#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bbw n VAL 12 N 0.00 0.51 -0.14 2.52 3.14 -1.26 -2.86 118.33 120.24 1bbw n VAL 12 Ca 0.00 0.13 -0.03 0.00 -2.96 0.00 0.00 64.34 61.47 1bbw n VAL 12 Cb 0.00 -0.98 0.05 0.00 -1.06 0.00 0.00 33.84 31.85 1bbw n VAL 12 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 1bbw h ASP 13 N 0.00 0.00 0.35 6.55 1.82 -2.06 -1.62 116.42 121.46 1bbw h ASP 13 Ca 0.00 0.08 -0.04 0.00 -0.39 0.00 0.00 57.03 56.68 1bbw h ASP 13 Cb 0.05 0.11 -0.01 0.00 0.68 0.00 0.00 39.33 40.16 1bbw h ASP 13 CO 0.00 0.03 -0.21 -0.07 -1.61 0.00 0.00 179.24 177.38 1bbw h LEU 14 N 0.22 0.00 -1.51 2.28 -0.00 -1.97 -2.79 115.31 111.54 1bbw h LEU 14 Ca 0.23 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 58.05 1bbw h LEU 14 Cb 0.29 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.94 1bbw h LEU 14 CO -0.30 0.21 -0.25 -1.13 -0.00 0.00 0.00 178.44 176.97 1bbw h ASN 15 N 0.00 0.00 0.28 -0.43 -0.00 -1.50 -1.87 115.58 112.05 1bbw h ASN 15 Ca -0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 56.30 56.02 1bbw h ASN 15 Cb 0.44 0.00 0.02 0.00 -0.00 0.00 0.00 38.32 38.78 1bbw h ASN 15 CO 0.03 0.25 -1.15 0.78 -0.00 0.00 0.00 177.43 177.34 1bbw h ASN 16 N 0.00 0.70 -0.92 1.15 2.35 -1.49 -3.10 115.58 114.26 1bbw h ASN 16 Ca -0.00 -0.64 0.17 0.00 -0.55 0.00 0.00 56.30 55.28 1bbw h ASN 16 Cb 0.49 -0.22 -0.08 0.00 0.05 0.00 0.00 38.32 38.56 1bbw h ASN 16 CO 0.03 1.45 0.59 -0.33 -1.65 0.00 0.00 177.43 177.53 1bbw h GLU 17 N 0.23 0.63 0.00 0.81 4.39 -1.28 0.63 114.58 119.99 1bbw h GLU 17 Ca -0.15 -0.04 -0.12 0.00 0.34 0.00 0.00 59.36 59.40 1bbw h GLU 17 Cb 1.82 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 30.32 1bbw h GLU 17 CO 0.21 0.41 -0.55 1.25 -1.16 0.00 0.00 179.01 179.18 1bbw h LEU 18 N 0.65 0.00 0.01 1.33 5.85 -1.43 -2.08 115.31 119.64 1bbw h LEU 18 Ca 0.48 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.20 1bbw h LEU 18 Cb 0.87 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.90 1bbw h LEU 18 CO -0.24 0.55 -0.00 0.11 -0.34 0.00 0.00 178.44 178.52 1bbw h LYS 19 N 0.00 -0.01 0.54 1.25 6.56 0.16 -2.97 116.57 122.10 1bbw h LYS 19 Ca -0.01 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.56 1bbw h LYS 19 Cb 1.05 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.72 1bbw h LYS 19 CO 0.07 0.64 -0.26 0.00 -2.06 0.00 0.00 179.45 177.84 1bbw h THR 20 N -0.67 0.00 -0.73 -0.16 1.03 -0.67 -2.30 112.91 109.40 1bbw h THR 20 Ca -0.00 -0.05 0.13 0.00 -0.01 0.00 0.00 66.41 66.48 1bbw h THR 20 Cb 0.65 0.00 -0.09 0.00 -1.07 0.00 0.00 68.15 67.64 1bbw h THR 20 CO 0.00 0.00 0.29 0.03 -0.01 0.00 0.00 175.52 175.83 1bbw h ARG 21 N -0.78 0.43 -0.34 0.00 3.08 -1.56 0.21 114.38 115.42 1bbw h ARG 21 Ca -0.07 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1bbw h ARG 21 Cb 0.56 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 1bbw h ARG 21 CO 0.12 0.29 0.11 -0.09 -1.07 0.00 0.00 179.97 179.33 1bbw h ARG 22 N 0.45 0.49 0.08 0.04 2.43 -1.55 -2.00 114.38 114.32 1bbw h ARG 22 Ca 0.39 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.49 1bbw h ARG 22 Cb 0.57 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1bbw h ARG 22 CO -0.38 0.43 -0.04 0.93 -1.51 0.00 0.00 179.97 179.40 1bbw h GLU 23 N 0.49 -0.10 -1.08 0.20 5.08 -0.23 -3.00 114.58 115.93 1bbw h GLU 23 Ca 0.12 0.01 0.33 0.00 -1.00 0.00 0.00 59.36 58.81 1bbw h GLU 23 Cb 0.15 0.02 -0.13 0.00 0.50 0.00 0.00 28.75 29.29 1bbw h GLU 23 CO -0.01 0.44 0.66 0.87 -1.00 0.00 0.00 179.01 179.97 1bbw h LYS 24 N -0.74 0.30 -0.27 2.33 1.57 -0.28 0.12 116.57 119.61 1bbw h LYS 24 Ca -0.01 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.57 1bbw h LYS 24 Cb 0.58 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1bbw h LYS 24 CO 0.02 0.20 -0.56 1.25 -0.57 0.00 0.00 179.45 179.79 1bbw h LEU 25 N 0.31 0.95 -2.27 2.94 6.46 -1.40 -0.09 115.31 122.23 1bbw h LEU 25 Ca 0.71 -0.55 0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1bbw h LEU 25 Cb 1.79 -0.27 -0.00 0.00 -0.73 0.00 0.00 40.66 41.45 1bbw h LEU 25 CO -0.47 1.32 0.04 0.00 -0.62 0.00 0.00 178.44 178.71 1bbw h ALA 26 N 0.66 1.76 0.08 1.25 0.00 -0.64 -1.67 119.26 120.70 1bbw h ALA 26 Ca 0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1bbw h ALA 26 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1bbw h ALA 26 CO 0.12 -0.06 -0.04 -0.91 0.00 0.00 0.00 179.25 178.36 1bbw h ASN 27 N 0.00 -0.09 -1.04 0.00 2.35 -0.82 -3.25 115.58 112.72 1bbw h ASN 27 Ca 0.02 -0.49 0.30 0.00 -0.55 0.00 0.00 56.30 55.58 1bbw h ASN 27 Cb 0.10 0.02 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 1bbw h ASN 27 CO -0.00 0.57 0.75 -0.07 -1.65 0.00 0.00 177.43 177.03 1bbw h LEU 28 N -0.89 0.00 -0.88 1.61 3.38 -0.25 0.57 115.31 118.85 1bbw h LEU 28 Ca -0.01 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1bbw h LEU 28 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1bbw h LEU 28 CO 0.02 0.00 -0.48 0.03 0.09 0.00 0.00 178.44 178.10 1bbw h ARG 29 N 0.00 0.19 -0.15 1.13 3.08 -1.38 -1.57 114.38 115.68 1bbw h ARG 29 Ca 0.49 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.41 1bbw h ARG 29 Cb 1.99 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 32.04 1bbw h ARG 29 CO -0.01 0.63 -0.04 0.93 -1.07 0.00 0.00 179.97 180.41 1bbw h GLU 30 N 0.15 0.30 -0.29 0.04 4.39 0.08 -3.36 114.58 115.89 1bbw h GLU 30 Ca 0.01 -0.12 -0.07 0.00 0.34 0.00 0.00 59.36 59.52 1bbw h GLU 30 Cb 0.91 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 1bbw h GLU 30 CO 0.07 0.59 -0.10 1.96 -1.16 0.00 0.00 179.01 180.37 1bbw h GLN 31 N -0.01 0.58 0.00 2.33 4.20 -1.17 -3.50 115.11 117.55 1bbw h GLN 31 Ca 0.04 -0.24 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1bbw h GLN 31 Cb 0.48 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1bbw h GLN 31 CO 0.02 0.79 0.00 0.41 -0.67 0.00 0.00 178.83 179.38 1bbw n GLY 32 N -0.11 2.09 3.65 3.46 0.00 -0.61 -5.08 105.19 108.58 1bbw n GLY 32 Ca -0.03 -0.25 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 1bbw n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bbw s ILE 33 N -0.57 4.52 0.25 -0.61 1.01 -1.26 -4.52 121.20 120.02 1bbw s ILE 33 Ca 0.00 1.78 -0.03 0.00 0.00 0.00 0.00 60.65 62.40 1bbw s ILE 33 Cb 0.00 -4.34 0.12 0.00 0.01 0.00 0.00 42.46 38.25 1bbw s ILE 33 CO 0.00 -0.37 1.77 0.00 0.00 0.00 0.00 174.94 176.33 1bbw h ALA 34 N 8.00 1.10 -2.21 9.38 0.00 -1.92 -3.35 119.26 130.27 1bbw h ALA 34 Ca -0.21 -0.25 -0.59 0.00 0.00 0.00 0.00 54.91 53.86 1bbw h ALA 34 Cb 1.07 -0.21 -0.42 0.00 0.00 0.00 0.00 17.79 18.23 1bbw h ALA 34 CO 1.01 0.58 -0.63 1.19 0.00 0.00 0.00 179.25 181.41 1bbw n PHE 35 N -4.23 3.61 -1.78 0.00 3.01 -1.26 -4.73 117.46 112.09 1bbw n PHE 35 Ca 0.03 -4.10 -0.41 0.00 1.01 0.00 0.00 57.45 53.99 1bbw n PHE 35 Cb 0.28 -0.53 0.00 0.00 -0.01 0.00 0.00 39.48 39.22 1bbw n PHE 35 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1bbw n PRO 36 N 0.56 2.59 -0.29 -1.08 -0.04 -1.25 -4.90 135.00 130.58 1bbw n PRO 36 Ca 0.30 0.91 0.08 0.00 -0.04 0.00 0.00 63.50 64.75 1bbw n PRO 36 Cb 0.41 -2.67 0.16 0.00 -0.04 0.00 0.00 33.50 31.36 1bbw n PRO 36 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1bbw n ASN 37 N 0.26 2.04 0.00 3.54 6.94 -1.26 -4.70 115.26 122.09 1bbw n ASN 37 Ca 0.02 -3.33 0.11 0.00 -0.02 0.00 0.00 54.58 51.36 1bbw n ASN 37 Cb 0.40 -0.46 -0.10 0.00 -2.36 0.00 0.00 39.78 37.26 1bbw n ASN 37 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1bbw n ASP 38 N -1.26 0.50 -4.75 0.53 5.68 -1.26 -4.93 116.55 111.07 1bbw n ASP 38 Ca 0.16 -0.38 -0.41 0.00 -0.50 0.00 0.00 54.79 53.66 1bbw n ASP 38 Cb 0.67 1.34 -0.03 0.00 -1.14 0.00 0.00 41.12 41.95 1bbw n ASP 38 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1bbw s PHE 39 N -3.26 3.35 -0.09 2.11 2.19 -1.26 -5.01 117.98 116.00 1bbw s PHE 39 Ca 0.00 1.42 0.01 0.00 0.33 0.00 0.00 56.93 58.69 1bbw s PHE 39 Cb 0.15 -3.49 0.02 0.00 -1.31 0.00 0.00 43.02 38.39 1bbw s PHE 39 CO 0.87 -1.36 -0.09 1.03 1.83 0.00 0.00 175.22 177.50 1bbw s ARG 40 N -0.64 1.55 0.00 10.12 1.81 -1.26 -5.14 118.95 125.39 1bbw s ARG 40 Ca 0.52 -0.30 0.00 0.00 -1.72 0.00 0.00 55.73 54.23 1bbw s ARG 40 Cb -0.35 -1.49 0.00 0.00 -0.45 0.00 0.00 34.95 32.66 1bbw s ARG 40 CO 0.40 -0.16 0.00 2.89 -0.68 0.00 0.00 175.30 177.75 1bbw n ARG 41 N 4.52 3.12 0.00 3.54 1.85 -1.26 -4.93 116.66 123.49 1bbw n ARG 41 Ca -0.17 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.68 1bbw n ARG 41 Cb 0.51 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.92 1bbw n ARG 41 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 1bbw n ASP 42 N 0.00 0.00 -3.77 2.89 5.68 -0.43 -4.90 116.55 116.02 1bbw n ASP 42 Ca 0.00 0.00 -0.13 0.00 -0.50 0.00 0.00 54.79 54.16 1bbw n ASP 42 Cb 0.00 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 39.88 1bbw n ASP 42 CO 0.00 0.00 0.00 -1.00 -1.33 0.00 0.00 177.20 174.87 1bbw s HIS 43 N 0.00 -0.24 0.11 2.11 3.76 -0.50 -4.90 115.29 115.63 1bbw s HIS 43 Ca 0.00 0.52 0.10 0.00 -0.15 0.00 0.00 55.06 55.53 1bbw s HIS 43 Cb 0.00 0.09 -0.04 0.00 1.11 0.00 0.00 32.58 33.75 1bbw s HIS 43 CO 0.00 -0.27 -0.24 0.95 -0.85 0.00 0.00 174.74 174.34 1bbw s THR 44 N -0.58 2.46 0.04 1.30 -4.23 -1.26 -4.44 115.64 108.93 1bbw s THR 44 Ca -0.07 -1.59 -0.08 0.00 -1.18 0.00 0.00 61.69 58.78 1bbw s THR 44 Cb -0.04 -2.08 -0.02 0.00 1.34 0.00 0.00 72.50 71.70 1bbw s THR 44 CO 0.02 0.15 0.83 -1.54 -0.54 0.00 0.00 174.62 173.54 1bbw n SER 45 N 1.04 -0.26 -0.32 3.99 3.41 -1.26 -0.65 113.62 119.57 1bbw n SER 45 Ca -0.17 0.89 0.15 0.00 -0.26 0.00 0.00 58.87 59.48 1bbw n SER 45 Cb 0.53 -0.28 0.34 0.00 -0.26 0.00 0.00 64.21 64.53 1bbw n SER 45 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1bbw h ASP 46 N 0.00 0.44 -0.32 4.04 3.04 -1.88 0.27 116.42 122.01 1bbw h ASP 46 Ca 0.04 0.15 0.02 0.00 -3.24 0.00 0.00 57.03 54.00 1bbw h ASP 46 Cb 0.10 0.10 -0.03 0.00 -1.04 0.00 0.00 39.33 38.47 1bbw h ASP 46 CO -0.23 0.02 0.16 1.56 -2.04 0.00 0.00 179.24 178.71 1bbw h GLN 47 N 0.45 0.33 0.00 4.15 4.20 -1.23 0.12 115.11 123.12 1bbw h GLN 47 Ca 0.59 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 59.28 1bbw h GLN 47 Cb 1.13 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.84 1bbw h GLN 47 CO -0.52 0.22 -0.00 -0.07 -0.67 0.00 0.00 178.83 177.79 1bbw h LEU 48 N 0.33 -0.00 0.46 1.46 3.38 -0.60 -2.99 115.31 117.35 1bbw h LEU 48 Ca 0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1bbw h LEU 48 Cb 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1bbw h LEU 48 CO -0.09 0.21 -0.41 0.45 0.09 0.00 0.00 178.44 178.69 1bbw h HIS 49 N -0.21 -1.13 0.00 1.13 3.86 -0.09 0.19 115.15 118.90 1bbw h HIS 49 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1bbw h HIS 49 Cb 0.21 0.43 0.00 0.00 1.06 0.00 0.00 27.41 29.11 1bbw h HIS 49 CO -0.01 -0.56 0.07 0.00 0.86 0.00 0.00 177.93 178.30 1bbw n ALA 50 N -2.69 0.88 -0.12 2.45 0.00 0.36 -0.19 120.51 121.21 1bbw n ALA 50 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1bbw n ALA 50 Cb 0.38 -0.84 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1bbw n ALA 50 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1bbw n GLU 51 N -1.37 1.57 0.00 0.00 2.13 -0.80 -4.83 120.64 117.34 1bbw n GLU 51 Ca 0.00 -0.26 0.00 0.00 0.66 0.00 0.00 57.16 57.56 1bbw n GLU 51 Cb 0.07 -0.72 0.00 0.00 0.27 0.00 0.00 31.44 31.06 1bbw n GLU 51 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1bbw n PHE 52 N -0.30 0.00 0.10 4.31 3.72 0.59 -4.87 117.46 121.01 1bbw n PHE 52 Ca 0.00 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.58 1bbw n PHE 52 Cb 0.03 0.00 0.56 0.00 -0.94 0.00 0.00 39.48 39.13 1bbw n PHE 52 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1bbw h ASP 53 N 0.00 0.00 -0.56 4.37 5.19 -0.70 -1.45 116.42 123.27 1bbw h ASP 53 Ca 0.00 0.00 -0.32 0.00 -0.62 0.00 0.00 57.03 56.09 1bbw h ASP 53 Cb 0.00 0.00 -0.19 0.00 0.18 0.00 0.00 39.33 39.32 1bbw h ASP 53 CO 0.00 0.00 0.09 0.61 -3.12 0.00 0.00 179.24 176.82 1bbw n GLY 54 N -1.50 5.00 3.04 2.75 0.00 -1.26 -4.95 105.19 108.28 1bbw n GLY 54 Ca 0.09 -1.38 -0.29 0.00 0.00 0.00 0.00 46.02 44.44 1bbw n GLY 54 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bbw s LYS 55 N -3.33 2.20 0.59 1.61 0.00 -0.55 -5.13 119.74 115.13 1bbw s LYS 55 Ca 0.49 -0.54 -0.17 0.00 0.00 0.00 0.00 55.97 55.76 1bbw s LYS 55 Cb 0.43 -1.93 -0.04 0.00 0.00 0.00 0.00 37.83 36.29 1bbw s LYS 55 CO 0.02 -0.13 1.07 -1.21 0.00 0.00 0.00 175.35 175.11 1bbw s GLU 56 N 1.18 3.28 0.09 1.78 0.41 -1.26 -4.88 118.70 119.30 1bbw s GLU 56 Ca -0.02 1.30 -0.01 0.00 -0.41 0.00 0.00 54.97 55.84 1bbw s GLU 56 Cb -0.14 -2.02 0.20 0.00 -1.78 0.00 0.00 34.13 30.39 1bbw s GLU 56 CO -0.05 -0.85 0.49 0.09 -0.49 0.00 0.00 175.26 174.45 1bbw n ASN 57 N -1.89 -0.06 -0.08 -0.19 3.02 -1.26 -2.22 115.26 112.57 1bbw n ASN 57 Ca 0.09 0.53 -0.02 0.00 -0.03 0.00 0.00 54.58 55.16 1bbw n ASN 57 Cb 0.52 -0.18 -0.02 0.00 -0.61 0.00 0.00 39.78 39.49 1bbw n ASN 57 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1bbw h GLU 58 N 0.00 -0.01 -0.20 3.52 3.07 -1.99 0.91 114.58 119.88 1bbw h GLU 58 Ca 0.17 0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.07 1bbw h GLU 58 Cb 0.33 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 1bbw h GLU 58 CO -0.30 -0.00 0.14 0.93 -1.40 0.00 0.00 179.01 178.37 1bbw h GLU 59 N -0.01 0.12 -0.19 2.33 5.08 -1.81 -0.35 114.58 119.75 1bbw h GLU 59 Ca 0.03 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1bbw h GLU 59 Cb 0.08 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1bbw h GLU 59 CO -0.17 0.08 0.02 -0.07 -1.00 0.00 0.00 179.01 177.87 1bbw h LEU 60 N 0.12 0.31 -1.88 1.33 -0.00 -1.44 0.23 115.31 113.98 1bbw h LEU 60 Ca 0.09 -0.28 -0.00 0.00 -0.00 0.00 0.00 57.88 57.69 1bbw h LEU 60 Cb 0.20 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 40.78 1bbw h LEU 60 CO -0.01 0.51 0.06 -0.08 -0.00 0.00 0.00 178.44 178.92 1bbw h GLU 61 N 0.10 0.14 0.00 1.13 4.57 0.79 -0.04 114.58 121.26 1bbw h GLU 61 Ca 0.06 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 1bbw h GLU 61 Cb 0.34 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.89 1bbw h GLU 61 CO 0.01 0.10 -0.43 0.00 -1.18 0.00 0.00 179.01 177.51 1bbw h ALA 62 N 1.93 0.07 -0.49 2.92 0.00 -1.03 -3.36 119.26 119.30 1bbw h ALA 62 Ca 0.04 -0.57 0.06 0.00 0.00 0.00 0.00 54.91 54.44 1bbw h ALA 62 Cb -0.00 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1bbw h ALA 62 CO -0.01 0.28 0.33 1.37 0.00 0.00 0.00 179.25 181.22 1bbw h LEU 63 N -1.00 0.37 -1.60 0.00 8.10 -0.46 -3.46 115.31 117.26 1bbw h LEU 63 Ca -0.09 0.00 -0.45 0.00 0.11 0.00 0.00 57.88 57.45 1bbw h LEU 63 Cb 0.75 -0.08 0.01 0.00 -0.44 0.00 0.00 40.66 40.90 1bbw h LEU 63 CO -0.06 0.24 -0.82 -3.20 -4.11 0.00 0.00 178.44 170.49 1bbw n ASN 64 N -4.47 -1.92 -4.64 0.17 5.15 -0.04 -4.90 115.26 104.61 1bbw n ASN 64 Ca 0.06 -0.85 -0.43 0.00 -0.60 0.00 0.00 54.58 52.77 1bbw n ASN 64 Cb 0.25 -3.82 -0.02 0.00 -0.53 0.00 0.00 39.78 35.66 1bbw n ASN 64 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1bbw s ILE 65 N -3.62 4.49 -0.04 -1.44 1.01 -1.26 -5.01 121.20 115.32 1bbw s ILE 65 Ca 0.18 1.72 -0.09 0.00 0.00 0.00 0.00 60.65 62.46 1bbw s ILE 65 Cb -0.09 -4.39 -0.05 0.00 0.01 0.00 0.00 42.46 37.94 1bbw s ILE 65 CO 0.83 -0.47 0.26 -0.70 0.00 0.00 0.00 174.94 174.87 1bbw s GLU 66 N 3.67 3.62 0.28 2.79 2.12 -1.26 -2.25 118.70 127.68 1bbw s GLU 66 Ca 0.46 0.04 0.02 0.00 0.36 0.00 0.00 54.97 55.85 1bbw s GLU 66 Cb -0.13 -3.15 -0.05 0.00 0.26 0.00 0.00 34.13 31.07 1bbw s GLU 66 CO 0.16 0.70 0.12 0.14 -0.54 0.00 0.00 175.26 175.83 1bbw s VAL 67 N -1.15 0.51 -0.06 3.70 -7.23 -0.52 -4.96 120.40 110.68 1bbw s VAL 67 Ca 0.22 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.39 1bbw s VAL 67 Cb -0.14 -2.59 0.03 0.00 0.56 0.00 0.00 36.38 34.24 1bbw s VAL 67 CO 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.91 1bbw s ALA 68 N -3.67 0.56 0.16 1.32 0.00 -1.26 -2.20 121.76 116.68 1bbw s ALA 68 Ca 0.36 -0.02 0.06 0.00 0.00 0.00 0.00 51.96 52.36 1bbw s ALA 68 Cb 0.07 -0.61 -0.04 0.00 0.00 0.00 0.00 23.12 22.53 1bbw s ALA 68 CO 0.15 -0.34 -0.12 0.14 0.00 0.00 0.00 175.76 175.59 1bbw s VAL 69 N 1.71 1.37 -0.02 0.00 -7.23 -0.27 -1.32 120.40 114.64 1bbw s VAL 69 Ca 0.00 -2.07 -0.08 0.00 -1.81 0.00 0.00 61.98 58.02 1bbw s VAL 69 Cb -0.13 -1.87 0.01 0.00 0.56 0.00 0.00 36.38 34.95 1bbw s VAL 69 CO -0.04 -0.66 0.18 0.00 -0.31 0.00 0.00 175.10 174.27 1bbw s ALA 70 N -3.08 -0.43 0.00 1.32 0.00 -1.26 -0.81 121.76 117.50 1bbw s ALA 70 Ca 0.18 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1bbw s ALA 70 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.12 1bbw s ALA 70 CO 0.03 -0.19 0.00 0.41 0.00 0.00 0.00 175.76 176.01 1bbw n GLY 71 N 1.82 -0.88 3.75 0.00 0.00 -0.25 -4.55 105.19 105.07 1bbw n GLY 71 Ca -0.20 -0.72 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 1bbw n GLY 71 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bbw s ARG 72 N -0.13 3.01 -0.63 1.61 3.52 0.12 -0.46 118.95 125.99 1bbw s ARG 72 Ca 0.00 -0.48 -0.27 0.00 -0.13 0.00 0.00 55.73 54.85 1bbw s ARG 72 Cb 0.00 -2.83 0.03 0.00 -1.56 0.00 0.00 34.95 30.60 1bbw s ARG 72 CO 0.00 0.66 1.18 1.41 -0.81 0.00 0.00 175.30 177.73 1bbw s MET 73 N -1.52 3.37 -0.14 5.12 -2.45 0.25 -0.31 119.30 123.62 1bbw s MET 73 Ca 0.20 -0.03 -0.09 0.00 -1.25 0.00 0.00 55.69 54.52 1bbw s MET 73 Cb -0.12 -4.08 -0.05 0.00 1.25 0.00 0.00 34.83 31.82 1bbw s MET 73 CO 0.11 -1.81 -0.03 0.52 1.05 0.00 0.00 175.02 174.85 1bbw h MET 74 N 9.67 0.00 -5.41 4.11 0.00 -1.77 0.34 114.93 121.87 1bbw h MET 74 Ca -0.26 0.00 -0.57 0.00 0.00 0.00 0.00 59.70 58.87 1bbw h MET 74 Cb 1.06 0.00 -0.31 0.00 0.00 0.00 0.00 31.60 32.35 1bbw h MET 74 CO 1.20 0.18 -0.84 0.95 0.00 0.00 0.00 176.91 178.40 1bbw s THR 75 N -2.08 1.47 -0.12 2.22 -4.23 -1.21 -4.80 115.64 106.89 1bbw s THR 75 Ca -0.13 -0.75 -0.01 0.00 -1.18 0.00 0.00 61.69 59.62 1bbw s THR 75 Cb 0.02 -1.25 0.03 0.00 1.34 0.00 0.00 72.50 72.64 1bbw s THR 75 CO 0.23 0.42 -0.03 -0.60 -0.54 0.00 0.00 174.62 174.10 1bbw s ARG 76 N -0.05 1.08 -0.52 3.99 3.52 -1.26 -0.64 118.95 125.07 1bbw s ARG 76 Ca -0.02 -0.19 -0.07 0.00 -0.13 0.00 0.00 55.73 55.32 1bbw s ARG 76 Cb -0.11 -1.49 0.13 0.00 -1.56 0.00 0.00 34.95 31.92 1bbw s ARG 76 CO 0.02 -0.35 0.37 -0.98 -0.81 0.00 0.00 175.30 173.55 1bbw s ARG 77 N 1.81 2.50 -0.91 5.12 1.04 0.47 -4.99 118.95 123.98 1bbw s ARG 77 Ca 0.04 -1.99 -0.25 0.00 -1.04 0.00 0.00 55.73 52.49 1bbw s ARG 77 Cb -0.13 -3.86 0.04 0.00 -2.04 0.00 0.00 34.95 28.95 1bbw s ARG 77 CO -0.07 -1.18 1.40 0.42 -0.04 0.00 0.00 175.30 175.84 1bbw s ILE 78 N 0.93 3.83 -0.55 4.99 1.01 -1.26 -1.73 121.20 128.42 1bbw s ILE 78 Ca 0.10 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.38 1bbw s ILE 78 Cb -0.23 -4.97 -0.00 0.00 0.01 0.00 0.00 42.46 37.26 1bbw s ILE 78 CO -0.03 -1.88 2.90 0.23 0.00 0.00 0.00 174.94 176.16 1bbw n MET 79 N 9.07 2.73 0.00 2.79 2.81 -0.20 -4.92 117.12 129.40 1bbw n MET 79 Ca 0.22 -2.24 0.00 0.00 -1.81 0.00 0.00 57.70 53.87 1bbw n MET 79 Cb 0.50 -2.22 0.00 0.00 -0.71 0.00 0.00 33.22 30.79 1bbw n MET 79 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1bbw n GLY 80 N 1.46 2.16 0.05 3.03 0.00 -1.26 -3.15 105.19 107.47 1bbw n GLY 80 Ca 0.51 0.09 0.03 0.00 0.00 0.00 0.00 46.02 46.65 1bbw n GLY 80 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1bbw n LYS 81 N 0.00 4.15 -4.33 1.61 0.00 -1.26 -5.00 118.16 113.33 1bbw n LYS 81 Ca 0.00 -0.18 -0.22 0.00 -0.00 0.00 0.00 58.31 57.91 1bbw n LYS 81 Cb 0.00 -0.82 -0.11 0.00 -0.00 0.00 0.00 35.03 34.10 1bbw n LYS 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1bbw s ALA 82 N -1.27 2.01 0.04 0.58 0.00 -1.19 -2.44 121.76 119.49 1bbw s ALA 82 Ca 0.03 -1.47 -0.14 0.00 0.00 0.00 0.00 51.96 50.38 1bbw s ALA 82 Cb 0.04 -0.20 0.02 0.00 0.00 0.00 0.00 23.12 22.98 1bbw s ALA 82 CO 0.18 0.26 0.31 -1.12 0.00 0.00 0.00 175.76 175.39 1bbw s SER 83 N -2.60 -0.13 -0.27 0.00 0.01 0.13 -1.03 113.70 109.80 1bbw s SER 83 Ca 0.15 -0.17 0.03 0.00 1.31 0.00 0.00 55.95 57.27 1bbw s SER 83 Cb -0.06 0.36 0.07 0.00 0.21 0.00 0.00 66.02 66.59 1bbw s SER 83 CO 0.07 -0.61 -0.09 -0.36 0.41 0.00 0.00 173.24 172.65 1bbw s PHE 84 N -2.51 3.33 0.01 2.43 0.08 -0.70 -1.23 117.98 119.38 1bbw s PHE 84 Ca -0.05 -2.41 0.06 0.00 0.12 0.00 0.00 56.93 54.64 1bbw s PHE 84 Cb -0.01 -2.05 -0.03 0.00 -0.57 0.00 0.00 43.02 40.36 1bbw s PHE 84 CO -0.03 -0.89 -0.15 0.08 -0.10 0.00 0.00 175.22 174.13 1bbw s VAL 85 N 1.08 2.98 -0.20 -0.44 1.01 -0.80 -0.40 120.40 123.64 1bbw s VAL 85 Ca -0.06 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 60.90 1bbw s VAL 85 Cb -0.20 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 33.94 1bbw s VAL 85 CO -0.05 0.42 -0.10 -0.89 0.00 0.00 0.00 175.10 174.47 1bbw s THR 86 N -0.88 2.94 -0.09 3.92 2.01 0.19 -0.01 115.64 123.71 1bbw s THR 86 Ca 0.14 -0.65 -0.08 0.00 0.31 0.00 0.00 61.69 61.41 1bbw s THR 86 Cb -0.11 -2.30 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 1bbw s THR 86 CO 0.04 0.47 0.19 -0.22 -0.69 0.00 0.00 174.62 174.42 1bbw s LEU 87 N 1.26 4.40 -0.19 4.42 2.96 -0.54 -2.14 118.68 128.86 1bbw s LEU 87 Ca 0.03 0.56 0.01 0.00 -0.22 0.00 0.00 54.13 54.51 1bbw s LEU 87 Cb -0.14 -2.20 0.03 0.00 0.50 0.00 0.00 46.19 44.38 1bbw s LEU 87 CO -0.05 0.39 -0.18 -1.58 -1.32 0.00 0.00 176.35 173.60 1bbw s GLN 88 N -1.08 2.84 0.00 1.98 0.74 0.57 -2.07 119.66 122.64 1bbw s GLN 88 Ca 0.17 -0.87 0.00 0.00 0.05 0.00 0.00 55.36 54.71 1bbw s GLN 88 Cb -0.13 -2.57 0.00 0.00 1.10 0.00 0.00 33.01 31.41 1bbw s GLN 88 CO 0.06 -0.26 0.00 -0.40 -0.55 0.00 0.00 175.29 174.15 1bbw n ASP 89 N 4.61 0.18 0.09 6.67 5.68 -0.69 0.13 116.55 133.22 1bbw n ASP 89 Ca -0.20 0.00 -0.08 0.00 -0.50 0.00 0.00 54.79 54.01 1bbw n ASP 89 Cb 0.49 0.00 -0.02 0.00 -1.14 0.00 0.00 41.12 40.45 1bbw n ASP 89 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 1bbw h VAL 90 N 0.00 1.53 -0.69 2.12 3.04 -1.99 -3.32 116.25 116.93 1bbw h VAL 90 Ca 0.00 -2.73 0.00 0.00 -1.01 0.00 0.00 66.70 62.96 1bbw h VAL 90 Cb 0.00 2.53 0.00 0.00 -2.01 0.00 0.00 31.29 31.81 1bbw h VAL 90 CO 0.00 0.79 0.00 0.61 -1.01 0.00 0.00 177.57 177.96 1bbw n GLY 91 N 0.94 2.60 0.00 3.17 0.00 -1.26 -5.08 105.19 105.56 1bbw n GLY 91 Ca -0.03 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.20 1bbw n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbw n GLY 92 N 1.43 0.51 3.21 -0.02 0.00 -1.25 -3.35 105.19 105.72 1bbw n GLY 92 Ca 0.24 -1.67 -0.26 0.00 0.00 0.00 0.00 46.02 44.33 1bbw n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bbw s ARG 93 N -1.35 1.55 -0.01 1.61 0.52 -1.26 -1.70 118.95 118.31 1bbw s ARG 93 Ca 0.00 -0.75 0.02 0.00 -0.52 0.00 0.00 55.73 54.48 1bbw s ARG 93 Cb 0.00 -1.53 0.00 0.00 0.52 0.00 0.00 34.95 33.95 1bbw s ARG 93 CO 0.00 0.41 -0.06 0.96 0.02 0.00 0.00 175.30 176.63 1bbw s ILE 94 N -0.53 0.50 0.12 1.52 -0.00 -0.88 -4.85 121.20 117.08 1bbw s ILE 94 Ca 0.07 -0.23 -0.20 0.00 -0.00 0.00 0.00 60.65 60.30 1bbw s ILE 94 Cb -0.08 -0.45 -0.07 0.00 -0.00 0.00 0.00 42.46 41.86 1bbw s ILE 94 CO -0.00 0.16 0.62 -1.10 -0.00 0.00 0.00 174.94 174.62 1bbw s GLN 95 N 0.09 4.24 -0.04 0.37 -0.21 -1.19 -1.47 119.66 121.45 1bbw s GLN 95 Ca -0.01 0.79 0.06 0.00 0.02 0.00 0.00 55.36 56.22 1bbw s GLN 95 Cb -0.05 -3.15 -0.01 0.00 1.00 0.00 0.00 33.01 30.80 1bbw s GLN 95 CO -0.00 0.57 -0.22 -0.51 -2.12 0.00 0.00 175.29 173.01 1bbw s LEU 96 N -1.36 2.02 -0.48 2.90 1.43 0.99 -1.22 118.68 122.97 1bbw s LEU 96 Ca 0.33 -0.44 -0.13 0.00 -1.03 0.00 0.00 54.13 52.86 1bbw s LEU 96 Cb -0.19 -1.20 0.10 0.00 0.03 0.00 0.00 46.19 44.93 1bbw s LEU 96 CO 0.20 0.23 0.39 -0.47 0.23 0.00 0.00 176.35 176.93 1bbw s TYR 97 N -0.24 3.30 -0.21 0.29 5.04 0.95 -1.90 117.35 124.59 1bbw s TYR 97 Ca 0.00 -1.36 -0.19 0.00 -2.44 0.00 0.00 57.07 53.09 1bbw s TYR 97 Cb -0.12 -3.38 -0.03 0.00 0.35 0.00 0.00 41.96 38.79 1bbw s TYR 97 CO 0.02 -0.91 0.54 0.08 -1.34 0.00 0.00 175.55 173.93 1bbw s VAL 98 N 1.52 5.08 -0.09 3.14 1.01 -0.36 -1.58 120.40 129.12 1bbw s VAL 98 Ca 0.04 0.99 -0.02 0.00 0.00 0.00 0.00 61.98 62.99 1bbw s VAL 98 Cb -0.26 -3.86 0.03 0.00 0.00 0.00 0.00 36.38 32.29 1bbw s VAL 98 CO 0.03 0.15 0.02 0.00 0.00 0.00 0.00 175.10 175.31 1bbw s ALA 99 N 1.77 0.64 0.33 5.51 0.00 -1.26 0.17 121.76 128.92 1bbw s ALA 99 Ca 0.25 -0.16 0.10 0.00 0.00 0.00 0.00 51.96 52.15 1bbw s ALA 99 Cb -0.15 -0.80 1.01 0.00 0.00 0.00 0.00 23.12 23.17 1bbw s ALA 99 CO 0.10 -0.61 1.59 -0.09 0.00 0.00 0.00 175.76 176.74 1bbw h ARG 100 N 8.34 0.04 0.03 0.00 2.43 -1.83 -1.00 114.38 122.39 1bbw h ARG 100 Ca -0.18 -0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.76 1bbw h ARG 100 Cb 1.12 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.65 1bbw h ARG 100 CO 0.25 0.02 -1.09 -0.44 -1.51 0.00 0.00 179.97 177.21 1bbw h ASP 101 N 0.04 0.11 1.26 -3.80 3.32 -1.93 -3.29 116.42 112.13 1bbw h ASP 101 Ca 0.70 -0.12 -0.13 0.00 0.02 0.00 0.00 57.03 57.50 1bbw h ASP 101 Cb 1.65 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 41.15 1bbw h ASP 101 CO -0.82 1.10 -0.63 0.44 -1.72 0.00 0.00 179.24 177.60 1bbw h ASP 102 N 0.02 0.00 -4.07 6.45 3.32 -1.67 -3.45 116.42 117.02 1bbw h ASP 102 Ca -0.05 0.00 -0.49 0.00 0.02 0.00 0.00 57.03 56.51 1bbw h ASP 102 Cb 1.83 0.00 0.03 0.00 0.22 0.00 0.00 39.33 41.41 1bbw h ASP 102 CO 0.15 0.63 0.30 -0.22 -1.72 0.00 0.00 179.24 178.38 1bbw s LEU 103 N -6.63 3.53 0.70 1.55 2.96 -0.46 -4.58 118.68 115.74 1bbw s LEU 103 Ca 0.03 1.34 -0.16 0.00 -0.22 0.00 0.00 54.13 55.11 1bbw s LEU 103 Cb 0.09 -4.31 0.00 0.00 0.50 0.00 0.00 46.19 42.47 1bbw s LEU 103 CO 0.76 -0.65 1.04 -2.65 -1.32 0.00 0.00 176.35 173.54 1bbw n PRO 104 N -2.03 0.63 -1.89 0.98 -0.02 -1.26 -4.88 135.00 126.53 1bbw n PRO 104 Ca 0.05 0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 61.38 1bbw n PRO 104 Cb 0.54 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.71 1bbw n PRO 104 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1bbw s GLU 105 N -3.34 4.19 0.00 -0.52 2.12 -1.26 -2.89 118.70 117.01 1bbw s GLU 105 Ca 0.75 2.43 0.00 0.00 0.36 0.00 0.00 54.97 58.52 1bbw s GLU 105 Cb -0.35 -3.10 0.00 0.00 0.26 0.00 0.00 34.13 30.94 1bbw s GLU 105 CO 0.48 -0.59 0.00 0.41 -0.54 0.00 0.00 175.26 175.02 1bbw n GLY 106 N 3.01 1.70 0.12 -1.50 0.00 -1.26 -4.89 105.19 102.38 1bbw n GLY 106 Ca 0.11 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.94 1bbw n GLY 106 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1bbw h VAL 107 N 0.00 0.91 -0.55 1.61 -1.51 -1.90 -2.58 116.25 112.24 1bbw h VAL 107 Ca 0.00 -2.59 -0.05 0.00 -1.23 0.00 0.00 66.70 62.84 1bbw h VAL 107 Cb 0.00 2.65 -0.03 0.00 -2.13 0.00 0.00 31.29 31.78 1bbw h VAL 107 CO 0.00 0.81 0.15 0.22 -1.23 0.00 0.00 177.57 177.52 1bbw h TYR 108 N 0.07 0.84 0.01 5.19 5.03 -1.87 0.32 116.97 126.56 1bbw h TYR 108 Ca -0.32 -0.07 -0.40 0.00 2.58 0.00 0.00 58.73 60.51 1bbw h TYR 108 Cb 2.04 -0.25 -0.06 0.00 1.55 0.00 0.00 36.73 40.01 1bbw h TYR 108 CO 0.07 0.69 -2.24 0.09 -1.32 0.00 0.00 178.16 175.46 1bbw n ASN 109 N -4.29 1.95 0.00 -2.11 3.02 -1.26 -2.83 115.26 109.74 1bbw n ASN 109 Ca 0.04 0.30 0.13 0.00 -0.03 0.00 0.00 54.58 55.02 1bbw n ASN 109 Cb 0.21 -0.81 0.62 0.00 -0.61 0.00 0.00 39.78 39.19 1bbw n ASN 109 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1bbw n GLU 110 N -4.15 0.19 0.00 3.52 4.71 -0.97 -4.31 120.64 119.63 1bbw n GLU 110 Ca -0.48 0.04 0.00 0.00 -0.01 0.00 0.00 57.16 56.71 1bbw n GLU 110 Cb 0.86 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.79 1bbw n GLU 110 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1bbw n GLN 111 N -1.40 0.00 -0.29 3.49 6.02 -0.47 -4.75 117.38 119.99 1bbw n GLN 111 Ca 0.09 0.00 0.13 0.00 -0.01 0.00 0.00 57.00 57.21 1bbw n GLN 111 Cb 0.26 0.00 0.25 0.00 1.02 0.00 0.00 30.24 31.77 1bbw n GLN 111 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1bbw n PHE 112 N -1.34 0.54 0.35 1.08 7.35 0.10 0.15 117.46 125.70 1bbw n PHE 112 Ca 0.00 1.00 0.14 0.00 -0.76 0.00 0.00 57.45 57.83 1bbw n PHE 112 Cb 0.00 -1.13 0.55 0.00 0.35 0.00 0.00 39.48 39.25 1bbw n PHE 112 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1bbw h LYS 113 N 0.00 0.00 -0.02 -4.13 1.79 -1.71 -2.66 116.57 109.83 1bbw h LYS 113 Ca 0.51 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.98 1bbw h LYS 113 Cb 1.05 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 1bbw h LYS 113 CO -0.77 0.00 -0.13 0.36 -1.08 0.00 0.00 179.45 177.82 1bbw n LYS 114 N -2.67 1.75 -2.44 3.15 -0.00 0.40 -4.93 118.16 113.43 1bbw n LYS 114 Ca 0.02 -1.32 -0.29 0.00 -0.00 0.00 0.00 58.31 56.72 1bbw n LYS 114 Cb 0.30 -1.47 -0.00 0.00 -0.00 0.00 0.00 35.03 33.85 1bbw n LYS 114 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1bbw s TRP 115 N -2.16 3.57 0.46 5.58 0.51 -1.00 -5.07 118.94 120.83 1bbw s TRP 115 Ca 0.28 0.99 0.06 0.00 -2.12 0.00 0.00 56.10 55.31 1bbw s TRP 115 Cb 0.20 -2.45 -0.02 0.00 -0.81 0.00 0.00 33.47 30.39 1bbw s TRP 115 CO 0.39 -0.38 0.26 -0.51 -0.51 0.00 0.00 176.95 176.20 1bbw s ASP 116 N -4.00 4.54 0.39 2.95 1.01 -1.26 -5.04 116.67 115.27 1bbw s ASP 116 Ca 0.50 -1.14 -0.24 0.00 0.71 0.00 0.00 52.55 52.38 1bbw s ASP 116 Cb -0.10 -0.12 -0.10 0.00 1.01 0.00 0.00 42.92 43.61 1bbw s ASP 116 CO 0.46 -0.76 1.00 -0.76 0.21 0.00 0.00 175.17 175.32 1bbw s LEU 117 N -4.05 4.12 0.00 1.23 1.43 -1.26 -3.33 118.68 116.82 1bbw s LEU 117 Ca 0.36 1.90 0.00 0.00 -1.03 0.00 0.00 54.13 55.36 1bbw s LEU 117 Cb 0.01 -4.25 0.00 0.00 0.03 0.00 0.00 46.19 41.98 1bbw s LEU 117 CO 0.21 -0.38 0.00 0.61 0.23 0.00 0.00 176.35 177.02 1bbw n GLY 118 N 0.13 3.36 3.77 -3.19 0.00 0.12 -4.62 105.19 104.75 1bbw n GLY 118 Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1bbw n GLY 118 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bbw s ASP 119 N -1.04 6.01 -0.28 1.61 1.11 -1.21 -4.41 116.67 118.46 1bbw s ASP 119 Ca 0.00 2.40 -0.18 0.00 0.18 0.00 0.00 52.55 54.95 1bbw s ASP 119 Cb 0.00 -2.61 -0.02 0.00 1.07 0.00 0.00 42.92 41.36 1bbw s ASP 119 CO 0.00 -1.03 0.53 -0.63 1.18 0.00 0.00 175.17 175.21 1bbw s ILE 120 N -1.49 5.05 0.28 0.77 -1.09 -0.16 -0.58 121.20 123.97 1bbw s ILE 120 Ca 0.65 0.81 0.10 0.00 -2.23 0.00 0.00 60.65 59.98 1bbw s ILE 120 Cb -0.31 -3.86 -0.05 0.00 -1.58 0.00 0.00 42.46 36.66 1bbw s ILE 120 CO 0.37 0.03 -0.15 -0.76 -1.23 0.00 0.00 174.94 173.20 1bbw s LEU 121 N 2.35 2.60 -0.02 2.97 1.43 0.39 -0.20 118.68 128.20 1bbw s LEU 121 Ca 0.21 -1.08 0.07 0.00 -1.03 0.00 0.00 54.13 52.30 1bbw s LEU 121 Cb -0.16 -0.94 -0.02 0.00 0.03 0.00 0.00 46.19 45.11 1bbw s LEU 121 CO 0.10 -0.09 -0.22 -0.83 0.23 0.00 0.00 176.35 175.54 1bbw s GLY 122 N -3.48 1.08 -0.05 -3.19 0.00 0.37 -1.09 107.32 100.95 1bbw s GLY 122 Ca 0.29 -0.95 -0.03 0.00 0.00 0.00 0.00 44.72 44.03 1bbw s GLY 122 CO 0.13 -0.77 0.13 0.00 0.00 0.00 0.00 173.10 172.58 1bbw s ALA 123 N -0.49 -0.27 -0.05 3.20 0.00 0.01 -0.29 121.76 123.87 1bbw s ALA 123 Ca 0.08 0.47 0.04 0.00 0.00 0.00 0.00 51.96 52.55 1bbw s ALA 123 Cb -0.09 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1bbw s ALA 123 CO -0.01 -0.10 -0.16 0.15 0.00 0.00 0.00 175.76 175.64 1bbw s LYS 124 N 0.55 1.83 0.00 0.00 1.02 -0.02 -1.12 119.74 122.00 1bbw s LYS 124 Ca -0.04 -0.58 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1bbw s LYS 124 Cb -0.06 -1.55 0.00 0.00 -0.52 0.00 0.00 37.83 35.70 1bbw s LYS 124 CO -0.02 0.19 0.00 0.41 -0.92 0.00 0.00 175.35 175.00 1bbw n GLY 125 N 3.33 -0.48 3.74 -3.33 0.00 -0.93 -1.39 105.19 106.13 1bbw n GLY 125 Ca -0.19 -1.00 -0.40 0.00 0.00 0.00 0.00 46.02 44.43 1bbw n GLY 125 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bbw s LYS 126 N -2.00 4.65 0.28 1.61 1.02 -0.71 -1.44 119.74 123.15 1bbw s LYS 126 Ca 0.00 1.31 -0.18 0.00 0.02 0.00 0.00 55.97 57.12 1bbw s LYS 126 Cb 0.00 -3.34 -0.09 0.00 -0.52 0.00 0.00 37.83 33.88 1bbw s LYS 126 CO 0.00 0.33 0.76 -0.51 -0.92 0.00 0.00 175.35 175.01 1bbw s LEU 127 N -0.36 4.20 0.00 3.17 1.02 -0.95 0.29 118.68 126.05 1bbw s LEU 127 Ca 0.42 1.41 0.00 0.00 0.02 0.00 0.00 54.13 55.99 1bbw s LEU 127 Cb -0.23 -3.89 0.00 0.00 0.02 0.00 0.00 46.19 42.10 1bbw s LEU 127 CO 0.28 -0.10 0.00 2.22 0.02 0.00 0.00 176.35 178.77 1bbw n PHE 128 N 0.18 -0.80 -4.33 0.29 -1.74 1.00 -4.84 117.46 107.22 1bbw n PHE 128 Ca 0.01 0.00 -0.19 0.00 -0.56 0.00 0.00 57.45 56.71 1bbw n PHE 128 Cb 0.52 0.00 -0.15 0.00 1.52 0.00 0.00 39.48 41.37 1bbw n PHE 128 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 1bbw s LYS 129 N -1.85 0.79 0.41 3.97 1.02 -1.26 0.15 119.74 122.97 1bbw s LYS 129 Ca 0.00 -0.28 -0.05 0.00 0.02 0.00 0.00 55.97 55.67 1bbw s LYS 129 Cb 0.00 -0.76 0.09 0.00 -0.52 0.00 0.00 37.83 36.65 1bbw s LYS 129 CO 0.00 0.12 0.56 0.25 -0.92 0.00 0.00 175.35 175.37 1bbw n THR 130 N 3.16 0.00 -0.10 2.17 -2.24 -0.92 -4.93 114.28 111.42 1bbw n THR 130 Ca -0.16 -0.56 -0.09 0.00 -2.27 0.00 0.00 64.05 60.96 1bbw n THR 130 Cb 0.55 -1.54 -0.02 0.00 -2.10 0.00 0.00 70.33 67.23 1bbw n THR 130 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1bbw h LYS 131 N 0.00 0.45 0.00 -0.78 -0.00 -2.02 -2.79 116.57 111.43 1bbw h LYS 131 Ca -0.18 -0.06 0.00 0.00 -0.00 0.00 0.00 60.65 60.41 1bbw h LYS 131 Cb 0.56 -0.09 0.00 0.00 -0.00 0.00 0.00 32.23 32.70 1bbw h LYS 131 CO 0.15 0.39 0.00 0.25 -0.00 0.00 0.00 179.45 180.24 1bbw n THR 132 N -4.79 0.24 -0.18 0.07 -2.24 -1.26 -4.90 114.28 101.23 1bbw n THR 132 Ca -0.01 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1bbw n THR 132 Cb 0.08 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 67.58 1bbw n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bbw n GLY 133 N 0.34 0.84 3.88 3.38 0.00 -1.05 -5.09 105.19 107.49 1bbw n GLY 133 Ca 0.12 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 1bbw n GLY 133 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bbw s GLU 134 N -0.82 3.60 0.36 1.61 2.02 -1.26 -4.87 118.70 119.34 1bbw s GLU 134 Ca 0.00 -0.01 -0.26 0.00 0.02 0.00 0.00 54.97 54.72 1bbw s GLU 134 Cb 0.00 -3.12 -0.09 0.00 0.10 0.00 0.00 34.13 31.02 1bbw s GLU 134 CO 0.00 0.68 1.14 -0.48 0.02 0.00 0.00 175.26 176.62 1bbw s LEU 135 N -1.50 4.30 0.22 1.80 0.05 -1.26 -2.17 118.68 120.12 1bbw s LEU 135 Ca 0.24 2.29 -0.07 0.00 0.05 0.00 0.00 54.13 56.64 1bbw s LEU 135 Cb -0.13 -3.91 -0.02 0.00 -2.05 0.00 0.00 46.19 40.07 1bbw s LEU 135 CO 0.13 -0.48 0.31 -0.44 -0.55 0.00 0.00 176.35 175.33 1bbw s SER 136 N -1.09 0.02 -0.19 1.48 0.01 0.12 -3.15 113.70 110.90 1bbw s SER 136 Ca 0.53 -1.13 0.01 0.00 1.31 0.00 0.00 55.95 56.66 1bbw s SER 136 Cb -0.30 0.49 0.04 0.00 0.21 0.00 0.00 66.02 66.45 1bbw s SER 136 CO 0.38 -0.99 -0.12 -0.63 0.41 0.00 0.00 173.24 172.29 1bbw s ILE 137 N -4.08 1.69 -0.34 1.44 1.01 -0.36 -0.00 121.20 120.56 1bbw s ILE 137 Ca 0.30 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.68 1bbw s ILE 137 Cb 0.03 -1.72 -0.00 0.00 0.01 0.00 0.00 42.46 40.78 1bbw s ILE 137 CO 0.10 0.23 1.47 -2.28 0.00 0.00 0.00 174.94 174.45 1bbw s HIS 138 N 1.39 2.35 -0.33 3.97 5.65 0.14 -0.03 115.29 128.43 1bbw s HIS 138 Ca -0.00 0.69 -0.28 0.00 0.25 0.00 0.00 55.06 55.72 1bbw s HIS 138 Cb -0.16 -4.14 0.01 0.00 -1.18 0.00 0.00 32.58 27.12 1bbw s HIS 138 CO -0.09 -2.19 1.01 0.00 -0.65 0.00 0.00 174.74 172.81 1bbw n THR 140 N 5.83 0.03 -3.76 0.00 -2.24 -0.49 -4.12 114.28 109.54 1bbw n THR 140 Ca 0.10 -0.06 -0.13 0.00 -2.27 0.00 0.00 64.05 61.69 1bbw n THR 140 Cb 0.47 0.59 -0.12 0.00 -2.10 0.00 0.00 70.33 69.18 1bbw n THR 140 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1bbw s GLU 141 N -3.05 0.30 -0.28 -0.78 2.12 -0.50 -4.27 118.70 112.25 1bbw s GLU 141 Ca 0.08 0.45 -0.19 0.00 0.36 0.00 0.00 54.97 55.67 1bbw s GLU 141 Cb 0.16 0.08 0.08 0.00 0.26 0.00 0.00 34.13 34.71 1bbw s GLU 141 CO 0.81 -0.07 0.71 -1.17 -0.54 0.00 0.00 175.26 174.99 1bbw s LEU 142 N 0.48 -0.88 0.16 2.70 2.96 -1.26 -0.84 118.68 122.00 1bbw s LEU 142 Ca -0.03 1.48 -0.21 0.00 -0.22 0.00 0.00 54.13 55.15 1bbw s LEU 142 Cb -0.04 2.39 0.06 0.00 0.50 0.00 0.00 46.19 49.10 1bbw s LEU 142 CO -0.02 -0.24 0.56 0.00 -1.32 0.00 0.00 176.35 175.32 1bbw s ARG 143 N 1.26 1.27 0.04 1.98 1.70 0.60 -4.98 118.95 120.82 1bbw s ARG 143 Ca -0.07 -0.58 -0.30 0.00 -0.47 0.00 0.00 55.73 54.31 1bbw s ARG 143 Cb -0.05 0.56 -0.04 0.00 -0.57 0.00 0.00 34.95 34.85 1bbw s ARG 143 CO -0.14 -0.54 1.02 -1.17 -1.08 0.00 0.00 175.30 173.39 1bbw s LEU 144 N -2.78 4.40 -0.17 -1.89 2.96 -1.26 -0.48 118.68 119.46 1bbw s LEU 144 Ca 0.03 1.77 -0.10 0.00 -0.22 0.00 0.00 54.13 55.60 1bbw s LEU 144 Cb -0.01 -3.58 -0.07 0.00 0.50 0.00 0.00 46.19 43.03 1bbw s LEU 144 CO -0.11 -0.26 -0.25 0.18 -1.32 0.00 0.00 176.35 174.60 1bbw n LEU 145 N 3.62 1.43 -3.88 -0.68 4.77 0.72 -4.82 117.00 118.15 1bbw n LEU 145 Ca 0.06 0.24 -0.20 0.00 -0.03 0.00 0.00 56.01 56.08 1bbw n LEU 145 Cb 0.50 -0.57 -0.16 0.00 -2.33 0.00 0.00 43.42 40.85 1bbw n LEU 145 CO 0.52 0.20 -0.40 -0.89 -1.33 0.00 0.00 177.39 175.49 1bbw s THR 146 N -2.42 0.49 -0.22 -5.08 2.01 -0.90 -3.89 115.64 105.64 1bbw s THR 146 Ca -0.25 -0.09 -0.29 0.00 0.31 0.00 0.00 61.69 61.37 1bbw s THR 146 Cb 0.08 -0.53 0.01 0.00 0.01 0.00 0.00 72.50 72.07 1bbw s THR 146 CO 0.33 0.22 1.05 -0.75 -0.69 0.00 0.00 174.62 174.77 1bbw s LYS 147 N 0.97 4.27 -0.85 4.92 2.47 -1.26 -0.99 119.74 129.27 1bbw s LYS 147 Ca -0.10 1.38 -0.25 0.00 -1.56 0.00 0.00 55.97 55.43 1bbw s LYS 147 Cb -0.14 -3.64 0.01 0.00 -1.46 0.00 0.00 37.83 32.61 1bbw s LYS 147 CO -0.00 -0.61 1.56 0.00 0.16 0.00 0.00 175.35 176.46 1bbw s ALA 148 N 3.12 2.44 0.50 3.13 0.00 -1.26 -4.85 121.76 124.83 1bbw s ALA 148 Ca 0.45 -1.61 0.24 0.00 0.00 0.00 0.00 51.96 51.04 1bbw s ALA 148 Cb -0.16 -4.42 1.32 0.00 0.00 0.00 0.00 23.12 19.86 1bbw s ALA 148 CO 0.07 -3.80 1.94 -0.07 0.00 0.00 0.00 175.76 173.91 1bbw h LEU 149 N 14.41 0.12 -9.07 0.00 3.38 -1.93 -3.42 115.31 118.79 1bbw h LEU 149 Ca -0.03 0.01 -0.68 0.00 0.09 0.00 0.00 57.88 57.27 1bbw h LEU 149 Cb 1.04 -0.01 -0.19 0.00 0.09 0.00 0.00 40.66 41.59 1bbw h LEU 149 CO 1.31 0.06 -0.81 -0.13 0.09 0.00 0.00 178.44 178.96 1bbw s ARG 150 N -5.12 1.77 0.97 1.13 0.52 -1.26 -4.61 118.95 112.34 1bbw s ARG 150 Ca -0.06 -1.18 -0.12 0.00 -0.52 0.00 0.00 55.73 53.85 1bbw s ARG 150 Cb 0.21 -2.10 0.17 0.00 0.52 0.00 0.00 34.95 33.74 1bbw s ARG 150 CO 0.75 0.48 1.10 -2.14 0.02 0.00 0.00 175.30 175.51 1bbw s PRO 151 N -2.09 0.70 1.27 3.54 0.02 -1.26 -4.96 135.00 132.22 1bbw s PRO 151 Ca 0.17 0.57 -0.18 0.00 0.02 0.00 0.00 61.00 61.59 1bbw s PRO 151 Cb -0.11 -1.76 0.29 0.00 0.02 0.00 0.00 34.50 32.95 1bbw s PRO 151 CO 0.09 -2.56 0.76 1.28 -0.33 0.00 0.00 177.00 176.24 1bbw n LEU 152 N -4.07 -1.39 0.00 -5.54 4.77 -1.26 -5.07 117.00 104.44 1bbw n LEU 152 Ca 0.06 -0.45 -0.16 0.00 -0.03 0.00 0.00 56.01 55.42 1bbw n LEU 152 Cb 0.57 -1.08 0.16 0.00 -2.33 0.00 0.00 43.42 40.74 1bbw n LEU 152 CO 0.57 -3.77 0.19 -0.81 -1.33 0.00 0.00 177.39 172.24 1bbw n PRO 153 N -4.61 -2.97 0.00 3.23 -0.04 -1.26 -5.16 135.00 124.19 1bbw n PRO 153 Ca 0.06 -0.78 0.00 0.00 -0.04 0.00 0.00 63.50 62.74 1bbw n PRO 153 Cb 0.56 -1.12 0.00 0.00 -0.04 0.00 0.00 33.50 32.90 1bbw n PRO 153 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1bbw n ASP 161 N -3.80 -0.13 -1.42 3.54 2.03 -1.26 -5.14 116.55 110.36 1bbw n ASP 161 Ca 0.07 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.38 1bbw n ASP 161 Cb 0.32 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.72 1bbw n ASP 161 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1bbw n GLN 162 N -0.13 0.92 -0.00 -0.67 0.00 -1.26 -2.99 117.38 113.24 1bbw n GLN 162 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 57.00 57.04 1bbw n GLN 162 Cb 0.00 -1.04 -0.06 0.00 0.00 0.00 0.00 30.24 29.15 1bbw n GLN 162 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 1bbw n GLU 163 N 1.33 3.22 0.17 2.61 1.02 -1.26 -4.19 120.64 123.53 1bbw n GLU 163 Ca 0.00 -0.02 0.02 0.00 -0.02 0.00 0.00 57.16 57.14 1bbw n GLU 163 Cb 0.46 -0.99 0.28 0.00 -0.02 0.00 0.00 31.44 31.17 1bbw n GLU 163 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bbw h ALA 164 N 1.19 1.13 0.00 0.62 0.00 -1.97 -1.58 119.26 118.65 1bbw h ALA 164 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1bbw h ALA 164 Cb 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1bbw h ALA 164 CO 0.00 0.60 0.04 2.89 0.00 0.00 0.00 179.25 182.78 1bbw n ARG 165 N -3.86 0.13 -0.06 0.00 -4.01 -1.26 -1.70 116.66 105.89 1bbw n ARG 165 Ca -0.01 0.62 -0.07 0.00 -1.04 0.00 0.00 57.85 57.35 1bbw n ARG 165 Cb 0.51 -1.96 -0.07 0.00 -3.04 0.00 0.00 32.46 27.90 1bbw n ARG 165 CO 0.00 0.00 0.00 0.66 -3.04 0.00 0.00 177.63 175.25 1bbw n TYR 166 N -2.20 0.00 0.23 2.89 4.01 -0.76 -4.14 117.16 117.18 1bbw n TYR 166 Ca -0.01 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.81 1bbw n TYR 166 Cb 0.07 -0.52 0.54 0.00 -0.31 0.00 0.00 39.34 39.12 1bbw n TYR 166 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bbw h ARG 167 N 0.00 0.00 -1.80 -0.72 3.08 -0.42 -3.31 114.38 111.21 1bbw h ARG 167 Ca -0.30 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.30 1bbw h ARG 167 Cb 1.56 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 31.23 1bbw h ARG 167 CO -0.02 0.23 -1.14 1.04 -1.07 0.00 0.00 179.97 179.01 1bbw n GLN 168 N -3.79 0.98 -0.67 0.04 6.02 -0.85 -4.97 117.38 114.14 1bbw n GLN 168 Ca -0.02 -3.25 0.51 0.00 -0.01 0.00 0.00 57.00 54.23 1bbw n GLN 168 Cb 0.33 -1.63 0.79 0.00 1.02 0.00 0.00 30.24 30.75 1bbw n GLN 168 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 1bbw n ARG 169 N 0.27 -0.01 0.01 -1.09 3.00 -1.25 0.49 116.66 118.08 1bbw n ARG 169 Ca 0.23 1.12 -0.11 0.00 -0.00 0.00 0.00 57.85 59.08 1bbw n ARG 169 Cb 0.67 -2.49 -0.06 0.00 0.00 0.00 0.00 32.46 30.58 1bbw n ARG 169 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.63 177.73 1bbw h TYR 170 N 0.00 0.09 -0.97 -0.14 -0.00 -1.93 0.42 116.97 114.44 1bbw h TYR 170 Ca 0.93 0.00 0.07 0.00 -0.00 0.00 0.00 58.73 59.73 1bbw h TYR 170 Cb 3.60 -0.03 -0.07 0.00 -0.00 0.00 0.00 36.73 40.23 1bbw h TYR 170 CO -0.00 0.06 0.62 -0.07 -0.00 0.00 0.00 178.16 178.77 1bbw h LEU 171 N 0.09 0.98 -0.35 0.10 3.38 -0.36 -0.78 115.31 118.37 1bbw h LEU 171 Ca 0.03 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1bbw h LEU 171 Cb -0.01 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1bbw h LEU 171 CO -0.01 0.62 0.17 -0.78 0.09 0.00 0.00 178.44 178.53 1bbw h ASP 172 N 1.11 0.45 0.46 -0.43 1.82 -1.08 -1.92 116.42 116.85 1bbw h ASP 172 Ca 0.43 -0.12 -0.04 0.00 -0.39 0.00 0.00 57.03 56.91 1bbw h ASP 172 Cb 0.20 -0.12 -0.01 0.00 0.68 0.00 0.00 39.33 40.09 1bbw h ASP 172 CO -0.18 0.45 -0.18 -0.07 -1.61 0.00 0.00 179.24 177.65 1bbw h LEU 173 N 0.43 0.00 -0.06 2.28 3.38 0.12 0.39 115.31 121.85 1bbw h LEU 173 Ca 0.12 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.95 1bbw h LEU 173 Cb 0.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.87 1bbw h LEU 173 CO -0.02 0.18 -0.50 0.40 0.09 0.00 0.00 178.44 178.60 1bbw h ILE 174 N 0.00 1.41 0.08 1.22 2.04 -0.77 -3.40 117.51 118.09 1bbw h ILE 174 Ca -0.00 -1.90 -0.00 0.00 1.00 0.00 0.00 64.86 63.95 1bbw h ILE 174 Cb 0.46 2.39 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 1bbw h ILE 174 CO 0.02 0.56 -0.04 0.28 0.00 0.00 0.00 178.15 178.97 1bbw h SER 175 N -0.03 -0.09 -3.16 1.72 0.02 -1.02 -3.46 113.55 107.53 1bbw h SER 175 Ca -0.05 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.33 1bbw h SER 175 Cb 1.17 0.02 -0.07 0.00 0.14 0.00 0.00 62.40 63.67 1bbw h SER 175 CO 0.10 0.35 0.76 0.20 -1.14 0.00 0.00 176.83 177.10 1bbw s ASN 176 N -5.19 7.02 0.46 3.07 0.01 0.10 -4.90 114.94 115.51 1bbw s ASN 176 Ca -0.02 1.25 0.25 0.00 -0.71 0.00 0.00 52.86 53.64 1bbw s ASN 176 Cb 0.00 -2.52 0.58 0.00 0.41 0.00 0.00 41.25 39.71 1bbw s ASN 176 CO 0.05 -0.69 1.70 0.44 -1.51 0.00 0.00 177.10 177.08 1bbw h ASP 177 N 7.63 0.00 0.71 -1.22 5.19 -1.86 -3.10 116.42 123.76 1bbw h ASP 177 Ca -0.20 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.18 1bbw h ASP 177 Cb 1.07 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.57 1bbw h ASP 177 CO 0.97 0.00 -0.49 -0.33 -3.12 0.00 0.00 179.24 176.28 1bbw h GLU 178 N 0.00 -1.09 0.18 3.56 5.08 -1.95 -2.10 114.58 118.26 1bbw h GLU 178 Ca 0.00 0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1bbw h GLU 178 Cb 0.89 0.25 -0.03 0.00 0.50 0.00 0.00 28.75 30.36 1bbw h GLU 178 CO 0.00 -0.73 -0.27 0.77 -1.00 0.00 0.00 179.01 177.78 1bbw h SER 179 N -1.13 -0.76 -0.36 1.42 0.02 -1.90 0.20 113.55 111.03 1bbw h SER 179 Ca -0.09 0.08 0.11 0.00 -0.84 0.00 0.00 61.79 61.04 1bbw h SER 179 Cb 0.93 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 1bbw h SER 179 CO 0.06 -0.37 0.41 0.03 -1.14 0.00 0.00 176.83 175.82 1bbw h ARG 180 N -0.52 0.00 0.16 3.45 3.08 -1.53 0.60 114.38 119.62 1bbw h ARG 180 Ca 0.01 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.76 1bbw h ARG 180 Cb 0.52 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.58 1bbw h ARG 180 CO -0.12 0.00 -1.50 -0.91 -1.07 0.00 0.00 179.97 176.38 1bbw h ASN 181 N 0.00 0.53 0.07 7.04 2.35 -0.48 -2.71 115.58 122.38 1bbw h ASN 181 Ca 0.17 -0.90 0.00 0.00 -0.55 0.00 0.00 56.30 55.02 1bbw h ASN 181 Cb 1.00 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 1bbw h ASN 181 CO -0.00 1.68 -0.15 0.74 -1.65 0.00 0.00 177.43 178.05 1bbw h THR 182 N -0.11 0.00 -0.74 2.81 2.02 0.10 -1.62 112.91 115.37 1bbw h THR 182 Ca -0.30 0.00 0.09 0.00 0.77 0.00 0.00 66.41 66.97 1bbw h THR 182 Cb 1.92 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 68.26 1bbw h THR 182 CO 0.13 0.00 0.39 -0.26 0.37 0.00 0.00 175.52 176.15 1bbw h PHE 183 N -0.24 0.70 -0.83 3.16 0.04 -1.37 0.17 116.94 118.57 1bbw h PHE 183 Ca -0.01 0.03 0.13 0.00 2.80 0.00 0.00 57.97 60.92 1bbw h PHE 183 Cb 0.23 -0.20 -0.06 0.00 2.20 0.00 0.00 35.95 38.11 1bbw h PHE 183 CO -0.27 0.26 0.54 0.87 -0.60 0.00 0.00 178.31 179.12 1bbw h LYS 184 N 0.66 0.62 0.07 1.51 6.56 -1.34 0.34 116.57 124.98 1bbw h LYS 184 Ca 0.36 -0.04 -0.25 0.00 -1.06 0.00 0.00 60.65 59.67 1bbw h LYS 184 Cb 0.37 -0.14 -0.01 0.00 -0.57 0.00 0.00 32.23 31.87 1bbw h LYS 184 CO -0.26 0.41 -1.15 0.28 -2.06 0.00 0.00 179.45 176.67 1bbw h VAL 185 N 0.64 1.58 -0.77 0.50 2.07 0.21 -2.90 116.25 117.56 1bbw h VAL 185 Ca 0.41 -3.22 0.12 0.00 0.82 0.00 0.00 66.70 64.83 1bbw h VAL 185 Cb 0.67 2.88 -0.08 0.00 -1.52 0.00 0.00 31.29 33.24 1bbw h VAL 185 CO -0.17 0.92 0.38 -0.09 0.02 0.00 0.00 177.57 178.64 1bbw h ARG 186 N 0.04 0.58 0.16 1.57 2.43 0.14 0.18 114.38 119.48 1bbw h ARG 186 Ca -0.08 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 1bbw h ARG 186 Cb 1.88 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 31.30 1bbw h ARG 186 CO 0.17 0.38 -0.08 0.77 -1.51 0.00 0.00 179.97 179.70 1bbw h SER 187 N 0.60 -0.19 -1.02 -3.80 0.02 -1.48 -2.08 113.55 105.61 1bbw h SER 187 Ca 0.40 -0.16 0.25 0.00 -0.84 0.00 0.00 61.79 61.45 1bbw h SER 187 Cb 0.51 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 63.01 1bbw h SER 187 CO -0.32 0.05 0.66 -0.61 -1.14 0.00 0.00 176.83 175.47 1bbw h GLN 188 N -0.43 0.40 0.23 3.45 4.15 -0.91 -1.14 115.11 120.86 1bbw h GLN 188 Ca -0.02 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 1bbw h GLN 188 Cb 0.33 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.93 1bbw h GLN 188 CO 0.04 0.26 -0.11 0.82 -1.93 0.00 0.00 178.83 177.91 1bbw h ILE 189 N 0.41 0.75 -0.26 2.39 2.04 -0.42 -2.37 117.51 120.05 1bbw h ILE 189 Ca 0.57 -0.90 0.06 0.00 1.00 0.00 0.00 64.86 65.60 1bbw h ILE 189 Cb 1.43 1.19 -0.07 0.00 -0.74 0.00 0.00 36.82 38.63 1bbw h ILE 189 CO -0.28 0.17 -0.20 -0.07 0.00 0.00 0.00 178.15 177.77 1bbw h LEU 190 N -0.83 -0.65 -1.73 1.44 3.38 -0.55 0.49 115.31 116.87 1bbw h LEU 190 Ca -0.03 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 1bbw h LEU 190 Cb 0.51 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1bbw h LEU 190 CO 0.05 -0.24 -0.17 0.77 0.09 0.00 0.00 178.44 178.94 1bbw h SER 191 N -0.19 0.00 -0.03 -0.43 4.64 -1.42 -1.49 113.55 114.63 1bbw h SER 191 Ca 0.14 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1bbw h SER 191 Cb 0.41 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1bbw h SER 191 CO -0.37 0.17 0.00 1.23 -0.87 0.00 0.00 176.83 176.99 1bbw h GLY 192 N 0.93 0.05 0.62 -0.77 0.00 0.35 -2.38 103.07 101.88 1bbw h GLY 192 Ca -0.00 -0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.32 1bbw h GLY 192 CO 0.02 0.04 -0.07 -2.22 0.00 0.00 0.00 176.54 174.31 1bbw h ILE 193 N -0.25 0.77 -0.27 2.60 2.04 0.18 -1.68 117.51 120.90 1bbw h ILE 193 Ca 0.01 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.93 1bbw h ILE 193 Cb 0.32 0.77 -0.08 0.00 -0.74 0.00 0.00 36.82 37.09 1bbw h ILE 193 CO 0.00 0.00 -0.30 0.03 0.00 0.00 0.00 178.15 177.88 1bbw h ARG 194 N -0.06 -0.29 -0.15 2.37 3.08 -1.26 -1.43 114.38 116.65 1bbw h ARG 194 Ca 0.08 0.02 -0.10 0.00 0.07 0.00 0.00 59.98 60.06 1bbw h ARG 194 Cb 0.18 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1bbw h ARG 194 CO -0.19 -0.19 -0.32 0.37 -1.07 0.00 0.00 179.97 178.57 1bbw h GLN 195 N -0.30 0.31 -0.13 0.04 4.15 -1.30 0.94 115.11 118.82 1bbw h GLN 195 Ca 0.14 -0.12 -0.00 0.00 0.77 0.00 0.00 58.65 59.43 1bbw h GLN 195 Cb 0.52 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.19 1bbw h GLN 195 CO -0.44 0.60 0.07 0.35 -1.93 0.00 0.00 178.83 177.48 1bbw h PHE 196 N 0.27 0.19 -0.44 3.99 3.57 -0.76 -0.40 116.94 123.35 1bbw h PHE 196 Ca 0.03 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 1bbw h PHE 196 Cb 0.71 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.37 1bbw h PHE 196 CO 0.02 0.23 0.01 0.52 -2.23 0.00 0.00 178.31 176.85 1bbw h MET 197 N 0.09 0.76 -0.25 1.11 2.86 -1.01 -2.71 114.93 115.79 1bbw h MET 197 Ca 0.05 -0.24 -0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1bbw h MET 197 Cb 0.11 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 1bbw h MET 197 CO -0.01 0.83 0.15 0.28 1.06 0.00 0.00 176.91 179.22 1bbw h VAL 198 N 0.61 1.07 -0.35 -2.22 2.07 -0.62 -1.02 116.25 115.79 1bbw h VAL 198 Ca 0.12 -0.15 -0.05 0.00 0.82 0.00 0.00 66.70 67.44 1bbw h VAL 198 Cb 0.48 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 1bbw h VAL 198 CO 0.02 0.07 -0.01 0.78 0.02 0.00 0.00 177.57 178.45 1bbw h ASN 199 N 0.33 0.52 -0.52 0.57 2.35 -0.74 -2.58 115.58 115.51 1bbw h ASN 199 Ca 0.09 -0.10 -0.33 0.00 -0.55 0.00 0.00 56.30 55.41 1bbw h ASN 199 Cb -0.02 -0.14 -0.15 0.00 0.05 0.00 0.00 38.32 38.06 1bbw h ASN 199 CO -0.02 0.60 0.42 0.54 -1.65 0.00 0.00 177.43 177.32 1bbw n ARG 200 N -4.26 1.80 -3.51 0.81 1.74 -0.41 -4.86 116.66 107.96 1bbw n ARG 200 Ca 0.01 -1.66 -0.24 0.00 -0.77 0.00 0.00 57.85 55.20 1bbw n ARG 200 Cb 0.26 -1.65 0.07 0.00 -1.02 0.00 0.00 32.46 30.12 1bbw n ARG 200 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bbw n GLY 201 N 0.06 -0.54 3.78 -0.13 0.00 -0.97 -5.01 105.19 102.39 1bbw n GLY 201 Ca 0.32 0.23 -0.30 0.00 0.00 0.00 0.00 46.02 46.27 1bbw n GLY 201 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bbw s PHE 202 N -3.29 3.20 -0.14 1.61 0.40 -1.04 -4.71 117.98 114.01 1bbw s PHE 202 Ca 0.54 0.07 0.01 0.00 -0.60 0.00 0.00 56.93 56.95 1bbw s PHE 202 Cb -0.24 -1.61 0.02 0.00 0.51 0.00 0.00 43.02 41.70 1bbw s PHE 202 CO 0.67 0.52 -0.16 0.00 0.70 0.00 0.00 175.22 176.95 1bbw s MET 203 N -2.51 2.43 0.50 0.44 0.23 -0.08 -4.44 119.30 115.88 1bbw s MET 203 Ca 0.30 -0.62 -0.19 0.00 -1.03 0.00 0.00 55.69 54.14 1bbw s MET 203 Cb -0.12 -2.14 -0.08 0.00 -1.53 0.00 0.00 34.83 30.97 1bbw s MET 203 CO 0.22 -0.17 1.04 -2.00 -2.03 0.00 0.00 175.02 172.09 1bbw s GLU 204 N 1.26 3.71 0.12 3.16 2.12 -1.26 -2.33 118.70 125.49 1bbw s GLU 204 Ca 0.01 1.34 -0.05 0.00 0.36 0.00 0.00 54.97 56.62 1bbw s GLU 204 Cb -0.14 -2.08 -0.02 0.00 0.26 0.00 0.00 34.13 32.15 1bbw s GLU 204 CO -0.08 -0.50 0.15 0.14 -0.54 0.00 0.00 175.26 174.43 1bbw s VAL 205 N -2.05 0.12 -0.20 3.70 -7.23 -0.46 -4.88 120.40 109.40 1bbw s VAL 205 Ca 0.67 -1.55 0.01 0.00 -1.81 0.00 0.00 61.98 59.30 1bbw s VAL 205 Cb -0.16 -1.73 0.03 0.00 0.56 0.00 0.00 36.38 35.08 1bbw s VAL 205 CO 0.23 -0.54 -0.16 -1.61 -0.31 0.00 0.00 175.10 172.71 1bbw s GLU 206 N -3.96 2.65 0.42 4.82 2.02 -1.26 -4.60 118.70 118.79 1bbw s GLU 206 Ca 0.15 -0.93 0.08 0.00 0.02 0.00 0.00 54.97 54.28 1bbw s GLU 206 Cb 0.06 -2.59 -0.03 0.00 0.10 0.00 0.00 34.13 31.66 1bbw s GLU 206 CO -0.04 -0.32 0.32 0.95 0.02 0.00 0.00 175.26 176.19 1bbw s THR 207 N 1.27 2.53 0.72 3.63 -4.23 -1.26 -5.10 115.64 113.20 1bbw s THR 207 Ca 0.01 -1.45 -0.16 0.00 -1.18 0.00 0.00 61.69 58.90 1bbw s THR 207 Cb -0.15 -2.98 -0.05 0.00 1.34 0.00 0.00 72.50 70.66 1bbw s THR 207 CO -0.10 0.00 0.39 -2.65 -0.54 0.00 0.00 174.62 171.72 1bbw n PRO 208 N -1.46 0.24 -0.01 3.99 -0.02 -1.26 -4.94 135.00 131.55 1bbw n PRO 208 Ca 0.02 0.12 0.07 0.00 -2.02 0.00 0.00 63.50 61.69 1bbw n PRO 208 Cb 0.63 -1.70 -0.11 0.00 -0.02 0.00 0.00 33.50 32.30 1bbw n PRO 208 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1bbw n MET 209 N -0.36 0.43 -4.60 -0.52 2.81 -1.26 -4.88 117.12 108.75 1bbw n MET 209 Ca 0.09 -0.12 -0.33 0.00 -1.81 0.00 0.00 57.70 55.53 1bbw n MET 209 Cb 0.50 -1.33 -0.16 0.00 -0.71 0.00 0.00 33.22 31.53 1bbw n MET 209 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1bbw s MET 210 N -2.95 3.12 0.34 0.03 -1.94 -1.25 -0.20 119.30 116.45 1bbw s MET 210 Ca -0.05 -0.80 0.07 0.00 -1.71 0.00 0.00 55.69 53.20 1bbw s MET 210 Cb 0.09 -2.53 -0.07 0.00 2.01 0.00 0.00 34.83 34.33 1bbw s MET 210 CO 0.57 0.00 -0.03 -0.65 -0.01 0.00 0.00 175.02 174.90 1bbw s GLN 211 N 0.82 1.77 0.03 2.03 -0.21 0.16 -4.87 119.66 119.38 1bbw s GLN 211 Ca -0.06 -1.95 0.23 0.00 0.02 0.00 0.00 55.36 53.60 1bbw s GLN 211 Cb -0.15 -1.42 0.02 0.00 1.00 0.00 0.00 33.01 32.46 1bbw s GLN 211 CO -0.01 0.01 1.02 0.28 -2.12 0.00 0.00 175.29 174.47 1bbw n VAL 212 N -0.77 0.10 -3.80 1.09 0.31 -1.26 0.09 118.33 114.08 1bbw n VAL 212 Ca -0.05 -0.17 -0.13 0.00 -0.01 0.00 0.00 64.34 63.98 1bbw n VAL 212 Cb 0.65 0.38 -0.14 0.00 -0.91 0.00 0.00 33.84 33.82 1bbw n VAL 212 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1bbw s ILE 213 N -3.14 -0.03 0.00 2.52 -4.36 -1.26 -4.79 121.20 110.13 1bbw s ILE 213 Ca 0.05 0.11 0.00 0.00 -0.26 0.00 0.00 60.65 60.55 1bbw s ILE 213 Cb 0.15 -0.14 0.00 0.00 1.25 0.00 0.00 42.46 43.73 1bbw s ILE 213 CO 0.81 0.04 0.00 -0.81 0.24 0.00 0.00 174.94 175.22 1bbw n PRO 214 N 3.66 1.28 -3.31 0.37 -0.04 -1.26 -4.99 135.00 130.71 1bbw n PRO 214 Ca -0.20 0.00 -0.47 0.00 -0.04 0.00 0.00 63.50 62.79 1bbw n PRO 214 Cb 0.55 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.98 1bbw n PRO 214 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bbw s ALA 218 N -2.19 3.93 0.24 0.55 0.00 -1.26 -4.94 121.76 118.10 1bbw s ALA 218 Ca 0.00 -3.06 -0.03 0.00 0.00 0.00 0.00 51.96 48.87 1bbw s ALA 218 Cb 0.00 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 1bbw s ALA 218 CO 0.00 -2.22 0.26 0.00 0.00 0.00 0.00 175.76 173.80 1bbw s ALA 219 N 0.68 0.92 0.22 0.00 0.00 -1.26 -5.16 121.76 117.16 1bbw s ALA 219 Ca 0.14 -1.56 -0.19 0.00 0.00 0.00 0.00 51.96 50.35 1bbw s ALA 219 Cb -0.16 1.31 -0.08 0.00 0.00 0.00 0.00 23.12 24.19 1bbw s ALA 219 CO -0.05 -0.68 0.71 0.50 0.00 0.00 0.00 175.76 176.24 1bbw s ARG 220 N -3.92 4.20 -0.09 0.00 3.52 -1.26 -5.02 118.95 116.37 1bbw s ARG 220 Ca 0.35 0.81 -0.10 0.00 -0.13 0.00 0.00 55.73 56.66 1bbw s ARG 220 Cb 0.04 -2.84 -0.05 0.00 -1.56 0.00 0.00 34.95 30.54 1bbw s ARG 220 CO 0.14 0.38 0.23 -1.25 -0.81 0.00 0.00 175.30 173.99 1bbw s PRO 221 N -2.07 3.70 -0.71 5.12 0.04 -1.26 -2.46 135.00 137.35 1bbw s PRO 221 Ca 0.43 0.04 -0.26 0.00 0.04 0.00 0.00 61.00 61.25 1bbw s PRO 221 Cb -0.16 -3.23 0.04 0.00 0.04 0.00 0.00 34.50 31.19 1bbw s PRO 221 CO 0.20 0.68 1.20 -0.06 0.04 0.00 0.00 177.00 179.06 1bbw s PHE 222 N -0.82 2.39 -0.12 0.56 0.08 -1.26 -4.81 117.98 113.99 1bbw s PHE 222 Ca 0.17 -0.13 -0.17 0.00 0.12 0.00 0.00 56.93 56.92 1bbw s PHE 222 Cb -0.13 -4.54 -0.04 0.00 -0.57 0.00 0.00 43.02 37.73 1bbw s PHE 222 CO 0.06 -1.95 0.44 0.42 -0.10 0.00 0.00 175.22 174.09 1bbw s ILE 223 N 5.31 5.21 0.03 0.64 1.01 -1.26 -1.71 121.20 130.43 1bbw s ILE 223 Ca 0.33 0.86 0.00 0.00 0.00 0.00 0.00 60.65 61.84 1bbw s ILE 223 Cb -0.10 -3.77 -0.00 0.00 0.01 0.00 0.00 42.46 38.60 1bbw s ILE 223 CO 0.15 0.35 0.01 1.07 0.00 0.00 0.00 174.94 176.51 1bbw n THR 224 N 3.57 0.00 -3.88 2.92 5.66 -0.90 -5.03 114.28 116.63 1bbw n THR 224 Ca -0.08 -0.19 -0.11 0.00 -3.05 0.00 0.00 64.05 60.62 1bbw n THR 224 Cb 0.52 0.06 -0.12 0.00 -1.55 0.00 0.00 70.33 69.23 1bbw n THR 224 CO 0.00 0.00 0.00 -2.28 -3.05 0.00 0.00 175.07 169.74 1bbw s HIS 225 N -1.49 0.01 -0.15 1.09 2.46 -1.26 -2.88 115.29 113.06 1bbw s HIS 225 Ca 0.01 0.00 -0.08 0.00 0.47 0.00 0.00 55.06 55.46 1bbw s HIS 225 Cb 0.00 -0.03 -0.04 0.00 -0.13 0.00 0.00 32.58 32.38 1bbw s HIS 225 CO 0.01 -0.13 0.13 -1.58 -2.47 0.00 0.00 174.74 170.70 1bbw s HIS 226 N -0.57 3.52 -0.04 3.88 2.46 -0.98 -4.91 115.29 118.65 1bbw s HIS 226 Ca -0.06 0.45 -0.09 0.00 0.47 0.00 0.00 55.06 55.82 1bbw s HIS 226 Cb -0.04 -2.02 -0.05 0.00 -0.13 0.00 0.00 32.58 30.34 1bbw s HIS 226 CO 0.00 0.57 0.45 -2.95 -2.47 0.00 0.00 174.74 170.34 1bbw h ASN 227 N 5.62 -0.28 0.00 9.88 7.08 -1.97 -2.91 115.58 133.01 1bbw h ASN 227 Ca -0.50 0.01 0.00 0.00 -3.08 0.00 0.00 56.30 52.73 1bbw h ASN 227 Cb 1.20 0.07 0.00 0.00 -2.08 0.00 0.00 38.32 37.51 1bbw h ASN 227 CO 0.65 0.07 0.00 0.00 -2.08 0.00 0.00 177.43 176.07 1bbw n ALA 228 N -2.58 1.79 -2.07 4.14 0.00 -1.26 -2.20 120.51 118.33 1bbw n ALA 228 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.39 1bbw n ALA 228 Cb 0.13 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 1bbw n ALA 228 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1bbw n LEU 229 N -0.42 -0.10 -0.33 0.00 4.77 -1.26 -5.03 117.00 114.63 1bbw n LEU 229 Ca 0.00 -1.37 0.00 0.00 -0.03 0.00 0.00 56.01 54.61 1bbw n LEU 229 Cb 0.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1bbw n LEU 229 CO 0.00 0.87 0.00 -0.90 -1.33 0.00 0.00 177.39 176.03 1bbw n ASP 230 N 0.07 0.00 -4.38 -1.43 5.75 -0.94 -4.81 116.55 110.82 1bbw n ASP 230 Ca -0.06 0.00 -0.34 0.00 -0.01 0.00 0.00 54.79 54.38 1bbw n ASP 230 Cb 0.68 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.64 1bbw n ASP 230 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1bbw s LEU 231 N 0.00 2.94 -0.01 -2.12 1.02 -1.24 -4.90 118.68 114.37 1bbw s LEU 231 Ca 0.00 -0.30 -0.30 0.00 0.02 0.00 0.00 54.13 53.55 1bbw s LEU 231 Cb 0.00 -1.71 -0.05 0.00 0.02 0.00 0.00 46.19 44.44 1bbw s LEU 231 CO 0.00 0.08 1.40 -1.81 0.02 0.00 0.00 176.35 176.04 1bbw s ASP 232 N 0.85 6.85 0.42 2.29 1.11 -1.26 -2.31 116.67 124.62 1bbw s ASP 232 Ca -0.02 2.10 0.08 0.00 0.18 0.00 0.00 52.55 54.88 1bbw s ASP 232 Cb -0.15 -2.56 -0.02 0.00 1.07 0.00 0.00 42.92 41.26 1bbw s ASP 232 CO 0.01 -0.72 0.37 -0.04 1.18 0.00 0.00 175.17 175.97 1bbw s MET 233 N 2.48 2.51 0.02 8.23 -1.94 -1.14 -4.80 119.30 124.66 1bbw s MET 233 Ca 0.64 -1.56 0.04 0.00 -1.71 0.00 0.00 55.69 53.09 1bbw s MET 233 Cb -0.31 -2.35 -0.02 0.00 2.01 0.00 0.00 34.83 34.16 1bbw s MET 233 CO 0.26 -0.20 -0.13 0.71 -0.01 0.00 0.00 175.02 175.65 1bbw s TYR 234 N -2.49 1.15 0.11 -0.03 1.51 0.11 -2.12 117.35 115.60 1bbw s TYR 234 Ca 0.48 -0.30 -0.28 0.00 -1.01 0.00 0.00 57.07 55.96 1bbw s TYR 234 Cb -0.03 -0.70 -0.06 0.00 -0.11 0.00 0.00 41.96 41.06 1bbw s TYR 234 CO 0.27 0.01 0.88 -0.51 -1.11 0.00 0.00 175.55 175.09 1bbw s LEU 235 N -0.79 4.51 0.38 -1.29 1.43 -0.69 -0.66 118.68 121.57 1bbw s LEU 235 Ca 0.02 1.69 -0.27 0.00 -1.03 0.00 0.00 54.13 54.55 1bbw s LEU 235 Cb -0.07 -3.45 -0.10 0.00 0.03 0.00 0.00 46.19 42.60 1bbw s LEU 235 CO 0.00 0.02 1.39 0.00 0.23 0.00 0.00 176.35 178.00 1bbw s ARG 236 N -0.29 4.07 -0.01 1.70 1.70 0.72 -4.55 118.95 122.29 1bbw s ARG 236 Ca 0.42 2.37 0.19 0.00 -0.47 0.00 0.00 55.73 58.25 1bbw s ARG 236 Cb -0.23 -2.90 -0.23 0.00 -0.57 0.00 0.00 34.95 31.03 1bbw s ARG 236 CO 0.28 -0.49 0.72 0.44 -1.08 0.00 0.00 175.30 175.17 1bbw n ILE 237 N 0.36 0.00 -3.63 4.99 -5.35 -1.26 -0.33 119.36 114.14 1bbw n ILE 237 Ca 0.02 -0.14 -0.05 0.00 -0.27 0.00 0.00 62.75 62.31 1bbw n ILE 237 Cb 0.41 0.80 -0.06 0.00 -1.74 0.00 0.00 39.64 39.05 1bbw n ILE 237 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1bbw s ALA 238 N -2.90 -2.11 -0.40 -1.28 0.00 -1.26 -4.67 121.76 109.14 1bbw s ALA 238 Ca 0.04 1.77 0.05 0.00 0.00 0.00 0.00 51.96 53.82 1bbw s ALA 238 Cb 0.14 -1.47 0.65 0.00 0.00 0.00 0.00 23.12 22.44 1bbw s ALA 238 CO 0.78 -0.20 1.83 -0.35 0.00 0.00 0.00 175.76 177.82 1bbw n PRO 239 N 1.15 2.57 0.07 0.00 -0.04 -1.26 -4.79 135.00 132.70 1bbw n PRO 239 Ca -0.07 -2.84 -0.10 0.00 -0.04 0.00 0.00 63.50 60.45 1bbw n PRO 239 Cb 0.58 -2.12 -0.06 0.00 -0.04 0.00 0.00 33.50 31.85 1bbw n PRO 239 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1bbw h GLU 240 N 1.38 -0.43 -0.93 0.54 4.81 -1.99 -2.24 114.58 115.73 1bbw h GLU 240 Ca 0.50 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.82 1bbw h GLU 240 Cb 2.63 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 32.04 1bbw h GLU 240 CO 0.95 -0.28 0.60 -0.07 -0.73 0.00 0.00 179.01 179.48 1bbw h LEU 241 N -0.44 0.95 -0.83 1.64 3.38 -2.00 -1.74 115.31 116.26 1bbw h LEU 241 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1bbw h LEU 241 Cb 0.45 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1bbw h LEU 241 CO -0.17 0.61 -0.22 1.88 0.09 0.00 0.00 178.44 180.63 1bbw h TYR 242 N 1.08 0.70 -0.46 1.13 -1.99 -1.92 -2.40 116.97 113.12 1bbw h TYR 242 Ca 0.39 -0.15 -0.10 0.00 2.00 0.00 0.00 58.73 60.87 1bbw h TYR 242 Cb 0.16 -0.17 -0.01 0.00 2.00 0.00 0.00 36.73 38.70 1bbw h TYR 242 CO -0.00 0.80 -0.10 -0.07 -0.00 0.00 0.00 178.16 178.79 1bbw h LEU 243 N 0.55 0.88 -0.92 3.88 3.38 -0.71 -2.89 115.31 119.47 1bbw h LEU 243 Ca 0.08 -0.36 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 1bbw h LEU 243 Cb 0.68 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1bbw h LEU 243 CO 0.05 1.03 -0.02 0.11 0.09 0.00 0.00 178.44 179.70 1bbw h LYS 244 N 0.72 0.77 -0.81 1.13 1.57 -1.18 -2.07 116.57 116.69 1bbw h LYS 244 Ca 0.12 -0.21 0.14 0.00 -1.87 0.00 0.00 60.65 58.83 1bbw h LYS 244 Cb 0.64 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 32.81 1bbw h LYS 244 CO 0.04 0.79 0.53 0.00 -0.57 0.00 0.00 179.45 180.24 1bbw h ARG 245 N 0.71 0.53 -0.20 3.15 3.08 -1.23 0.34 114.38 120.76 1bbw h ARG 245 Ca 0.14 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 60.06 1bbw h ARG 245 Cb 0.47 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.38 1bbw h ARG 245 CO 0.02 0.35 -0.28 -0.07 -1.07 0.00 0.00 179.97 178.92 1bbw h LEU 246 N 0.54 0.40 -0.14 3.04 3.38 -1.23 0.10 115.31 121.40 1bbw h LEU 246 Ca 0.40 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 1bbw h LEU 246 Cb 0.77 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1bbw h LEU 246 CO -0.15 0.67 -0.11 0.58 0.09 0.00 0.00 178.44 179.52 1bbw h VAL 247 N 0.35 1.34 -0.16 1.22 2.07 -0.28 0.40 116.25 121.17 1bbw h VAL 247 Ca 0.05 -1.23 0.05 0.00 0.82 0.00 0.00 66.70 66.39 1bbw h VAL 247 Cb 0.68 1.83 -0.06 0.00 -1.52 0.00 0.00 31.29 32.22 1bbw h VAL 247 CO 0.05 0.36 -0.21 0.58 0.02 0.00 0.00 177.57 178.37 1bbw h VAL 248 N -0.03 0.46 0.00 2.57 2.07 -0.98 0.42 116.25 120.77 1bbw h VAL 248 Ca 0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1bbw h VAL 248 Cb 0.62 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1bbw h VAL 248 CO 0.03 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.23 1bbw n GLY 249 N -1.35 -0.58 0.00 2.17 0.00 0.35 -4.82 105.19 100.96 1bbw n GLY 249 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1bbw n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbw n GLY 250 N -1.30 1.99 3.55 -0.02 0.00 0.15 -5.02 105.19 104.54 1bbw n GLY 250 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.63 1bbw n GLY 250 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bbw s PHE 251 N -2.09 2.20 -0.89 1.61 0.08 0.12 -4.82 117.98 114.19 1bbw s PHE 251 Ca 0.00 -0.05 0.28 0.00 0.12 0.00 0.00 56.93 57.28 1bbw s PHE 251 Cb 0.00 -4.52 1.06 0.00 -0.57 0.00 0.00 43.02 38.99 1bbw s PHE 251 CO 0.00 -2.06 1.86 0.39 -0.10 0.00 0.00 175.22 175.31 1bbw n GLU 252 N 9.20 0.11 -3.50 0.44 1.02 -1.26 -3.22 120.64 123.43 1bbw n GLU 252 Ca 0.15 0.09 -0.28 0.00 -0.02 0.00 0.00 57.16 57.10 1bbw n GLU 252 Cb 0.50 -1.63 -0.13 0.00 -0.02 0.00 0.00 31.44 30.16 1bbw n GLU 252 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1bbw s ARG 253 N -3.04 0.34 0.11 3.49 0.52 -1.26 -1.28 118.95 117.83 1bbw s ARG 253 Ca 0.13 -0.82 0.02 0.00 -0.52 0.00 0.00 55.73 54.54 1bbw s ARG 253 Cb 0.16 -1.18 -0.04 0.00 0.52 0.00 0.00 34.95 34.41 1bbw s ARG 253 CO 0.56 -1.10 -0.08 0.14 0.02 0.00 0.00 175.30 174.85 1bbw s VAL 254 N 1.70 0.81 0.22 3.52 -7.23 -1.05 -0.91 120.40 117.47 1bbw s VAL 254 Ca 0.13 -1.95 -0.17 0.00 -1.81 0.00 0.00 61.98 58.18 1bbw s VAL 254 Cb -0.19 -1.70 0.02 0.00 0.56 0.00 0.00 36.38 35.07 1bbw s VAL 254 CO -0.21 -0.83 0.55 0.72 -0.31 0.00 0.00 175.10 175.02 1bbw s PHE 255 N -3.49 -0.03 -0.27 2.82 -0.71 -0.98 -0.32 117.98 115.00 1bbw s PHE 255 Ca 0.13 -0.34 -0.01 0.00 -1.04 0.00 0.00 56.93 55.67 1bbw s PHE 255 Cb 0.04 0.41 0.15 0.00 -1.21 0.00 0.00 43.02 42.41 1bbw s PHE 255 CO -0.03 -1.00 0.42 -2.00 -1.34 0.00 0.00 175.22 171.27 1bbw s GLU 256 N -3.91 0.40 -0.38 1.99 2.12 0.07 -1.35 118.70 117.63 1bbw s GLU 256 Ca 0.12 0.46 -0.21 0.00 0.36 0.00 0.00 54.97 55.70 1bbw s GLU 256 Cb -0.02 -0.29 0.01 0.00 0.26 0.00 0.00 34.13 34.09 1bbw s GLU 256 CO 0.02 -0.78 0.66 0.42 -0.54 0.00 0.00 175.26 175.04 1bbw s ILE 257 N 2.59 4.85 0.01 -3.70 1.01 -1.26 -2.98 121.20 121.71 1bbw s ILE 257 Ca 0.13 0.48 -0.28 0.00 0.00 0.00 0.00 60.65 60.97 1bbw s ILE 257 Cb -0.14 -4.13 0.10 0.00 0.01 0.00 0.00 42.46 38.30 1bbw s ILE 257 CO -0.21 -0.42 1.25 0.21 0.00 0.00 0.00 174.94 175.77 1bbw s ASN 258 N 1.87 -0.02 0.31 3.58 3.84 -0.16 -4.99 114.94 119.37 1bbw s ASN 258 Ca 0.25 -0.23 -0.29 0.00 0.21 0.00 0.00 52.86 52.80 1bbw s ASN 258 Cb -0.14 0.20 -0.10 0.00 -0.55 0.00 0.00 41.25 40.65 1bbw s ASN 258 CO 0.17 -0.38 1.42 -0.60 -2.79 0.00 0.00 177.10 174.91 1bbw s ARG 259 N -2.23 4.24 0.14 0.43 6.06 -1.26 -1.53 118.95 124.80 1bbw s ARG 259 Ca 0.22 2.37 0.07 0.00 -2.50 0.00 0.00 55.73 55.88 1bbw s ARG 259 Cb 0.01 -3.05 -0.04 0.00 0.06 0.00 0.00 34.95 31.93 1bbw s ARG 259 CO -0.01 -0.39 -0.15 -0.80 -2.50 0.00 0.00 175.30 171.45 1bbw s ASN 260 N -0.05 2.22 -0.09 -2.12 0.01 -0.34 -4.91 114.94 109.67 1bbw s ASN 260 Ca 0.54 -0.83 0.02 0.00 -0.71 0.00 0.00 52.86 51.88 1bbw s ASN 260 Cb -0.43 -0.10 0.01 0.00 0.41 0.00 0.00 41.25 41.15 1bbw s ASN 260 CO 0.52 -0.11 -0.15 -0.36 -1.51 0.00 0.00 177.10 175.49 1bbw s PHE 261 N -2.12 1.84 -0.28 2.20 0.40 0.55 -2.46 117.98 118.11 1bbw s PHE 261 Ca 0.11 -0.81 0.02 0.00 -0.60 0.00 0.00 56.93 55.65 1bbw s PHE 261 Cb -0.05 -1.33 0.08 0.00 0.51 0.00 0.00 43.02 42.23 1bbw s PHE 261 CO 0.04 -0.41 -0.00 1.03 0.70 0.00 0.00 175.22 176.58 1bbw s ARG 262 N 0.87 1.46 -1.20 0.44 1.81 -1.03 -4.26 118.95 117.03 1bbw s ARG 262 Ca -0.10 -1.29 -0.20 0.00 -1.72 0.00 0.00 55.73 52.43 1bbw s ARG 262 Cb -0.15 -2.67 -0.03 0.00 -0.45 0.00 0.00 34.95 31.64 1bbw s ARG 262 CO 0.01 -0.77 1.89 -1.71 -0.68 0.00 0.00 175.30 174.04 1bbw n ASN 263 N 4.57 3.73 0.00 0.23 5.15 -1.03 -4.39 115.26 123.52 1bbw n ASN 263 Ca -0.06 -2.78 0.00 0.00 -0.60 0.00 0.00 54.58 51.14 1bbw n ASN 263 Cb 0.43 -1.67 0.00 0.00 -0.53 0.00 0.00 39.78 38.01 1bbw n ASN 263 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 1bbw n GLU 264 N 8.01 1.64 -4.03 1.20 0.28 -1.26 -4.54 120.64 121.94 1bbw n GLU 264 Ca 0.47 0.00 -0.22 0.00 -0.16 0.00 0.00 57.16 57.26 1bbw n GLU 264 Cb 0.45 0.00 -0.04 0.00 1.43 0.00 0.00 31.44 33.28 1bbw n GLU 264 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1bbw s GLY 265 N 0.00 1.40 -0.87 -1.84 0.00 -1.26 -4.90 107.32 99.85 1bbw s GLY 265 Ca 0.00 -1.40 -0.20 0.00 0.00 0.00 0.00 44.72 43.12 1bbw s GLY 265 CO 0.00 -1.42 1.10 -0.42 0.00 0.00 0.00 173.10 172.36 1bbw s ILE 266 N -2.12 4.62 -0.50 0.90 -1.09 -1.26 -4.49 121.20 117.27 1bbw s ILE 266 Ca 0.34 -1.30 -0.26 0.00 -2.23 0.00 0.00 60.65 57.20 1bbw s ILE 266 Cb -0.08 -4.77 0.03 0.00 -1.58 0.00 0.00 42.46 36.07 1bbw s ILE 266 CO 0.26 -1.51 0.98 -0.44 -1.23 0.00 0.00 174.94 173.00 1bbw s SER 267 N 3.70 6.46 0.00 3.58 0.01 -1.26 -4.92 113.70 121.27 1bbw s SER 267 Ca 0.31 0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.59 1bbw s SER 267 Cb -0.07 -2.47 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1bbw s SER 267 CO -0.06 -1.16 0.10 1.33 0.41 0.00 0.00 173.24 173.86 1bbw n VAL 268 N 6.43 0.00 -1.94 3.43 0.24 -1.26 -4.72 118.33 120.51 1bbw n VAL 268 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1bbw n VAL 268 Cb 0.48 -0.46 0.00 0.00 -1.47 0.00 0.00 33.84 32.40 1bbw n VAL 268 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1bbw n HIS 270 N 1.73 -1.13 -4.24 6.34 -0.00 -1.26 -4.06 115.22 112.59 1bbw n HIS 270 Ca 0.00 0.68 -0.24 0.00 -0.00 0.00 0.00 57.72 58.15 1bbw n HIS 270 Cb 0.00 -1.52 -0.17 0.00 -0.00 0.00 0.00 29.99 28.30 1bbw n HIS 270 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1bbw s ASN 271 N -0.13 1.73 0.63 0.41 2.47 -1.26 -4.03 114.94 114.75 1bbw s ASN 271 Ca 0.00 -0.25 0.17 0.00 0.42 0.00 0.00 52.86 53.19 1bbw s ASN 271 Cb 0.00 -0.73 0.61 0.00 -1.45 0.00 0.00 41.25 39.67 1bbw s ASN 271 CO 0.00 -0.04 1.22 -0.65 -3.72 0.00 0.00 177.10 173.91 1bbw h PRO 272 N 7.47 0.00 -1.97 0.43 0.11 -1.85 -3.32 132.00 132.87 1bbw h PRO 272 Ca -0.31 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.60 1bbw h PRO 272 Cb 1.16 0.00 -0.31 0.00 0.11 0.00 0.00 31.00 31.96 1bbw h PRO 272 CO 0.44 0.00 -0.53 -1.83 -0.21 0.00 0.00 178.00 175.87 1bbw s GLU 273 N -4.27 0.34 0.34 1.05 -1.05 -1.26 -2.48 118.70 111.37 1bbw s GLU 273 Ca -0.02 0.33 0.09 0.00 -0.15 0.00 0.00 54.97 55.23 1bbw s GLU 273 Cb 0.09 -0.56 -0.06 0.00 -0.44 0.00 0.00 34.13 33.15 1bbw s GLU 273 CO 0.29 -0.76 -0.07 -0.59 0.95 0.00 0.00 175.26 175.08 1bbw s PHE 274 N 2.49 2.44 -0.20 4.83 -0.71 -1.03 -4.93 117.98 120.88 1bbw s PHE 274 Ca 0.11 -0.48 -0.14 0.00 -1.04 0.00 0.00 56.93 55.38 1bbw s PHE 274 Cb -0.15 -1.41 -0.04 0.00 -1.21 0.00 0.00 43.02 40.21 1bbw s PHE 274 CO -0.20 0.56 0.31 0.99 -1.34 0.00 0.00 175.22 175.54 1bbw s THR 275 N -2.59 5.26 0.22 -4.49 2.01 -1.26 -1.20 115.64 113.60 1bbw s THR 275 Ca 0.33 0.54 0.10 0.00 0.31 0.00 0.00 61.69 62.97 1bbw s THR 275 Cb 0.02 -3.65 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 1bbw s THR 275 CO 0.17 0.31 -0.18 -0.04 -0.69 0.00 0.00 174.62 174.19 1bbw s MET 276 N 1.05 1.46 -0.15 4.92 -1.94 -0.58 -1.69 119.30 122.36 1bbw s MET 276 Ca 0.16 -1.60 -0.01 0.00 -1.71 0.00 0.00 55.69 52.52 1bbw s MET 276 Cb -0.14 -1.47 0.04 0.00 2.01 0.00 0.00 34.83 35.27 1bbw s MET 276 CO 0.06 0.28 -0.04 1.41 -0.01 0.00 0.00 175.02 176.72 1bbw s MET 277 N -3.29 1.25 -0.10 2.03 -2.45 -0.11 -0.99 119.30 115.63 1bbw s MET 277 Ca 0.23 -0.41 -0.00 0.00 -1.25 0.00 0.00 55.69 54.26 1bbw s MET 277 Cb -0.04 -1.87 -0.03 0.00 1.25 0.00 0.00 34.83 34.14 1bbw s MET 277 CO 0.10 -0.43 -0.08 -1.21 1.05 0.00 0.00 175.02 174.45 1bbw s GLU 278 N 1.71 3.05 0.02 4.11 2.02 -1.16 -0.82 118.70 127.63 1bbw s GLU 278 Ca 0.01 -0.57 0.01 0.00 0.02 0.00 0.00 54.97 54.44 1bbw s GLU 278 Cb -0.15 -2.66 -0.02 0.00 0.10 0.00 0.00 34.13 31.40 1bbw s GLU 278 CO -0.07 0.49 -0.04 -0.48 0.02 0.00 0.00 175.26 175.17 1bbw s LEU 279 N -0.34 2.23 0.06 1.80 0.05 -0.42 -0.75 118.68 121.30 1bbw s LEU 279 Ca 0.05 -0.48 0.06 0.00 0.05 0.00 0.00 54.13 53.81 1bbw s LEU 279 Cb -0.12 0.02 -0.03 0.00 -2.05 0.00 0.00 46.19 44.01 1bbw s LEU 279 CO 0.02 -0.25 -0.17 -0.31 -0.55 0.00 0.00 176.35 175.09 1bbw s TYR 280 N -1.33 1.48 -0.04 3.48 1.51 0.56 0.20 117.35 123.20 1bbw s TYR 280 Ca -0.13 -0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 55.52 1bbw s TYR 280 Cb -0.09 -0.86 0.03 0.00 -0.11 0.00 0.00 41.96 40.93 1bbw s TYR 280 CO -0.01 0.08 0.07 1.41 -1.11 0.00 0.00 175.55 176.00 1bbw s MET 281 N -1.38 -0.05 0.47 -0.62 -2.45 0.37 -2.54 119.30 113.09 1bbw s MET 281 Ca 0.03 0.38 -0.16 0.00 -1.25 0.00 0.00 55.69 54.70 1bbw s MET 281 Cb -0.09 -0.43 -0.08 0.00 1.25 0.00 0.00 34.83 35.48 1bbw s MET 281 CO 0.02 -0.30 0.92 0.00 1.05 0.00 0.00 175.02 176.71 1bbw s ALA 282 N 2.02 3.13 -1.06 4.11 0.00 -0.40 -0.45 121.76 129.11 1bbw s ALA 282 Ca 0.03 0.13 -0.01 0.00 0.00 0.00 0.00 51.96 52.10 1bbw s ALA 282 Cb -0.12 -3.02 -0.01 0.00 0.00 0.00 0.00 23.12 19.96 1bbw s ALA 282 CO -0.03 -0.11 0.89 0.66 0.00 0.00 0.00 175.76 177.17 1bbw n TYR 283 N -1.34 -2.05 -3.54 0.00 4.01 0.14 -4.92 117.16 109.46 1bbw n TYR 283 Ca 0.06 0.84 -0.07 0.00 -0.16 0.00 0.00 57.90 58.56 1bbw n TYR 283 Cb 0.54 -4.62 -0.02 0.00 -0.31 0.00 0.00 39.34 34.93 1bbw n TYR 283 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1bbw s ALA 284 N -3.33 -1.85 0.45 -0.72 0.00 -1.26 -5.05 121.76 109.99 1bbw s ALA 284 Ca 0.10 1.00 0.05 0.00 0.00 0.00 0.00 51.96 53.11 1bbw s ALA 284 Cb -0.01 0.36 -0.05 0.00 0.00 0.00 0.00 23.12 23.42 1bbw s ALA 284 CO 0.67 -0.72 0.03 0.16 0.00 0.00 0.00 175.76 175.90 1bbw s ASP 285 N -2.50 4.04 0.34 0.00 -4.77 -1.26 -3.00 116.67 109.53 1bbw s ASP 285 Ca 0.06 -1.44 0.13 0.00 -3.30 0.00 0.00 52.55 48.00 1bbw s ASP 285 Cb -0.01 -0.06 0.98 0.00 -1.09 0.00 0.00 42.92 42.74 1bbw s ASP 285 CO -0.07 -0.62 1.73 0.10 0.70 0.00 0.00 175.17 177.01 1bbw h TYR 286 N 1.56 0.90 -1.00 2.11 -0.00 -1.83 0.22 116.97 118.94 1bbw h TYR 286 Ca -0.44 0.03 0.13 0.00 0.00 0.00 0.00 58.73 58.45 1bbw h TYR 286 Cb 1.27 -0.26 -0.09 0.00 0.00 0.00 0.00 36.73 37.66 1bbw h TYR 286 CO 1.01 0.03 0.63 0.87 -0.00 0.00 0.00 178.16 180.69 1bbw h LYS 287 N 0.49 0.94 0.00 0.10 1.57 -1.94 0.33 116.57 118.07 1bbw h LYS 287 Ca 0.65 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 59.32 1bbw h LYS 287 Cb 1.39 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 1bbw h LYS 287 CO -0.45 0.62 -0.27 -0.44 -0.57 0.00 0.00 179.45 178.35 1bbw h ASP 288 N 0.97 0.00 0.47 0.86 3.32 -0.96 -2.13 116.42 118.95 1bbw h ASP 288 Ca 0.50 0.00 -0.28 0.00 0.02 0.00 0.00 57.03 57.28 1bbw h ASP 288 Cb 0.52 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.08 1bbw h ASP 288 CO -0.28 0.27 -1.22 -0.07 -1.72 0.00 0.00 179.24 176.22 1bbw h LEU 289 N 0.00 0.56 -0.34 1.55 3.38 -0.74 -2.44 115.31 117.27 1bbw h LEU 289 Ca -0.00 -0.56 0.06 0.00 0.09 0.00 0.00 57.88 57.47 1bbw h LEU 289 Cb 0.48 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1bbw h LEU 289 CO 0.04 1.41 0.02 0.40 0.09 0.00 0.00 178.44 180.40 1bbw h ILE 290 N 0.14 0.76 -0.09 1.22 2.04 0.03 0.39 117.51 122.00 1bbw h ILE 290 Ca -0.15 -0.04 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1bbw h ILE 290 Cb 1.92 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.63 1bbw h ILE 290 CO 0.21 0.02 -0.27 -0.08 0.00 0.00 0.00 178.15 178.04 1bbw h GLU 291 N 0.12 0.15 -0.17 2.37 4.81 -1.45 -2.17 114.58 118.25 1bbw h GLU 291 Ca 0.17 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.27 1bbw h GLU 291 Cb 0.22 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 1bbw h GLU 291 CO -0.26 0.42 -0.20 1.25 -0.73 0.00 0.00 179.01 179.48 1bbw h LEU 292 N 0.14 0.47 -0.61 1.64 5.85 -0.68 -2.54 115.31 119.58 1bbw h LEU 292 Ca 0.02 -0.50 0.10 0.00 0.84 0.00 0.00 57.88 58.35 1bbw h LEU 292 Cb 0.55 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.37 1bbw h LEU 292 CO 0.04 0.87 0.20 0.74 -0.34 0.00 0.00 178.44 179.95 1bbw h THR 293 N 0.07 0.73 0.15 1.05 2.02 -0.04 0.40 112.91 117.29 1bbw h THR 293 Ca 0.02 -0.13 -0.00 0.00 0.77 0.00 0.00 66.41 67.07 1bbw h THR 293 Cb 0.75 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1bbw h THR 293 CO 0.05 0.07 -0.13 -0.33 0.37 0.00 0.00 175.52 175.54 1bbw h GLU 294 N 0.36 -0.27 -0.93 6.66 5.08 -1.32 -1.47 114.58 122.69 1bbw h GLU 294 Ca 0.31 0.02 0.27 0.00 -1.00 0.00 0.00 59.36 58.96 1bbw h GLU 294 Cb 0.41 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.68 1bbw h GLU 294 CO -0.33 -0.18 0.70 1.03 -1.00 0.00 0.00 179.01 179.23 1bbw h SER 295 N -0.28 0.00 0.54 1.42 0.87 -1.25 -0.18 113.55 114.68 1bbw h SER 295 Ca -0.02 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.51 1bbw h SER 295 Cb 0.24 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.20 1bbw h SER 295 CO -0.01 0.00 -0.26 0.25 -0.53 0.00 0.00 176.83 176.28 1bbw h LEU 296 N 0.00 -0.62 -1.32 2.23 5.85 -0.22 -0.94 115.31 120.30 1bbw h LEU 296 Ca 0.44 0.02 0.05 0.00 0.84 0.00 0.00 57.88 59.24 1bbw h LEU 296 Cb 1.84 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 42.98 1bbw h LEU 296 CO -0.00 -0.33 0.50 -0.26 -0.34 0.00 0.00 178.44 178.00 1bbw h PHE 297 N -0.95 0.85 0.00 1.25 -1.00 -0.67 -0.82 116.94 115.59 1bbw h PHE 297 Ca -0.07 0.02 -0.12 0.00 2.81 0.00 0.00 57.97 60.61 1bbw h PHE 297 Cb 0.56 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.82 1bbw h PHE 297 CO 0.04 0.47 -0.55 -0.09 -1.61 0.00 0.00 178.31 176.57 1bbw h ARG 298 N 0.86 0.00 0.10 1.51 2.43 -1.09 -2.46 114.38 115.72 1bbw h ARG 298 Ca 0.31 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.19 1bbw h ARG 298 Cb 0.16 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1bbw h ARG 298 CO -0.10 0.55 -1.48 1.15 -1.51 0.00 0.00 179.97 178.58 1bbw h THR 299 N 0.00 1.20 -0.13 0.20 2.02 -0.35 -3.00 112.91 112.85 1bbw h THR 299 Ca -0.01 -2.86 -0.03 0.00 0.77 0.00 0.00 66.41 64.29 1bbw h THR 299 Cb 1.19 2.75 -0.00 0.00 -1.74 0.00 0.00 68.15 70.35 1bbw h THR 299 CO 0.07 0.81 -0.02 -0.07 0.37 0.00 0.00 175.52 176.68 1bbw h LEU 300 N 0.06 0.25 -1.32 2.58 3.38 -1.22 -0.85 115.31 118.19 1bbw h LEU 300 Ca -0.22 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.39 1bbw h LEU 300 Cb 1.99 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 42.65 1bbw h LEU 300 CO 0.16 0.54 0.28 0.00 0.09 0.00 0.00 178.44 179.51 1bbw h ALA 301 N 0.72 1.48 -0.30 1.53 0.00 -1.58 0.21 119.26 121.32 1bbw h ALA 301 Ca 0.03 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.73 1bbw h ALA 301 Cb 0.42 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1bbw h ALA 301 CO 0.01 0.43 -0.28 0.37 0.00 0.00 0.00 179.25 179.78 1bbw h GLN 302 N 0.76 0.72 0.19 0.00 5.75 -1.39 -0.83 115.11 120.30 1bbw h GLN 302 Ca 0.19 -0.37 -0.35 0.00 -0.15 0.00 0.00 58.65 57.97 1bbw h GLN 302 Cb 0.05 0.01 0.01 0.00 1.07 0.00 0.00 27.48 28.61 1bbw h GLN 302 CO -0.03 0.99 -1.76 -0.44 -2.65 0.00 0.00 178.83 174.94 1bbw h ASP 303 N 0.47 0.62 0.56 -0.69 3.32 -0.89 -2.76 116.42 117.05 1bbw h ASP 303 Ca 0.05 -0.93 -0.29 0.00 0.02 0.00 0.00 57.03 55.88 1bbw h ASP 303 Cb 0.85 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 40.19 1bbw h ASP 303 CO 0.07 1.79 -1.37 0.40 -1.72 0.00 0.00 179.24 178.41 1bbw h ILE 304 N 0.11 1.34 0.00 0.35 2.04 -0.70 -3.39 117.51 117.26 1bbw h ILE 304 Ca -0.35 -2.95 0.00 0.00 1.00 0.00 0.00 64.86 62.57 1bbw h ILE 304 Cb 2.10 2.86 0.00 0.00 -0.74 0.00 0.00 36.82 41.04 1bbw h ILE 304 CO 0.18 0.85 -0.48 0.18 0.00 0.00 0.00 178.15 178.88 1bbw n LEU 305 N -3.49 0.17 0.00 1.44 4.77 -0.44 -5.05 117.00 114.42 1bbw n LEU 305 Ca -0.12 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 1bbw n LEU 305 Cb 1.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.12 1bbw n LEU 305 CO 0.52 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1bbw n GLY 306 N 1.39 1.49 3.71 -0.72 0.00 -0.50 -4.93 105.19 105.62 1bbw n GLY 306 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 1bbw n GLY 306 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bbw s LYS 307 N 0.00 4.31 0.48 1.61 3.01 -1.26 -4.69 119.74 123.20 1bbw s LYS 307 Ca 0.00 2.05 0.30 0.00 -1.01 0.00 0.00 55.97 57.31 1bbw s LYS 307 Cb 0.00 -3.32 1.12 0.00 -1.01 0.00 0.00 37.83 34.62 1bbw s LYS 307 CO 0.00 -0.47 1.88 1.79 0.51 0.00 0.00 175.35 179.06 1bbw h THR 308 N 4.41 0.00 -3.22 2.17 1.35 -1.92 -3.42 112.91 112.28 1bbw h THR 308 Ca -0.41 -0.55 -0.67 0.00 -0.55 0.00 0.00 66.41 64.23 1bbw h THR 308 Cb 1.20 1.51 -0.14 0.00 -1.73 0.00 0.00 68.15 68.99 1bbw h THR 308 CO 0.87 0.00 -0.60 -1.61 -0.25 0.00 0.00 175.52 173.93 1bbw s GLU 309 N -3.52 3.22 -0.10 4.72 8.01 -1.26 -1.03 118.70 128.74 1bbw s GLU 309 Ca 0.03 -0.37 -0.01 0.00 0.01 0.00 0.00 54.97 54.63 1bbw s GLU 309 Cb 0.08 -2.91 0.03 0.00 -4.31 0.00 0.00 34.13 27.02 1bbw s GLU 309 CO 0.54 0.62 -0.05 0.08 0.01 0.00 0.00 175.26 176.47 1bbw s VAL 310 N -0.65 0.82 0.30 2.63 1.01 0.16 -4.95 120.40 119.72 1bbw s VAL 310 Ca 0.11 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.63 1bbw s VAL 310 Cb -0.12 -0.89 -0.10 0.00 0.00 0.00 0.00 36.38 35.27 1bbw s VAL 310 CO 0.02 0.33 1.40 -0.89 0.00 0.00 0.00 175.10 175.97 1bbw s THR 311 N 1.78 2.56 -0.35 3.92 2.01 -1.26 -0.77 115.64 123.52 1bbw s THR 311 Ca 0.05 0.52 0.04 0.00 0.31 0.00 0.00 61.69 62.61 1bbw s THR 311 Cb -0.12 -3.33 0.17 0.00 0.01 0.00 0.00 72.50 69.22 1bbw s THR 311 CO -0.07 0.10 0.46 -0.47 -0.69 0.00 0.00 174.62 173.96 1bbw s TYR 312 N -0.61 -0.98 0.00 4.92 5.04 0.51 -4.72 117.35 121.50 1bbw s TYR 312 Ca 0.54 -0.08 0.00 0.00 -2.44 0.00 0.00 57.07 55.10 1bbw s TYR 312 Cb -0.42 -0.10 0.00 0.00 0.35 0.00 0.00 41.96 41.79 1bbw s TYR 312 CO 0.50 -1.04 0.00 0.41 -1.34 0.00 0.00 175.55 174.09 1bbw n GLY 313 N 4.70 2.00 0.04 8.97 0.00 -1.26 -2.41 105.19 117.24 1bbw n GLY 313 Ca 0.07 -0.43 0.12 0.00 0.00 0.00 0.00 46.02 45.78 1bbw n GLY 313 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bbw n ASP 314 N 5.14 0.29 -4.56 1.61 8.00 -1.26 -4.84 116.55 120.93 1bbw n ASP 314 Ca 0.00 0.54 -0.24 0.00 0.71 0.00 0.00 54.79 55.81 1bbw n ASP 314 Cb 0.00 -0.62 -0.09 0.00 -0.02 0.00 0.00 41.12 40.40 1bbw n ASP 314 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1bbw s VAL 315 N -3.08 3.02 -0.19 2.53 1.01 -1.01 -5.12 120.40 117.56 1bbw s VAL 315 Ca 0.10 -2.08 -0.01 0.00 0.00 0.00 0.00 61.98 59.99 1bbw s VAL 315 Cb 0.13 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.93 1bbw s VAL 315 CO 0.45 -0.35 -0.13 -0.89 0.00 0.00 0.00 175.10 174.18 1bbw s THR 316 N -2.30 2.70 -0.15 3.92 2.01 -1.26 -0.37 115.64 120.18 1bbw s THR 316 Ca 0.30 -0.73 -0.17 0.00 0.31 0.00 0.00 61.69 61.39 1bbw s THR 316 Cb -0.06 -2.17 -0.04 0.00 0.01 0.00 0.00 72.50 70.24 1bbw s THR 316 CO 0.17 0.49 0.44 -0.76 -0.69 0.00 0.00 174.62 174.27 1bbw s LEU 317 N 1.20 4.23 -0.33 4.42 1.43 0.05 -4.91 118.68 124.77 1bbw s LEU 317 Ca 0.02 0.69 -0.04 0.00 -1.03 0.00 0.00 54.13 53.77 1bbw s LEU 317 Cb -0.14 -2.61 0.06 0.00 0.03 0.00 0.00 46.19 43.52 1bbw s LEU 317 CO -0.06 -0.02 0.07 -0.62 0.23 0.00 0.00 176.35 175.95 1bbw s ASP 318 N 0.75 5.11 0.00 2.29 2.15 -1.26 0.38 116.67 126.09 1bbw s ASP 318 Ca 0.23 -1.34 0.22 0.00 0.43 0.00 0.00 52.55 52.08 1bbw s ASP 318 Cb -0.15 -1.79 0.59 0.00 -0.30 0.00 0.00 42.92 41.28 1bbw s ASP 318 CO 0.09 -0.33 1.47 0.49 -0.17 0.00 0.00 175.17 176.72 1bbw n PHE 319 N 4.69 0.32 0.07 -5.34 3.72 -0.20 -4.24 117.46 116.48 1bbw n PHE 319 Ca -0.11 -0.16 -0.06 0.00 -0.05 0.00 0.00 57.45 57.06 1bbw n PHE 319 Cb 0.43 0.00 -0.04 0.00 -0.94 0.00 0.00 39.48 38.94 1bbw n PHE 319 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1bbw h GLY 320 N 4.83 -0.28 -4.03 1.37 0.00 -1.89 -3.45 103.07 99.61 1bbw h GLY 320 Ca 0.00 0.10 -0.51 0.00 0.00 0.00 0.00 47.33 46.92 1bbw h GLY 320 CO 0.00 -0.10 0.45 -1.59 0.00 0.00 0.00 176.54 175.30 1bbw s LYS 321 N -2.66 4.63 0.28 4.80 0.00 -1.26 -4.96 119.74 120.57 1bbw s LYS 321 Ca -0.07 1.67 -0.27 0.00 0.00 0.00 0.00 55.97 57.31 1bbw s LYS 321 Cb 0.00 -3.28 -0.15 0.00 0.00 0.00 0.00 37.83 34.40 1bbw s LYS 321 CO 0.22 0.14 0.77 -2.30 0.00 0.00 0.00 175.35 174.18 1bbw n PRO 322 N 2.26 0.78 -0.57 1.78 -0.02 -1.26 -4.90 135.00 133.06 1bbw n PRO 322 Ca 0.02 0.28 -0.30 0.00 -2.02 0.00 0.00 63.50 61.48 1bbw n PRO 322 Cb 0.46 -1.51 0.21 0.00 -0.02 0.00 0.00 33.50 32.65 1bbw n PRO 322 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1bbw n PHE 323 N -0.04 -0.27 -2.96 6.00 3.72 -1.26 -4.96 117.46 117.69 1bbw n PHE 323 Ca 0.13 0.11 -0.39 0.00 -0.05 0.00 0.00 57.45 57.26 1bbw n PHE 323 Cb 0.31 -1.84 -0.06 0.00 -0.94 0.00 0.00 39.48 36.95 1bbw n PHE 323 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1bbw s GLU 324 N -4.49 4.53 -0.20 -1.08 2.56 -0.32 -4.94 118.70 114.76 1bbw s GLU 324 Ca 0.68 1.15 0.01 0.00 0.00 0.00 0.00 54.97 56.80 1bbw s GLU 324 Cb -0.24 -3.13 0.02 0.00 2.00 0.00 0.00 34.13 32.78 1bbw s GLU 324 CO 0.62 0.50 -0.16 0.21 -0.56 0.00 0.00 175.26 175.87 1bbw s LYS 325 N -1.42 2.90 -0.05 4.30 2.47 -1.26 -0.03 119.74 126.64 1bbw s LYS 325 Ca 0.39 -0.90 -0.08 0.00 -1.56 0.00 0.00 55.97 53.82 1bbw s LYS 325 Cb -0.22 -2.70 0.02 0.00 -1.46 0.00 0.00 37.83 33.47 1bbw s LYS 325 CO 0.25 -0.28 0.20 -0.51 0.16 0.00 0.00 175.35 175.17 1bbw s LEU 326 N 1.28 1.27 0.64 5.43 1.43 0.99 -4.97 118.68 124.74 1bbw s LEU 326 Ca 0.02 0.25 -0.10 0.00 -1.03 0.00 0.00 54.13 53.27 1bbw s LEU 326 Cb -0.15 0.73 -0.01 0.00 0.03 0.00 0.00 46.19 46.80 1bbw s LEU 326 CO -0.10 -0.17 1.02 0.42 0.23 0.00 0.00 176.35 177.75 1bbw s THR 327 N -0.34 4.16 0.31 5.49 -4.23 -1.26 -0.45 115.64 119.32 1bbw s THR 327 Ca -0.04 0.57 -0.01 0.00 -1.18 0.00 0.00 61.69 61.03 1bbw s THR 327 Cb -0.03 -3.68 0.23 0.00 1.34 0.00 0.00 72.50 70.36 1bbw s THR 327 CO 0.01 -0.85 1.93 -0.03 -0.54 0.00 0.00 174.62 175.14 1bbw h MET 328 N -0.38 0.95 -0.31 3.99 4.05 -1.42 0.20 114.93 122.01 1bbw h MET 328 Ca -0.45 -0.10 -0.01 0.00 -0.28 0.00 0.00 59.70 58.87 1bbw h MET 328 Cb 1.22 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.81 1bbw h MET 328 CO 0.63 0.69 0.16 0.00 0.23 0.00 0.00 176.91 178.62 1bbw h ARG 329 N 0.96 0.43 -0.62 0.39 2.47 -1.85 -2.03 114.38 114.13 1bbw h ARG 329 Ca 0.25 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.87 1bbw h ARG 329 Cb 0.01 -0.08 -0.03 0.00 -1.65 0.00 0.00 29.97 28.22 1bbw h ARG 329 CO -0.04 0.38 0.23 0.93 0.56 0.00 0.00 179.97 182.03 1bbw h GLU 330 N 0.38 0.92 0.09 0.04 5.08 -1.71 -2.87 114.58 116.52 1bbw h GLU 330 Ca 0.11 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1bbw h GLU 330 Cb 0.08 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1bbw h GLU 330 CO -0.02 0.77 -0.05 0.00 -1.00 0.00 0.00 179.01 178.72 1bbw h ALA 331 N 1.35 -0.13 -0.94 3.43 0.00 -0.56 -1.19 119.26 121.22 1bbw h ALA 331 Ca 0.21 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.14 1bbw h ALA 331 Cb 0.21 0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 1bbw h ALA 331 CO -0.02 -0.52 0.58 0.82 0.00 0.00 0.00 179.25 180.11 1bbw h ILE 332 N -0.23 0.97 -0.02 0.00 2.04 -1.22 -0.68 117.51 118.37 1bbw h ILE 332 Ca -0.01 -0.33 -0.13 0.00 1.00 0.00 0.00 64.86 65.38 1bbw h ILE 332 Cb 0.19 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.16 1bbw h ILE 332 CO 0.02 0.18 -0.61 0.50 0.00 0.00 0.00 178.15 178.24 1bbw h LYS 333 N 0.98 0.07 -0.07 2.37 1.63 -1.32 -0.61 116.57 119.62 1bbw h LYS 333 Ca 0.44 -0.05 -0.16 0.00 -0.85 0.00 0.00 60.65 60.03 1bbw h LYS 333 Cb 0.35 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.98 1bbw h LYS 333 CO -0.23 0.66 -0.65 -0.22 -3.45 0.00 0.00 179.45 175.55 1bbw h LYS 334 N 0.05 0.29 0.00 1.90 3.64 0.11 -3.00 116.57 119.57 1bbw h LYS 334 Ca -0.01 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 1bbw h LYS 334 Cb 1.09 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1bbw h LYS 334 CO 0.08 0.84 -1.22 0.66 -2.27 0.00 0.00 179.45 177.55 1bbw n TYR 335 N -3.85 0.00 -3.19 1.91 4.01 -0.70 -4.44 117.16 110.90 1bbw n TYR 335 Ca -0.03 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.47 1bbw n TYR 335 Cb 0.65 -0.15 -0.06 0.00 -0.31 0.00 0.00 39.34 39.48 1bbw n TYR 335 CO 0.00 0.00 0.00 -2.13 -0.46 0.00 0.00 176.86 174.27 1bbw n ARG 336 N -1.69 1.98 -0.37 -0.72 0.63 -0.24 -4.93 116.66 111.32 1bbw n ARG 336 Ca 0.01 -4.13 0.38 0.00 -0.92 0.00 0.00 57.85 53.19 1bbw n ARG 336 Cb 0.36 -1.90 0.72 0.00 0.45 0.00 0.00 32.46 32.09 1bbw n ARG 336 CO 0.00 0.00 0.00 -1.35 -2.51 0.00 0.00 177.63 173.77 1bbw h PRO 337 N 3.58 0.00 0.00 -0.14 0.11 -1.74 -0.36 132.00 133.45 1bbw h PRO 337 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 1bbw h PRO 337 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1bbw h PRO 337 CO 0.68 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.62 1bbw n GLU 338 N -3.90 0.83 -2.88 1.05 0.00 -1.26 -4.76 120.64 109.72 1bbw n GLU 338 Ca 0.29 0.00 -0.43 0.00 0.00 0.00 0.00 57.16 57.02 1bbw n GLU 338 Cb 1.45 -1.07 -0.05 0.00 0.00 0.00 0.00 31.44 31.77 1bbw n GLU 338 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.13 178.12 1bbw s THR 339 N -2.00 4.56 -0.79 3.84 2.01 -0.15 -4.95 115.64 118.16 1bbw s THR 339 Ca 0.06 0.68 -0.25 0.00 0.31 0.00 0.00 61.69 62.49 1bbw s THR 339 Cb 0.03 -4.37 -0.01 0.00 0.01 0.00 0.00 72.50 68.16 1bbw s THR 339 CO 0.04 -0.75 1.69 -0.62 -0.69 0.00 0.00 174.62 174.30 1bbw s ASP 340 N 2.17 5.63 0.48 3.53 2.15 -1.26 -4.83 116.67 124.53 1bbw s ASP 340 Ca 0.34 -0.41 0.35 0.00 0.43 0.00 0.00 52.55 53.27 1bbw s ASP 340 Cb -0.11 -2.55 1.50 0.00 -0.30 0.00 0.00 42.92 41.45 1bbw s ASP 340 CO 0.24 -2.22 1.66 0.24 -0.17 0.00 0.00 175.17 174.92 1bbw h MET 341 N 12.05 0.08 -0.87 4.34 2.86 -1.96 0.26 114.93 131.68 1bbw h MET 341 Ca -0.09 -0.00 0.23 0.00 -2.06 0.00 0.00 59.70 57.77 1bbw h MET 341 Cb 1.07 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.66 1bbw h MET 341 CO 1.26 0.05 0.60 0.00 1.06 0.00 0.00 176.91 179.89 1bbw h ALA 342 N 1.42 2.54 0.00 6.32 0.00 -2.01 0.68 119.26 128.20 1bbw h ALA 342 Ca 0.78 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.65 1bbw h ALA 342 Cb 2.71 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 20.52 1bbw h ALA 342 CO -0.23 -0.80 -0.14 -0.44 0.00 0.00 0.00 179.25 177.64 1bbw h ASP 343 N 0.18 0.00 1.60 0.00 3.32 -1.29 -2.10 116.42 118.13 1bbw h ASP 343 Ca 0.44 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.47 1bbw h ASP 343 Cb 1.42 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.97 1bbw h ASP 343 CO -0.09 0.14 -0.08 -0.07 -1.72 0.00 0.00 179.24 177.42 1bbw h LEU 344 N 0.00 0.00 -0.09 1.55 3.38 -1.04 -2.15 115.31 116.97 1bbw h LEU 344 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1bbw h LEU 344 Cb 0.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.02 1bbw h LEU 344 CO 0.02 0.08 -0.03 0.47 0.09 0.00 0.00 178.44 179.07 1bbw n ASP 345 N -3.14 0.17 -3.93 -0.43 9.92 -0.79 -4.68 116.55 113.68 1bbw n ASP 345 Ca 0.03 -0.49 -0.26 0.00 -0.53 0.00 0.00 54.79 53.53 1bbw n ASP 345 Cb 0.49 -0.15 -0.17 0.00 -0.64 0.00 0.00 41.12 40.65 1bbw n ASP 345 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1bbw s ASN 346 N -2.40 2.08 0.17 -2.24 3.84 -1.15 -5.07 114.94 110.17 1bbw s ASN 346 Ca 0.33 -0.30 -0.27 0.00 0.21 0.00 0.00 52.86 52.83 1bbw s ASN 346 Cb 0.21 -0.83 0.02 0.00 -0.55 0.00 0.00 41.25 40.09 1bbw s ASN 346 CO 0.44 -0.09 1.55 0.15 -2.79 0.00 0.00 177.10 176.37 1bbw h PHE 347 N 7.93 -1.52 -0.88 0.43 3.57 -1.83 -2.22 116.94 122.41 1bbw h PHE 347 Ca -0.30 0.10 0.04 0.00 3.53 0.00 0.00 57.97 61.34 1bbw h PHE 347 Cb 1.14 0.77 -0.05 0.00 2.79 0.00 0.00 35.95 40.60 1bbw h PHE 347 CO 0.48 -0.41 0.57 -0.44 -2.23 0.00 0.00 178.31 176.27 1bbw h ASP 348 N -0.13 0.94 0.79 0.41 3.32 -1.98 0.35 116.42 120.12 1bbw h ASP 348 Ca 0.19 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.18 1bbw h ASP 348 Cb 0.52 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.85 1bbw h ASP 348 CO -0.82 0.64 -0.28 0.77 -1.72 0.00 0.00 179.24 177.83 1bbw h SER 349 N 1.09 0.00 0.64 6.45 4.64 -1.65 -1.64 113.55 123.08 1bbw h SER 349 Ca 0.35 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.40 1bbw h SER 349 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 1bbw h SER 349 CO -0.12 0.28 -1.26 0.00 -0.87 0.00 0.00 176.83 174.86 1bbw h ALA 350 N 1.72 0.14 -0.47 5.18 0.00 -0.61 -2.13 119.26 123.08 1bbw h ALA 350 Ca -0.00 -0.92 -0.05 0.00 0.00 0.00 0.00 54.91 53.94 1bbw h ALA 350 Cb 0.75 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 1bbw h ALA 350 CO 0.04 1.02 0.10 1.57 0.00 0.00 0.00 179.25 181.97 1bbw h LYS 351 N 0.07 0.76 0.00 0.00 2.10 -0.04 -0.60 116.57 118.86 1bbw h LYS 351 Ca -0.14 -0.19 -0.10 0.00 -2.00 0.00 0.00 60.65 58.22 1bbw h LYS 351 Cb 1.96 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 33.18 1bbw h LYS 351 CO 0.19 0.76 -0.46 0.00 -2.00 0.00 0.00 179.45 177.94 1bbw h ALA 352 N 0.97 1.14 0.00 0.07 0.00 -1.37 -1.06 119.26 119.02 1bbw h ALA 352 Ca 0.15 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.52 1bbw h ALA 352 Cb 0.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1bbw h ALA 352 CO 0.00 0.58 -0.53 0.82 0.00 0.00 0.00 179.25 180.13 1bbw h ILE 353 N 0.00 0.95 0.03 0.00 5.03 -1.14 -2.29 117.51 120.08 1bbw h ILE 353 Ca -0.00 -2.22 -0.00 0.00 -0.12 0.00 0.00 64.86 62.51 1bbw h ILE 353 Cb 0.87 2.39 0.00 0.00 -3.03 0.00 0.00 36.82 37.04 1bbw h ILE 353 CO 0.06 0.52 -0.01 0.00 -0.68 0.00 0.00 178.15 178.04 1bbw h ALA 354 N 1.47 -0.04 -0.28 1.87 0.00 -0.75 -3.30 119.26 118.23 1bbw h ALA 354 Ca -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.57 1bbw h ALA 354 Cb 1.34 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1bbw h ALA 354 CO 0.07 -0.16 0.16 0.93 0.00 0.00 0.00 179.25 180.24 1bbw h GLU 355 N -0.75 0.39 0.00 0.00 5.08 -1.25 -2.24 114.58 115.80 1bbw h GLU 355 Ca -0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1bbw h GLU 355 Cb 0.68 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1bbw h GLU 355 CO 0.01 0.33 0.00 -1.13 -1.00 0.00 0.00 179.01 177.22 1bbw n SER 356 N -4.83 0.00 -0.65 1.42 3.41 -0.86 0.38 113.62 112.48 1bbw n SER 356 Ca -0.02 -0.08 0.07 0.00 -0.26 0.00 0.00 58.87 58.58 1bbw n SER 356 Cb 0.07 -0.15 0.12 0.00 -0.26 0.00 0.00 64.21 63.99 1bbw n SER 356 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1bbw n ILE 357 N -1.15 0.45 -1.94 -1.33 -0.00 -0.90 -4.98 119.36 109.52 1bbw n ILE 357 Ca 0.06 -0.72 0.00 0.00 -0.00 0.00 0.00 62.75 62.09 1bbw n ILE 357 Cb 0.06 0.93 0.00 0.00 -0.00 0.00 0.00 39.64 40.63 1bbw n ILE 357 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1bbw n GLY 358 N 0.76 0.58 3.15 7.39 0.00 0.16 -5.08 105.19 112.15 1bbw n GLY 358 Ca 0.11 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.31 1bbw n GLY 358 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bbw s ILE 359 N -2.84 2.14 -0.98 -0.61 1.01 -0.90 -5.00 121.20 114.02 1bbw s ILE 359 Ca 0.00 -0.93 -0.24 0.00 0.00 0.00 0.00 60.65 59.48 1bbw s ILE 359 Cb 0.00 -1.89 -0.08 0.00 0.01 0.00 0.00 42.46 40.51 1bbw s ILE 359 CO 0.00 0.54 2.00 -1.38 0.00 0.00 0.00 174.94 176.09 1bbw s HIS 360 N 1.14 1.76 -0.79 3.97 -3.43 -1.26 -4.06 115.29 112.62 1bbw s HIS 360 Ca 0.01 0.80 -0.25 0.00 -0.80 0.00 0.00 55.06 54.81 1bbw s HIS 360 Cb -0.14 -3.94 -0.02 0.00 -1.43 0.00 0.00 32.58 27.05 1bbw s HIS 360 CO -0.09 -1.52 1.82 0.08 -2.00 0.00 0.00 174.74 173.03 1bbw s VAL 361 N 11.15 3.47 0.75 -5.38 1.01 -1.26 -4.98 120.40 125.16 1bbw s VAL 361 Ca 0.72 -0.12 -0.15 0.00 0.00 0.00 0.00 61.98 62.43 1bbw s VAL 361 Cb -0.05 -4.15 0.05 0.00 0.00 0.00 0.00 36.38 32.23 1bbw s VAL 361 CO 0.05 -1.09 1.23 -1.61 0.00 0.00 0.00 175.10 173.68 1bbw s GLU 362 N 6.74 1.95 0.50 2.72 2.02 -1.26 -4.92 118.70 126.45 1bbw s GLU 362 Ca 0.64 1.85 0.15 0.00 0.02 0.00 0.00 54.97 57.63 1bbw s GLU 362 Cb -0.08 -1.80 1.20 0.00 0.10 0.00 0.00 34.13 33.54 1bbw s GLU 362 CO 0.08 -2.00 2.13 1.57 0.02 0.00 0.00 175.26 177.06 1bbw h LYS 363 N -0.41 0.10 0.00 1.61 5.09 -2.06 -3.00 116.57 117.90 1bbw h LYS 363 Ca -0.48 -0.01 -0.17 0.00 0.09 0.00 0.00 60.65 60.09 1bbw h LYS 363 Cb 1.31 -0.02 -0.02 0.00 0.10 0.00 0.00 32.23 33.59 1bbw h LYS 363 CO 0.49 0.07 -0.82 0.66 -2.09 0.00 0.00 179.45 177.75 1bbw h SER 364 N 0.10 0.00 -1.90 7.07 4.64 -2.02 -3.46 113.55 117.98 1bbw h SER 364 Ca 0.03 0.00 -0.65 0.00 -0.47 0.00 0.00 61.79 60.70 1bbw h SER 364 Cb 0.01 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.12 1bbw h SER 364 CO -0.01 0.82 0.95 0.79 -0.87 0.00 0.00 176.83 178.51 1bbw n TRP 365 N -3.53 2.18 -4.05 4.77 8.01 -1.14 -5.00 117.44 118.68 1bbw n TRP 365 Ca -0.00 0.23 -0.24 0.00 -1.31 0.00 0.00 57.50 56.18 1bbw n TRP 365 Cb 0.79 -2.56 -0.04 0.00 -2.01 0.00 0.00 31.31 27.49 1bbw n TRP 365 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1bbw s GLY 366 N 3.20 1.54 0.11 6.99 0.00 -1.26 -4.89 107.32 113.01 1bbw s GLY 366 Ca 0.92 -1.25 0.01 0.00 0.00 0.00 0.00 44.72 44.40 1bbw s GLY 366 CO 0.53 -1.27 0.57 -0.10 0.00 0.00 0.00 173.10 172.84 1bbw n LEU 367 N -0.80 -0.03 -0.32 0.66 7.94 -1.26 -0.10 117.00 123.08 1bbw n LEU 367 Ca -0.08 0.62 0.00 0.00 -1.11 0.00 0.00 56.01 55.44 1bbw n LEU 367 Cb 0.56 -0.23 0.14 0.00 0.53 0.00 0.00 43.42 44.42 1bbw n LEU 367 CO 0.44 -0.63 1.22 1.23 -1.11 0.00 0.00 177.39 178.54 1bbw h GLY 368 N 0.00 1.32 1.60 -3.96 0.00 -1.95 -1.88 103.07 98.20 1bbw h GLY 368 Ca 0.23 -0.42 -0.28 0.00 0.00 0.00 0.00 47.33 46.86 1bbw h GLY 368 CO -0.34 0.32 -1.27 -0.09 0.00 0.00 0.00 176.54 175.16 1bbw h ARG 369 N 1.05 0.29 0.02 4.80 9.65 -0.89 -2.41 114.38 126.89 1bbw h ARG 369 Ca 0.37 -0.50 0.01 0.00 -1.10 0.00 0.00 59.98 58.77 1bbw h ARG 369 Cb 0.11 0.19 -0.02 0.00 -1.39 0.00 0.00 29.97 28.85 1bbw h ARG 369 CO -0.15 1.24 -0.10 0.82 2.80 0.00 0.00 179.97 184.58 1bbw h ILE 370 N 0.08 0.75 0.17 1.20 2.04 -1.42 0.88 117.51 121.21 1bbw h ILE 370 Ca -0.15 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 1bbw h ILE 370 Cb 1.99 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 1bbw h ILE 370 CO 0.21 0.00 -0.08 0.58 0.00 0.00 0.00 178.15 178.86 1bbw h VAL 371 N -0.18 0.86 -0.91 1.67 2.07 -1.42 0.21 116.25 118.55 1bbw h VAL 371 Ca 0.03 -0.09 0.05 0.00 0.82 0.00 0.00 66.70 67.51 1bbw h VAL 371 Cb 0.22 0.92 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 1bbw h VAL 371 CO -0.09 0.02 0.58 0.71 0.02 0.00 0.00 177.57 178.81 1bbw h THR 372 N -0.27 1.10 -0.21 2.57 1.35 -1.32 -0.78 112.91 115.35 1bbw h THR 372 Ca -0.02 -0.37 0.02 0.00 -0.55 0.00 0.00 66.41 65.48 1bbw h THR 372 Cb 0.21 -0.08 -0.02 0.00 -1.73 0.00 0.00 68.15 66.52 1bbw h THR 372 CO 0.04 0.20 0.07 -0.08 -0.25 0.00 0.00 175.52 175.50 1bbw h GLU 373 N 1.09 0.17 -0.93 4.72 4.57 -0.39 -1.09 114.58 122.72 1bbw h GLU 373 Ca 0.38 -0.01 0.14 0.00 -1.18 0.00 0.00 59.36 58.69 1bbw h GLU 373 Cb 0.10 -0.04 -0.08 0.00 -0.16 0.00 0.00 28.75 28.57 1bbw h GLU 373 CO -0.15 0.11 0.59 0.82 -1.18 0.00 0.00 179.01 179.20 1bbw h ILE 374 N 0.18 0.86 -0.44 2.32 1.08 0.37 0.15 117.51 122.03 1bbw h ILE 374 Ca 0.09 -0.27 -0.03 0.00 -0.39 0.00 0.00 64.86 64.26 1bbw h ILE 374 Cb 0.06 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 33.79 1bbw h ILE 374 CO -0.09 0.14 0.14 0.15 -0.69 0.00 0.00 178.15 177.80 1bbw h PHE 375 N 0.79 0.70 -0.22 1.37 3.57 -0.02 0.07 116.94 123.20 1bbw h PHE 375 Ca 0.46 -0.07 0.02 0.00 3.53 0.00 0.00 57.97 61.92 1bbw h PHE 375 Cb 0.65 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 1bbw h PHE 375 CO -0.00 0.63 0.08 0.93 -2.23 0.00 0.00 178.31 177.72 1bbw h GLU 376 N 0.57 0.18 0.84 1.11 5.08 0.28 0.08 114.58 122.72 1bbw h GLU 376 Ca 0.14 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1bbw h GLU 376 Cb 0.26 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.47 1bbw h GLU 376 CO -0.01 0.12 -0.40 1.49 -1.00 0.00 0.00 179.01 179.21 1bbw h GLU 377 N 0.19 -1.09 0.26 2.33 4.57 -0.92 -3.27 114.58 116.64 1bbw h GLU 377 Ca 0.09 0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.34 1bbw h GLU 377 Cb 0.06 0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1bbw h GLU 377 CO -0.09 -0.73 -0.12 0.28 -1.18 0.00 0.00 179.01 177.17 1bbw h VAL 378 N -1.30 0.80 0.00 0.32 2.07 -0.95 -3.42 116.25 113.77 1bbw h VAL 378 Ca -0.12 -0.50 0.00 0.00 0.82 0.00 0.00 66.70 66.90 1bbw h VAL 378 Cb 0.87 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1bbw h VAL 378 CO 0.19 0.11 -0.62 0.00 0.02 0.00 0.00 177.57 177.27 1bbw n ALA 379 N -2.39 2.35 0.03 1.67 0.00 -0.02 -4.76 120.51 117.39 1bbw n ALA 379 Ca -0.09 -0.10 -0.11 0.00 0.00 0.00 0.00 53.44 53.14 1bbw n ALA 379 Cb 0.23 -0.14 -0.04 0.00 0.00 0.00 0.00 19.45 19.50 1bbw n ALA 379 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1bbw h GLU 380 N 0.00 -0.35 -0.00 0.00 4.81 -1.50 -2.90 114.58 114.64 1bbw h GLU 380 Ca 0.00 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 1bbw h GLU 380 Cb 0.13 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.59 1bbw h GLU 380 CO 0.00 -0.23 0.01 0.00 -0.73 0.00 0.00 179.01 178.05 1bbw h ALA 381 N 0.51 1.49 -0.00 2.92 0.00 -1.80 -1.87 119.26 120.50 1bbw h ALA 381 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1bbw h ALA 381 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1bbw h ALA 381 CO -0.28 -0.01 -0.17 0.72 0.00 0.00 0.00 179.25 179.51 1bbw n HIS 382 N -3.78 0.00 -1.61 0.00 8.25 -1.10 -4.48 115.22 112.51 1bbw n HIS 382 Ca -0.03 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.03 1bbw n HIS 382 Cb 0.09 -0.28 -0.04 0.00 1.12 0.00 0.00 29.99 30.87 1bbw n HIS 382 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1bbw n LEU 383 N -1.22 4.57 -0.09 2.41 4.77 -0.70 -4.58 117.00 122.16 1bbw n LEU 383 Ca 0.10 -3.32 -0.17 0.00 -0.03 0.00 0.00 56.01 52.59 1bbw n LEU 383 Cb 0.31 -1.42 -0.12 0.00 -2.33 0.00 0.00 43.42 39.86 1bbw n LEU 383 CO 0.27 -0.29 -0.08 0.40 -1.33 0.00 0.00 177.39 176.37 1bbw h ILE 384 N 4.83 1.28 -4.19 -0.08 1.08 -1.86 0.08 117.51 118.64 1bbw h ILE 384 Ca 0.42 -2.20 -0.50 0.00 -0.39 0.00 0.00 64.86 62.19 1bbw h ILE 384 Cb 0.74 2.65 0.15 0.00 -3.07 0.00 0.00 36.82 37.28 1bbw h ILE 384 CO 1.75 0.43 0.28 -1.10 -0.69 0.00 0.00 178.15 178.82 1bbw s GLN 385 N -2.27 1.69 -0.03 2.37 -1.52 -1.26 -1.13 119.66 117.50 1bbw s GLN 385 Ca -0.23 1.07 -0.29 0.00 -1.95 0.00 0.00 55.36 53.95 1bbw s GLN 385 Cb 0.01 -1.84 -0.08 0.00 -0.22 0.00 0.00 33.01 30.89 1bbw s GLN 385 CO 0.61 -2.01 2.04 -2.14 -0.25 0.00 0.00 175.29 173.54 1bbw s PRO 386 N -4.88 3.87 0.00 2.91 0.02 -1.26 -4.51 135.00 131.16 1bbw s PRO 386 Ca 0.63 2.46 -0.00 0.00 0.02 0.00 0.00 61.00 64.11 1bbw s PRO 386 Cb -0.18 -4.22 -0.00 0.00 0.02 0.00 0.00 34.50 30.11 1bbw s PRO 386 CO 0.57 -1.27 -0.01 0.99 -0.33 0.00 0.00 177.00 176.95 1bbw s THR 387 N 5.50 0.02 -0.17 0.99 2.01 0.95 -1.18 115.64 123.77 1bbw s THR 387 Ca 0.92 -0.20 -0.06 0.00 0.31 0.00 0.00 61.69 62.66 1bbw s THR 387 Cb -0.40 -0.07 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 1bbw s THR 387 CO 0.40 -0.11 0.02 -0.36 -0.69 0.00 0.00 174.62 173.88 1bbw s PHE 388 N -0.33 3.16 -0.16 4.92 0.08 0.96 0.49 117.98 127.10 1bbw s PHE 388 Ca -0.04 -0.07 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 1bbw s PHE 388 Cb -0.02 -2.02 -0.01 0.00 -0.57 0.00 0.00 43.02 40.40 1bbw s PHE 388 CO -0.00 0.09 -0.12 0.42 -0.10 0.00 0.00 175.22 175.51 1bbw s ILE 389 N 0.31 2.92 0.52 0.64 -1.09 -0.47 -0.01 121.20 124.02 1bbw s ILE 389 Ca 0.00 -0.68 0.03 0.00 -2.23 0.00 0.00 60.65 57.77 1bbw s ILE 389 Cb -0.13 -2.25 0.00 0.00 -1.58 0.00 0.00 42.46 38.50 1bbw s ILE 389 CO 0.01 0.50 0.15 0.42 -1.23 0.00 0.00 174.94 174.79 1bbw s THR 390 N 0.80 1.36 -0.72 2.92 -4.23 0.41 -1.34 115.64 114.84 1bbw s THR 390 Ca -0.04 -1.82 -0.03 0.00 -1.18 0.00 0.00 61.69 58.62 1bbw s THR 390 Cb -0.15 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.51 1bbw s THR 390 CO 0.01 0.00 0.67 -0.62 -0.54 0.00 0.00 174.62 174.13 1bbw n GLU 391 N -1.44 -1.49 -3.34 3.99 1.02 -1.09 -1.39 120.64 116.90 1bbw n GLU 391 Ca -0.13 1.38 -0.38 0.00 -0.02 0.00 0.00 57.16 58.01 1bbw n GLU 391 Cb 0.66 -4.81 -0.06 0.00 -0.02 0.00 0.00 31.44 27.21 1bbw n GLU 391 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1bbw s TYR 392 N -2.91 3.75 0.71 -0.32 1.51 -1.25 -4.33 117.35 114.51 1bbw s TYR 392 Ca 0.03 1.17 -0.16 0.00 -1.01 0.00 0.00 57.07 57.10 1bbw s TYR 392 Cb -0.01 -2.42 -0.04 0.00 -0.11 0.00 0.00 41.96 39.38 1bbw s TYR 392 CO 0.79 0.57 0.58 -2.30 -1.11 0.00 0.00 175.55 174.08 1bbw n PRO 393 N 1.58 0.34 -0.12 -1.71 -0.02 -1.26 -1.39 135.00 132.42 1bbw n PRO 393 Ca -0.10 0.16 -0.09 0.00 -2.02 0.00 0.00 63.50 61.44 1bbw n PRO 393 Cb 0.51 -1.86 -0.01 0.00 -0.02 0.00 0.00 33.50 32.11 1bbw n PRO 393 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bbw h ALA 394 N -0.32 0.46 -0.21 3.55 0.00 -1.52 -3.24 119.26 117.97 1bbw h ALA 394 Ca -0.46 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.36 1bbw h ALA 394 Cb 1.35 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.97 1bbw h ALA 394 CO 0.43 0.03 -0.20 1.49 0.00 0.00 0.00 179.25 181.01 1bbw h GLU 395 N 0.43 -0.09 0.00 0.00 4.81 -1.90 0.62 114.58 118.46 1bbw h GLU 395 Ca 0.12 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1bbw h GLU 395 Cb 0.15 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1bbw h GLU 395 CO -0.01 -0.06 0.00 1.33 -0.73 0.00 0.00 179.01 179.54 1bbw n VAL 396 N -3.68 0.00 -3.67 0.32 0.24 -1.25 -4.76 118.33 105.54 1bbw n VAL 396 Ca -0.01 0.00 -0.35 0.00 -2.04 0.00 0.00 64.34 61.95 1bbw n VAL 396 Cb 0.11 -0.52 -0.05 0.00 -1.47 0.00 0.00 33.84 31.90 1bbw n VAL 396 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1bbw s SER 397 N -1.78 6.57 0.00 -1.34 0.01 0.21 -5.03 113.70 112.34 1bbw s SER 397 Ca 0.09 0.68 0.00 0.00 1.31 0.00 0.00 55.95 58.03 1bbw s SER 397 Cb 0.04 -2.13 0.00 0.00 0.21 0.00 0.00 66.02 64.14 1bbw s SER 397 CO 0.07 0.21 0.00 -0.81 0.41 0.00 0.00 173.24 173.12 1bbw n PRO 398 N 1.01 0.00 -2.64 12.44 -0.04 -1.26 -4.67 135.00 139.84 1bbw n PRO 398 Ca -0.10 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.94 1bbw n PRO 398 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.99 1bbw n PRO 398 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1bbw n LEU 399 N 0.00 6.30 -4.73 1.53 -0.00 -1.26 -4.97 117.00 113.87 1bbw n LEU 399 Ca 0.00 -4.75 -0.36 0.00 -0.00 0.00 0.00 56.01 50.89 1bbw n LEU 399 Cb 0.00 -1.46 -0.07 0.00 -0.00 0.00 0.00 43.42 41.89 1bbw n LEU 399 CO 0.00 1.33 -0.04 0.00 -0.00 0.00 0.00 177.39 178.68 1bbw s ALA 400 N -0.16 3.61 -0.25 1.47 0.00 -1.26 -4.37 121.76 120.79 1bbw s ALA 400 Ca 0.38 -0.49 -0.29 0.00 0.00 0.00 0.00 51.96 51.56 1bbw s ALA 400 Cb 0.05 -2.36 -0.03 0.00 0.00 0.00 0.00 23.12 20.79 1bbw s ALA 400 CO 0.02 0.10 1.78 0.50 0.00 0.00 0.00 175.76 178.16 1bbw s ARG 401 N 0.45 3.54 0.43 0.00 3.52 -1.25 -4.90 118.95 120.74 1bbw s ARG 401 Ca 0.15 1.65 -0.26 0.00 -0.13 0.00 0.00 55.73 57.14 1bbw s ARG 401 Cb -0.13 -4.15 -0.09 0.00 -1.56 0.00 0.00 34.95 29.02 1bbw s ARG 401 CO 0.03 -1.61 1.42 1.03 -0.81 0.00 0.00 175.30 175.36 1bbw s ARG 402 N 5.27 3.81 0.00 5.12 0.52 -1.26 -0.86 118.95 131.56 1bbw s ARG 402 Ca 0.79 2.42 -0.30 0.00 -0.52 0.00 0.00 55.73 58.12 1bbw s ARG 402 Cb -0.26 -2.74 -0.04 0.00 0.52 0.00 0.00 34.95 32.43 1bbw s ARG 402 CO 0.33 -0.71 1.16 1.21 0.02 0.00 0.00 175.30 177.31 1bbw s ASN 403 N -0.46 7.11 0.14 0.23 3.84 -0.74 -4.72 114.94 120.34 1bbw s ASN 403 Ca 0.59 1.88 -0.18 0.00 0.21 0.00 0.00 52.86 55.35 1bbw s ASN 403 Cb -0.44 -2.57 0.03 0.00 -0.55 0.00 0.00 41.25 37.72 1bbw s ASN 403 CO 0.57 -0.48 1.73 0.44 -2.79 0.00 0.00 177.10 176.56 1bbw h ASP 404 N 7.07 -0.02 -0.25 -4.21 3.32 -1.92 -1.03 116.42 119.38 1bbw h ASP 404 Ca -0.38 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 56.64 1bbw h ASP 404 Cb 1.19 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.81 1bbw h ASP 404 CO 0.83 0.02 -0.15 0.58 -1.72 0.00 0.00 179.24 178.80 1bbw h VAL 405 N 0.14 1.31 -2.80 -1.35 2.07 -1.99 -3.40 116.25 110.23 1bbw h VAL 405 Ca 0.14 -1.25 -0.55 0.00 0.82 0.00 0.00 66.70 65.85 1bbw h VAL 405 Cb 0.15 1.59 -0.40 0.00 -1.52 0.00 0.00 31.29 31.12 1bbw h VAL 405 CO -0.19 0.39 -0.79 0.21 0.02 0.00 0.00 177.57 177.21 1bbw s ASN 406 N -6.25 3.48 0.00 0.57 2.47 -1.13 -5.00 114.94 109.08 1bbw s ASN 406 Ca -0.13 -1.57 0.12 0.00 0.42 0.00 0.00 52.86 51.69 1bbw s ASN 406 Cb 0.07 -0.45 0.63 0.00 -1.45 0.00 0.00 41.25 40.05 1bbw s ASN 406 CO 0.78 -0.40 1.22 -0.81 -3.72 0.00 0.00 177.10 174.18 1bbw n PRO 407 N 4.88 0.24 0.24 0.43 -0.04 -0.40 -2.66 135.00 137.68 1bbw n PRO 407 Ca -0.01 0.11 0.11 0.00 -0.04 0.00 0.00 63.50 63.67 1bbw n PRO 407 Cb 0.41 -1.50 0.60 0.00 -0.04 0.00 0.00 33.50 32.97 1bbw n PRO 407 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1bbw h GLU 408 N 0.00 0.00 -5.65 0.54 4.39 -1.94 -3.42 114.58 108.49 1bbw h GLU 408 Ca 0.00 0.00 -0.62 0.00 0.34 0.00 0.00 59.36 59.08 1bbw h GLU 408 Cb 0.07 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.59 1bbw h GLU 408 CO 0.00 0.18 -0.60 0.96 -1.16 0.00 0.00 179.01 178.39 1bbw s ILE 409 N -3.98 1.98 0.28 3.13 -5.25 -1.09 -1.41 121.20 114.86 1bbw s ILE 409 Ca -0.02 -2.01 0.12 0.00 -0.99 0.00 0.00 60.65 57.75 1bbw s ILE 409 Cb 0.12 -2.97 -0.05 0.00 2.95 0.00 0.00 42.46 42.51 1bbw s ILE 409 CO 0.61 -0.01 -0.20 0.42 -1.79 0.00 0.00 174.94 173.98 1bbw s THR 410 N -2.73 2.45 -1.39 8.37 -4.23 -0.48 -1.79 115.64 115.83 1bbw s THR 410 Ca 0.35 -2.40 -0.12 0.00 -1.18 0.00 0.00 61.69 58.34 1bbw s THR 410 Cb 0.10 -2.30 0.09 0.00 1.34 0.00 0.00 72.50 71.72 1bbw s THR 410 CO 0.18 -0.40 2.09 0.47 -0.54 0.00 0.00 174.62 176.42 1bbw n ASP 411 N -0.62 4.35 -4.10 3.99 9.92 -0.04 -3.91 116.55 126.15 1bbw n ASP 411 Ca -0.05 -2.95 -0.10 0.00 -0.53 0.00 0.00 54.79 51.16 1bbw n ASP 411 Cb 0.60 -1.59 -0.11 0.00 -0.64 0.00 0.00 41.12 39.39 1bbw n ASP 411 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1bbw s ARG 412 N 2.08 0.64 0.04 -1.24 1.70 -1.26 -2.41 118.95 118.51 1bbw s ARG 412 Ca 0.44 -1.06 0.01 0.00 -0.47 0.00 0.00 55.73 54.65 1bbw s ARG 412 Cb 0.12 -0.11 -0.03 0.00 -0.57 0.00 0.00 34.95 34.37 1bbw s ARG 412 CO -0.05 -0.02 -0.06 -0.59 -1.08 0.00 0.00 175.30 173.50 1bbw s PHE 413 N -2.80 0.55 -0.04 5.89 -0.12 -0.49 -2.69 117.98 118.27 1bbw s PHE 413 Ca 0.01 -0.62 0.06 0.00 -0.05 0.00 0.00 56.93 56.34 1bbw s PHE 413 Cb -0.00 -0.34 -0.01 0.00 -0.63 0.00 0.00 43.02 42.03 1bbw s PHE 413 CO -0.04 -0.16 -0.24 -1.21 -0.05 0.00 0.00 175.22 173.52 1bbw s GLU 414 N -2.05 2.30 -0.13 1.99 2.02 -0.45 -1.51 118.70 120.87 1bbw s GLU 414 Ca -0.08 -0.87 -0.07 0.00 0.02 0.00 0.00 54.97 53.97 1bbw s GLU 414 Cb -0.06 -2.03 -0.04 0.00 0.10 0.00 0.00 34.13 32.09 1bbw s GLU 414 CO -0.02 0.42 0.12 0.12 0.02 0.00 0.00 175.26 175.92 1bbw s PHE 415 N -0.29 3.49 -0.02 1.61 5.36 -1.10 -1.37 117.98 125.66 1bbw s PHE 415 Ca 0.01 0.42 0.03 0.00 -0.96 0.00 0.00 56.93 56.43 1bbw s PHE 415 Cb -0.12 -1.97 -0.00 0.00 -0.34 0.00 0.00 43.02 40.59 1bbw s PHE 415 CO 0.02 0.59 -0.10 -0.06 -1.46 0.00 0.00 175.22 174.21 1bbw s PHE 416 N -0.67 0.95 -0.11 10.12 0.08 0.18 -0.87 117.98 127.65 1bbw s PHE 416 Ca 0.13 -0.21 -0.05 0.00 0.12 0.00 0.00 56.93 56.92 1bbw s PHE 416 Cb -0.12 -0.64 0.05 0.00 -0.57 0.00 0.00 43.02 41.74 1bbw s PHE 416 CO 0.02 -0.06 0.26 0.42 -0.10 0.00 0.00 175.22 175.76 1bbw s ILE 417 N -0.04 -0.09 -1.47 0.64 1.01 -0.57 -0.04 121.20 120.63 1bbw s ILE 417 Ca 0.01 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.82 1bbw s ILE 417 Cb -0.06 -0.40 0.00 0.00 0.01 0.00 0.00 42.46 42.01 1bbw s ILE 417 CO 0.00 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.62 1bbw n GLY 418 N 4.40 -0.06 2.39 6.18 0.00 -0.29 -1.75 105.19 116.06 1bbw n GLY 418 Ca -0.22 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1bbw n GLY 418 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bbw n GLY 419 N -1.01 0.52 3.59 -0.02 0.00 0.01 -4.91 105.19 103.38 1bbw n GLY 419 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1bbw n GLY 419 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bbw s ARG 420 N -0.28 2.16 -0.34 1.61 0.52 -0.72 -4.56 118.95 117.34 1bbw s ARG 420 Ca 0.00 -1.10 -0.28 0.00 -0.52 0.00 0.00 55.73 53.83 1bbw s ARG 420 Cb 0.00 -2.28 0.02 0.00 0.52 0.00 0.00 34.95 33.21 1bbw s ARG 420 CO 0.00 0.48 1.03 -2.00 0.02 0.00 0.00 175.30 174.83 1bbw s GLU 421 N -2.51 3.98 -0.15 3.54 2.12 -1.26 -1.52 118.70 122.91 1bbw s GLU 421 Ca 0.23 0.89 0.08 0.00 0.36 0.00 0.00 54.97 56.54 1bbw s GLU 421 Cb -0.10 -3.76 -0.15 0.00 0.26 0.00 0.00 34.13 30.38 1bbw s GLU 421 CO 0.15 -0.93 -0.02 -0.89 -0.54 0.00 0.00 175.26 173.02 1bbw n ILE 422 N 5.95 0.95 -4.53 -3.70 2.08 -0.05 -4.88 119.36 115.18 1bbw n ILE 422 Ca 0.10 -0.51 -0.25 0.00 0.56 0.00 0.00 62.75 62.66 1bbw n ILE 422 Cb 0.48 -0.80 -0.06 0.00 -0.75 0.00 0.00 39.64 38.50 1bbw n ILE 422 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1bbw n GLY 423 N 2.34 3.48 3.51 7.39 0.00 -1.03 -2.12 105.19 118.76 1bbw n GLY 423 Ca -0.25 -2.20 -0.14 0.00 0.00 0.00 0.00 46.02 43.43 1bbw n GLY 423 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1bbw s ASN 424 N -3.29 -0.55 -0.28 1.61 3.04 0.36 -2.72 114.94 113.11 1bbw s ASN 424 Ca 0.10 0.45 -0.25 0.00 0.04 0.00 0.00 52.86 53.20 1bbw s ASN 424 Cb 0.01 0.48 0.14 0.00 -1.54 0.00 0.00 41.25 40.33 1bbw s ASN 424 CO 0.07 -0.61 1.13 -0.83 -3.04 0.00 0.00 177.10 173.83 1bbw s GLY 425 N -1.58 -0.03 0.28 1.21 0.00 -0.57 -1.03 107.32 105.60 1bbw s GLY 425 Ca -0.05 2.87 0.04 0.00 0.00 0.00 0.00 44.72 47.58 1bbw s GLY 425 CO 0.02 1.83 0.22 -1.36 0.00 0.00 0.00 173.10 173.82 1bbw s PHE 426 N 0.13 1.55 -0.35 1.90 0.40 -0.23 -1.39 117.98 119.99 1bbw s PHE 426 Ca 0.04 -1.56 -0.00 0.00 -0.60 0.00 0.00 56.93 54.81 1bbw s PHE 426 Cb -0.05 -0.66 0.09 0.00 0.51 0.00 0.00 43.02 42.90 1bbw s PHE 426 CO -0.08 -0.79 0.08 -1.12 0.70 0.00 0.00 175.22 174.01 1bbw s SER 427 N -3.30 4.95 0.29 1.36 0.01 -1.01 -2.49 113.70 113.51 1bbw s SER 427 Ca 0.40 -1.78 -0.30 0.00 1.31 0.00 0.00 55.95 55.58 1bbw s SER 427 Cb 0.04 -1.72 -0.12 0.00 0.21 0.00 0.00 66.02 64.43 1bbw s SER 427 CO 0.22 -0.39 1.57 -0.62 0.41 0.00 0.00 173.24 174.43 1bbw n GLU 428 N 4.50 2.61 -2.06 12.44 -0.58 0.25 -3.83 120.64 133.97 1bbw n GLU 428 Ca -0.05 0.93 -0.41 0.00 -0.42 0.00 0.00 57.16 57.21 1bbw n GLU 428 Cb 0.42 -2.70 -0.03 0.00 -0.57 0.00 0.00 31.44 28.57 1bbw n GLU 428 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1bbw s LEU 429 N -0.41 3.43 -0.26 -4.62 2.96 -1.26 -4.54 118.68 113.98 1bbw s LEU 429 Ca 0.64 0.86 0.12 0.00 -0.22 0.00 0.00 54.13 55.54 1bbw s LEU 429 Cb -0.52 -3.13 0.59 0.00 0.50 0.00 0.00 46.19 43.63 1bbw s LEU 429 CO 0.49 -1.93 1.56 -0.46 -1.32 0.00 0.00 176.35 174.69 1bbw n ASN 430 N 11.05 3.69 -4.35 3.68 6.94 -1.26 -4.87 115.26 130.14 1bbw n ASN 430 Ca 0.21 -3.33 -0.46 0.00 -0.02 0.00 0.00 54.58 50.98 1bbw n ASN 430 Cb 0.49 -0.64 -0.01 0.00 -2.36 0.00 0.00 39.78 37.26 1bbw n ASN 430 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1bbw s ASP 431 N -1.87 7.00 0.17 0.53 -1.08 -1.26 -4.72 116.67 115.45 1bbw s ASP 431 Ca 0.47 -3.04 -0.19 0.00 -0.52 0.00 0.00 52.55 49.27 1bbw s ASP 431 Cb 0.39 -2.23 0.11 0.00 -1.46 0.00 0.00 42.92 39.73 1bbw s ASP 431 CO 0.07 -0.49 1.30 0.00 0.52 0.00 0.00 175.17 176.57 1bbw n ALA 432 N 3.69 -0.26 -0.31 3.66 0.00 -1.26 -0.79 120.51 125.24 1bbw n ALA 432 Ca 0.20 0.79 0.06 0.00 0.00 0.00 0.00 53.44 54.49 1bbw n ALA 432 Cb 0.44 -0.28 0.27 0.00 0.00 0.00 0.00 19.45 19.87 1bbw n ALA 432 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1bbw h GLU 433 N 0.00 0.93 -0.15 0.00 5.08 -1.94 0.15 114.58 118.64 1bbw h GLU 433 Ca 0.24 -0.06 -0.18 0.00 -1.00 0.00 0.00 59.36 58.36 1bbw h GLU 433 Cb 0.45 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.49 1bbw h GLU 433 CO -0.82 0.62 -0.61 0.22 -1.00 0.00 0.00 179.01 177.41 1bbw h ASP 434 N 0.96 0.80 0.21 1.42 3.58 -1.39 -2.01 116.42 119.99 1bbw h ASP 434 Ca 0.42 -0.62 0.00 0.00 0.42 0.00 0.00 57.03 57.26 1bbw h ASP 434 Cb 0.35 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 1bbw h ASP 434 CO -0.18 1.28 -0.21 -0.61 -2.88 0.00 0.00 179.24 176.65 1bbw h GLN 435 N 0.37 -0.43 -0.55 0.28 5.75 -0.10 -1.65 115.11 118.78 1bbw h GLN 435 Ca -0.03 0.03 0.08 0.00 -0.15 0.00 0.00 58.65 58.58 1bbw h GLN 435 Cb 1.24 0.10 -0.07 0.00 1.07 0.00 0.00 27.48 29.83 1bbw h GLN 435 CO 0.13 -0.29 0.19 0.00 -2.65 0.00 0.00 178.83 176.21 1bbw h ALA 436 N 0.28 0.68 -0.95 3.38 0.00 -0.77 0.62 119.26 122.50 1bbw h ALA 436 Ca -0.00 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.05 1bbw h ALA 436 Cb 0.42 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1bbw h ALA 436 CO -0.05 -0.22 0.62 0.37 0.00 0.00 0.00 179.25 179.97 1bbw h GLN 437 N 0.36 1.05 0.00 0.00 5.75 -1.07 -2.02 115.11 119.19 1bbw h GLN 437 Ca 0.27 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 58.59 1bbw h GLN 437 Cb 0.32 -0.24 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1bbw h GLN 437 CO -0.28 0.70 -0.57 0.00 -2.65 0.00 0.00 178.83 176.03 1bbw h ARG 438 N 1.09 0.00 0.26 1.69 3.08 0.04 0.60 114.38 121.13 1bbw h ARG 438 Ca 0.41 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.45 1bbw h ARG 438 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1bbw h ARG 438 CO -0.16 0.57 -0.12 0.74 -1.07 0.00 0.00 179.97 179.92 1bbw h PHE 439 N 0.00 -0.32 -0.14 3.04 0.04 -0.54 -2.30 116.94 116.72 1bbw h PHE 439 Ca -0.01 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 1bbw h PHE 439 Cb 1.11 0.11 -0.01 0.00 2.20 0.00 0.00 35.95 39.36 1bbw h PHE 439 CO 0.00 0.00 0.08 -0.07 -0.60 0.00 0.00 178.31 177.72 1bbw h LEU 440 N -0.67 0.16 -0.24 1.54 4.07 -1.36 -2.53 115.31 116.28 1bbw h LEU 440 Ca -0.04 -0.01 0.06 0.00 0.08 0.00 0.00 57.88 57.97 1bbw h LEU 440 Cb 0.47 -0.04 -0.06 0.00 1.08 0.00 0.00 40.66 42.11 1bbw h LEU 440 CO 0.06 0.13 -0.12 -0.78 -1.08 0.00 0.00 178.44 176.65 1bbw h ASP 441 N 0.19 -0.39 -3.35 -0.43 1.82 -0.49 -3.17 116.42 110.60 1bbw h ASP 441 Ca 0.05 0.09 -0.80 0.00 -0.39 0.00 0.00 57.03 55.98 1bbw h ASP 441 Cb 0.00 0.22 -0.28 0.00 0.68 0.00 0.00 39.33 39.95 1bbw h ASP 441 CO -0.01 -0.15 0.58 0.00 -1.61 0.00 0.00 179.24 178.05 1bbw n GLN 442 N -5.28 3.76 0.00 0.28 6.02 -0.90 -5.07 117.38 116.19 1bbw n GLN 442 Ca -0.01 -4.46 0.00 0.00 -0.01 0.00 0.00 57.00 52.52 1bbw n GLN 442 Cb 0.20 -2.56 0.00 0.00 1.02 0.00 0.00 30.24 28.90 1bbw n GLN 442 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1bbw n VAL 443 N 2.42 0.00 0.00 5.09 0.24 -1.20 -4.96 118.33 119.92 1bbw n VAL 443 Ca 0.25 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.55 1bbw n VAL 443 Cb 0.38 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.75 1bbw n VAL 443 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1bbw n TYR 456 N 0.00 0.00 -2.83 6.34 4.19 -1.26 -5.16 117.16 118.45 1bbw n TYR 456 Ca 0.00 0.00 -0.43 0.00 3.31 0.00 0.00 57.90 60.78 1bbw n TYR 456 Cb 0.00 0.00 -0.03 0.00 0.49 0.00 0.00 39.34 39.80 1bbw n TYR 456 CO 0.00 0.00 0.00 0.34 0.91 0.00 0.00 176.86 178.11 1bbw s ASP 457 N 0.00 6.28 0.17 2.98 -1.08 -1.26 -4.90 116.67 118.86 1bbw s ASP 457 Ca 0.00 -1.19 -0.16 0.00 -0.52 0.00 0.00 52.55 50.68 1bbw s ASP 457 Cb 0.00 -2.44 0.10 0.00 -1.46 0.00 0.00 42.92 39.13 1bbw s ASP 457 CO 0.00 -1.41 1.69 -0.33 0.52 0.00 0.00 175.17 175.65 1bbw h GLU 458 N 9.48 0.09 0.00 4.34 5.08 -2.03 -0.89 114.58 130.64 1bbw h GLU 458 Ca -0.17 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1bbw h GLU 458 Cb 1.06 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 1bbw h GLU 458 CO 1.19 0.06 -0.01 0.22 -1.00 0.00 0.00 179.01 179.47 1bbw h ASP 459 N 0.09 0.00 0.54 1.42 3.58 -1.99 -0.97 116.42 119.09 1bbw h ASP 459 Ca 0.19 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.62 1bbw h ASP 459 Cb 0.28 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.33 1bbw h ASP 459 CO -0.33 0.01 -0.26 0.22 -2.88 0.00 0.00 179.24 176.00 1bbw h TYR 460 N 0.00 -0.67 -0.81 0.28 3.20 -1.57 -0.59 116.97 116.80 1bbw h TYR 460 Ca -0.00 -0.02 0.15 0.00 3.14 0.00 0.00 58.73 62.00 1bbw h TYR 460 Cb 0.02 0.22 -0.10 0.00 1.54 0.00 0.00 36.73 38.42 1bbw h TYR 460 CO 0.00 -0.34 0.38 0.28 -1.64 0.00 0.00 178.16 176.84 1bbw h VAL 461 N -0.96 0.69 -0.92 1.81 2.07 -1.21 0.59 116.25 118.31 1bbw h VAL 461 Ca -0.07 -0.19 0.04 0.00 0.82 0.00 0.00 66.70 67.30 1bbw h VAL 461 Cb 0.63 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1bbw h VAL 461 CO 0.12 0.10 0.59 0.74 0.02 0.00 0.00 177.57 179.14 1bbw h THR 462 N 0.54 1.12 -0.56 2.57 2.02 -1.05 0.35 112.91 117.90 1bbw h THR 462 Ca 0.45 -0.39 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 1bbw h THR 462 Cb 0.66 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.95 1bbw h THR 462 CO -0.38 0.21 0.23 0.00 0.37 0.00 0.00 175.52 175.95 1bbw h ALA 463 N 1.40 0.73 -0.59 6.16 0.00 0.17 -1.61 119.26 125.52 1bbw h ALA 463 Ca 0.38 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1bbw h ALA 463 Cb 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1bbw h ALA 463 CO -0.14 0.34 0.30 -0.07 0.00 0.00 0.00 179.25 179.68 1bbw h LEU 464 N 0.77 0.76 -2.47 0.00 3.38 0.29 -1.15 115.31 116.89 1bbw h LEU 464 Ca 0.19 -0.11 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1bbw h LEU 464 Cb 0.19 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.74 1bbw h LEU 464 CO -0.02 0.66 0.04 -0.33 0.09 0.00 0.00 178.44 178.88 1bbw h GLU 465 N 0.80 0.00 0.00 1.13 5.08 0.24 0.59 114.58 122.42 1bbw h GLU 465 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 1bbw h GLU 465 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 1bbw h GLU 465 CO -0.03 0.00 -0.12 0.72 -1.00 0.00 0.00 179.01 178.58 1bbw n HIS 466 N -3.77 0.63 0.00 4.33 8.25 -0.46 -4.97 115.22 119.23 1bbw n HIS 466 Ca -0.02 0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.62 1bbw n HIS 466 Cb 0.12 -0.77 0.00 0.00 1.12 0.00 0.00 29.99 30.46 1bbw n HIS 466 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bbw n GLY 467 N 1.36 1.23 3.55 -1.41 0.00 0.21 -5.09 105.19 105.04 1bbw n GLY 467 Ca 0.06 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 1bbw n GLY 467 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1bbw s LEU 468 N 0.00 4.15 1.00 0.99 2.96 -1.23 -4.61 118.68 121.93 1bbw s LEU 468 Ca 0.00 -0.18 -0.13 0.00 -0.22 0.00 0.00 54.13 53.60 1bbw s LEU 468 Cb 0.00 -2.11 0.10 0.00 0.50 0.00 0.00 46.19 44.69 1bbw s LEU 468 CO 0.00 -0.11 0.60 -2.65 -1.32 0.00 0.00 176.35 172.86 1bbw n PRO 469 N 5.06 -0.79 -1.95 0.98 -0.02 -1.26 -4.83 135.00 132.19 1bbw n PRO 469 Ca -0.14 -0.19 -0.41 0.00 -2.02 0.00 0.00 63.50 60.74 1bbw n PRO 469 Cb 0.51 -2.00 -0.02 0.00 -0.02 0.00 0.00 33.50 31.98 1bbw n PRO 469 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1bbw s PRO 470 N -3.94 4.23 -0.01 0.52 0.02 -1.26 -4.84 135.00 129.71 1bbw s PRO 470 Ca 0.61 2.39 -0.09 0.00 0.02 0.00 0.00 61.00 63.92 1bbw s PRO 470 Cb -0.21 -3.05 0.01 0.00 0.02 0.00 0.00 34.50 31.27 1bbw s PRO 470 CO 0.65 -0.41 0.18 0.99 -0.33 0.00 0.00 177.00 178.08 1bbw s THR 471 N -0.60 0.07 -0.11 0.99 2.01 -1.26 0.25 115.64 116.99 1bbw s THR 471 Ca 0.55 -0.54 -0.02 0.00 0.31 0.00 0.00 61.69 61.99 1bbw s THR 471 Cb -0.43 -0.45 -0.03 0.00 0.01 0.00 0.00 72.50 71.59 1bbw s THR 471 CO 0.52 -0.30 -0.02 0.00 -0.69 0.00 0.00 174.62 174.13 1bbw s ALA 472 N -1.15 3.16 -0.06 7.40 0.00 0.40 0.85 121.76 132.36 1bbw s ALA 472 Ca -0.12 -0.82 0.05 0.00 0.00 0.00 0.00 51.96 51.06 1bbw s ALA 472 Cb -0.06 -1.48 -0.02 0.00 0.00 0.00 0.00 23.12 21.56 1bbw s ALA 472 CO 0.02 0.46 -0.20 0.20 0.00 0.00 0.00 175.76 176.25 1bbw s GLY 473 N -0.47 1.41 -0.05 0.00 0.00 -1.04 -0.48 107.32 106.70 1bbw s GLY 473 Ca 0.08 -1.01 0.01 0.00 0.00 0.00 0.00 44.72 43.79 1bbw s GLY 473 CO 0.02 -0.67 -0.04 -2.27 0.00 0.00 0.00 173.10 170.14 1bbw s LEU 474 N -0.37 3.32 -0.06 0.66 2.96 0.13 -1.07 118.68 124.26 1bbw s LEU 474 Ca 0.03 0.00 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 1bbw s LEU 474 Cb -0.12 -1.79 0.01 0.00 0.50 0.00 0.00 46.19 44.79 1bbw s LEU 474 CO 0.02 0.34 -0.11 -0.83 -1.32 0.00 0.00 176.35 174.45 1bbw s GLY 475 N -1.04 0.75 -0.04 7.98 0.00 -0.20 -1.30 107.32 113.48 1bbw s GLY 475 Ca 0.14 -0.37 -0.02 0.00 0.00 0.00 0.00 44.72 44.47 1bbw s GLY 475 CO 0.04 0.17 0.09 -0.42 0.00 0.00 0.00 173.10 172.98 1bbw s ILE 476 N 0.72 -0.04 -0.73 0.90 1.01 -0.00 -0.49 121.20 122.57 1bbw s ILE 476 Ca -0.14 0.14 -0.21 0.00 0.00 0.00 0.00 60.65 60.45 1bbw s ILE 476 Cb -0.16 -0.15 0.10 0.00 0.01 0.00 0.00 42.46 42.26 1bbw s ILE 476 CO 0.03 0.06 0.96 -0.83 0.00 0.00 0.00 174.94 175.16 1bbw s GLY 477 N 0.83 1.62 0.23 6.18 0.00 -0.90 -0.94 107.32 114.34 1bbw s GLY 477 Ca -0.07 -2.20 -0.07 0.00 0.00 0.00 0.00 44.72 42.38 1bbw s GLY 477 CO -0.03 1.95 1.70 -2.22 0.00 0.00 0.00 173.10 174.49 1bbw h ILE 478 N 5.91 0.57 -0.01 0.90 1.08 -1.66 -2.76 117.51 121.54 1bbw h ILE 478 Ca -0.16 -0.09 0.03 0.00 -0.39 0.00 0.00 64.86 64.25 1bbw h ILE 478 Cb 1.06 0.27 -0.05 0.00 -3.07 0.00 0.00 36.82 35.03 1bbw h ILE 478 CO 1.14 0.05 -0.37 0.44 -0.69 0.00 0.00 178.15 178.72 1bbw h ASP 479 N 0.27 -1.13 -0.84 1.72 3.32 -1.92 -0.68 116.42 117.16 1bbw h ASP 479 Ca 0.37 0.14 0.08 0.00 0.02 0.00 0.00 57.03 57.65 1bbw h ASP 479 Cb 0.60 0.45 -0.06 0.00 0.22 0.00 0.00 39.33 40.54 1bbw h ASP 479 CO -0.46 -0.43 0.55 0.03 -1.72 0.00 0.00 179.24 177.21 1bbw h ARG 480 N -0.53 0.84 -0.46 3.56 3.08 -1.86 -0.18 114.38 118.83 1bbw h ARG 480 Ca 0.06 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 1bbw h ARG 480 Cb 0.61 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1bbw h ARG 480 CO -0.30 0.56 0.06 1.98 -1.07 0.00 0.00 179.97 181.20 1bbw h MET 481 N 0.87 0.72 -0.28 0.04 4.05 -1.06 -1.48 114.93 117.79 1bbw h MET 481 Ca 0.38 -0.16 -0.10 0.00 -0.28 0.00 0.00 59.70 59.54 1bbw h MET 481 Cb 0.33 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.02 1bbw h MET 481 CO -0.15 0.70 -0.20 0.28 0.23 0.00 0.00 176.91 177.76 1bbw h VAL 482 N 0.69 1.30 -0.05 -5.77 2.07 0.31 -2.90 116.25 111.91 1bbw h VAL 482 Ca 0.15 -1.34 0.04 0.00 0.82 0.00 0.00 66.70 66.36 1bbw h VAL 482 Cb 0.34 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.61 1bbw h VAL 482 CO 0.01 0.43 -0.24 0.24 0.02 0.00 0.00 177.57 178.02 1bbw h MET 483 N 0.37 -0.34 0.00 1.57 2.07 -0.71 0.28 114.93 118.18 1bbw h MET 483 Ca 0.05 0.02 0.00 0.00 -2.07 0.00 0.00 59.70 57.71 1bbw h MET 483 Cb 0.75 0.08 0.00 0.00 -1.87 0.00 0.00 31.60 30.56 1bbw h MET 483 CO 0.05 -0.23 0.00 1.28 1.07 0.00 0.00 176.91 179.09 1bbw n LEU 484 N -5.36 0.00 -0.00 1.22 4.77 -0.59 -1.30 117.00 115.73 1bbw n LEU 484 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1bbw n LEU 484 Cb 0.28 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.36 1bbw n LEU 484 CO 0.21 0.00 -0.51 0.49 -1.33 0.00 0.00 177.39 176.24 1bbw n PHE 485 N -0.79 0.00 0.20 -1.77 3.01 -0.04 -4.69 117.46 113.39 1bbw n PHE 485 Ca 0.04 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.55 1bbw n PHE 485 Cb 0.02 -0.02 0.06 0.00 -0.01 0.00 0.00 39.48 39.53 1bbw n PHE 485 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1bbw n THR 486 N -1.61 0.32 -0.31 4.37 -2.24 -0.47 -4.99 114.28 109.35 1bbw n THR 486 Ca -0.00 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1bbw n THR 486 Cb 0.10 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.30 1bbw n THR 486 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1bbw n ASN 487 N 0.44 0.00 -4.68 3.42 2.85 -0.42 -4.93 115.26 111.94 1bbw n ASN 487 Ca 0.06 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.13 1bbw n ASN 487 Cb 0.27 -0.02 0.01 0.00 1.24 0.00 0.00 39.78 41.29 1bbw n ASN 487 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1bbw n SER 488 N 0.00 2.16 -0.22 1.20 7.64 -1.13 -4.78 113.62 118.49 1bbw n SER 488 Ca 0.00 1.07 0.04 0.00 1.01 0.00 0.00 58.87 60.99 1bbw n SER 488 Cb 0.00 -1.46 0.08 0.00 -1.01 0.00 0.00 64.21 61.82 1bbw n SER 488 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 1bbw n HIS 489 N -0.37 0.18 -3.76 1.43 8.25 -1.26 -4.52 115.22 115.17 1bbw n HIS 489 Ca 0.08 -0.64 -0.13 0.00 -0.26 0.00 0.00 57.72 56.77 1bbw n HIS 489 Cb 0.40 -0.09 -0.10 0.00 1.12 0.00 0.00 29.99 31.32 1bbw n HIS 489 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1bbw s THR 490 N -1.56 0.02 0.38 1.59 -1.32 -1.26 -5.05 115.64 108.44 1bbw s THR 490 Ca 0.15 -0.17 0.07 0.00 -1.21 0.00 0.00 61.69 60.54 1bbw s THR 490 Cb 0.11 -0.53 0.30 0.00 -1.51 0.00 0.00 72.50 70.87 1bbw s THR 490 CO 0.05 -0.09 1.97 -0.29 -2.21 0.00 0.00 174.62 174.05 1bbw h ILE 491 N 4.35 1.01 0.00 5.08 2.10 -1.91 -1.53 117.51 126.61 1bbw h ILE 491 Ca -0.28 -0.23 -0.00 0.00 1.08 0.00 0.00 64.86 65.43 1bbw h ILE 491 Cb 1.18 0.27 -0.00 0.00 -1.09 0.00 0.00 36.82 37.18 1bbw h ILE 491 CO 0.33 0.12 -0.01 0.03 -1.08 0.00 0.00 178.15 177.55 1bbw h ARG 492 N 0.68 0.00 0.00 2.19 3.08 -1.92 -0.09 114.38 118.32 1bbw h ARG 492 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1bbw h ARG 492 Cb 0.27 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.32 1bbw h ARG 492 CO -0.09 0.01 0.00 -0.25 -1.07 0.00 0.00 179.97 178.57 1bbw n ASP 493 N -3.60 0.00 0.00 7.04 8.00 -0.58 -3.41 116.55 124.01 1bbw n ASP 493 Ca -0.03 0.39 0.00 0.00 0.71 0.00 0.00 54.79 55.86 1bbw n ASP 493 Cb 0.09 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.74 1bbw n ASP 493 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1bbw n VAL 494 N -1.46 0.70 -3.99 2.53 0.24 -0.05 -4.87 118.33 111.42 1bbw n VAL 494 Ca 0.07 -0.84 -0.31 0.00 -2.04 0.00 0.00 64.34 61.22 1bbw n VAL 494 Cb 0.24 0.66 -0.15 0.00 -1.47 0.00 0.00 33.84 33.12 1bbw n VAL 494 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1bbw s ILE 495 N -0.70 1.92 0.46 1.34 1.01 -1.18 -5.00 121.20 119.05 1bbw s ILE 495 Ca 0.00 -1.74 0.36 0.00 0.00 0.00 0.00 60.65 59.27 1bbw s ILE 495 Cb 0.00 -2.23 0.55 0.00 0.01 0.00 0.00 42.46 40.79 1bbw s ILE 495 CO 0.00 -0.29 1.51 0.18 0.00 0.00 0.00 174.94 176.33 1bbw n LEU 496 N 4.47 0.15 -3.20 2.97 4.77 -1.26 -2.60 117.00 122.31 1bbw n LEU 496 Ca -0.06 1.24 -0.24 0.00 -0.03 0.00 0.00 56.01 56.91 1bbw n LEU 496 Cb 0.43 -0.61 -0.07 0.00 -2.33 0.00 0.00 43.42 40.84 1bbw n LEU 496 CO 0.20 -1.32 -0.28 0.49 -1.33 0.00 0.00 177.39 175.15 1bbw n PHE 497 N -4.43 -0.59 -1.00 -1.77 3.01 -1.26 -4.74 117.46 106.69 1bbw n PHE 497 Ca 0.40 -3.44 -0.33 0.00 1.01 0.00 0.00 57.45 55.09 1bbw n PHE 497 Cb 1.64 -0.18 0.13 0.00 -0.01 0.00 0.00 39.48 41.06 1bbw n PHE 497 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 1bbw n PRO 498 N 1.62 0.00 -2.44 -1.08 -0.02 -1.07 -4.90 135.00 127.11 1bbw n PRO 498 Ca 0.22 0.07 -0.41 0.00 -2.02 0.00 0.00 63.50 61.36 1bbw n PRO 498 Cb 0.53 -2.27 -0.04 0.00 -0.02 0.00 0.00 33.50 31.69 1bbw n PRO 498 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1bbw s ALA 499 N -2.24 3.41 0.02 3.55 0.00 -1.26 -5.01 121.76 120.23 1bbw s ALA 499 Ca 0.69 0.90 0.05 0.00 0.00 0.00 0.00 51.96 53.59 1bbw s ALA 499 Cb -0.27 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.44 1bbw s ALA 499 CO 0.55 -0.26 -0.11 -1.64 0.00 0.00 0.00 175.76 174.30 1bbw s MET 500 N -0.65 2.37 -0.21 0.00 -1.94 -1.26 -5.02 119.30 112.59 1bbw s MET 500 Ca 0.49 -0.82 -0.29 0.00 -1.71 0.00 0.00 55.69 53.36 1bbw s MET 500 Cb -0.31 -2.38 -0.02 0.00 2.01 0.00 0.00 34.83 34.12 1bbw s MET 500 CO 0.38 0.58 1.42 -0.98 -0.01 0.00 0.00 175.02 176.40 1bbw s ARG 501 N -1.43 4.00 0.00 2.03 3.03 -1.26 -5.17 118.95 120.15 1bbw s ARG 501 Ca 0.16 1.59 0.00 0.00 2.03 0.00 0.00 55.73 59.51 1bbw s ARG 501 Cb -0.11 -3.90 0.00 0.00 -1.03 0.00 0.00 34.95 29.91 1bbw s ARG 501 CO 0.07 -1.02 0.00 -2.30 -1.13 0.00 0.00 175.30 170.92