.26 0.00 0.00 58.87 58.17 3bwc n SER 143 Cb 0.92 -0.22 0.52 0.00 -0.26 0.00 0.00 64.21 65.17 3bwc n SER 143 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3bwc h ARG 144 N 0.15 0.38 0.00 4.33 3.08 -1.66 -1.57 114.38 119.08 3bwc h ARG 144 Ca 0.00 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 60.00 3bwc h ARG 144 Cb 0.31 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.27 3bwc h ARG 144 CO 0.00 0.25 -0.11 0.66 -1.07 0.00 0.00 179.97 179.70 3bwc h SER 145 N 0.39 0.00 0.10 7.04 4.64 -1.83 -3.06 113.55 120.83 3bwc h SER 145 Ca 0.46 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.77 3bwc h SER 145 Cb 1.17 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3bwc h SER 145 CO -0.17 0.11 -0.05 -0.07 -0.87 0.00 0.00 176.83 175.78 3bwc h LEU 146 N 0.00 0.00 -2.27 5.97 3.38 -1.57 -1.93 115.31 118.89 3bwc h LEU 146 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3bwc h LEU 146 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3bwc h LEU 146 CO 0.01 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.59 3bwc n ALA 147 N -2.36 2.68 -1.94 1.53 0.00 -1.16 -4.71 120.51 114.55 3bwc n ALA 147 Ca -0.03 -1.09 -0.41 0.00 0.00 0.00 0.00 53.44 51.91 3bwc n ALA 147 Cb 0.13 -0.99 -0.04 0.00 0.00 0.00 0.00 19.45 18.56 3bwc n ALA 147 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3bwc s ASP 148 N -0.90 7.12 0.30 0.00 -1.08 -0.73 -4.95 116.67 116.44 3bwc s ASP 148 Ca 0.38 2.28 0.06 0.00 -0.52 0.00 0.00 52.55 54.75 3bwc s ASP 148 Cb 0.22 -2.62 0.74 0.00 -1.46 0.00 0.00 42.92 39.81 3bwc s ASP 148 CO 0.22 -0.31 1.77 -0.65 0.52 0.00 0.00 175.17 176.72 3bwc h PRO 149 N 4.63 0.70 0.00 4.34 0.11 -1.93 0.30 132.00 140.15 3bwc h PRO 149 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3bwc h PRO 149 Cb 1.21 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3bwc h PRO 149 CO 0.71 0.46 0.00 0.54 -0.21 0.00 0.00 178.00 179.51 3bwc n ARG 150 N -4.80 0.47 -4.24 1.05 1.74 -1.26 -4.75 116.66 104.87 3bwc n ARG 150 Ca 0.23 0.04 -0.35 0.00 -0.77 0.00 0.00 57.85 57.00 3bwc n ARG 150 Cb 0.59 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.43 3bwc n ARG 150 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3bwc s ALA 151 N -2.42 3.35 -0.22 7.54 0.00 0.09 -0.53 121.76 129.58 3bwc s ALA 151 Ca 0.27 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.47 3bwc s ALA 151 Cb 0.17 -1.64 0.03 0.00 0.00 0.00 0.00 23.12 21.68 3bwc s ALA 151 CO 0.36 0.46 -0.15 0.99 0.00 0.00 0.00 175.76 177.42 3bwc s THR 152 N -0.50 2.25 -0.27 0.00 2.01 -0.53 -4.72 115.64 113.88 3bwc s THR 152 Ca 0.09 -1.15 -0.10 0.00 0.31 0.00 0.00 61.69 60.84 3bwc s THR 152 Cb -0.12 -2.09 -0.05 0.00 0.01 0.00 0.00 72.50 70.25 3bwc s THR 152 CO 0.02 0.31 0.17 -0.69 -0.69 0.00 0.00 174.62 173.75 3bwc s VAL 153 N 1.24 5.19 -0.06 3.82 1.01 -1.26 -1.47 120.40 128.87 3bwc s VAL 153 Ca 0.00 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.13 3bwc s VAL 153 Cb -0.16 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 3bwc s VAL 153 CO -0.09 0.27 -0.11 -0.13 0.00 0.00 0.00 175.10 175.04 3bwc s ARG 154 N 1.66 2.64 -0.55 2.72 0.52 0.13 -4.98 118.95 121.09 3bwc s ARG 154 Ca 0.07 -0.63 -0.16 0.00 -0.52 0.00 0.00 55.73 54.49 3bwc s ARG 154 Cb -0.16 -2.48 0.13 0.00 0.52 0.00 0.00 34.95 32.97 3bwc s ARG 154 CO 0.09 0.63 0.51 0.08 0.02 0.00 0.00 175.30 176.63 3bwc s VAL 155 N -0.73 5.22 -0.03 3.52 1.01 -1.26 -1.91 120.40 126.23 3bwc s VAL 155 Ca 0.11 -1.54 -0.30 0.00 0.00 0.00 0.00 61.98 60.25 3bwc s VAL 155 Cb -0.11 -4.35 0.12 0.00 0.00 0.00 0.00 36.38 32.04 3bwc s VAL 155 CO 0.01 -0.88 1.32 -0.83 0.00 0.00 0.00 175.10 174.72 3bwc s GLY 156 N 3.54 -0.37 0.13 4.51 0.00 -0.06 -4.93 107.32 110.14 3bwc s GLY 156 Ca 0.04 0.59 -0.31 0.00 0.00 0.00 0.00 44.72 45.04 3bwc s GLY 156 CO 0.03 1.44 1.30 -0.35 0.00 0.00 0.00 173.10 175.51 3bwc s ASP 157 N -3.18 6.93 0.28 1.64 2.15 -1.26 -2.51 116.67 120.72 3bwc s ASP 157 Ca 0.18 2.26 0.12 0.00 0.43 0.00 0.00 52.55 55.54 3bwc s ASP 157 Cb 0.04 -2.59 0.33 0.00 -0.30 0.00 0.00 42.92 40.40 3bwc s ASP 157 CO -0.04 -0.54 1.58 1.23 -0.17 0.00 0.00 175.17 177.23 3bwc h GLY 158 N 6.24 0.00 0.98 2.66 0.00 -1.95 -1.80 103.07 109.20 3bwc h GLY 158 Ca -0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.90 3bwc h GLY 158 CO 0.81 0.00 0.05 1.41 0.00 0.00 0.00 176.54 178.82 3bwc h LEU 159 N 0.00 0.10 -0.81 3.11 4.07 -1.98 -1.52 115.31 118.27 3bwc h LEU 159 Ca -0.01 -0.03 -0.09 0.00 0.08 0.00 0.00 57.88 57.84 3bwc h LEU 159 Cb 1.17 -0.02 -0.02 0.00 1.08 0.00 0.00 40.66 42.87 3bwc h LEU 159 CO 0.08 0.10 -0.08 0.00 -1.08 0.00 0.00 178.44 177.45 3bwc h ALA 160 N 1.01 1.00 -0.05 1.53 0.00 -1.95 -2.86 119.26 117.93 3bwc h ALA 160 Ca 0.03 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.63 3bwc h ALA 160 Cb 0.01 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3bwc h ALA 160 CO -0.01 0.60 0.02 0.35 0.00 0.00 0.00 179.25 180.21 3bwc h PHE 161 N 0.74 0.09 0.00 0.00 3.57 -1.14 -2.68 116.94 117.51 3bwc h PHE 161 Ca 0.13 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 3bwc h PHE 161 Cb 0.56 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3bwc h PHE 161 CO 0.03 0.27 -0.37 -0.39 -2.23 0.00 0.00 178.31 175.61 3bwc h VAL 162 N -0.12 1.27 -0.02 1.41 -1.51 -1.31 -1.47 116.25 114.49 3bwc h VAL 162 Ca 0.02 -1.28 -0.10 0.00 -1.23 0.00 0.00 66.70 64.11 3bwc h VAL 162 Cb 0.22 1.69 -0.01 0.00 -2.13 0.00 0.00 31.29 31.06 3bwc h VAL 162 CO -0.00 0.36 -0.46 -0.09 -1.23 0.00 0.00 177.57 176.16 3bwc h ARG 163 N 0.00 0.04 -0.03 5.19 2.43 -1.40 -3.02 114.38 117.59 3bwc h ARG 163 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3bwc h ARG 163 Cb 0.66 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 3bwc h ARG 163 CO 0.05 0.49 0.00 1.04 -1.51 0.00 0.00 179.97 180.04 3bwc n GLN 164 N -3.99 2.30 -2.96 0.20 6.02 -0.99 -4.92 117.38 113.04 3bwc n GLN 164 Ca -0.02 -1.89 -0.40 0.00 -0.01 0.00 0.00 57.00 54.69 3bwc n GLN 164 Cb 0.49 -1.46 -0.05 0.00 1.02 0.00 0.00 30.24 30.23 3bwc n GLN 164 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3bwc s THR 165 N -1.99 4.71 1.04 5.09 2.01 -0.59 -5.06 115.64 120.84 3bwc s THR 165 Ca 0.29 1.67 -0.12 0.00 0.31 0.00 0.00 61.69 63.84 3bwc s THR 165 Cb 0.20 -4.13 0.21 0.00 0.01 0.00 0.00 72.50 68.79 3bwc s THR 165 CO 0.30 0.36 1.07 -2.84 -0.69 0.00 0.00 174.62 172.82 3bwc s PRO 166 N -0.05 0.11 0.58 4.92 0.02 -1.26 -4.86 135.00 134.46 3bwc s PRO 166 Ca 0.39 0.82 -0.19 0.00 0.02 0.00 0.00 61.00 62.03 3bwc s PRO 166 Cb -0.21 -1.68 -0.04 0.00 0.02 0.00 0.00 34.50 32.60 3bwc s PRO 166 CO 0.24 -3.02 1.22 -0.51 -0.33 0.00 0.00 177.00 174.60 3bwc s ASP 167 N -2.99 5.25 -1.32 2.53 1.11 -1.26 -3.92 116.67 116.07 3bwc s ASP 167 Ca 0.66 2.43 -0.02 0.00 0.18 0.00 0.00 52.55 55.81 3bwc s ASP 167 Cb -0.21 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.17 3bwc s ASP 167 CO 0.60 -1.55 0.63 0.59 1.18 0.00 0.00 175.17 176.62 3bwc n ASN 168 N -1.45 -1.30 -0.11 0.27 3.02 -0.67 -4.92 115.26 110.10 3bwc n ASN 168 Ca 0.13 -0.88 -0.25 0.00 -0.03 0.00 0.00 54.58 53.55 3bwc n ASN 168 Cb 0.49 -3.77 -0.11 0.00 -0.61 0.00 0.00 39.78 35.78 3bwc n ASN 168 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 3bwc n THR 169 N -4.28 1.56 -4.13 3.41 -1.04 0.12 -4.70 114.28 105.22 3bwc n THR 169 Ca -0.29 -0.31 -0.30 0.00 -2.04 0.00 0.00 64.05 61.11 3bwc n THR 169 Cb 0.67 -1.86 -0.08 0.00 -1.82 0.00 0.00 70.33 67.24 3bwc n THR 169 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 3bwc s TYR 170 N -2.46 2.98 -0.03 -1.42 2.02 -0.43 -4.86 117.35 113.15 3bwc s TYR 170 Ca -0.33 -0.03 -0.02 0.00 -0.37 0.00 0.00 57.07 56.32 3bwc s TYR 170 Cb 0.10 -1.53 -0.27 0.00 -0.40 0.00 0.00 41.96 39.86 3bwc s TYR 170 CO 0.57 0.48 0.72 -0.44 -1.57 0.00 0.00 175.55 175.31 3bwc h ASP 171 N 3.41 0.35 -3.68 2.29 3.32 -0.93 0.73 116.42 121.91 3bwc h ASP 171 Ca -0.48 -0.56 -0.27 0.00 0.02 0.00 0.00 57.03 55.74 3bwc h ASP 171 Cb 1.17 -0.11 -0.30 0.00 0.22 0.00 0.00 39.33 40.30 3bwc h ASP 171 CO 0.60 1.48 -0.73 -0.69 -1.72 0.00 0.00 179.24 178.18 3bwc s VAL 172 N -2.60 0.04 -0.22 -1.35 1.01 -1.14 -1.34 120.40 114.81 3bwc s VAL 172 Ca -0.11 0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.92 3bwc s VAL 172 Cb 0.07 -0.09 0.04 0.00 0.00 0.00 0.00 36.38 36.40 3bwc s VAL 172 CO 0.83 0.05 -0.15 -0.69 0.00 0.00 0.00 175.10 175.14 3bwc s VAL 173 N 0.34 2.20 -0.26 2.92 1.01 -0.63 -0.54 120.40 125.45 3bwc s VAL 173 Ca -0.03 -1.24 -0.08 0.00 0.00 0.00 0.00 61.98 60.63 3bwc s VAL 173 Cb -0.05 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 3bwc s VAL 173 CO -0.01 0.26 0.09 -0.63 0.00 0.00 0.00 175.10 174.81 3bwc s ILE 174 N 1.22 4.37 -0.61 2.22 1.01 0.89 -0.00 121.20 130.30 3bwc s ILE 174 Ca -0.01 -0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.27 3bwc s ILE 174 Cb -0.16 -3.08 0.15 0.00 0.01 0.00 0.00 42.46 39.38 3bwc s ILE 174 CO -0.09 0.29 0.56 -0.63 0.00 0.00 0.00 174.94 175.08 3bwc s ILE 175 N 1.61 5.29 -1.13 2.92 1.01 0.31 -0.47 121.20 130.75 3bwc s ILE 175 Ca 0.06 -1.74 -0.04 0.00 0.00 0.00 0.00 60.65 58.93 3bwc s ILE 175 Cb -0.15 -4.36 0.16 0.00 0.01 0.00 0.00 42.46 38.12 3bwc s ILE 175 CO 0.04 -0.91 2.30 -0.67 0.00 0.00 0.00 174.94 175.70 3bwc n ASP 176 N 4.93 7.69 -3.18 3.58 -0.08 0.11 -2.68 116.55 126.92 3bwc n ASP 176 Ca -0.07 -3.30 0.04 0.00 -1.51 0.00 0.00 54.79 49.95 3bwc n ASP 176 Cb 0.42 -1.29 -0.01 0.00 2.34 0.00 0.00 41.12 42.57 3bwc n ASP 176 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 3bwc s THR 177 N -2.14 -0.74 0.00 5.18 -1.32 -1.26 -3.76 115.64 111.60 3bwc s THR 177 Ca 0.51 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.99 3bwc s THR 177 Cb 0.22 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.21 3bwc s THR 177 CO -0.13 0.00 0.00 0.41 -2.21 0.00 0.00 174.62 172.69 3bwc n THR 178 N 5.43 0.00 0.00 5.08 -1.04 -1.26 -4.82 114.28 117.67 3bwc n THR 178 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 3bwc n THR 178 Cb 0.52 -0.28 0.00 0.00 -1.82 0.00 0.00 70.33 68.75 3bwc n THR 178 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3bwc n PHE 188 N 0.90 0.00 -0.44 -1.42 3.01 -1.26 -5.12 117.46 113.13 3bwc n PHE 188 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3bwc n PHE 188 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3bwc n PHE 188 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3bwc n GLY 189 N 0.00 1.15 0.09 1.37 0.00 -1.26 -4.90 105.19 101.64 3bwc n GLY 189 Ca 0.00 -1.67 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 3bwc n GLY 189 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3bwc h GLU 190 N 0.00 0.17 -0.36 1.61 4.11 -2.00 -3.13 114.58 114.99 3bwc h GLU 190 Ca 0.00 -0.29 -0.01 0.00 0.07 0.00 0.00 59.36 59.12 3bwc h GLU 190 Cb 0.00 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3bwc h GLU 190 CO 0.00 1.14 0.16 0.00 0.07 0.00 0.00 179.01 180.38 3bwc h ALA 191 N 0.74 1.62 0.01 1.06 0.00 -1.98 -0.88 119.26 119.82 3bwc h ALA 191 Ca -0.09 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.74 3bwc h ALA 191 Cb 1.89 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3bwc h ALA 191 CO 0.18 0.31 -0.00 0.35 0.00 0.00 0.00 179.25 180.08 3bwc h PHE 192 N 0.50 -0.01 0.00 0.00 3.57 -1.90 -1.89 116.94 117.21 3bwc h PHE 192 Ca 0.13 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.55 3bwc h PHE 192 Cb 0.07 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.80 3bwc h PHE 192 CO 0.00 0.47 -0.37 1.88 -2.23 0.00 0.00 178.31 178.06 3bwc h TYR 193 N -0.49 0.00 -0.76 0.41 0.05 -1.51 -0.01 116.97 114.67 3bwc h TYR 193 Ca -0.00 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.72 3bwc h TYR 193 Cb 0.48 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.19 3bwc h TYR 193 CO 0.09 0.37 0.25 0.87 -1.05 0.00 0.00 178.16 178.69 3bwc h LYS 194 N 0.00 1.16 -0.42 4.88 1.79 -1.19 -1.44 116.57 121.35 3bwc h LYS 194 Ca -0.00 -0.24 -0.06 0.00 -2.18 0.00 0.00 60.65 58.16 3bwc h LYS 194 Cb 0.95 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.41 3bwc h LYS 194 CO 0.05 0.98 0.02 -0.44 -1.08 0.00 0.00 179.45 178.97 3bwc h ASP 195 N 1.12 0.71 -0.69 0.86 3.32 -0.60 -1.89 116.42 119.25 3bwc h ASP 195 Ca 0.25 -0.30 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 3bwc h ASP 195 Cb 0.28 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 3bwc h ASP 195 CO -0.01 0.84 0.36 0.58 -1.72 0.00 0.00 179.24 179.29 3bwc h VAL 196 N 0.57 1.22 -0.39 -1.35 2.07 -0.94 -0.52 116.25 116.92 3bwc h VAL 196 Ca 0.12 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 3bwc h VAL 196 Cb 0.46 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3bwc h VAL 196 CO 0.02 0.25 0.18 0.25 0.02 0.00 0.00 177.57 178.29 3bwc h LEU 197 N 0.96 0.52 -0.48 2.57 5.85 -1.20 -2.85 115.31 120.68 3bwc h LEU 197 Ca 0.24 -0.14 -0.17 0.00 0.84 0.00 0.00 57.88 58.65 3bwc h LEU 197 Cb 0.07 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3bwc h LEU 197 CO -0.04 0.51 -0.65 0.08 -0.34 0.00 0.00 178.44 178.01 3bwc h ARG 198 N 0.49 0.45 0.00 1.25 0.11 -1.05 -3.08 114.38 112.54 3bwc h ARG 198 Ca 0.13 -0.32 0.00 0.00 0.10 0.00 0.00 59.98 59.89 3bwc h ARG 198 Cb 0.14 0.05 0.00 0.00 1.11 0.00 0.00 29.97 31.27 3bwc h ARG 198 CO -0.02 0.94 0.00 -0.84 0.10 0.00 0.00 179.97 180.16 3bwc h ILE 199 N 0.32 0.00 -3.93 0.08 3.07 -1.11 -1.78 117.51 114.16 3bwc h ILE 199 Ca -0.01 -0.46 -0.47 0.00 1.55 0.00 0.00 64.86 65.47 3bwc h ILE 199 Cb 1.20 1.36 -0.00 0.00 -0.27 0.00 0.00 36.82 39.10 3bwc h ILE 199 CO 0.11 0.00 0.38 -0.76 -1.05 0.00 0.00 178.15 176.83 3bwc s LEU 200 N -5.04 4.23 0.82 0.16 1.43 -1.08 0.14 118.68 119.33 3bwc s LEU 200 Ca 0.06 1.91 -0.12 0.00 -1.03 0.00 0.00 54.13 54.96 3bwc s LEU 200 Cb 0.10 -4.12 0.08 0.00 0.03 0.00 0.00 46.19 42.28 3bwc s LEU 200 CO 0.52 -0.26 1.11 -0.54 0.23 0.00 0.00 176.35 177.40 3bwc s LYS 201 N -2.32 1.92 0.32 1.70 1.02 0.25 -3.91 119.74 118.72 3bwc s LYS 201 Ca 0.54 0.52 0.08 0.00 0.02 0.00 0.00 55.97 57.14 3bwc s LYS 201 Cb -0.19 -1.91 0.82 0.00 -0.52 0.00 0.00 37.83 36.03 3bwc s LYS 201 CO 0.25 -1.71 1.76 -1.35 -0.92 0.00 0.00 175.35 173.38 3bwc h PRO 202 N -1.15 0.65 -0.86 -1.68 0.11 -1.96 0.36 132.00 127.48 3bwc h PRO 202 Ca -0.48 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 65.38 3bwc h PRO 202 Cb 1.28 -0.15 -0.13 0.00 0.11 0.00 0.00 31.00 32.12 3bwc h PRO 202 CO 0.60 0.43 0.27 -0.25 -0.21 0.00 0.00 178.00 178.85 3bwc n ASP 203 N -4.80 4.03 -4.78 -2.05 8.00 -1.26 -3.13 116.55 112.56 3bwc n ASP 203 Ca 0.25 -2.99 -0.35 0.00 0.71 0.00 0.00 54.79 52.41 3bwc n ASP 203 Cb 0.66 -0.71 -0.01 0.00 -0.02 0.00 0.00 41.12 41.05 3bwc n ASP 203 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3bwc s GLY 204 N -0.67 2.65 -0.11 0.44 0.00 0.13 -4.82 107.32 104.94 3bwc s GLY 204 Ca 0.42 0.81 0.03 0.00 0.00 0.00 0.00 44.72 45.99 3bwc s GLY 204 CO 0.10 1.19 -0.23 -0.42 0.00 0.00 0.00 173.10 173.74 3bwc s ILE 205 N -1.74 2.00 -0.08 0.90 -1.09 -0.45 -1.98 121.20 118.76 3bwc s ILE 205 Ca 0.69 -0.97 -0.05 0.00 -2.23 0.00 0.00 60.65 58.09 3bwc s ILE 205 Cb -0.24 -1.75 -0.04 0.00 -1.58 0.00 0.00 42.46 38.85 3bwc s ILE 205 CO 0.28 0.54 0.13 0.00 -1.23 0.00 0.00 174.94 174.66 3bwc s ASN 208 N 0.69 0.62 -0.09 0.00 3.84 -0.57 0.12 114.94 119.55 3bwc s ASN 208 Ca -0.09 -0.58 -0.30 0.00 0.21 0.00 0.00 52.86 52.11 3bwc s ASN 208 Cb -0.12 0.07 -0.02 0.00 -0.55 0.00 0.00 41.25 40.63 3bwc s ASN 208 CO 0.00 -0.28 1.15 0.00 -2.79 0.00 0.00 177.10 175.19 3bwc s GLN 209 N -1.77 4.35 0.60 0.43 -2.07 -1.09 -0.53 119.66 119.57 3bwc s GLN 209 Ca -0.10 1.59 0.01 0.00 -1.82 0.00 0.00 55.36 55.03 3bwc s GLN 209 Cb -0.08 -3.58 0.06 0.00 -1.09 0.00 0.00 33.01 28.32 3bwc s GLN 209 CO -0.01 -0.46 0.83 0.20 -1.32 0.00 0.00 175.29 174.54 3bwc s GLY 210 N 1.43 1.81 0.87 2.60 0.00 0.39 -4.71 107.32 109.70 3bwc s GLY 210 Ca 0.53 -1.47 -0.11 0.00 0.00 0.00 0.00 44.72 43.67 3bwc s GLY 210 CO 0.19 -1.10 1.21 -0.54 0.00 0.00 0.00 173.10 172.86 3bwc s GLU 211 N -4.86 1.10 0.24 2.90 0.41 -1.26 -3.81 118.70 113.42 3bwc s GLU 211 Ca 0.60 -0.53 -0.30 0.00 -0.41 0.00 0.00 54.97 54.33 3bwc s GLU 211 Cb -0.09 -1.99 -0.09 0.00 -1.78 0.00 0.00 34.13 30.18 3bwc s GLU 211 CO 0.40 -2.04 0.99 0.45 -0.49 0.00 0.00 175.26 174.57 3bwc s SER 212 N -4.80 7.53 0.28 -0.19 0.15 -1.26 -3.93 113.70 111.48 3bwc s SER 212 Ca 0.70 2.02 0.24 0.00 0.70 0.00 0.00 55.95 59.62 3bwc s SER 212 Cb -0.05 -2.61 1.01 0.00 -1.71 0.00 0.00 66.02 62.65 3bwc s SER 212 CO 0.50 0.06 1.73 0.16 1.20 0.00 0.00 173.24 176.89 3bwc h ILE 213 N 3.23 0.00 0.00 6.45 3.07 -1.84 -2.58 117.51 125.84 3bwc h ILE 213 Ca -0.45 -0.26 0.00 0.00 1.55 0.00 0.00 64.86 65.70 3bwc h ILE 213 Cb 1.20 1.01 0.00 0.00 -0.27 0.00 0.00 36.82 38.76 3bwc h ILE 213 CO 0.68 0.00 -0.35 -0.50 -1.05 0.00 0.00 178.15 176.93 3bwc h TRP 214 N 0.00 0.00 -0.00 0.16 4.06 -1.92 -3.35 115.95 114.90 3bwc h TRP 214 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 3bwc h TRP 214 Cb 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.54 3bwc h TRP 214 CO 0.00 0.00 -0.23 1.47 -3.56 0.00 0.00 178.44 176.12 3bwc n LEU 215 N -4.02 0.31 -2.73 -4.49 -0.00 -1.25 -4.37 117.00 100.44 3bwc n LEU 215 Ca -0.05 0.20 -0.09 0.00 -0.00 0.00 0.00 56.01 56.07 3bwc n LEU 215 Cb 0.18 -0.34 0.08 0.00 -0.00 0.00 0.00 43.42 43.35 3bwc n LEU 215 CO 0.07 0.07 0.33 -0.67 -0.00 0.00 0.00 177.39 177.20 3bwc n ASP 216 N -1.39 -2.40 0.05 1.45 2.03 -0.98 -4.87 116.55 110.45 3bwc n ASP 216 Ca 0.08 -3.54 0.00 0.00 0.52 0.00 0.00 54.79 51.85 3bwc n ASP 216 Cb 0.33 1.88 0.31 0.00 -0.72 0.00 0.00 41.12 42.92 3bwc n ASP 216 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3bwc h LEU 217 N 3.16 0.37 -0.76 -2.67 5.85 -1.68 -3.15 115.31 116.44 3bwc h LEU 217 Ca -0.12 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.40 3bwc h LEU 217 Cb 1.09 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 3bwc h LEU 217 CO 0.16 0.52 -0.27 -0.33 -0.34 0.00 0.00 178.44 178.18 3bwc h GLU 218 N 0.36 0.65 0.00 1.25 3.07 -1.92 -2.60 114.58 115.39 3bwc h GLU 218 Ca 0.07 -0.27 -0.11 0.00 -0.50 0.00 0.00 59.36 58.55 3bwc h GLU 218 Cb 0.43 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 3bwc h GLU 218 CO 0.02 0.85 -0.54 1.25 -1.40 0.00 0.00 179.01 179.19 3bwc h LEU 219 N 0.56 0.00 -0.30 1.33 6.46 -1.94 -2.55 115.31 118.87 3bwc h LEU 219 Ca 0.07 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.81 3bwc h LEU 219 Cb 0.75 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 3bwc h LEU 219 CO 0.06 0.54 0.08 0.40 -0.62 0.00 0.00 178.44 178.90 3bwc h ILE 220 N 0.00 1.21 -0.46 4.05 2.04 -1.47 -3.10 117.51 119.79 3bwc h ILE 220 Ca -0.01 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.15 3bwc h ILE 220 Cb 0.96 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 3bwc h ILE 220 CO 0.07 0.24 0.30 -0.33 0.00 0.00 0.00 178.15 178.42 3bwc h GLU 221 N 0.32 0.61 -0.09 2.37 5.08 -1.42 0.11 114.58 121.56 3bwc h GLU 221 Ca 0.10 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3bwc h GLU 221 Cb 0.28 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.40 3bwc h GLU 221 CO 0.00 0.41 0.00 1.63 -1.00 0.00 0.00 179.01 180.05 3bwc n LYS 222 N -4.76 0.11 0.00 2.33 5.02 -0.97 -1.68 118.16 118.21 3bwc n LYS 222 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3bwc n LYS 222 Cb 0.03 -1.05 0.00 0.00 -0.02 0.00 0.00 35.03 33.99 3bwc n LYS 222 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3bwc n SER 224 N 0.35 0.00 -0.05 4.39 2.88 0.38 -0.62 113.62 120.95 3bwc n SER 224 Ca 0.00 0.00 -0.16 0.00 -1.33 0.00 0.00 58.87 57.38 3bwc n SER 224 Cb 0.02 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.42 3bwc n SER 224 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 3bwc h ARG 225 N 0.00 0.79 -0.76 -1.46 2.43 -1.57 -2.75 114.38 111.06 3bwc h ARG 225 Ca 0.00 -0.58 0.05 0.00 -0.81 0.00 0.00 59.98 58.64 3bwc h ARG 225 Cb 0.00 0.10 -0.06 0.00 -0.42 0.00 0.00 29.97 29.60 3bwc h ARG 225 CO 0.00 1.20 0.46 0.35 -1.51 0.00 0.00 179.97 180.47 3bwc h PHE 226 N 0.54 0.84 -0.58 2.20 3.57 -1.11 0.80 116.94 123.19 3bwc h PHE 226 Ca -0.02 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 3bwc h PHE 226 Cb 1.27 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 3bwc h PHE 226 CO 0.09 0.43 0.09 0.82 -2.23 0.00 0.00 178.31 177.51 3bwc h ILE 227 N 0.85 1.25 -0.39 1.41 2.04 -1.79 -1.69 117.51 119.18 3bwc h ILE 227 Ca 0.33 -0.97 -0.14 0.00 1.00 0.00 0.00 64.86 65.08 3bwc h ILE 227 Cb 0.14 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 3bwc h ILE 227 CO -0.16 0.36 -0.29 0.03 0.00 0.00 0.00 178.15 178.09 3bwc h ARG 228 N 0.89 0.88 0.00 2.37 3.08 -1.07 -3.02 114.38 117.51 3bwc h ARG 228 Ca 0.18 -0.43 -0.05 0.00 0.07 0.00 0.00 59.98 59.75 3bwc h ARG 228 Cb 0.40 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3bwc h ARG 228 CO 0.01 1.08 -0.25 0.93 -1.07 0.00 0.00 179.97 180.67 3bwc h GLU 229 N 0.70 0.00 -0.19 0.04 4.39 -0.75 -2.54 114.58 116.22 3bwc h GLU 229 Ca 0.08 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 3bwc h GLU 229 Cb 0.86 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 3bwc h GLU 229 CO 0.08 0.25 -0.04 1.15 -1.16 0.00 0.00 179.01 179.29 3bwc h THR 230 N 0.00 1.15 0.00 1.13 2.02 -1.17 -3.46 112.91 112.57 3bwc h THR 230 Ca -0.00 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.58 3bwc h THR 230 Cb 0.53 1.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 3bwc h THR 230 CO 0.03 0.20 0.00 0.61 0.37 0.00 0.00 175.52 176.73 3bwc n GLY 231 N -1.04 0.47 3.76 2.16 0.00 -0.96 -4.87 105.19 104.71 3bwc n GLY 231 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3bwc n GLY 231 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3bwc s PHE 232 N 0.00 3.03 0.06 1.61 0.08 -1.21 -4.95 117.98 116.60 3bwc s PHE 232 Ca 0.00 1.26 -0.21 0.00 0.12 0.00 0.00 56.93 58.10 3bwc s PHE 232 Cb 0.00 -3.74 -0.12 0.00 -0.57 0.00 0.00 43.02 38.59 3bwc s PHE 232 CO 0.00 -2.19 1.54 0.00 -0.10 0.00 0.00 175.22 174.47 3bwc h ALA 233 N 4.03 0.17 -2.76 5.36 0.00 -1.04 -3.42 119.26 121.61 3bwc h ALA 233 Ca -0.48 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.13 3bwc h ALA 233 Cb 1.22 -0.05 -0.20 0.00 0.00 0.00 0.00 17.79 18.77 3bwc h ALA 233 CO 0.70 -0.18 -0.60 -1.54 0.00 0.00 0.00 179.25 177.64 3bwc s SER 234 N -5.64 0.19 -0.01 0.00 1.04 -1.09 -5.01 113.70 103.17 3bwc s SER 234 Ca -0.14 -0.47 -0.00 0.00 0.48 0.00 0.00 55.95 55.82 3bwc s SER 234 Cb 0.06 0.17 0.02 0.00 0.10 0.00 0.00 66.02 66.36 3bwc s SER 234 CO 0.70 -0.39 0.02 0.54 0.98 0.00 0.00 173.24 175.09 3bwc s VAL 235 N -1.92 -0.04 -0.03 5.02 0.11 -1.26 -0.40 120.40 121.89 3bwc s VAL 235 Ca -0.11 0.14 0.02 0.00 -2.93 0.00 0.00 61.98 59.10 3bwc s VAL 235 Cb -0.06 -0.06 0.00 0.00 -1.53 0.00 0.00 36.38 34.74 3bwc s VAL 235 CO -0.02 0.06 -0.09 -1.10 -3.33 0.00 0.00 175.10 170.62 3bwc s GLN 236 N 0.70 0.97 -0.20 1.54 -1.52 -0.83 -4.89 119.66 115.43 3bwc s GLN 236 Ca -0.06 -0.31 -0.18 0.00 -1.95 0.00 0.00 55.36 52.87 3bwc s GLN 236 Cb -0.08 -0.90 -0.03 0.00 -0.22 0.00 0.00 33.01 31.77 3bwc s GLN 236 CO -0.02 0.12 0.48 -0.47 -0.25 0.00 0.00 175.29 175.15 3bwc s TYR 237 N 0.19 3.37 -0.13 0.91 5.04 -1.26 -0.81 117.35 124.65 3bwc s TYR 237 Ca -0.03 0.72 -0.04 0.00 -2.44 0.00 0.00 57.07 55.28 3bwc s TYR 237 Cb -0.08 -2.63 -0.03 0.00 0.35 0.00 0.00 41.96 39.56 3bwc s TYR 237 CO 0.00 -0.08 0.01 0.00 -1.34 0.00 0.00 175.55 174.14 3bwc s ALA 238 N 1.55 3.24 0.59 3.97 0.00 0.33 -4.48 121.76 126.98 3bwc s ALA 238 Ca 0.22 -0.79 0.09 0.00 0.00 0.00 0.00 51.96 51.48 3bwc s ALA 238 Cb -0.15 -1.62 0.09 0.00 0.00 0.00 0.00 23.12 21.44 3bwc s ALA 238 CO 0.09 0.38 0.74 -1.17 0.00 0.00 0.00 175.76 175.80 3bwc s LEU 239 N -0.21 2.94 -0.39 0.00 2.96 0.21 -1.05 118.68 123.14 3bwc s LEU 239 Ca 0.06 -0.99 0.02 0.00 -0.22 0.00 0.00 54.13 53.00 3bwc s LEU 239 Cb -0.12 -1.40 0.12 0.00 0.50 0.00 0.00 46.19 45.28 3bwc s LEU 239 CO 0.02 -1.38 0.15 -1.00 -1.32 0.00 0.00 176.35 172.83 3bwc s HIS 241 N -2.73 2.59 -0.30 5.38 0.09 -1.26 -4.53 115.29 114.53 3bwc s HIS 241 Ca 0.57 -2.53 0.02 0.00 -0.00 0.00 0.00 55.06 53.12 3bwc s HIS 241 Cb -0.05 -2.28 0.08 0.00 -0.00 0.00 0.00 32.58 30.33 3bwc s HIS 241 CO 0.36 -0.85 -0.02 0.08 -0.00 0.00 0.00 174.74 174.32 3bwc s VAL 242 N 0.72 2.41 0.44 -0.90 1.01 -1.14 -4.98 120.40 117.97 3bwc s VAL 242 Ca 0.14 -1.87 0.27 0.00 0.00 0.00 0.00 61.98 60.52 3bwc s VAL 242 Cb -0.21 -2.55 0.30 0.00 0.00 0.00 0.00 36.38 33.91 3bwc s VAL 242 CO -0.09 -0.28 2.10 1.55 0.00 0.00 0.00 175.10 178.38 3bwc h PRO 243 N 7.77 0.00 0.00 2.72 0.13 -1.95 -3.10 132.00 137.58 3bwc h PRO 243 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 3bwc h PRO 243 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 3bwc h PRO 243 CO 0.51 0.10 -0.06 1.79 -0.23 0.00 0.00 178.00 180.11 3bwc h THR 244 N 0.00 0.00 -3.80 1.56 1.35 -1.95 -3.42 112.91 106.65 3bwc h THR 244 Ca -0.00 -0.59 -0.50 0.00 -0.55 0.00 0.00 66.41 64.77 3bwc h THR 244 Cb 0.28 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3bwc h THR 244 CO 0.01 0.00 0.42 -0.47 -0.25 0.00 0.00 175.52 175.23 3bwc s TYR 245 N -3.13 3.72 0.14 4.73 5.04 -1.17 -4.93 117.35 121.75 3bwc s TYR 245 Ca 0.09 1.79 -0.04 0.00 -2.44 0.00 0.00 57.07 56.47 3bwc s TYR 245 Cb 0.11 -3.14 0.24 0.00 0.35 0.00 0.00 41.96 39.52 3bwc s TYR 245 CO 0.62 -0.13 0.80 -2.30 -1.34 0.00 0.00 175.55 173.21 3bwc n PRO 246 N 1.19 -0.05 -0.25 4.97 -0.02 -1.26 0.85 135.00 140.44 3bwc n PRO 246 Ca -0.01 0.80 0.10 0.00 -2.02 0.00 0.00 63.50 62.37 3bwc n PRO 246 Cb 0.46 -1.20 0.23 0.00 -0.02 0.00 0.00 33.50 32.98 3bwc n PRO 246 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bwc n GLY 248 N 1.25 0.54 3.28 0.00 0.00 0.25 -4.98 105.19 105.53 3bwc n GLY 248 Ca 0.19 -0.27 0.03 0.00 0.00 0.00 0.00 46.02 45.97 3bwc n GLY 248 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3bwc s SER 249 N -2.33 -1.28 0.58 1.61 1.04 -1.24 -2.87 113.70 109.22 3bwc s SER 249 Ca 0.00 1.02 0.10 0.00 0.48 0.00 0.00 55.95 57.55 3bwc s SER 249 Cb 0.00 2.16 0.09 0.00 0.10 0.00 0.00 66.02 68.37 3bwc s SER 249 CO 0.00 -0.24 0.79 -0.51 0.98 0.00 0.00 173.24 174.26 3bwc s ILE 250 N 2.87 2.06 0.14 -1.02 2.07 -1.26 -4.61 121.20 121.44 3bwc s ILE 250 Ca 0.13 -1.03 0.01 0.00 -1.41 0.00 0.00 60.65 58.35 3bwc s ILE 250 Cb -0.14 -2.08 -0.00 0.00 0.13 0.00 0.00 42.46 40.36 3bwc s ILE 250 CO -0.20 0.00 0.15 0.61 -1.91 0.00 0.00 174.94 173.59 3bwc n GLY 251 N -2.24 3.16 3.13 1.50 0.00 -1.25 -4.73 105.19 104.77 3bwc n GLY 251 Ca 0.15 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.44 3bwc n GLY 251 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3bwc s THR 252 N -2.56 -0.02 -0.32 2.61 -1.32 -0.21 -0.46 115.64 113.36 3bwc s THR 252 Ca 0.14 0.09 -0.22 0.00 -1.21 0.00 0.00 61.69 60.48 3bwc s THR 252 Cb 0.00 -0.43 -0.00 0.00 -1.51 0.00 0.00 72.50 70.56 3bwc s THR 252 CO 0.10 0.03 0.72 -0.76 -2.21 0.00 0.00 174.62 172.50 3bwc s LEU 253 N 0.88 4.13 -0.45 9.08 1.43 0.32 -0.51 118.68 133.56 3bwc s LEU 253 Ca -0.06 0.49 -0.14 0.00 -1.03 0.00 0.00 54.13 53.39 3bwc s LEU 253 Cb -0.07 -2.95 0.07 0.00 0.03 0.00 0.00 46.19 43.27 3bwc s LEU 253 CO -0.06 -0.58 0.36 -0.69 0.23 0.00 0.00 176.35 175.61 3bwc s VAL 254 N 2.83 5.03 0.08 -1.59 1.01 0.01 -1.51 120.40 126.26 3bwc s VAL 254 Ca 0.29 -1.08 -0.01 0.00 0.00 0.00 0.00 61.98 61.18 3bwc s VAL 254 Cb -0.14 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 3bwc s VAL 254 CO 0.13 -0.53 0.25 0.00 0.00 0.00 0.00 175.10 174.95 3bwc s SER 256 N -2.54 2.01 0.03 0.00 0.15 0.46 -1.01 113.70 112.79 3bwc s SER 256 Ca 0.36 -0.34 -0.18 0.00 0.70 0.00 0.00 55.95 56.49 3bwc s SER 256 Cb -0.13 -0.92 -0.23 0.00 -1.71 0.00 0.00 66.02 63.03 3bwc s SER 256 CO 0.27 0.04 1.13 0.50 1.20 0.00 0.00 173.24 176.38 3bwc h LYS 257 N 7.01 0.50 -6.94 5.44 3.64 -1.68 0.19 116.57 124.73 3bwc h LYS 257 Ca -0.29 -0.54 -0.49 0.00 -1.27 0.00 0.00 60.65 58.06 3bwc h LYS 257 Cb 1.19 0.15 0.02 0.00 -0.41 0.00 0.00 32.23 33.19 3bwc h LYS 257 CO 0.47 1.17 0.43 0.21 -2.27 0.00 0.00 179.45 179.47 3bwc s LYS 258 N -3.25 4.20 0.32 1.90 2.47 -1.18 -3.73 119.74 120.46 3bwc s LYS 258 Ca -0.12 1.60 -0.13 0.00 -1.56 0.00 0.00 55.97 55.75 3bwc s LYS 258 Cb 0.05 -2.64 -0.08 0.00 -1.46 0.00 0.00 37.83 33.70 3bwc s LYS 258 CO 0.85 -0.13 0.71 0.00 0.16 0.00 0.00 175.35 176.94 3bwc s ALA 259 N -1.56 3.37 -0.31 3.13 0.00 -1.26 -4.42 121.76 120.71 3bwc s ALA 259 Ca 0.56 -0.06 -0.02 0.00 0.00 0.00 0.00 51.96 52.44 3bwc s ALA 259 Cb -0.25 -2.69 0.00 0.00 0.00 0.00 0.00 23.12 20.18 3bwc s ALA 259 CO 0.31 0.30 0.27 0.41 0.00 0.00 0.00 175.76 177.05 3bwc n GLY 260 N -0.50 0.58 2.88 0.00 0.00 -1.26 -5.06 105.19 101.83 3bwc n GLY 260 Ca 0.03 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.39 3bwc n GLY 260 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3bwc s VAL 261 N -3.08 0.52 -0.49 1.61 -7.23 -1.26 -5.11 120.40 105.37 3bwc s VAL 261 Ca 0.13 -0.09 -0.11 0.00 -1.81 0.00 0.00 61.98 60.09 3bwc s VAL 261 Cb -0.06 -0.57 0.12 0.00 0.56 0.00 0.00 36.38 36.43 3bwc s VAL 261 CO 0.17 0.23 0.39 -0.62 -0.31 0.00 0.00 175.10 174.96 3bwc s ASP 262 N 1.08 5.86 0.09 4.85 2.15 -1.26 -4.93 116.67 124.51 3bwc s ASP 262 Ca -0.08 -1.82 0.23 0.00 0.43 0.00 0.00 52.55 51.31 3bwc s ASP 262 Cb -0.14 -2.07 0.93 0.00 -0.30 0.00 0.00 42.92 41.33 3bwc s ASP 262 CO -0.01 -0.73 1.72 1.33 -0.17 0.00 0.00 175.17 177.32 3bwc n VAL 263 N 5.02 0.56 0.25 1.11 0.24 -1.26 -3.13 118.33 121.13 3bwc n VAL 263 Ca -0.10 0.06 0.15 0.00 -2.04 0.00 0.00 64.34 62.41 3bwc n VAL 263 Cb 0.41 -0.78 0.53 0.00 -1.47 0.00 0.00 33.84 32.52 3bwc n VAL 263 CO 0.00 0.00 0.00 0.71 -2.14 0.00 0.00 176.83 175.40 3bwc h THR 264 N 0.00 0.12 -3.33 3.34 1.35 -1.93 -3.41 112.91 109.05 3bwc h THR 264 Ca 0.00 -0.76 -0.65 0.00 -0.55 0.00 0.00 66.41 64.45 3bwc h THR 264 Cb 0.45 1.68 -0.25 0.00 -1.73 0.00 0.00 68.15 68.29 3bwc h THR 264 CO 0.00 0.05 -0.73 -0.54 -0.25 0.00 0.00 175.52 174.05 3bwc s LYS 265 N -3.56 3.48 -0.05 4.72 1.02 -1.18 -4.01 119.74 120.15 3bwc s LYS 265 Ca 0.02 -0.62 -0.32 0.00 0.02 0.00 0.00 55.97 55.07 3bwc s LYS 265 Cb 0.08 -2.79 -0.10 0.00 -0.52 0.00 0.00 37.83 34.51 3bwc s LYS 265 CO 0.59 0.15 1.96 -2.30 -0.92 0.00 0.00 175.35 174.83 3bwc n PRO 266 N 3.74 2.44 -0.14 -1.68 -0.02 -1.26 -4.87 135.00 133.22 3bwc n PRO 266 Ca -0.18 0.88 -0.10 0.00 -2.02 0.00 0.00 63.50 62.09 3bwc n PRO 266 Cb 0.52 -2.85 -0.01 0.00 -0.02 0.00 0.00 33.50 31.15 3bwc n PRO 266 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3bwc h LEU 267 N 10.35 0.61 -7.74 2.45 5.85 -1.73 -3.38 115.31 121.72 3bwc h LEU 267 Ca -0.48 -0.24 -0.65 0.00 0.84 0.00 0.00 57.88 57.36 3bwc h LEU 267 Cb 1.26 -0.16 -0.38 0.00 0.37 0.00 0.00 40.66 41.75 3bwc h LEU 267 CO 0.95 0.69 -0.78 -0.13 -0.34 0.00 0.00 178.44 178.82 3bwc s ARG 268 N -5.28 1.87 0.26 1.25 0.52 -0.89 -5.06 118.95 111.61 3bwc s ARG 268 Ca -0.13 -1.33 -0.30 0.00 -0.52 0.00 0.00 55.73 53.45 3bwc s ARG 268 Cb 0.10 -2.83 -0.10 0.00 0.52 0.00 0.00 34.95 32.64 3bwc s ARG 268 CO 0.77 -0.66 1.49 -1.25 0.02 0.00 0.00 175.30 175.66 3bwc s PRO 269 N 1.17 4.23 0.43 3.54 0.04 -1.26 -4.77 135.00 138.37 3bwc s PRO 269 Ca -0.04 2.38 0.30 0.00 0.04 0.00 0.00 61.00 63.68 3bwc s PRO 269 Cb -0.19 -3.09 1.28 0.00 0.04 0.00 0.00 34.50 32.54 3bwc s PRO 269 CO -0.07 -0.48 1.89 -0.24 0.04 0.00 0.00 177.00 178.14 3bwc h VAL 270 N 3.50 0.00 0.00 -0.36 3.04 -1.96 -2.66 116.25 117.81 3bwc h VAL 270 Ca -0.46 -0.35 -0.02 0.00 -1.01 0.00 0.00 66.70 64.86 3bwc h VAL 270 Cb 1.22 1.22 -0.00 0.00 -2.01 0.00 0.00 31.29 31.71 3bwc h VAL 270 CO 0.78 0.00 -0.11 -0.33 -1.01 0.00 0.00 177.57 176.91 3bwc h GLU 271 N 0.00 0.00 -2.34 4.17 3.07 -1.94 -3.38 114.58 114.16 3bwc h GLU 271 Ca 0.00 0.00 -0.12 0.00 -0.50 0.00 0.00 59.36 58.74 3bwc h GLU 271 Cb 0.40 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.26 3bwc h GLU 271 CO 0.00 0.11 -0.08 -0.25 -1.40 0.00 0.00 179.01 177.39 3bwc n ASP 272 N -4.16 3.40 -0.05 1.42 10.43 -1.01 -4.89 116.55 121.70 3bwc n ASP 272 Ca -0.03 -2.13 -0.05 0.00 2.57 0.00 0.00 54.79 55.15 3bwc n ASP 272 Cb 0.19 -0.92 -0.06 0.00 1.84 0.00 0.00 41.12 42.17 3bwc n ASP 272 CO 0.00 0.00 0.00 -2.65 -1.07 0.00 0.00 177.20 173.48 3bwc n PRO 274 N 2.66 1.80 0.00 -0.24 -0.02 -1.26 -5.07 135.00 132.87 3bwc n PRO 274 Ca 0.27 0.02 0.11 0.00 -2.02 0.00 0.00 63.50 61.89 3bwc n PRO 274 Cb 0.59 -1.22 0.64 0.00 -0.02 0.00 0.00 33.50 33.50 3bwc n PRO 274 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 3bwc n PHE 275 N -2.49 0.00 -0.34 6.00 1.16 -1.26 -3.98 117.46 116.55 3bwc n PHE 275 Ca -0.16 0.00 0.12 0.00 -1.87 0.00 0.00 57.45 55.54 3bwc n PHE 275 Cb 0.75 -0.11 0.32 0.00 -1.61 0.00 0.00 39.48 38.83 3bwc n PHE 275 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3bwc h ALA 276 N 3.30 1.69 -0.00 1.98 0.00 -1.90 -0.54 119.26 123.79 3bwc h ALA 276 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3bwc h ALA 276 Cb 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3bwc h ALA 276 CO 0.00 -0.01 -0.02 1.63 0.00 0.00 0.00 179.25 180.85 3bwc n LYS 277 N -4.67 0.78 0.08 0.00 5.02 -1.26 -3.33 118.16 114.78 3bwc n LYS 277 Ca 0.21 -0.11 0.11 0.00 -2.02 0.00 0.00 58.31 56.50 3bwc n LYS 277 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.02 3bwc n LYS 277 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3bwc n ASP 278 N -1.01 0.72 -4.78 4.39 9.92 -0.21 -4.95 116.55 120.62 3bwc n ASP 278 Ca 0.18 0.22 -0.35 0.00 -0.53 0.00 0.00 54.79 54.31 3bwc n ASP 278 Cb 0.21 0.61 -0.02 0.00 -0.64 0.00 0.00 41.12 41.28 3bwc n ASP 278 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 3bwc s LEU 279 N -5.00 3.85 -0.01 0.64 1.43 -1.21 -4.98 118.68 113.40 3bwc s LEU 279 Ca -0.00 2.08 0.18 0.00 -1.03 0.00 0.00 54.13 55.36 3bwc s LEU 279 Cb 0.11 -4.51 -0.23 0.00 0.03 0.00 0.00 46.19 41.60 3bwc s LEU 279 CO 0.80 -0.95 0.63 0.29 0.23 0.00 0.00 176.35 177.35 3bwc n LYS 280 N -0.98 0.92 0.10 1.70 5.02 -1.26 -4.83 118.16 118.83 3bwc n LYS 280 Ca 0.10 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 3bwc n LYS 280 Cb 0.51 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.15 3bwc n LYS 280 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 3bwc n TYR 281 N -1.67 -1.35 -2.47 2.13 9.36 -1.26 -5.05 117.16 116.85 3bwc n TYR 281 Ca 0.01 0.24 -0.41 0.00 3.32 0.00 0.00 57.90 61.06 3bwc n TYR 281 Cb 0.35 0.31 -0.04 0.00 -0.63 0.00 0.00 39.34 39.33 3bwc n TYR 281 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 3bwc s TYR 282 N -1.98 3.56 0.35 2.98 5.04 -1.26 -5.03 117.35 121.00 3bwc s TYR 282 Ca 0.00 1.62 -0.12 0.00 -2.44 0.00 0.00 57.07 56.13 3bwc s TYR 282 Cb 0.00 -3.31 0.03 0.00 0.35 0.00 0.00 41.96 39.03 3bwc s TYR 282 CO 0.00 -0.68 0.66 0.16 -1.34 0.00 0.00 175.55 174.34 3bwc s ASP 283 N -0.46 0.24 0.37 4.32 1.47 -1.26 -4.86 116.67 116.49 3bwc s ASP 283 Ca 0.47 -1.17 0.06 0.00 1.18 0.00 0.00 52.55 53.10 3bwc s ASP 283 Cb -0.31 0.76 0.77 0.00 -0.34 0.00 0.00 42.92 43.79 3bwc s ASP 283 CO 0.38 -1.48 1.99 0.28 0.68 0.00 0.00 175.17 177.02 3bwc h SER 284 N 2.06 0.62 0.00 2.11 0.02 -1.97 -0.62 113.55 115.76 3bwc h SER 284 Ca -0.29 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 3bwc h SER 284 Cb 1.25 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.65 3bwc h SER 284 CO 0.38 0.41 0.00 -0.62 -1.14 0.00 0.00 176.83 175.86 3bwc n GLU 285 N -4.47 0.57 0.00 3.45 -0.58 -1.26 -1.99 120.64 116.37 3bwc n GLU 285 Ca 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 3bwc n GLU 285 Cb 0.18 -1.22 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 3bwc n GLU 285 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 3bwc n HIS 287 N 0.66 0.00 -0.04 -0.32 -0.00 -0.24 -2.07 115.22 113.21 3bwc n HIS 287 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.63 3bwc n HIS 287 Cb 0.27 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 30.24 3bwc n HIS 287 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 176.34 177.21 3bwc h LYS 288 N 0.00 0.11 -0.16 1.57 1.57 -1.53 -3.04 116.57 115.10 3bwc h LYS 288 Ca 0.00 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 3bwc h LYS 288 Cb 0.00 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 3bwc h LYS 288 CO 0.00 0.07 -0.24 0.00 -0.57 0.00 0.00 179.45 178.72 3bwc h ALA 289 N 1.15 1.31 -0.22 3.86 0.00 -1.70 -3.03 119.26 120.63 3bwc h ALA 289 Ca 0.09 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.77 3bwc h ALA 289 Cb 0.09 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3bwc h ALA 289 CO -0.13 0.47 0.16 0.66 0.00 0.00 0.00 179.25 180.41 3bwc h SER 290 N 0.25 0.00 0.05 0.00 4.64 -1.76 -0.81 113.55 115.92 3bwc h SER 290 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 3bwc h SER 290 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3bwc h SER 290 CO 0.04 0.00 -0.04 0.49 -0.87 0.00 0.00 176.83 176.44 3bwc n PHE 291 N -4.42 0.00 -2.79 4.77 3.72 -1.15 0.64 117.46 118.23 3bwc n PHE 291 Ca 0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.00 3bwc n PHE 291 Cb 0.31 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 38.78 3bwc n PHE 291 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3bwc s ALA 292 N -2.11 3.32 0.10 4.37 0.00 -0.31 -4.97 121.76 122.16 3bwc s ALA 292 Ca 0.37 -0.57 0.04 0.00 0.00 0.00 0.00 51.96 51.80 3bwc s ALA 292 Cb 0.21 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 3bwc s ALA 292 CO 0.38 -1.83 0.03 -0.51 0.00 0.00 0.00 175.76 173.83 3bwc s LEU 293 N 3.67 3.58 0.58 0.00 1.43 -1.26 -4.90 118.68 121.78 3bwc s LEU 293 Ca 0.39 -0.13 -0.19 0.00 -1.03 0.00 0.00 54.13 53.17 3bwc s LEU 293 Cb -0.11 -2.29 -0.06 0.00 0.03 0.00 0.00 46.19 43.76 3bwc s LEU 293 CO 0.23 0.16 0.80 -2.65 0.23 0.00 0.00 176.35 175.12 3bwc n PRO 294 N 0.44 0.76 -0.34 1.29 -0.02 -1.26 -4.53 135.00 131.34 3bwc n PRO 294 Ca -0.10 0.30 0.15 0.00 -2.02 0.00 0.00 63.50 61.83 3bwc n PRO 294 Cb 0.52 -1.98 0.35 0.00 -0.02 0.00 0.00 33.50 32.37 3bwc n PRO 294 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bwc h ARG 295 N 0.44 0.60 0.00 -0.52 3.08 -1.99 0.73 114.38 116.72 3bwc h ARG 295 Ca -0.47 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.52 3bwc h ARG 295 Cb 1.38 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 3bwc h ARG 295 CO 0.50 0.40 -0.09 0.27 -1.07 0.00 0.00 179.97 179.97 3bwc h PHE 296 N 0.62 0.00 -0.12 3.04 -5.15 -2.03 -2.69 116.94 110.61 3bwc h PHE 296 Ca 0.61 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 58.38 3bwc h PHE 296 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.26 3bwc h PHE 296 CO -0.02 0.09 0.00 0.00 -2.00 0.00 0.00 178.31 176.38 3bwc n ALA 297 N -2.29 2.37 -0.31 12.09 0.00 0.10 -4.75 120.51 127.73 3bwc n ALA 297 Ca -0.02 -0.77 -0.02 0.00 0.00 0.00 0.00 53.44 52.63 3bwc n ALA 297 Cb 0.20 -0.36 0.14 0.00 0.00 0.00 0.00 19.45 19.44 3bwc n ALA 297 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 3bwc h ARG 298 N 1.91 1.20 -0.28 0.00 2.43 -0.80 -2.79 114.38 116.05 3bwc h ARG 298 Ca 0.00 -0.11 0.08 0.00 -0.81 0.00 0.00 59.98 59.15 3bwc h ARG 298 Cb 0.52 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 3bwc h ARG 298 CO 0.00 0.84 0.45 1.12 -1.51 0.00 0.00 179.97 180.87 3bwc h HIS 299 N 1.22 0.00 -0.70 2.20 2.07 -1.85 -0.84 115.15 117.24 3bwc h HIS 299 Ca 0.32 0.00 0.01 0.00 -2.85 0.00 0.00 60.37 57.85 3bwc h HIS 299 Cb -0.06 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 29.89 3bwc h HIS 299 CO 0.00 0.00 0.46 0.82 -3.07 0.00 0.00 177.93 176.15 3bwc h ILE 300 N 0.00 1.17 0.00 6.12 2.04 -1.88 -3.06 117.51 121.90 3bwc h ILE 300 Ca 0.13 -0.32 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3bwc h ILE 300 Cb 1.03 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 3bwc h ILE 300 CO -0.00 0.17 -1.32 0.59 0.00 0.00 0.00 178.15 177.59 3bwc n ASN 301 N -4.61 0.51 0.00 1.72 3.02 -0.44 -4.83 115.26 110.64 3bwc n ASN 301 Ca 0.06 -0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.40 3bwc n ASN 301 Cb 0.03 1.16 0.00 0.00 -0.61 0.00 0.00 39.78 40.36 3bwc n ASN 301 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23