#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bwc s GLY 17 N 0.00 1.25 -1.12 0.46 0.00 -1.26 -3.98 107.32 102.67 3bwc s GLY 17 Ca 0.00 -2.10 -0.05 0.00 0.00 0.00 0.00 44.72 42.57 3bwc s GLY 17 CO 0.00 2.58 0.97 0.61 0.00 0.00 0.00 173.10 177.26 3bwc n GLY 18 N 6.34 -0.30 2.91 0.20 0.00 -1.26 -4.97 105.19 108.10 3bwc n GLY 18 Ca 0.24 0.09 -0.09 0.00 0.00 0.00 0.00 46.02 46.26 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 -3.28 -0.84 -0.19 1.61 0.52 -1.26 -2.24 118.94 113.27 3bwc s TRP 19 Ca 0.36 0.78 -0.29 0.00 0.02 0.00 0.00 56.10 56.97 3bwc s TRP 19 Cb -0.16 0.00 0.00 0.00 -1.15 0.00 0.00 33.47 32.17 3bwc s TRP 19 CO 0.62 -0.74 1.01 0.12 0.02 0.00 0.00 176.95 177.98 3bwc s PHE 20 N 2.54 3.40 -0.03 -1.98 5.36 0.42 -3.04 117.98 124.65 3bwc s PHE 20 Ca 0.12 1.49 0.02 0.00 -0.96 0.00 0.00 56.93 57.60 3bwc s PHE 20 Cb -0.15 -3.22 -0.03 0.00 -0.34 0.00 0.00 43.02 39.27 3bwc s PHE 20 CO -0.17 -0.38 -0.06 0.50 -1.46 0.00 0.00 175.22 173.64 3bwc s ARG 21 N 2.76 2.67 -0.13 10.12 3.52 -1.26 0.46 118.95 137.08 3bwc s ARG 21 Ca 0.45 -0.62 0.02 0.00 -0.13 0.00 0.00 55.73 55.44 3bwc s ARG 21 Cb -0.16 -2.57 -0.00 0.00 -1.56 0.00 0.00 34.95 30.66 3bwc s ARG 21 CO 0.10 0.64 -0.19 -2.00 -0.81 0.00 0.00 175.30 173.04 3bwc s GLU 22 N -1.14 3.16 1.85 5.12 2.12 -1.26 -4.99 118.70 123.55 3bwc s GLU 22 Ca 0.15 -0.79 0.00 0.00 0.36 0.00 0.00 54.97 54.69 3bwc s GLU 22 Cb -0.11 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 31.78 3bwc s GLU 22 CO 0.05 0.09 0.00 0.39 -0.54 0.00 0.00 175.26 175.25 3bwc n GLU 23 N 3.83 0.00 0.10 4.30 1.02 -1.26 -4.49 120.64 124.14 3bwc n GLU 23 Ca -0.19 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.85 3bwc n GLU 23 Cb 0.52 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.88 3bwc n GLU 23 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3bwc h PRO 28 N 0.00 -0.33 -0.66 3.49 0.11 -2.04 -3.43 132.00 129.14 3bwc h PRO 28 Ca 0.00 0.02 -0.38 0.00 0.11 0.00 0.00 66.00 65.76 3bwc h PRO 28 Cb 0.00 0.07 -0.22 0.00 0.11 0.00 0.00 31.00 30.97 3bwc h PRO 28 CO 0.00 0.00 0.19 0.41 -0.21 0.00 0.00 178.00 178.39 3bwc n GLY 29 N 0.48 5.04 3.21 -0.55 0.00 -1.26 -4.99 105.19 107.12 3bwc n GLY 29 Ca -0.07 -1.45 -0.12 0.00 0.00 0.00 0.00 46.02 44.38 3bwc n GLY 29 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3bwc s GLN 30 N -3.37 1.13 0.00 1.61 -2.07 -1.26 -5.33 119.66 110.37 3bwc s GLN 30 Ca 0.51 -1.58 0.00 0.00 -1.82 0.00 0.00 55.36 52.48 3bwc s GLN 30 Cb 0.44 0.11 0.00 0.00 -1.09 0.00 0.00 33.01 32.47 3bwc s GLN 30 CO 0.03 -0.30 0.00 0.00 -1.32 0.00 0.00 175.29 173.70 3bwc n ALA 31 N -0.24 0.00 0.00 2.60 0.00 -1.26 -4.82 120.51 116.79 3bwc n ALA 31 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 3bwc n ALA 31 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.10 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 -0.24 0.00 -4.06 0.00 7.64 -1.26 -4.97 113.62 110.73 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 1.99 0.27 -3.43 1.43 0.17 -4.95 118.68 114.16 3bwc s LEU 34 Ca 0.00 -0.21 -0.29 0.00 -1.03 0.00 0.00 54.13 52.59 3bwc s LEU 34 Cb 0.00 -0.60 -0.09 0.00 0.03 0.00 0.00 46.19 45.52 3bwc s LEU 34 CO 0.00 0.13 1.12 -0.60 0.23 0.00 0.00 176.35 177.23 3bwc s ARG 35 N -0.20 4.61 -0.36 1.70 3.52 -1.26 0.16 118.95 127.13 3bwc s ARG 35 Ca 0.03 1.83 -0.14 0.00 -0.13 0.00 0.00 55.73 57.32 3bwc s ARG 35 Cb -0.05 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 30.14 3bwc s ARG 35 CO -0.00 0.17 0.27 0.08 -0.81 0.00 0.00 175.30 175.00 3bwc s VAL 36 N -1.06 5.27 -0.02 7.11 1.01 -0.95 -3.08 120.40 128.68 3bwc s VAL 36 Ca 0.45 -0.32 -0.19 0.00 0.00 0.00 0.00 61.98 61.92 3bwc s VAL 36 Cb -0.32 -3.78 -0.33 0.00 0.00 0.00 0.00 36.38 31.94 3bwc s VAL 36 CO 0.41 -0.10 0.92 -0.08 0.00 0.00 0.00 175.10 176.25 3bwc h GLU 37 N 8.53 0.40 -2.14 2.72 4.57 -1.01 -3.45 114.58 124.19 3bwc h GLU 37 Ca -0.30 -0.68 -0.00 0.00 -1.18 0.00 0.00 59.36 57.20 3bwc h GLU 37 Cb 1.15 0.25 -0.22 0.00 -0.16 0.00 0.00 28.75 29.77 3bwc h GLU 37 CO 0.67 1.33 -0.08 0.21 -1.18 0.00 0.00 179.01 179.96 3bwc s LYS 38 N -2.50 0.62 -0.32 1.92 2.20 -1.10 -4.98 119.74 115.57 3bwc s LYS 38 Ca -0.12 1.17 -0.28 0.00 -0.36 0.00 0.00 55.97 56.38 3bwc s LYS 38 Cb 0.02 0.21 0.01 0.00 -1.51 0.00 0.00 37.83 36.57 3bwc s LYS 38 CO 0.88 -0.16 1.03 0.08 -0.36 0.00 0.00 175.35 176.81 3bwc s VAL 39 N 1.80 4.55 -0.08 4.02 1.01 -1.26 0.11 120.40 130.55 3bwc s VAL 39 Ca -0.09 1.61 0.07 0.00 0.00 0.00 0.00 61.98 63.56 3bwc s VAL 39 Cb -0.07 -4.38 -0.24 0.00 0.00 0.00 0.00 36.38 31.69 3bwc s VAL 39 CO -0.18 -0.46 0.52 0.18 0.00 0.00 0.00 175.10 175.15 3bwc n LEU 40 N 6.79 1.43 -3.64 3.92 4.77 0.31 -4.96 117.00 125.62 3bwc n LEU 40 Ca 0.10 0.32 -0.13 0.00 -0.03 0.00 0.00 56.01 56.27 3bwc n LEU 40 Cb 0.47 -0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.25 3bwc n LEU 40 CO 0.58 0.55 0.38 -0.47 -1.33 0.00 0.00 177.39 177.11 3bwc s TYR 41 N -2.58 -0.78 -0.29 -1.77 5.04 0.16 -4.96 117.35 112.18 3bwc s TYR 41 Ca -0.11 1.86 0.03 0.00 -2.44 0.00 0.00 57.07 56.42 3bwc s TYR 41 Cb 0.07 0.28 0.20 0.00 0.35 0.00 0.00 41.96 42.86 3bwc s TYR 41 CO 0.80 -0.37 0.65 0.34 -1.34 0.00 0.00 175.55 175.63 3bwc s ASP 42 N 0.45 -1.47 -0.07 4.32 -1.08 -1.25 0.54 116.67 118.10 3bwc s ASP 42 Ca -0.01 0.21 -0.29 0.00 -0.52 0.00 0.00 52.55 51.94 3bwc s ASP 42 Cb -0.05 1.95 0.11 0.00 -1.46 0.00 0.00 42.92 43.47 3bwc s ASP 42 CO -0.00 -0.27 0.91 0.00 0.52 0.00 0.00 175.17 176.32 3bwc s ALA 43 N 2.85 -1.86 -0.10 3.66 0.00 -0.85 -5.03 121.76 120.43 3bwc s ALA 43 Ca 0.13 1.28 -0.30 0.00 0.00 0.00 0.00 51.96 53.07 3bwc s ALA 43 Cb -0.09 -0.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 3bwc s ALA 43 CO -0.25 -0.50 1.03 -1.25 0.00 0.00 0.00 175.76 174.79 3bwc s PRO 44 N -2.10 4.41 0.35 0.00 0.04 -1.26 -1.60 135.00 134.84 3bwc s PRO 44 Ca 0.00 1.42 -0.03 0.00 0.04 0.00 0.00 61.00 62.43 3bwc s PRO 44 Cb -0.01 -3.55 0.07 0.00 0.04 0.00 0.00 34.50 31.06 3bwc s PRO 44 CO -0.03 -0.34 0.47 -2.37 0.04 0.00 0.00 177.00 174.78 3bwc n THR 45 N 4.58 0.00 0.25 1.26 5.66 0.84 -4.94 114.28 121.93 3bwc n THR 45 Ca 0.09 -0.55 0.10 0.00 -3.05 0.00 0.00 64.05 60.64 3bwc n THR 45 Cb 0.48 -1.44 0.67 0.00 -1.55 0.00 0.00 70.33 68.49 3bwc n THR 45 CO 0.00 0.00 0.00 0.50 -3.05 0.00 0.00 175.07 172.52 3bwc h LYS 46 N 0.00 0.00 0.00 1.09 3.64 -1.99 -3.32 116.57 115.99 3bwc h LYS 46 Ca -0.16 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.16 3bwc h LYS 46 Cb 0.50 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 3bwc h LYS 46 CO 0.14 0.10 -1.26 1.19 -2.27 0.00 0.00 179.45 177.35 3bwc n PHE 47 N -4.08 0.00 -3.69 1.91 3.72 -1.26 -5.10 117.46 108.96 3bwc n PHE 47 Ca -0.02 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.28 3bwc n PHE 47 Cb 0.19 -0.18 -0.02 0.00 -0.94 0.00 0.00 39.48 38.52 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 -2.13 1.57 -0.27 -1.08 -2.07 -1.25 -5.12 119.66 109.31 3bwc s GLN 48 Ca -0.02 -0.79 -0.25 0.00 -1.82 0.00 0.00 55.36 52.48 3bwc s GLN 48 Cb 0.01 0.60 -0.00 0.00 -1.09 0.00 0.00 33.01 32.53 3bwc s GLN 48 CO 0.17 -0.71 0.85 -1.58 -1.32 0.00 0.00 175.29 172.70 3bwc s HIS 49 N -3.85 3.26 -0.25 9.60 5.65 -1.26 -0.11 115.29 128.32 3bwc s HIS 49 Ca 0.07 1.06 -0.09 0.00 0.25 0.00 0.00 55.06 56.35 3bwc s HIS 49 Cb -0.04 -3.18 -0.04 0.00 -1.18 0.00 0.00 32.58 28.15 3bwc s HIS 49 CO -0.01 -0.49 0.12 -1.17 -0.65 0.00 0.00 174.74 172.54 3bwc s LEU 50 N 2.98 3.75 -0.09 8.88 2.96 -0.63 -0.55 118.68 135.98 3bwc s LEU 50 Ca 0.36 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.22 3bwc s LEU 50 Cb -0.15 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.53 3bwc s LEU 50 CO 0.10 -0.01 -0.19 -0.89 -1.32 0.00 0.00 176.35 174.03 3bwc s THR 51 N 1.51 1.69 -0.05 3.68 2.01 -0.01 -2.00 115.64 122.48 3bwc s THR 51 Ca 0.06 -0.81 0.00 0.00 0.31 0.00 0.00 61.69 61.26 3bwc s THR 51 Cb -0.15 -1.49 0.02 0.00 0.01 0.00 0.00 72.50 70.90 3bwc s THR 51 CO 0.06 0.48 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.81 3bwc s ILE 52 N 0.48 0.47 0.03 1.82 1.01 0.19 -0.05 121.20 125.15 3bwc s ILE 52 Ca -0.17 -0.04 -0.08 0.00 0.00 0.00 0.00 60.65 60.35 3bwc s ILE 52 Cb -0.17 -0.54 0.00 0.00 0.01 0.00 0.00 42.46 41.76 3bwc s ILE 52 CO 0.07 0.23 0.17 0.72 0.00 0.00 0.00 174.94 176.13 3bwc s PHE 53 N 1.23 0.07 -0.14 3.97 -0.12 -0.50 -0.53 117.98 121.97 3bwc s PHE 53 Ca -0.06 -0.28 -0.25 0.00 -0.05 0.00 0.00 56.93 56.29 3bwc s PHE 53 Cb -0.14 -0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.18 3bwc s PHE 53 CO -0.02 -0.39 0.80 -2.00 -0.05 0.00 0.00 175.22 173.57 3bwc s GLU 54 N -2.31 4.33 1.04 1.99 2.56 0.12 -0.36 118.70 126.07 3bwc s GLU 54 Ca -0.07 0.99 -0.17 0.00 0.00 0.00 0.00 54.97 55.72 3bwc s GLU 54 Cb -0.02 -3.54 0.24 0.00 2.00 0.00 0.00 34.13 32.80 3bwc s GLU 54 CO -0.03 -0.23 1.29 -1.54 -0.56 0.00 0.00 175.26 174.19 3bwc s SER 55 N 1.08 2.41 0.02 -1.70 1.04 -0.01 -0.56 113.70 115.99 3bwc s SER 55 Ca 0.38 0.27 -0.33 0.00 0.48 0.00 0.00 55.95 56.75 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 -3.17 1.80 -0.67 0.98 0.00 0.00 173.24 172.32 3bwc n ASP 56 N -4.06 3.47 0.24 7.02 -0.08 -1.18 -4.29 116.55 117.67 3bwc n ASP 56 Ca 0.16 1.00 0.10 0.00 -1.51 0.00 0.00 54.79 54.54 3bwc n ASP 56 Cb 0.59 -1.42 0.67 0.00 2.34 0.00 0.00 41.12 43.31 3bwc n ASP 56 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3bwc h PRO 57 N 8.29 0.00 0.00 -0.67 0.11 -1.95 -0.56 132.00 137.23 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 0.00 0.00 1.63 -0.21 0.00 0.00 178.00 180.35 3bwc n LYS 58 N -4.45 0.09 -3.00 1.05 4.76 -1.26 -4.76 118.16 110.59 3bwc n LYS 58 Ca -0.02 0.10 -0.22 0.00 -2.87 0.00 0.00 58.31 55.31 3bwc n LYS 58 Cb 0.14 -1.61 0.01 0.00 -1.84 0.00 0.00 35.03 31.74 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 -3.21 1.64 0.00 0.72 0.00 -0.22 -5.05 107.32 101.20 3bwc s GLY 59 Ca 0.12 -1.21 0.26 0.00 0.00 0.00 0.00 44.72 43.90 3bwc s GLY 59 CO 0.53 -1.03 1.55 -1.55 0.00 0.00 0.00 173.10 172.60 3bwc n PRO 60 N -2.05 0.61 -0.02 2.90 -0.04 -1.26 -4.50 135.00 130.65 3bwc n PRO 60 Ca 0.03 -0.35 -0.05 0.00 -0.04 0.00 0.00 63.50 63.08 3bwc n PRO 60 Cb 0.58 -1.49 0.15 0.00 -0.04 0.00 0.00 33.50 32.70 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 0.86 0.66 0.00 0.54 -0.00 -1.96 -3.38 115.95 112.67 3bwc h TRP 61 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 58.89 58.74 3bwc h TRP 61 Cb 0.50 -0.16 0.00 0.00 -0.00 0.00 0.00 29.16 29.50 3bwc h TRP 61 CO 0.00 0.80 0.00 0.41 -0.00 0.00 0.00 178.44 179.65 3bwc n GLY 62 N -0.27 1.97 3.72 1.49 0.00 -1.26 -2.40 105.19 108.44 3bwc n GLY 62 Ca -0.00 -0.52 -0.42 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 4.00 0.00 2.61 2.01 -1.26 -0.83 115.64 122.17 3bwc s THR 63 Ca 0.00 1.53 0.00 0.00 0.31 0.00 0.00 61.69 63.53 3bwc s THR 63 Cb 0.00 -3.98 -0.00 0.00 0.01 0.00 0.00 72.50 68.53 3bwc s THR 63 CO 0.00 0.17 0.00 0.52 -0.69 0.00 0.00 174.62 174.62 3bwc n VAL 64 N 3.36 0.00 0.00 3.82 0.31 0.52 -2.07 118.33 124.26 3bwc n VAL 64 Ca 0.07 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.38 3bwc n VAL 64 Cb 0.46 0.00 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 -2.99 0.00 -3.88 3.52 0.00 0.93 -1.41 120.51 116.69 3bwc n ALA 66 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 3bwc n ALA 66 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 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 2.04 -1.51 0.00 1.43 0.64 -0.83 118.68 120.45 3bwc s LEU 67 Ca 0.00 -0.59 -0.09 0.00 -1.03 0.00 0.00 54.13 52.41 3bwc s LEU 67 Cb 0.00 -1.40 0.07 0.00 0.03 0.00 0.00 46.19 44.89 3bwc s LEU 67 CO 0.00 0.03 0.75 0.47 0.23 0.00 0.00 176.35 177.82 3bwc n ASP 68 N 4.37 -2.70 0.00 2.29 8.00 0.28 -1.83 116.55 126.97 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 -3.43 0.00 0.00 -0.02 0.00 0.00 41.12 38.18 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 -1.67 1.03 3.41 0.44 0.00 -1.26 -5.01 105.19 102.12 3bwc n GLY 69 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 1.16 3.25 -0.11 0.00 1.01 -1.26 -0.26 121.20 124.98 3bwc s ILE 71 Ca 0.03 0.36 0.09 0.00 0.00 0.00 0.00 60.65 61.13 3bwc s ILE 71 Cb -0.14 -3.23 -0.13 0.00 0.01 0.00 0.00 42.46 38.96 3bwc s ILE 71 CO 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 174.94 174.95 3bwc n GLN 72 N 7.12 2.09 -3.79 2.79 1.13 -1.26 -4.92 117.38 120.54 3bwc n GLN 72 Ca 0.18 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 55.11 3bwc n GLN 72 Cb 0.42 -1.28 -0.14 0.00 0.11 0.00 0.00 30.24 29.34 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 -2.26 -0.03 0.02 5.09 1.01 -1.26 -5.05 120.40 117.91 3bwc s VAL 73 Ca -0.06 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.06 3bwc s VAL 73 Cb 0.03 -0.16 -0.01 0.00 0.00 0.00 0.00 36.38 36.24 3bwc s VAL 73 CO 0.44 0.05 -0.07 0.42 0.00 0.00 0.00 175.10 175.94 3bwc s THR 74 N 0.76 0.48 0.40 3.92 -4.23 -1.26 -4.39 115.64 111.31 3bwc s THR 74 Ca -0.06 -0.67 0.15 0.00 -1.18 0.00 0.00 61.69 59.93 3bwc s THR 74 Cb -0.08 -0.48 0.36 0.00 1.34 0.00 0.00 72.50 73.64 3bwc s THR 74 CO -0.03 -0.15 1.86 0.44 -0.54 0.00 0.00 174.62 176.20 3bwc h ASP 75 N 5.22 0.48 0.45 3.99 3.32 -1.05 -1.96 116.42 126.86 3bwc h ASP 75 Ca -0.32 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 56.75 3bwc h ASP 75 Cb 1.20 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3bwc h ASP 75 CO 0.45 0.20 -0.21 0.22 -1.72 0.00 0.00 179.24 178.18 3bwc h TYR 76 N 0.48 -0.56 -0.02 4.55 3.20 -1.72 -3.37 116.97 119.54 3bwc h TYR 76 Ca 0.46 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.32 3bwc h TYR 76 Cb 1.04 0.18 0.00 0.00 1.54 0.00 0.00 36.73 39.49 3bwc h TYR 76 CO -0.00 -0.35 -0.26 -0.40 -1.64 0.00 0.00 178.16 175.51 3bwc n ASP 77 N -4.41 2.16 -0.30 -2.11 5.75 -1.22 -4.54 116.55 111.87 3bwc n ASP 77 Ca -0.07 -1.58 0.19 0.00 -0.01 0.00 0.00 54.79 53.31 3bwc n ASP 77 Cb 0.24 0.25 0.35 0.00 -1.03 0.00 0.00 41.12 40.93 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 0.34 -0.06 0.23 0.11 0.00 -0.74 -0.97 120.64 119.55 3bwc n GLU 78 Ca 0.12 1.29 0.07 0.00 0.00 0.00 0.00 57.16 58.63 3bwc n GLU 78 Cb 0.48 -2.14 0.55 0.00 0.00 0.00 0.00 31.44 30.33 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 0.00 0.88 4.31 -5.15 -1.86 -3.12 116.94 112.00 3bwc h PHE 79 Ca 0.61 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 58.34 3bwc h PHE 79 Cb 1.42 0.00 0.01 0.00 0.22 0.00 0.00 35.95 37.60 3bwc h PHE 79 CO -0.29 0.17 -0.42 0.28 -2.00 0.00 0.00 178.31 176.04 3bwc h VAL 80 N 0.00 0.11 -0.53 0.88 2.07 -1.41 -0.60 116.25 116.77 3bwc h VAL 80 Ca -0.00 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 3bwc h VAL 80 Cb 0.31 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 3bwc h VAL 80 CO 0.02 0.00 0.10 0.22 0.02 0.00 0.00 177.57 177.93 3bwc h TYR 81 N -1.22 0.86 -0.01 1.57 3.20 -1.70 -1.40 116.97 118.27 3bwc h TYR 81 Ca -0.12 -0.09 -0.26 0.00 3.14 0.00 0.00 58.73 61.40 3bwc h TYR 81 Cb 0.91 -0.25 0.02 0.00 1.54 0.00 0.00 36.73 38.95 3bwc h TYR 81 CO -0.01 0.74 -1.02 0.45 -1.64 0.00 0.00 178.16 176.68 3bwc h HIS 82 N 0.79 1.04 -0.50 -3.82 3.86 -1.52 -2.35 115.15 112.66 3bwc h HIS 82 Ca 0.17 -0.56 -0.08 0.00 -1.16 0.00 0.00 60.37 58.74 3bwc h HIS 82 Cb 0.34 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 3bwc h HIS 82 CO 0.02 1.40 -0.00 0.93 0.86 0.00 0.00 177.93 181.14 3bwc h GLU 83 N 0.40 0.88 0.07 2.45 5.08 -1.02 -1.69 114.58 120.73 3bwc h GLU 83 Ca -0.12 -0.28 -0.00 0.00 -1.00 0.00 0.00 59.36 57.95 3bwc h GLU 83 Cb 1.67 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.84 3bwc h GLU 83 CO 0.20 0.92 -0.03 0.28 -1.00 0.00 0.00 179.01 179.38 3bwc h VAL 84 N 0.74 1.09 -0.13 3.13 2.07 -1.28 0.41 116.25 122.28 3bwc h VAL 84 Ca 0.14 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 3bwc h VAL 84 Cb 0.52 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3bwc h VAL 84 CO 0.03 0.13 0.07 -0.07 0.02 0.00 0.00 177.57 177.75 3bwc h LEU 85 N -0.32 0.16 0.05 2.57 3.38 -1.49 -1.84 115.31 117.83 3bwc h LEU 85 Ca -0.01 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 3bwc h LEU 85 Cb 0.28 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3bwc h LEU 85 CO 0.01 0.17 -0.03 1.23 0.09 0.00 0.00 178.44 179.92 3bwc h GLY 86 N 0.13 -0.07 0.91 0.83 0.00 -1.29 -3.24 103.07 100.34 3bwc h GLY 86 Ca 0.05 0.03 -0.34 0.00 0.00 0.00 0.00 47.33 47.07 3bwc h GLY 86 CO -0.01 -0.03 -1.77 0.45 0.00 0.00 0.00 176.54 175.18 3bwc h HIS 87 N -0.33 0.48 -0.61 5.60 3.86 -0.97 -2.61 115.15 120.57 3bwc h HIS 87 Ca -0.01 -0.35 0.04 0.00 -1.16 0.00 0.00 60.37 58.89 3bwc h HIS 87 Cb 0.30 -0.02 -0.03 0.00 1.06 0.00 0.00 27.41 28.71 3bwc h HIS 87 CO 0.01 1.55 0.41 1.15 0.86 0.00 0.00 177.93 181.91 3bwc h THR 88 N 0.07 1.07 0.04 2.45 2.02 -1.46 0.69 112.91 117.79 3bwc h THR 88 Ca -0.34 -0.24 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 3bwc h THR 88 Cb 2.04 0.30 0.00 0.00 -1.74 0.00 0.00 68.15 68.76 3bwc h THR 88 CO 0.13 0.13 -0.02 0.77 0.37 0.00 0.00 175.52 176.90 3bwc h SER 89 N 0.71 -0.04 -0.56 4.18 4.64 -1.64 -3.18 113.55 117.65 3bwc h SER 89 Ca 0.25 -0.56 -0.08 0.00 -0.47 0.00 0.00 61.79 60.93 3bwc h SER 89 Cb 0.11 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.19 3bwc h SER 89 CO -0.07 0.70 0.05 -0.07 -0.87 0.00 0.00 176.83 176.57 3bwc h LEU 90 N -0.95 0.92 -0.18 5.97 4.07 -1.42 -2.24 115.31 121.47 3bwc h LEU 90 Ca -0.01 -0.28 0.00 0.00 0.08 0.00 0.00 57.88 57.67 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 0.97 0.00 0.00 -1.08 0.00 0.00 178.44 178.34 3bwc n SER 92 N -1.65 1.54 -4.68 0.00 7.64 -0.85 -1.77 113.62 113.85 3bwc n SER 92 Ca 0.02 -1.39 -0.35 0.00 1.01 0.00 0.00 58.87 58.17 3bwc n SER 92 Cb 0.14 0.05 -0.09 0.00 -1.01 0.00 0.00 64.21 63.30 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 -2.15 3.18 0.24 1.43 5.04 -0.32 -4.79 115.29 117.93 3bwc s HIS 93 Ca 0.33 0.18 -0.05 0.00 -1.54 0.00 0.00 55.06 53.97 3bwc s HIS 93 Cb 0.20 -1.82 0.36 0.00 0.04 0.00 0.00 32.58 31.36 3bwc s HIS 93 CO 0.39 0.44 1.84 -1.35 -2.34 0.00 0.00 174.74 173.71 3bwc h PRO 94 N 5.32 0.89 -0.94 2.88 0.11 -1.88 -3.41 132.00 134.97 3bwc h PRO 94 Ca -0.49 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.44 3bwc h PRO 94 Cb 1.19 -0.20 -0.16 0.00 0.11 0.00 0.00 31.00 31.94 3bwc h PRO 94 CO 0.56 0.59 -0.46 0.21 -0.21 0.00 0.00 178.00 178.68 3bwc s LYS 95 N -6.05 1.00 -0.52 1.05 2.20 -1.26 -5.04 119.74 111.11 3bwc s LYS 95 Ca -0.13 -0.94 -0.28 0.00 -0.36 0.00 0.00 55.97 54.27 3bwc s LYS 95 Cb 0.19 -0.03 0.02 0.00 -1.51 0.00 0.00 37.83 36.49 3bwc s LYS 95 CO 0.79 -1.24 1.34 -1.25 -0.36 0.00 0.00 175.35 174.63 3bwc s PRO 96 N 0.97 3.45 -0.18 4.03 0.04 -1.26 -4.82 135.00 137.23 3bwc s PRO 96 Ca 0.28 0.54 -0.03 0.00 0.04 0.00 0.00 61.00 61.84 3bwc s PRO 96 Cb 0.00 -4.06 -0.10 0.00 0.04 0.00 0.00 34.50 30.39 3bwc s PRO 96 CO -0.06 -1.74 -0.18 0.39 0.04 0.00 0.00 177.00 175.45 3bwc n GLU 97 N 8.39 0.42 -4.16 4.56 1.02 -1.26 -2.51 120.64 127.10 3bwc n GLU 97 Ca 0.13 0.13 -0.34 0.00 -0.02 0.00 0.00 57.16 57.05 3bwc n GLU 97 Cb 0.49 -1.28 -0.13 0.00 -0.02 0.00 0.00 31.44 30.50 3bwc n GLU 97 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3bwc s ARG 98 N -2.34 3.47 -0.01 3.49 0.52 -1.26 -0.47 118.95 122.36 3bwc s ARG 98 Ca -0.24 -0.60 0.05 0.00 -0.52 0.00 0.00 55.73 54.43 3bwc s ARG 98 Cb 0.07 -2.95 -0.01 0.00 0.52 0.00 0.00 34.95 32.58 3bwc s ARG 98 CO 0.37 -0.02 -0.18 0.08 0.02 0.00 0.00 175.30 175.58 3bwc s VAL 99 N 1.03 1.38 -0.07 3.52 1.01 -0.74 -0.29 120.40 126.23 3bwc s VAL 99 Ca 0.01 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.23 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 0.00 0.35 -0.17 -0.22 0.00 0.00 0.00 175.10 175.07 3bwc s LEU 100 N -0.51 2.54 -0.19 3.92 2.96 0.27 -0.70 118.68 126.97 3bwc s LEU 100 Ca 0.07 -0.32 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 3bwc s LEU 100 Cb -0.07 -1.52 0.03 0.00 0.50 0.00 0.00 46.19 45.14 3bwc s LEU 100 CO -0.00 0.27 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.53 3bwc s ILE 101 N -0.28 1.77 -0.23 6.68 1.01 0.85 -0.20 121.20 130.81 3bwc s ILE 101 Ca 0.01 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 59.57 3bwc s ILE 101 Cb -0.13 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 3bwc s ILE 101 CO 0.03 0.31 0.32 -0.63 0.00 0.00 0.00 174.94 174.97 3bwc s ILE 102 N 1.37 5.25 0.00 2.92 1.01 0.27 -0.33 121.20 131.68 3bwc s ILE 102 Ca 0.01 0.51 0.00 0.00 0.00 0.00 0.00 60.65 61.17 3bwc s ILE 102 Cb -0.15 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.67 3bwc s ILE 102 CO -0.10 0.26 0.00 0.61 0.00 0.00 0.00 174.94 175.72 3bwc n GLY 103 N 4.18 -0.12 2.68 6.18 0.00 0.56 0.16 105.19 118.84 3bwc n GLY 103 Ca -0.10 -1.18 -0.18 0.00 0.00 0.00 0.00 46.02 44.56 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 -0.28 0.27 -0.02 0.00 -1.24 -4.27 105.19 99.65 3bwc n GLY 104 Ca 0.00 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.93 0.00 2.00 -0.02 0.00 -1.93 -1.32 103.07 100.86 3bwc h GLY 105 Ca -0.42 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.90 3bwc h GLY 105 CO 0.46 0.00 -0.08 1.29 0.00 0.00 0.00 176.54 178.21 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 0.12 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.41 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 0.73 0.06 7.15 0.00 -0.50 -2.78 105.19 108.74 3bwc n GLY 107 Ca -0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 0.04 1.01 -0.02 0.00 -1.78 -0.99 103.07 101.33 3bwc h GLY 108 Ca 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.25 3bwc h GLY 108 CO 0.00 0.04 0.25 -2.08 0.00 0.00 0.00 176.54 174.75 3bwc h VAL 109 N -0.46 1.24 -0.48 4.60 2.07 -1.87 -2.76 116.25 118.59 3bwc h VAL 109 Ca 0.00 -0.75 0.06 0.00 0.82 0.00 0.00 66.70 66.84 3bwc h VAL 109 Cb 0.53 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.79 3bwc h VAL 109 CO 0.00 0.29 0.19 0.25 0.02 0.00 0.00 177.57 178.32 3bwc h LEU 110 N 0.89 0.21 -0.71 2.57 5.85 -1.85 -0.12 115.31 122.15 3bwc h LEU 110 Ca 0.21 0.05 0.11 0.00 0.84 0.00 0.00 57.88 59.09 3bwc h LEU 110 Cb 0.21 0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.19 3bwc h LEU 110 CO -0.02 0.15 0.33 -0.09 -0.34 0.00 0.00 178.44 178.47 3bwc h ARG 111 N 0.37 0.52 -0.36 1.25 2.43 -1.00 -0.38 114.38 117.21 3bwc h ARG 111 Ca 0.23 -0.03 -0.16 0.00 -0.81 0.00 0.00 59.98 59.21 3bwc h ARG 111 Cb 0.22 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3bwc h ARG 111 CO -0.22 0.34 -0.40 0.93 -1.51 0.00 0.00 179.97 179.11 3bwc h GLU 112 N 0.54 0.90 -0.89 0.20 4.39 -1.06 -2.98 114.58 115.68 3bwc h GLU 112 Ca 0.36 -0.48 -0.02 0.00 0.34 0.00 0.00 59.36 59.56 3bwc h GLU 112 Cb 0.44 0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 29.07 3bwc h GLU 112 CO -0.31 1.13 0.47 0.28 -1.16 0.00 0.00 179.01 179.42 3bwc h VAL 113 N 0.73 1.26 0.00 3.13 2.07 -0.62 -2.81 116.25 120.01 3bwc h VAL 113 Ca 0.06 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3bwc h VAL 113 Cb 0.99 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3bwc h VAL 113 CO 0.10 0.30 0.00 -0.07 0.02 0.00 0.00 177.57 177.91 3bwc h LEU 114 N 1.25 0.00 -1.90 2.57 3.38 -0.96 -2.48 115.31 117.16 3bwc h LEU 114 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 3bwc h LEU 114 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3bwc h LEU 114 CO -0.05 0.00 0.07 0.03 0.09 0.00 0.00 178.44 178.58 3bwc h ARG 115 N 0.00 0.13 -6.21 1.13 3.08 -1.35 -3.42 114.38 107.74 3bwc h ARG 115 Ca 0.00 -0.01 -0.56 0.00 0.07 0.00 0.00 59.98 59.48 3bwc h ARG 115 Cb 0.42 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 3bwc h ARG 115 CO 0.00 0.09 0.86 -1.01 -1.07 0.00 0.00 179.97 178.83 3bwc s HIS 116 N -5.17 2.88 0.22 3.04 3.76 -0.94 -4.91 115.29 114.17 3bwc s HIS 116 Ca -0.06 1.00 0.27 0.00 -0.15 0.00 0.00 55.06 56.12 3bwc s HIS 116 Cb 0.17 -3.52 1.16 0.00 1.11 0.00 0.00 32.58 31.50 3bwc s HIS 116 CO 0.69 -1.79 1.93 0.78 -0.85 0.00 0.00 174.74 175.49 3bwc h GLY 117 N 9.26 0.00 1.99 -2.22 0.00 -1.88 -2.79 103.07 107.43 3bwc h GLY 117 Ca -0.30 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 3bwc h GLY 117 CO 0.94 0.00 -0.26 -0.91 0.00 0.00 0.00 176.54 176.31 3bwc h THR 118 N 0.00 1.19 -2.57 4.70 1.35 -1.91 -3.42 112.91 112.25 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 0.59 1.48 -0.02 0.00 -1.73 0.00 0.00 68.15 68.47 3bwc h THR 118 CO 0.02 0.26 1.26 -0.69 -0.25 0.00 0.00 175.52 176.13 3bwc s VAL 119 N -4.45 3.43 -0.06 6.82 1.01 -1.04 -4.12 120.40 121.99 3bwc s VAL 119 Ca -0.04 0.46 0.03 0.00 0.00 0.00 0.00 61.98 62.44 3bwc s VAL 119 Cb 0.15 -3.51 -0.25 0.00 0.00 0.00 0.00 36.38 32.77 3bwc s VAL 119 CO 0.71 -0.28 0.60 -0.33 0.00 0.00 0.00 175.10 175.80 3bwc h GLU 120 N 12.43 0.13 -2.80 2.72 5.08 -1.02 -3.48 114.58 127.64 3bwc h GLU 120 Ca -0.36 -0.23 -0.12 0.00 -1.00 0.00 0.00 59.36 57.66 3bwc h GLU 120 Cb 1.18 0.08 -0.23 0.00 0.50 0.00 0.00 28.75 30.29 3bwc h GLU 120 CO 1.00 0.85 -0.23 -1.58 -1.00 0.00 0.00 179.01 178.06 3bwc s HIS 121 N -2.59 -0.37 -0.07 4.33 5.04 -0.78 -4.78 115.29 116.07 3bwc s HIS 121 Ca -0.11 0.83 0.01 0.00 -1.54 0.00 0.00 55.06 54.24 3bwc s HIS 121 Cb 0.07 0.15 0.02 0.00 0.04 0.00 0.00 32.58 32.86 3bwc s HIS 121 CO 0.81 -0.29 -0.06 0.00 -2.34 0.00 0.00 174.74 172.86 3bwc s ASP 123 N 1.18 6.31 -0.17 0.00 1.01 0.13 -1.41 116.67 123.72 3bwc s ASP 123 Ca -0.06 0.35 0.01 0.00 0.71 0.00 0.00 52.55 53.56 3bwc s ASP 123 Cb -0.14 -2.14 0.01 0.00 1.01 0.00 0.00 42.92 41.66 3bwc s ASP 123 CO -0.02 0.12 -0.19 -0.22 0.21 0.00 0.00 175.17 175.07 3bwc s LEU 124 N 0.54 2.21 -0.29 1.23 0.20 -0.55 -0.11 118.68 121.91 3bwc s LEU 124 Ca 0.12 -0.60 0.02 0.00 0.69 0.00 0.00 54.13 54.37 3bwc s LEU 124 Cb -0.12 -1.49 0.08 0.00 -0.43 0.00 0.00 46.19 44.23 3bwc s LEU 124 CO 0.02 0.04 -0.01 -0.69 -0.29 0.00 0.00 176.35 175.42 3bwc s VAL 125 N 1.08 1.88 -0.06 1.68 1.01 0.55 0.31 120.40 126.86 3bwc s VAL 125 Ca -0.00 -1.78 0.04 0.00 0.00 0.00 0.00 61.98 60.24 3bwc s VAL 125 Cb -0.14 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 3bwc s VAL 125 CO -0.07 -0.36 -0.18 -0.62 0.00 0.00 0.00 175.10 173.87 3bwc s ASP 126 N 1.16 3.71 0.35 3.32 -1.08 -0.79 -0.32 116.67 123.03 3bwc s ASP 126 Ca 0.02 -0.31 0.18 0.00 -0.52 0.00 0.00 52.55 51.93 3bwc s ASP 126 Cb -0.19 -0.87 0.48 0.00 -1.46 0.00 0.00 42.92 40.88 3bwc s ASP 126 CO -0.09 0.30 1.63 -0.29 0.52 0.00 0.00 175.17 177.24 3bwc h ILE 127 N 4.63 0.78 -3.56 4.11 2.10 -1.78 -0.06 117.51 123.73 3bwc h ILE 127 Ca -0.41 -1.71 -0.70 0.00 1.08 0.00 0.00 64.86 63.12 3bwc h ILE 127 Cb 1.16 2.10 -0.30 0.00 -1.09 0.00 0.00 36.82 38.69 3bwc h ILE 127 CO 0.50 0.38 -0.55 -0.62 -1.08 0.00 0.00 178.15 176.78 3bwc s ASP 128 N -6.38 5.39 0.50 2.19 2.15 -1.26 -4.42 116.67 114.83 3bwc s ASP 128 Ca 0.02 -1.46 0.29 0.00 0.43 0.00 0.00 52.55 51.82 3bwc s ASP 128 Cb 0.09 -1.89 1.13 0.00 -0.30 0.00 0.00 42.92 41.95 3bwc s ASP 128 CO 0.70 -0.44 1.90 1.23 -0.17 0.00 0.00 175.17 178.39 3bwc h GLY 129 N 8.24 0.00 2.00 2.66 0.00 -1.95 -2.93 103.07 111.09 3bwc h GLY 129 Ca -0.21 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 3bwc h GLY 129 CO 0.67 0.00 -0.46 -2.09 0.00 0.00 0.00 176.54 174.66 3bwc h GLU 130 N 0.00 0.00 -0.05 4.80 4.57 -1.98 -2.49 114.58 119.43 3bwc h GLU 130 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3bwc h GLU 130 Cb 0.63 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.22 3bwc h GLU 130 CO 0.01 0.46 0.00 0.28 -1.18 0.00 0.00 179.01 178.58 3bwc n VAL 131 N -3.64 0.00 0.00 0.32 0.31 -1.11 -1.35 118.33 112.86 3bwc n VAL 131 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 3bwc n VAL 131 Cb 0.54 -0.16 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 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 0.19 0.00 0.19 5.55 -0.58 -0.94 -1.23 120.64 123.82 3bwc n GLU 133 Ca 0.00 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.79 3bwc n GLU 133 Cb 0.01 0.00 0.33 0.00 -0.57 0.00 0.00 31.44 31.21 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 -0.30 3.49 1.08 -1.50 -2.75 115.11 115.13 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 0.38 -0.53 0.77 -0.95 0.00 0.00 178.83 178.50 3bwc h SER 135 N 0.00 0.98 -0.92 1.46 0.02 -1.40 -1.19 113.55 112.50 3bwc h SER 135 Ca -0.00 -0.52 0.04 0.00 -0.84 0.00 0.00 61.79 60.47 3bwc h SER 135 Cb 0.90 -0.28 -0.06 0.00 0.14 0.00 0.00 62.40 63.10 3bwc h SER 135 CO 0.05 1.32 0.59 0.11 -1.14 0.00 0.00 176.83 177.76 3bwc h LYS 136 N 0.68 1.10 -0.01 3.45 1.57 -1.76 0.22 116.57 121.82 3bwc h LYS 136 Ca 0.02 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.69 3bwc h LYS 136 Cb 1.14 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.20 3bwc h LYS 136 CO 0.12 0.73 -0.15 0.37 -0.57 0.00 0.00 179.45 179.94 3bwc h GLN 137 N 1.13 0.11 0.00 3.15 5.75 -1.43 -3.36 115.11 120.47 3bwc h GLN 137 Ca 0.37 -0.12 0.00 0.00 -0.15 0.00 0.00 58.65 58.76 3bwc h GLN 137 Cb 0.05 0.03 0.00 0.00 1.07 0.00 0.00 27.48 28.63 3bwc h GLN 137 CO -0.13 0.85 -0.83 0.72 -2.65 0.00 0.00 178.83 176.79 3bwc n HIS 138 N -4.59 0.00 -3.19 3.99 8.25 -0.46 -4.57 115.22 114.65 3bwc n HIS 138 Ca -0.09 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.13 3bwc n HIS 138 Cb 0.45 -0.06 -0.06 0.00 1.12 0.00 0.00 29.99 31.44 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 -1.44 1.56 0.20 4.41 3.72 0.76 -4.96 117.46 121.70 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 0.24 -0.44 0.42 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 3.56 0.00 0.00 -1.08 0.13 -1.70 -1.46 132.00 131.45 3bwc h PRO 140 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3bwc h PRO 140 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3bwc h PRO 140 CO 0.63 0.29 0.00 1.96 -0.23 0.00 0.00 178.00 180.64 3bwc h GLN 141 N 0.00 0.00 0.05 0.86 1.08 -1.92 -2.58 115.11 112.60 3bwc h GLN 141 Ca -0.00 0.00 -0.32 0.00 -1.45 0.00 0.00 58.65 56.88 3bwc h GLN 141 Cb 0.51 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 3bwc h GLN 141 CO 0.04 0.00 -1.78 -0.89 -0.95 0.00 0.00 178.83 175.25 3bwc n ILE 142 N -2.66 1.62 1.41 2.54 5.41 -0.93 -4.46 119.36 122.29 3bwc n ILE 142 Ca 0.04 -0.34 0.15 0.00 1.00 0.00 0.00 62.75 63.59 3bwc n ILE 142 Cb 0.44 -1.86 0.71 0.00 -0.71 0.00 0.00 39.64 38.22 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 -3.97 0.14 -0.26 4.38 3.41 -0.59 -3.79 113.62 112.94 3bwc n SER 143 Ca -0.36 -0.26 0.21 0.00 -0.26 0.00 0.00 58.87 58.20 3bwc n SER 143 Cb 0.87 -0.22 0.52 0.00 -0.26 0.00 0.00 64.21 65.12 3bwc n SER 143 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3bwc h ARG 144 N 0.16 0.37 0.00 4.33 2.43 -1.68 -1.52 114.38 118.48 3bwc h ARG 144 Ca 0.00 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 3bwc h ARG 144 Cb 0.31 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.77 3bwc h ARG 144 CO 0.00 0.25 -0.15 0.66 -1.51 0.00 0.00 179.97 179.21 3bwc h SER 145 N 0.38 0.00 0.08 -3.80 4.64 -1.83 -3.10 113.55 109.92 3bwc h SER 145 Ca 0.50 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.81 3bwc h SER 145 Cb 1.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3bwc h SER 145 CO -0.19 0.15 -0.04 -0.07 -0.87 0.00 0.00 176.83 175.81 3bwc h LEU 146 N 0.00 0.00 -2.39 5.97 3.38 -1.56 -1.94 115.31 118.77 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 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 3bwc h LEU 146 CO 0.02 0.04 0.00 0.00 0.09 0.00 0.00 178.44 178.59 3bwc n ALA 147 N -2.39 2.81 -1.92 1.53 0.00 -1.17 -4.71 120.51 114.65 3bwc n ALA 147 Ca -0.03 -1.16 -0.41 0.00 0.00 0.00 0.00 53.44 51.85 3bwc n ALA 147 Cb 0.13 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.53 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 -0.86 7.18 0.29 0.00 -1.08 -0.73 -4.95 116.67 116.53 3bwc s ASP 148 Ca 0.39 2.24 0.04 0.00 -0.52 0.00 0.00 52.55 54.70 3bwc s ASP 148 Cb 0.24 -2.62 0.70 0.00 -1.46 0.00 0.00 42.92 39.79 3bwc s ASP 148 CO 0.21 -0.25 1.75 -0.65 0.52 0.00 0.00 175.17 176.75 3bwc h PRO 149 N 4.54 0.61 0.00 4.34 0.11 -1.93 -0.07 132.00 139.60 3bwc h PRO 149 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3bwc h PRO 149 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3bwc h PRO 149 CO 0.70 0.40 0.00 0.54 -0.21 0.00 0.00 178.00 179.44 3bwc n ARG 150 N -4.87 0.42 -4.26 1.05 1.74 -1.26 -4.74 116.66 104.74 3bwc n ARG 150 Ca 0.22 0.05 -0.35 0.00 -0.77 0.00 0.00 57.85 57.00 3bwc n ARG 150 Cb 0.58 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.42 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 -2.45 3.34 -0.20 7.54 0.00 -0.04 -0.51 121.76 129.43 3bwc s ALA 151 Ca 0.25 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.45 3bwc s ALA 151 Cb 0.16 -1.61 0.03 0.00 0.00 0.00 0.00 23.12 21.70 3bwc s ALA 151 CO 0.34 0.48 -0.17 0.99 0.00 0.00 0.00 175.76 177.40 3bwc s THR 152 N -0.55 2.07 -0.27 0.00 2.01 -0.50 -4.72 115.64 113.67 3bwc s THR 152 Ca 0.10 -1.14 -0.11 0.00 0.31 0.00 0.00 61.69 60.84 3bwc s THR 152 Cb -0.12 -1.97 -0.05 0.00 0.01 0.00 0.00 72.50 70.37 3bwc s THR 152 CO 0.02 0.36 0.20 -0.69 -0.69 0.00 0.00 174.62 173.81 3bwc s VAL 153 N 1.24 5.31 -0.08 3.82 1.01 -1.26 -1.48 120.40 128.97 3bwc s VAL 153 Ca 0.01 0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.19 3bwc s VAL 153 Cb -0.15 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 3bwc s VAL 153 CO -0.10 0.26 -0.06 -0.13 0.00 0.00 0.00 175.10 175.07 3bwc s ARG 154 N 1.63 2.84 -0.57 2.72 1.81 0.15 -4.98 118.95 122.55 3bwc s ARG 154 Ca 0.08 -0.54 -0.16 0.00 -1.72 0.00 0.00 55.73 53.39 3bwc s ARG 154 Cb -0.15 -2.63 0.14 0.00 -0.45 0.00 0.00 34.95 31.85 3bwc s ARG 154 CO 0.10 0.63 0.54 0.08 -0.68 0.00 0.00 175.30 175.96 3bwc s VAL 155 N -0.71 5.23 -0.03 3.52 1.01 -1.26 -1.88 120.40 126.28 3bwc s VAL 155 Ca 0.11 -1.57 -0.30 0.00 0.00 0.00 0.00 61.98 60.21 3bwc s VAL 155 Cb -0.11 -4.36 0.12 0.00 0.00 0.00 0.00 36.38 32.03 3bwc s VAL 155 CO 0.02 -0.90 1.32 -0.83 0.00 0.00 0.00 175.10 174.71 3bwc s GLY 156 N 3.47 -0.37 0.14 4.51 0.00 -0.03 -4.93 107.32 110.10 3bwc s GLY 156 Ca 0.05 0.59 -0.30 0.00 0.00 0.00 0.00 44.72 45.06 3bwc s GLY 156 CO 0.02 1.49 1.26 -0.35 0.00 0.00 0.00 173.10 175.53 3bwc s ASP 157 N -3.19 6.99 0.27 1.64 -1.08 -1.26 -2.47 116.67 117.56 3bwc s ASP 157 Ca 0.18 2.24 0.12 0.00 -0.52 0.00 0.00 52.55 54.57 3bwc s ASP 157 Cb 0.04 -2.60 0.33 0.00 -1.46 0.00 0.00 42.92 39.24 3bwc s ASP 157 CO -0.04 -0.49 1.58 1.23 0.52 0.00 0.00 175.17 177.97 3bwc h GLY 158 N 6.01 0.00 0.80 2.66 0.00 -1.95 -1.84 103.07 108.76 3bwc h GLY 158 Ca -0.43 0.00 0.01 0.00 0.00 0.00 0.00 47.33 46.91 3bwc h GLY 158 CO 0.79 0.00 -0.11 1.41 0.00 0.00 0.00 176.54 178.63 3bwc h LEU 159 N 0.00 -0.31 -0.98 3.11 3.38 -1.98 -1.51 115.31 117.02 3bwc h LEU 159 Ca -0.01 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 3bwc h LEU 159 Cb 1.16 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 42.02 3bwc h LEU 159 CO 0.08 -0.17 -0.17 0.00 0.09 0.00 0.00 178.44 178.27 3bwc h ALA 160 N 0.68 1.15 -0.04 1.53 0.00 -1.95 -2.83 119.26 117.80 3bwc h ALA 160 Ca 0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 3bwc h ALA 160 Cb 0.24 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3bwc h ALA 160 CO -0.06 0.54 0.00 0.35 0.00 0.00 0.00 179.25 180.08 3bwc h PHE 161 N 0.48 0.07 -0.05 0.00 3.57 -1.15 -2.81 116.94 117.05 3bwc h PHE 161 Ca 0.08 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.49 3bwc h PHE 161 Cb 0.58 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 3bwc h PHE 161 CO 0.02 0.33 -0.33 -0.39 -2.23 0.00 0.00 178.31 175.71 3bwc h VAL 162 N -0.22 1.26 0.00 1.41 -1.51 -1.29 -1.31 116.25 114.59 3bwc h VAL 162 Ca 0.01 -1.22 -0.08 0.00 -1.23 0.00 0.00 66.70 64.18 3bwc h VAL 162 Cb 0.30 1.59 -0.01 0.00 -2.13 0.00 0.00 31.29 31.04 3bwc h VAL 162 CO 0.00 0.36 -0.39 0.08 -1.23 0.00 0.00 177.57 176.39 3bwc h ARG 163 N 0.08 0.00 -0.03 5.19 0.11 -1.48 -2.99 114.38 115.27 3bwc h ARG 163 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 3bwc h ARG 163 Cb 0.63 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.71 3bwc h ARG 163 CO 0.05 0.39 -0.03 1.04 0.10 0.00 0.00 179.97 181.52 3bwc n GLN 164 N -3.52 2.16 -2.99 0.08 6.02 -0.96 -4.93 117.38 113.25 3bwc n GLN 164 Ca -0.00 -1.73 -0.40 0.00 -0.01 0.00 0.00 57.00 54.86 3bwc n GLN 164 Cb 0.52 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 30.26 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 -2.03 4.54 0.96 5.09 2.01 -0.54 -5.06 115.64 120.62 3bwc s THR 165 Ca 0.29 1.66 -0.12 0.00 0.31 0.00 0.00 61.69 63.83 3bwc s THR 165 Cb 0.20 -4.12 0.17 0.00 0.01 0.00 0.00 72.50 68.76 3bwc s THR 165 CO 0.32 0.45 1.09 -2.84 -0.69 0.00 0.00 174.62 172.95 3bwc s PRO 166 N -0.65 0.73 0.61 4.92 0.02 -1.26 -4.87 135.00 134.50 3bwc s PRO 166 Ca 0.37 0.63 -0.18 0.00 0.02 0.00 0.00 61.00 61.84 3bwc s PRO 166 Cb -0.22 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 3bwc s PRO 166 CO 0.25 -2.56 1.21 -0.51 -0.33 0.00 0.00 177.00 175.05 3bwc s ASP 167 N -3.44 5.09 -1.33 2.53 1.11 -1.26 -3.90 116.67 115.48 3bwc s ASP 167 Ca 0.65 2.37 -0.02 0.00 0.18 0.00 0.00 52.55 55.73 3bwc s ASP 167 Cb -0.18 -2.60 -0.00 0.00 1.07 0.00 0.00 42.92 41.21 3bwc s ASP 167 CO 0.57 -1.66 0.60 0.59 1.18 0.00 0.00 175.17 176.45 3bwc n ASN 168 N -1.72 -1.26 -0.11 0.27 3.02 -0.77 -4.92 115.26 109.77 3bwc n ASN 168 Ca 0.14 -0.91 -0.25 0.00 -0.03 0.00 0.00 54.58 53.53 3bwc n ASN 168 Cb 0.50 -3.61 -0.11 0.00 -0.61 0.00 0.00 39.78 35.94 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 -4.30 1.56 -4.17 3.41 -1.04 0.14 -4.70 114.28 105.18 3bwc n THR 169 Ca -0.28 -0.34 -0.30 0.00 -2.04 0.00 0.00 64.05 61.08 3bwc n THR 169 Cb 0.67 -1.84 -0.08 0.00 -1.82 0.00 0.00 70.33 67.26 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 -2.47 2.94 -0.02 -1.42 2.02 -0.38 -4.85 117.35 113.16 3bwc s TYR 170 Ca -0.33 -0.05 -0.03 0.00 -0.37 0.00 0.00 57.07 56.29 3bwc s TYR 170 Cb 0.10 -1.52 -0.27 0.00 -0.40 0.00 0.00 41.96 39.87 3bwc s TYR 170 CO 0.57 0.46 0.77 -0.44 -1.57 0.00 0.00 175.55 175.35 3bwc h ASP 171 N 3.55 0.37 -3.68 2.29 3.32 -0.98 0.51 116.42 121.81 3bwc h ASP 171 Ca -0.48 -0.57 -0.27 0.00 0.02 0.00 0.00 57.03 55.74 3bwc h ASP 171 Cb 1.17 -0.12 -0.30 0.00 0.22 0.00 0.00 39.33 40.29 3bwc h ASP 171 CO 0.58 1.48 -0.73 -0.69 -1.72 0.00 0.00 179.24 178.16 3bwc s VAL 172 N -2.61 0.05 -0.21 -1.35 1.01 -1.13 -1.35 120.40 114.82 3bwc s VAL 172 Ca -0.11 0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.91 3bwc s VAL 172 Cb 0.07 -0.09 0.02 0.00 0.00 0.00 0.00 36.38 36.39 3bwc s VAL 172 CO 0.84 0.05 -0.15 -0.69 0.00 0.00 0.00 175.10 175.15 3bwc s VAL 173 N 0.31 2.36 -0.27 2.92 1.01 -0.67 -0.57 120.40 125.50 3bwc s VAL 173 Ca -0.03 -1.01 -0.07 0.00 0.00 0.00 0.00 61.98 60.87 3bwc s VAL 173 Cb -0.04 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 3bwc s VAL 173 CO -0.01 0.38 0.07 -0.63 0.00 0.00 0.00 175.10 174.92 3bwc s ILE 174 N 1.29 4.18 -0.59 2.22 1.01 0.72 0.06 121.20 130.09 3bwc s ILE 174 Ca 0.02 -0.36 -0.16 0.00 0.00 0.00 0.00 60.65 60.15 3bwc s ILE 174 Cb -0.15 -3.02 0.14 0.00 0.01 0.00 0.00 42.46 39.43 3bwc s ILE 174 CO -0.09 0.25 0.59 -0.63 0.00 0.00 0.00 174.94 175.05 3bwc s ILE 175 N 1.57 5.18 -1.11 2.92 1.09 0.33 -0.57 121.20 130.62 3bwc s ILE 175 Ca 0.05 -1.53 -0.04 0.00 -1.10 0.00 0.00 60.65 58.03 3bwc s ILE 175 Cb -0.16 -4.39 0.18 0.00 -1.06 0.00 0.00 42.46 37.02 3bwc s ILE 175 CO 0.03 -0.95 2.28 -0.67 -0.10 0.00 0.00 174.94 175.52 3bwc n ASP 176 N 5.31 7.65 0.00 3.58 2.03 0.12 -2.73 116.55 132.52 3bwc n ASP 176 Ca -0.09 -3.33 0.00 0.00 0.52 0.00 0.00 54.79 51.89 3bwc n ASP 176 Cb 0.42 -1.28 0.00 0.00 -0.72 0.00 0.00 41.12 39.54 3bwc n ASP 176 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 3bwc n THR 177 N 1.03 0.00 0.10 5.18 -1.04 -1.26 -3.70 114.28 114.59 3bwc n THR 177 Ca 0.56 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.36 3bwc n THR 177 Cb 0.29 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 68.65 3bwc n THR 177 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 3bwc h GLU 190 N 0.00 0.39 -0.40 -2.82 4.11 -2.00 -3.46 114.58 110.40 3bwc h GLU 190 Ca 0.00 -0.66 -0.01 0.00 0.07 0.00 0.00 59.36 58.76 3bwc h GLU 190 Cb 0.00 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 3bwc h GLU 190 CO 0.00 1.29 0.21 0.00 0.07 0.00 0.00 179.01 180.59 3bwc h ALA 191 N 0.27 1.63 0.02 1.06 0.00 -2.03 -1.00 119.26 119.20 3bwc h ALA 191 Ca -0.27 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 3bwc h ALA 191 Cb 2.09 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.71 3bwc h ALA 191 CO 0.21 0.31 -0.01 0.35 0.00 0.00 0.00 179.25 180.11 3bwc h PHE 192 N 0.55 -0.02 0.00 0.00 3.57 -1.99 -1.83 116.94 117.22 3bwc h PHE 192 Ca 0.14 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.57 3bwc h PHE 192 Cb 0.02 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 3bwc h PHE 192 CO 0.00 0.42 -0.35 1.88 -2.23 0.00 0.00 178.31 178.03 3bwc h TYR 193 N -0.47 0.00 -0.73 0.41 0.05 -1.97 0.09 116.97 114.34 3bwc h TYR 193 Ca -0.00 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 3bwc h TYR 193 Cb 0.45 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.16 3bwc h TYR 193 CO 0.08 0.35 0.34 0.87 -1.05 0.00 0.00 178.16 178.75 3bwc h LYS 194 N 0.00 1.07 -0.44 4.88 1.57 -1.20 -1.30 116.57 121.15 3bwc h LYS 194 Ca -0.00 -0.17 -0.08 0.00 -1.87 0.00 0.00 60.65 58.53 3bwc h LYS 194 Cb 0.96 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 3bwc h LYS 194 CO 0.05 0.85 -0.03 -0.44 -0.57 0.00 0.00 179.45 179.31 3bwc h ASP 195 N 1.04 0.78 -0.71 0.86 3.32 -0.60 -1.81 116.42 119.30 3bwc h ASP 195 Ca 0.25 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 56.97 3bwc h ASP 195 Cb 0.14 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 3bwc h ASP 195 CO -0.03 0.92 0.40 0.58 -1.72 0.00 0.00 179.24 179.39 3bwc h VAL 196 N 0.63 1.21 -0.38 -1.35 2.07 -0.90 -0.34 116.25 117.20 3bwc h VAL 196 Ca 0.12 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 3bwc h VAL 196 Cb 0.53 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 3bwc h VAL 196 CO 0.03 0.23 0.19 0.25 0.02 0.00 0.00 177.57 178.29 3bwc h LEU 197 N 0.97 0.50 -0.42 2.57 5.85 -1.18 -2.88 115.31 120.71 3bwc h LEU 197 Ca 0.25 -0.12 -0.09 0.00 0.84 0.00 0.00 57.88 58.76 3bwc h LEU 197 Cb 0.02 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 3bwc h LEU 197 CO -0.04 0.47 -0.10 -0.09 -0.34 0.00 0.00 178.44 178.34 3bwc h ARG 198 N 0.48 0.81 0.00 1.25 2.43 -0.99 -3.07 114.38 115.29 3bwc h ARG 198 Ca 0.13 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 3bwc h ARG 198 Cb 0.10 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3bwc h ARG 198 CO -0.02 0.94 0.00 -0.84 -1.51 0.00 0.00 179.97 178.54 3bwc h ILE 199 N 0.64 0.00 -3.90 1.20 3.07 -1.09 -2.04 117.51 115.39 3bwc h ILE 199 Ca 0.11 -0.38 -0.47 0.00 1.55 0.00 0.00 64.86 65.66 3bwc h ILE 199 Cb 0.64 1.25 -0.01 0.00 -0.27 0.00 0.00 36.82 38.43 3bwc h ILE 199 CO 0.04 0.00 0.37 -0.76 -1.05 0.00 0.00 178.15 176.75 3bwc s LEU 200 N -4.63 4.30 0.83 0.16 1.43 -1.09 0.29 118.68 119.96 3bwc s LEU 200 Ca 0.07 1.91 -0.12 0.00 -1.03 0.00 0.00 54.13 54.97 3bwc s LEU 200 Cb 0.10 -4.04 0.09 0.00 0.03 0.00 0.00 46.19 42.38 3bwc s LEU 200 CO 0.50 -0.18 1.11 -0.54 0.23 0.00 0.00 176.35 177.47 3bwc s LYS 201 N -2.14 1.79 0.32 1.70 1.02 0.17 -3.96 119.74 118.64 3bwc s LYS 201 Ca 0.52 0.54 0.08 0.00 0.02 0.00 0.00 55.97 57.13 3bwc s LYS 201 Cb -0.20 -1.89 0.81 0.00 -0.52 0.00 0.00 37.83 36.03 3bwc s LYS 201 CO 0.26 -1.80 1.78 -1.35 -0.92 0.00 0.00 175.35 173.31 3bwc h PRO 202 N -1.22 0.67 -0.95 -1.68 0.11 -1.96 0.34 132.00 127.31 3bwc h PRO 202 Ca -0.48 -0.04 -0.40 0.00 0.11 0.00 0.00 66.00 65.19 3bwc h PRO 202 Cb 1.29 -0.15 -0.24 0.00 0.11 0.00 0.00 31.00 32.01 3bwc h PRO 202 CO 0.60 0.44 0.51 -0.40 -0.21 0.00 0.00 178.00 178.94 3bwc n ASP 203 N -4.74 3.85 -4.78 -2.05 5.75 -1.26 -3.24 116.55 110.07 3bwc n ASP 203 Ca 0.24 -3.34 -0.35 0.00 -0.01 0.00 0.00 54.79 51.33 3bwc n ASP 203 Cb 0.62 -0.78 -0.01 0.00 -1.03 0.00 0.00 41.12 39.91 3bwc n ASP 203 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3bwc s GLY 204 N -0.98 2.59 -0.10 6.12 0.00 0.12 -4.82 107.32 110.25 3bwc s GLY 204 Ca 0.50 0.74 0.04 0.00 0.00 0.00 0.00 44.72 45.99 3bwc s GLY 204 CO 0.10 1.08 -0.22 -0.42 0.00 0.00 0.00 173.10 173.65 3bwc s ILE 205 N -1.85 1.89 -0.07 0.90 -1.09 -0.46 -1.55 121.20 118.99 3bwc s ILE 205 Ca 0.70 -0.92 -0.04 0.00 -2.23 0.00 0.00 60.65 58.16 3bwc s ILE 205 Cb -0.21 -1.65 -0.04 0.00 -1.58 0.00 0.00 42.46 38.98 3bwc s ILE 205 CO 0.24 0.52 0.12 0.00 -1.23 0.00 0.00 174.94 174.60 3bwc s ASN 208 N 0.78 0.81 -0.12 0.00 2.20 -0.46 0.12 114.94 118.28 3bwc s ASN 208 Ca -0.10 -0.78 -0.30 0.00 -0.94 0.00 0.00 52.86 50.74 3bwc s ASN 208 Cb -0.13 0.09 -0.02 0.00 -2.00 0.00 0.00 41.25 39.19 3bwc s ASN 208 CO 0.00 -0.37 1.12 0.00 -2.94 0.00 0.00 177.10 174.91 3bwc s GLN 209 N -2.74 4.34 0.61 3.55 -2.07 -1.10 -0.82 119.66 121.43 3bwc s GLN 209 Ca -0.00 1.53 0.00 0.00 -1.82 0.00 0.00 55.36 55.07 3bwc s GLN 209 Cb -0.02 -3.60 0.07 0.00 -1.09 0.00 0.00 33.01 28.37 3bwc s GLN 209 CO -0.03 -0.47 0.86 0.20 -1.32 0.00 0.00 175.29 174.52 3bwc s GLY 210 N 1.38 1.80 0.86 2.60 0.00 0.76 -4.81 107.32 109.91 3bwc s GLY 210 Ca 0.51 -1.46 -0.10 0.00 0.00 0.00 0.00 44.72 43.68 3bwc s GLY 210 CO 0.17 -1.07 1.19 -0.54 0.00 0.00 0.00 173.10 172.85 3bwc s GLU 211 N -4.91 1.06 0.22 2.90 0.41 -1.26 -3.83 118.70 113.29 3bwc s GLU 211 Ca 0.60 -0.71 -0.30 0.00 -0.41 0.00 0.00 54.97 54.16 3bwc s GLU 211 Cb -0.09 -2.05 -0.08 0.00 -1.78 0.00 0.00 34.13 30.13 3bwc s GLU 211 CO 0.41 -2.02 1.01 0.45 -0.49 0.00 0.00 175.26 174.61 3bwc s SER 212 N -4.83 7.47 0.28 -0.19 0.15 -1.26 -3.89 113.70 111.44 3bwc s SER 212 Ca 0.71 2.03 0.24 0.00 0.70 0.00 0.00 55.95 59.63 3bwc s SER 212 Cb -0.04 -2.61 1.02 0.00 -1.71 0.00 0.00 66.02 62.68 3bwc s SER 212 CO 0.49 -0.01 1.74 0.16 1.20 0.00 0.00 173.24 176.82 3bwc h ILE 213 N 3.36 0.00 0.00 6.45 3.07 -1.84 -2.63 117.51 125.92 3bwc h ILE 213 Ca -0.45 -0.25 0.00 0.00 1.55 0.00 0.00 64.86 65.71 3bwc h ILE 213 Cb 1.21 1.01 0.00 0.00 -0.27 0.00 0.00 36.82 38.76 3bwc h ILE 213 CO 0.69 0.00 -0.36 -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 -3.36 115.95 114.89 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 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 3bwc h TRP 214 CO 0.00 0.00 -0.26 1.47 -3.56 0.00 0.00 178.44 176.09 3bwc n LEU 215 N -4.08 0.46 -2.73 -4.49 -0.00 -1.25 -4.40 117.00 100.51 3bwc n LEU 215 Ca -0.05 0.07 -0.08 0.00 -0.00 0.00 0.00 56.01 55.95 3bwc n LEU 215 Cb 0.19 -0.27 0.08 0.00 -0.00 0.00 0.00 43.42 43.42 3bwc n LEU 215 CO 0.08 0.10 0.33 -0.90 -0.00 0.00 0.00 177.39 176.99 3bwc n ASP 216 N -1.24 -2.43 0.09 1.45 5.68 -1.00 -4.99 116.55 114.11 3bwc n ASP 216 Ca 0.09 -3.36 0.00 0.00 -0.50 0.00 0.00 54.79 51.02 3bwc n ASP 216 Cb 0.32 1.80 0.31 0.00 -1.14 0.00 0.00 41.12 42.41 3bwc n ASP 216 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 3bwc h LEU 217 N 3.31 0.27 -0.70 -2.12 5.85 -1.68 -3.17 115.31 117.07 3bwc h LEU 217 Ca -0.14 -0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.39 3bwc h LEU 217 Cb 1.09 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.03 3bwc h LEU 217 CO 0.18 0.51 -0.24 -0.33 -0.34 0.00 0.00 178.44 178.22 3bwc h GLU 218 N 0.25 0.74 -0.08 1.25 3.07 -1.92 -2.61 114.58 115.28 3bwc h GLU 218 Ca 0.04 -0.31 -0.10 0.00 -0.50 0.00 0.00 59.36 58.49 3bwc h GLU 218 Cb 0.55 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 3bwc h GLU 218 CO 0.04 0.91 -0.42 1.25 -1.40 0.00 0.00 179.01 179.39 3bwc h LEU 219 N 0.64 0.18 -0.38 1.33 5.85 -1.94 -2.54 115.31 118.45 3bwc h LEU 219 Ca 0.09 -0.08 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 3bwc h LEU 219 Cb 0.75 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 3bwc h LEU 219 CO 0.06 0.59 0.05 0.40 -0.34 0.00 0.00 178.44 179.20 3bwc h ILE 220 N 0.15 1.25 -0.56 4.05 2.04 -1.47 -3.08 117.51 119.87 3bwc h ILE 220 Ca 0.01 -0.90 -0.06 0.00 1.00 0.00 0.00 64.86 64.91 3bwc h ILE 220 Cb 0.81 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.95 3bwc h ILE 220 CO 0.06 0.30 0.11 -0.08 0.00 0.00 0.00 178.15 178.55 3bwc h GLU 221 N 0.49 0.92 0.00 2.37 4.57 -1.43 0.91 114.58 122.41 3bwc h GLU 221 Ca 0.11 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 58.06 3bwc h GLU 221 Cb 0.39 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.87 3bwc h GLU 221 CO 0.01 0.87 0.00 1.63 -1.18 0.00 0.00 179.01 180.34 3bwc n LYS 222 N -4.36 0.00 0.00 1.92 5.02 -0.97 -1.42 118.16 118.36 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 0.25 -1.00 0.00 0.00 -0.02 0.00 0.00 35.03 34.26 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 0.25 0.00 -0.08 4.39 2.88 0.31 -0.70 113.62 120.68 3bwc n SER 224 Ca 0.00 0.00 -0.15 0.00 -1.33 0.00 0.00 58.87 57.39 3bwc n SER 224 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 3bwc n SER 224 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 3bwc h ARG 225 N 0.00 0.88 -0.71 -1.46 0.11 -1.49 -2.67 114.38 109.04 3bwc h ARG 225 Ca 0.00 -0.55 0.04 0.00 0.10 0.00 0.00 59.98 59.57 3bwc h ARG 225 Cb 0.00 0.06 -0.05 0.00 1.11 0.00 0.00 29.97 31.10 3bwc h ARG 225 CO 0.00 1.19 0.43 0.35 0.10 0.00 0.00 179.97 182.04 3bwc h PHE 226 N 0.66 0.80 -0.40 4.08 3.57 -1.15 0.64 116.94 125.14 3bwc h PHE 226 Ca 0.02 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.45 3bwc h PHE 226 Cb 1.15 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 3bwc h PHE 226 CO 0.07 0.44 -0.11 0.82 -2.23 0.00 0.00 178.31 177.31 3bwc h ILE 227 N 0.83 1.25 -0.32 1.41 2.04 -1.79 -1.57 117.51 119.36 3bwc h ILE 227 Ca 0.30 -1.13 -0.09 0.00 1.00 0.00 0.00 64.86 64.94 3bwc h ILE 227 Cb 0.08 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 3bwc h ILE 227 CO -0.13 0.38 -0.16 -0.09 0.00 0.00 0.00 178.15 178.14 3bwc h ARG 228 N 0.65 0.67 0.00 2.37 2.43 -1.03 -3.03 114.38 116.44 3bwc h ARG 228 Ca 0.11 -0.30 -0.03 0.00 -0.81 0.00 0.00 59.98 58.96 3bwc h ARG 228 Cb 0.56 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3bwc h ARG 228 CO 0.03 0.89 -0.13 0.93 -1.51 0.00 0.00 179.97 180.19 3bwc h GLU 229 N 0.43 0.00 -0.36 0.20 5.08 -0.81 -2.49 114.58 116.63 3bwc h GLU 229 Ca 0.07 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3bwc h GLU 229 Cb 0.70 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.93 3bwc h GLU 229 CO 0.05 0.13 0.16 1.15 -1.00 0.00 0.00 179.01 179.50 3bwc h THR 230 N 0.00 1.13 0.00 1.13 2.02 -1.16 -3.46 112.91 112.56 3bwc h THR 230 Ca -0.00 -0.37 0.00 0.00 0.77 0.00 0.00 66.41 66.81 3bwc h THR 230 Cb 0.66 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 3bwc h THR 230 CO 0.02 0.15 0.00 0.61 0.37 0.00 0.00 175.52 176.67 3bwc n GLY 231 N -1.29 0.48 3.76 2.16 0.00 -0.94 -4.87 105.19 104.49 3bwc n GLY 231 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 2.99 0.08 1.61 0.08 -1.20 -4.94 117.98 116.58 3bwc s PHE 232 Ca 0.00 1.22 -0.19 0.00 0.12 0.00 0.00 56.93 58.08 3bwc s PHE 232 Cb 0.00 -3.78 -0.09 0.00 -0.57 0.00 0.00 43.02 38.58 3bwc s PHE 232 CO 0.00 -2.33 1.52 0.00 -0.10 0.00 0.00 175.22 174.31 3bwc h ALA 233 N 4.07 0.29 -2.74 5.36 0.00 -1.33 -3.42 119.26 121.50 3bwc h ALA 233 Ca -0.48 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 54.09 3bwc h ALA 233 Cb 1.22 -0.08 -0.19 0.00 0.00 0.00 0.00 17.79 18.74 3bwc h ALA 233 CO 0.71 0.00 -0.58 -1.54 0.00 0.00 0.00 179.25 177.84 3bwc s SER 234 N -5.86 0.17 -0.02 0.00 1.04 -1.17 -4.97 113.70 102.90 3bwc s SER 234 Ca -0.14 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.84 3bwc s SER 234 Cb 0.07 0.18 0.02 0.00 0.10 0.00 0.00 66.02 66.39 3bwc s SER 234 CO 0.73 -0.41 0.01 -0.69 0.98 0.00 0.00 173.24 173.87 3bwc s VAL 235 N -1.97 0.02 -0.02 5.02 1.01 -1.26 -1.24 120.40 121.95 3bwc s VAL 235 Ca -0.11 0.13 0.02 0.00 0.00 0.00 0.00 61.98 62.03 3bwc s VAL 235 Cb -0.05 -0.12 0.00 0.00 0.00 0.00 0.00 36.38 36.21 3bwc s VAL 235 CO -0.02 0.09 -0.09 -1.10 0.00 0.00 0.00 175.10 173.98 3bwc s GLN 236 N 0.84 0.95 -0.20 2.72 -1.52 -0.65 -4.90 119.66 116.89 3bwc s GLN 236 Ca -0.07 -0.31 -0.18 0.00 -1.95 0.00 0.00 55.36 52.85 3bwc s GLN 236 Cb -0.11 -0.89 -0.03 0.00 -0.22 0.00 0.00 33.01 31.76 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 0.17 3.37 -0.12 0.91 5.04 -1.26 -0.90 117.35 124.56 3bwc s TYR 237 Ca -0.03 0.72 -0.04 0.00 -2.44 0.00 0.00 57.07 55.29 3bwc s TYR 237 Cb -0.08 -2.63 -0.03 0.00 0.35 0.00 0.00 41.96 39.57 3bwc s TYR 237 CO 0.00 -0.08 0.02 0.00 -1.34 0.00 0.00 175.55 174.15 3bwc s ALA 238 N 1.55 3.29 0.58 3.97 0.00 0.14 -4.52 121.76 126.77 3bwc s ALA 238 Ca 0.22 -0.78 0.08 0.00 0.00 0.00 0.00 51.96 51.48 3bwc s ALA 238 Cb -0.15 -1.62 0.08 0.00 0.00 0.00 0.00 23.12 21.43 3bwc s ALA 238 CO 0.09 0.43 0.69 -1.17 0.00 0.00 0.00 175.76 175.80 3bwc s LEU 239 N -0.39 2.92 -0.40 0.00 2.96 0.11 -0.71 118.68 123.18 3bwc s LEU 239 Ca 0.08 -1.01 0.02 0.00 -0.22 0.00 0.00 54.13 53.00 3bwc s LEU 239 Cb -0.12 -1.41 0.12 0.00 0.50 0.00 0.00 46.19 45.28 3bwc s LEU 239 CO 0.02 -1.32 0.16 -1.00 -1.32 0.00 0.00 176.35 172.89 3bwc s HIS 241 N -2.73 2.58 -0.30 5.38 0.09 -1.26 -4.58 115.29 114.47 3bwc s HIS 241 Ca 0.53 -2.53 0.02 0.00 -0.00 0.00 0.00 55.06 53.08 3bwc s HIS 241 Cb -0.04 -2.28 0.08 0.00 -0.00 0.00 0.00 32.58 30.33 3bwc s HIS 241 CO 0.34 -0.84 -0.02 0.08 -0.00 0.00 0.00 174.74 174.30 3bwc s VAL 242 N 0.70 2.43 0.44 -0.90 1.01 -1.13 -4.98 120.40 117.96 3bwc s VAL 242 Ca 0.14 -1.86 0.28 0.00 0.00 0.00 0.00 61.98 60.54 3bwc s VAL 242 Cb -0.22 -2.56 0.31 0.00 0.00 0.00 0.00 36.38 33.91 3bwc s VAL 242 CO -0.08 -0.28 2.10 1.55 0.00 0.00 0.00 175.10 178.39 3bwc h PRO 243 N 7.78 0.00 0.00 2.72 0.13 -1.95 -3.12 132.00 137.57 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 -3.81 1.56 1.35 -1.95 -3.42 112.91 106.64 3bwc h THR 244 Ca -0.00 -0.64 -0.50 0.00 -0.55 0.00 0.00 66.41 64.72 3bwc h THR 244 Cb 0.29 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 3bwc h THR 244 CO 0.01 0.00 0.43 -0.47 -0.25 0.00 0.00 175.52 175.24 3bwc s TYR 245 N -3.14 3.68 0.15 4.73 5.04 -1.18 -4.93 117.35 121.69 3bwc s TYR 245 Ca 0.09 1.77 -0.04 0.00 -2.44 0.00 0.00 57.07 56.45 3bwc s TYR 245 Cb 0.10 -3.16 0.25 0.00 0.35 0.00 0.00 41.96 39.50 3bwc s TYR 245 CO 0.63 -0.22 0.81 -2.30 -1.34 0.00 0.00 175.55 173.14 3bwc n PRO 246 N 1.14 -0.05 -0.24 4.97 -0.02 -1.26 0.75 135.00 140.29 3bwc n PRO 246 Ca -0.01 0.81 0.10 0.00 -2.02 0.00 0.00 63.50 62.38 3bwc n PRO 246 Cb 0.46 -1.22 0.22 0.00 -0.02 0.00 0.00 33.50 32.95 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 0.53 3.28 0.00 0.00 0.23 -4.98 105.19 105.50 3bwc n GLY 248 Ca 0.18 -0.28 0.03 0.00 0.00 0.00 0.00 46.02 45.96 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 -1.29 0.57 1.61 1.04 -1.24 -2.86 113.70 109.20 3bwc s SER 249 Ca 0.00 1.03 0.10 0.00 0.48 0.00 0.00 55.95 57.56 3bwc s SER 249 Cb 0.00 2.17 0.08 0.00 0.10 0.00 0.00 66.02 68.37 3bwc s SER 249 CO 0.00 -0.24 0.78 -0.51 0.98 0.00 0.00 173.24 174.25 3bwc s ILE 250 N 2.87 2.16 0.34 -1.02 2.07 -1.26 -4.60 121.20 121.75 3bwc s ILE 250 Ca 0.13 -1.00 0.04 0.00 -1.41 0.00 0.00 60.65 58.41 3bwc s ILE 250 Cb -0.14 -2.16 -0.02 0.00 0.13 0.00 0.00 42.46 40.27 3bwc s ILE 250 CO -0.20 0.00 0.36 -0.83 -1.91 0.00 0.00 174.94 172.35 3bwc s GLY 251 N -4.66 2.03 -0.01 1.50 0.00 -1.25 -4.73 107.32 100.20 3bwc s GLY 251 Ca 0.61 -1.87 0.01 0.00 0.00 0.00 0.00 44.72 43.47 3bwc s GLY 251 CO 0.39 -1.29 -0.03 -1.08 0.00 0.00 0.00 173.10 171.08 3bwc s THR 252 N -3.27 0.28 -0.26 0.90 -1.32 0.11 -0.17 115.64 111.92 3bwc s THR 252 Ca 0.37 -0.12 -0.17 0.00 -1.21 0.00 0.00 61.69 60.55 3bwc s THR 252 Cb 0.01 -0.26 -0.03 0.00 -1.51 0.00 0.00 72.50 70.71 3bwc s THR 252 CO 0.25 0.10 0.49 -0.76 -2.21 0.00 0.00 174.62 172.48 3bwc s LEU 253 N 0.11 4.06 -0.30 9.08 1.43 -0.00 0.25 118.68 133.30 3bwc s LEU 253 Ca -0.01 0.49 -0.08 0.00 -1.03 0.00 0.00 54.13 53.50 3bwc s LEU 253 Cb -0.04 -2.62 -0.00 0.00 0.03 0.00 0.00 46.19 43.56 3bwc s LEU 253 CO -0.00 -0.25 0.12 -0.69 0.23 0.00 0.00 176.35 175.75 3bwc s VAL 254 N 2.18 4.32 0.00 -1.59 1.01 -0.08 -1.36 120.40 124.89 3bwc s VAL 254 Ca 0.20 -0.53 0.06 0.00 0.00 0.00 0.00 61.98 61.71 3bwc s VAL 254 Cb -0.16 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.99 3bwc s VAL 254 CO 0.09 0.08 -0.18 0.00 0.00 0.00 0.00 175.10 175.09 3bwc s SER 256 N -1.11 3.81 0.10 0.00 0.15 -0.37 0.44 113.70 116.71 3bwc s SER 256 Ca 0.13 -0.30 -0.10 0.00 0.70 0.00 0.00 55.95 56.37 3bwc s SER 256 Cb -0.10 -1.05 -0.17 0.00 -1.71 0.00 0.00 66.02 62.99 3bwc s SER 256 CO 0.03 0.27 1.25 0.50 1.20 0.00 0.00 173.24 176.50 3bwc h LYS 257 N 5.87 0.63 -6.70 5.44 3.64 -1.56 -1.28 116.57 122.61 3bwc h LYS 257 Ca -0.38 -0.63 -0.50 0.00 -1.27 0.00 0.00 60.65 57.87 3bwc h LYS 257 Cb 1.17 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 33.14 3bwc h LYS 257 CO 0.51 1.24 0.34 0.21 -2.27 0.00 0.00 179.45 179.48 3bwc s LYS 258 N -3.40 4.82 0.54 1.90 2.20 -1.20 -3.82 119.74 120.79 3bwc s LYS 258 Ca -0.09 1.46 -0.16 0.00 -0.36 0.00 0.00 55.97 56.83 3bwc s LYS 258 Cb 0.08 -3.30 -0.07 0.00 -1.51 0.00 0.00 37.83 33.04 3bwc s LYS 258 CO 0.90 0.47 1.00 0.00 -0.36 0.00 0.00 175.35 177.36 3bwc s ALA 259 N -0.96 3.01 0.00 3.13 0.00 -1.26 -3.98 121.76 121.69 3bwc s ALA 259 Ca 0.42 0.19 0.00 0.00 0.00 0.00 0.00 51.96 52.56 3bwc s ALA 259 Cb -0.25 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.73 3bwc s ALA 259 CO 0.31 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 176.08 3bwc n GLY 260 N -1.61 0.81 3.68 0.00 0.00 -1.26 -5.02 105.19 101.79 3bwc n GLY 260 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3bwc n GLY 260 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bwc s VAL 261 N -3.24 5.06 -0.60 1.61 1.01 -1.26 -5.03 120.40 117.96 3bwc s VAL 261 Ca 0.00 1.16 -0.11 0.00 0.00 0.00 0.00 61.98 63.03 3bwc s VAL 261 Cb 0.00 -3.93 0.15 0.00 0.00 0.00 0.00 36.38 32.61 3bwc s VAL 261 CO 0.00 0.17 0.50 -0.62 0.00 0.00 0.00 175.10 175.16 3bwc s ASP 262 N 1.04 6.04 0.26 3.32 2.15 -1.26 -4.93 116.67 123.29 3bwc s ASP 262 Ca 0.29 -2.20 0.24 0.00 0.43 0.00 0.00 52.55 51.31 3bwc s ASP 262 Cb -0.16 -2.09 0.97 0.00 -0.30 0.00 0.00 42.92 41.34 3bwc s ASP 262 CO 0.11 -0.66 1.72 1.33 -0.17 0.00 0.00 175.17 177.50 3bwc n VAL 263 N 4.58 0.80 0.37 1.11 0.24 -1.26 -3.21 118.33 120.96 3bwc n VAL 263 Ca -0.02 0.18 0.13 0.00 -2.04 0.00 0.00 64.34 62.59 3bwc n VAL 263 Cb 0.42 -1.11 0.54 0.00 -1.47 0.00 0.00 33.84 32.22 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 0.00 -3.49 3.34 1.35 -1.93 -3.40 112.91 108.78 3bwc h THR 264 Ca 0.00 -0.28 -0.67 0.00 -0.55 0.00 0.00 66.41 64.91 3bwc h THR 264 Cb 0.40 1.06 -0.28 0.00 -1.73 0.00 0.00 68.15 67.60 3bwc h THR 264 CO 0.00 0.00 -0.80 -0.54 -0.25 0.00 0.00 175.52 173.93 3bwc s LYS 265 N -3.39 3.13 0.12 4.72 -0.14 -1.20 -4.06 119.74 118.92 3bwc s LYS 265 Ca 0.03 -0.74 -0.32 0.00 -1.36 0.00 0.00 55.97 53.59 3bwc s LYS 265 Cb 0.09 -2.50 -0.11 0.00 -1.68 0.00 0.00 37.83 33.63 3bwc s LYS 265 CO 0.42 0.28 1.80 -2.30 -0.76 0.00 0.00 175.35 174.79 3bwc n PRO 266 N 3.30 2.67 -0.13 -1.68 -0.02 -1.26 -4.87 135.00 133.00 3bwc n PRO 266 Ca -0.18 0.97 -0.11 0.00 -2.02 0.00 0.00 63.50 62.15 3bwc n PRO 266 Cb 0.53 -2.84 -0.02 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 8.11 0.79 -7.51 2.45 5.85 -1.67 -3.39 115.31 119.94 3bwc h LEU 267 Ca -0.46 -0.38 -0.62 0.00 0.84 0.00 0.00 57.88 57.26 3bwc h LEU 267 Cb 1.23 -0.22 -0.39 0.00 0.37 0.00 0.00 40.66 41.65 3bwc h LEU 267 CO 0.94 0.99 -0.76 -0.13 -0.34 0.00 0.00 178.44 179.15 3bwc s ARG 268 N -4.72 1.31 0.23 1.25 0.52 -0.73 -5.05 118.95 111.76 3bwc s ARG 268 Ca -0.12 -1.26 -0.31 0.00 -0.52 0.00 0.00 55.73 53.51 3bwc s ARG 268 Cb 0.10 -2.59 -0.14 0.00 0.52 0.00 0.00 34.95 32.84 3bwc s ARG 268 CO 0.82 -0.81 1.33 -2.30 0.02 0.00 0.00 175.30 174.37 3bwc n PRO 269 N 4.61 1.79 0.28 3.54 -0.02 -1.26 -4.76 135.00 139.18 3bwc n PRO 269 Ca -0.05 0.64 0.17 0.00 -2.02 0.00 0.00 63.50 62.24 3bwc n PRO 269 Cb 0.43 -2.24 0.77 0.00 -0.02 0.00 0.00 33.50 32.43 3bwc n PRO 269 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3bwc h VAL 270 N 2.91 0.17 -0.10 -1.45 3.04 -1.95 -2.97 116.25 115.89 3bwc h VAL 270 Ca -0.44 -0.50 0.03 0.00 -1.01 0.00 0.00 66.70 64.78 3bwc h VAL 270 Cb 1.30 1.42 -0.00 0.00 -2.01 0.00 0.00 31.29 31.99 3bwc h VAL 270 CO 0.73 0.05 0.13 -0.33 -1.01 0.00 0.00 177.57 177.15 3bwc h GLU 271 N 0.00 0.00 -2.01 4.17 3.07 -1.95 -3.39 114.58 114.48 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 0.42 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.28 3bwc h GLU 271 CO 0.01 0.00 -0.25 -0.25 -1.40 0.00 0.00 179.01 177.12 3bwc n ASP 272 N -3.67 5.23 -0.00 1.42 8.00 -1.13 -4.89 116.55 121.51 3bwc n ASP 272 Ca -0.00 -2.45 0.05 0.00 0.71 0.00 0.00 54.79 53.10 3bwc n ASP 272 Cb 0.23 -1.31 -0.07 0.00 -0.02 0.00 0.00 41.12 39.96 3bwc n ASP 272 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3bwc n PRO 274 N 2.15 1.28 -0.06 -0.24 -0.04 -1.26 -5.07 135.00 131.75 3bwc n PRO 274 Ca 0.28 -0.06 0.11 0.00 -0.04 0.00 0.00 63.50 63.78 3bwc n PRO 274 Cb 0.77 -1.15 0.40 0.00 -0.04 0.00 0.00 33.50 33.48 3bwc n PRO 274 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 3bwc n PHE 275 N -1.67 0.17 -0.24 0.54 1.16 -1.26 -4.48 117.46 111.68 3bwc n PHE 275 Ca -0.01 -0.08 0.01 0.00 -1.87 0.00 0.00 57.45 55.50 3bwc n PHE 275 Cb 0.22 0.00 0.13 0.00 -1.61 0.00 0.00 39.48 38.23 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 4.12 0.96 0.00 1.98 0.00 -1.91 -1.47 119.26 122.94 3bwc h ALA 276 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3bwc h ALA 276 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3bwc h ALA 276 CO 0.00 -0.07 0.00 1.63 0.00 0.00 0.00 179.25 180.81 3bwc n LYS 277 N -4.88 0.07 0.18 0.00 4.76 -1.26 -2.53 118.16 114.49 3bwc n LYS 277 Ca 0.11 0.19 0.12 0.00 -2.87 0.00 0.00 58.31 55.86 3bwc n LYS 277 Cb 0.28 -1.60 0.18 0.00 -1.84 0.00 0.00 35.03 32.04 3bwc n LYS 277 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 3bwc h ASP 278 N 0.00 0.00 -3.64 4.39 3.32 -1.57 -3.46 116.42 115.46 3bwc h ASP 278 Ca 0.00 -0.01 -0.51 0.00 0.02 0.00 0.00 57.03 56.53 3bwc h ASP 278 Cb 0.42 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.99 3bwc h ASP 278 CO 0.00 0.00 0.53 -0.76 -1.72 0.00 0.00 179.24 177.30 3bwc s LEU 279 N -5.81 4.49 0.04 1.55 1.43 -1.05 -4.95 118.68 114.37 3bwc s LEU 279 Ca 0.06 2.28 0.22 0.00 -1.03 0.00 0.00 54.13 55.67 3bwc s LEU 279 Cb 0.07 -3.62 -0.12 0.00 0.03 0.00 0.00 46.19 42.55 3bwc s LEU 279 CO 0.68 -0.30 0.84 0.29 0.23 0.00 0.00 176.35 178.08 3bwc n LYS 280 N 1.88 0.40 0.07 1.70 5.02 -1.26 -4.76 118.16 121.22 3bwc n LYS 280 Ca 0.02 -0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 3bwc n LYS 280 Cb 0.44 -1.58 0.00 0.00 -0.02 0.00 0.00 35.03 33.87 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 -2.07 -0.63 -2.53 2.13 9.36 -1.26 -5.07 117.16 117.09 3bwc n TYR 281 Ca 0.00 0.11 -0.41 0.00 3.32 0.00 0.00 57.90 60.92 3bwc n TYR 281 Cb 0.48 0.15 -0.04 0.00 -0.63 0.00 0.00 39.34 39.30 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 -2.00 3.58 0.28 2.98 5.04 -1.26 -5.03 117.35 120.94 3bwc s TYR 282 Ca 0.00 1.55 -0.03 0.00 -2.44 0.00 0.00 57.07 56.15 3bwc s TYR 282 Cb 0.00 -3.28 0.01 0.00 0.35 0.00 0.00 41.96 39.04 3bwc s TYR 282 CO 0.00 -0.65 0.42 -0.40 -1.34 0.00 0.00 175.55 173.57 3bwc n ASP 283 N 2.95 -1.17 0.10 4.32 5.68 -1.26 -4.85 116.55 122.32 3bwc n ASP 283 Ca 0.05 -2.47 0.00 0.00 -0.50 0.00 0.00 54.79 51.87 3bwc n ASP 283 Cb 0.47 2.14 0.31 0.00 -1.14 0.00 0.00 41.12 42.90 3bwc n ASP 283 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3bwc h SER 284 N 1.56 0.26 0.00 -1.12 0.02 -1.98 -0.50 113.55 111.79 3bwc h SER 284 Ca -0.22 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3bwc h SER 284 Cb 0.95 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.42 3bwc h SER 284 CO 0.30 0.51 0.00 -0.62 -1.14 0.00 0.00 176.83 175.87 3bwc n GLU 285 N -4.17 0.54 0.00 3.45 -0.58 -1.26 -1.99 120.64 116.64 3bwc n GLU 285 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 3bwc n GLU 285 Cb 0.35 -1.25 0.00 0.00 -0.57 0.00 0.00 31.44 29.98 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 0.53 0.00 -0.10 -0.32 -0.00 -0.20 -1.13 115.22 114.00 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 0.22 0.00 -0.01 0.00 -0.00 0.00 0.00 29.99 30.20 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 0.46 -0.15 1.57 1.57 -1.54 -2.92 116.57 115.57 3bwc h LYS 288 Ca 0.00 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3bwc h LYS 288 Cb 0.00 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 3bwc h LYS 288 CO 0.00 0.38 0.09 0.00 -0.57 0.00 0.00 179.45 179.35 3bwc h ALA 289 N 1.06 1.88 0.00 3.86 0.00 -1.40 -2.91 119.26 121.76 3bwc h ALA 289 Ca 0.12 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3bwc h ALA 289 Cb 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3bwc h ALA 289 CO -0.02 0.11 -0.11 0.66 0.00 0.00 0.00 179.25 179.89 3bwc h SER 290 N 0.20 0.00 -0.02 0.00 4.64 -1.76 -2.55 113.55 114.07 3bwc h SER 290 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3bwc h SER 290 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 3bwc h SER 290 CO -0.01 0.11 -0.01 0.49 -0.87 0.00 0.00 176.83 176.54 3bwc n PHE 291 N -3.61 0.00 -2.78 4.77 3.72 -1.10 0.05 117.46 118.52 3bwc n PHE 291 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.95 3bwc n PHE 291 Cb 0.23 -0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.73 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 -2.01 3.15 0.08 4.37 0.00 -0.96 -4.99 121.76 121.40 3bwc s ALA 292 Ca 0.33 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.30 3bwc s ALA 292 Cb 0.20 -3.77 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 3bwc s ALA 292 CO 0.32 -2.32 0.24 -0.51 0.00 0.00 0.00 175.76 173.48 3bwc s LEU 293 N 4.09 4.35 0.80 0.00 1.43 -1.26 -4.96 118.68 123.12 3bwc s LEU 293 Ca 0.35 0.27 -0.14 0.00 -1.03 0.00 0.00 54.13 53.58 3bwc s LEU 293 Cb -0.11 -2.97 0.02 0.00 0.03 0.00 0.00 46.19 43.16 3bwc s LEU 293 CO 0.23 0.14 0.72 -2.65 0.23 0.00 0.00 176.35 175.02 3bwc n PRO 294 N 0.10 0.13 -0.08 1.29 -0.02 -1.26 -4.65 135.00 130.52 3bwc n PRO 294 Ca -0.05 0.10 0.03 0.00 -2.02 0.00 0.00 63.50 61.56 3bwc n PRO 294 Cb 0.52 -2.03 0.37 0.00 -0.02 0.00 0.00 33.50 32.33 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 -0.81 0.69 0.00 -0.52 3.08 -1.99 -0.35 114.38 114.48 3bwc h ARG 295 Ca -0.45 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.56 3bwc h ARG 295 Cb 1.32 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.21 3bwc h ARG 295 CO 0.42 0.46 0.00 0.27 -1.07 0.00 0.00 179.97 180.04 3bwc h PHE 296 N 0.71 0.00 -0.04 3.04 -5.15 -2.02 -2.91 116.94 110.56 3bwc h PHE 296 Ca 0.20 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.97 3bwc h PHE 296 Cb -0.05 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.12 3bwc h PHE 296 CO -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 178.31 176.31 3bwc n ALA 297 N -1.86 2.16 0.20 12.09 0.00 -0.23 -4.79 120.51 128.07 3bwc n ALA 297 Ca 0.00 -0.88 0.05 0.00 0.00 0.00 0.00 53.44 52.61 3bwc n ALA 297 Cb 0.17 -0.07 0.41 0.00 0.00 0.00 0.00 19.45 19.95 3bwc n ALA 297 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 3bwc h ARG 298 N 0.36 0.00 0.00 0.00 0.11 -1.10 -2.73 114.38 111.02 3bwc h ARG 298 Ca 0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 3bwc h ARG 298 Cb 0.41 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.49 3bwc h ARG 298 CO 0.00 0.34 -0.00 1.12 0.10 0.00 0.00 179.97 181.53 3bwc h HIS 299 N 0.00 0.00 -0.81 4.08 2.07 -1.85 -1.72 115.15 116.93 3bwc h HIS 299 Ca -0.00 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.48 3bwc h HIS 299 Cb 0.67 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.61 3bwc h HIS 299 CO 0.00 0.00 0.36 0.82 -3.07 0.00 0.00 177.93 176.04 3bwc h ILE 300 N 0.00 1.26 -0.02 6.12 2.04 -1.87 -3.13 117.51 121.90 3bwc h ILE 300 Ca -0.00 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.10 3bwc h ILE 300 Cb 0.04 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.38 3bwc h ILE 300 CO 0.00 0.32 -0.31 0.59 0.00 0.00 0.00 178.15 178.75 3bwc n ASN 301 N -4.31 2.22 0.00 1.72 3.02 -0.82 -4.76 115.26 112.34 3bwc n ASN 301 Ca 0.08 -1.61 0.00 0.00 -0.03 0.00 0.00 54.58 53.01 3bwc n ASN 301 Cb 0.16 0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 3bwc n ASN 301 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23