#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bbw s LEU 5 N 0.00 4.31 0.30 3.14 1.43 -1.26 -5.05 118.68 121.55 2bbw s LEU 5 Ca 0.00 0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 53.64 2bbw s LEU 5 Cb 0.00 -3.16 -0.10 0.00 0.03 0.00 0.00 46.19 42.96 2bbw s LEU 5 CO 0.00 0.11 1.25 -0.22 0.23 0.00 0.00 176.35 177.72 2bbw s LEU 6 N -2.13 4.46 -0.47 1.79 2.96 -1.26 -4.93 118.68 119.10 2bbw s LEU 6 Ca 0.37 2.53 0.03 0.00 -0.22 0.00 0.00 54.13 56.83 2bbw s LEU 6 Cb -0.14 -3.64 0.14 0.00 0.50 0.00 0.00 46.19 43.06 2bbw s LEU 6 CO 0.19 -0.42 0.29 -0.13 -1.32 0.00 0.00 176.35 174.96 2bbw s ARG 7 N -1.45 1.41 0.14 1.98 1.81 -1.26 -1.05 118.95 120.53 2bbw s ARG 7 Ca 0.49 -2.21 0.10 0.00 -1.72 0.00 0.00 55.73 52.39 2bbw s ARG 7 Cb -0.37 -2.38 -0.04 0.00 -0.45 0.00 0.00 34.95 31.71 2bbw s ARG 7 CO 0.47 -1.20 -0.20 0.00 -0.68 0.00 0.00 175.30 173.69 2bbw s ALA 8 N 0.07 2.62 -0.01 2.13 0.00 -0.72 -1.38 121.76 124.46 2bbw s ALA 8 Ca 0.20 -1.45 -0.00 0.00 0.00 0.00 0.00 51.96 50.71 2bbw s ALA 8 Cb -0.18 -0.54 0.01 0.00 0.00 0.00 0.00 23.12 22.41 2bbw s ALA 8 CO -0.04 0.53 0.03 0.08 0.00 0.00 0.00 175.76 176.36 2bbw s VAL 9 N -1.30 -0.02 -0.18 0.00 1.01 -0.29 -1.36 120.40 118.26 2bbw s VAL 9 Ca 0.18 0.09 -0.02 0.00 0.00 0.00 0.00 61.98 62.23 2bbw s VAL 9 Cb -0.10 -0.06 -0.01 0.00 0.00 0.00 0.00 36.38 36.22 2bbw s VAL 9 CO 0.10 0.03 -0.10 -0.63 0.00 0.00 0.00 175.10 174.51 2bbw s ILE 10 N 0.44 3.05 0.24 2.22 -1.09 0.31 -0.73 121.20 125.64 2bbw s ILE 10 Ca -0.04 -0.62 0.11 0.00 -2.23 0.00 0.00 60.65 57.87 2bbw s ILE 10 Cb -0.05 -2.34 -0.05 0.00 -1.58 0.00 0.00 42.46 38.44 2bbw s ILE 10 CO -0.01 0.48 -0.20 -0.76 -1.23 0.00 0.00 174.94 173.21 2bbw s LEU 11 N 1.09 2.54 0.00 2.97 1.43 0.15 -0.90 118.68 125.97 2bbw s LEU 11 Ca 0.00 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.12 2bbw s LEU 11 Cb -0.15 -1.04 0.00 0.00 0.03 0.00 0.00 46.19 45.03 2bbw s LEU 11 CO -0.02 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.19 2bbw n GLY 12 N -0.33 2.41 3.60 -3.19 0.00 -1.26 -1.40 105.19 105.02 2bbw n GLY 12 Ca -0.08 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.07 2bbw n GLY 12 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bbw s PRO 13 N -2.00 0.22 0.04 1.61 0.04 -1.26 -4.86 135.00 128.80 2bbw s PRO 13 Ca 0.00 1.18 -0.38 0.00 0.04 0.00 0.00 61.00 61.84 2bbw s PRO 13 Cb 0.00 -1.66 -0.17 0.00 0.04 0.00 0.00 34.50 32.70 2bbw s PRO 13 CO 0.00 -3.06 1.30 -2.30 0.04 0.00 0.00 177.00 172.99 2bbw n PRO 14 N -4.49 0.89 -0.84 0.56 -0.02 -1.26 -2.19 135.00 127.65 2bbw n PRO 14 Ca 0.08 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 2bbw n PRO 14 Cb 0.53 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.08 2bbw n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bbw n GLY 15 N 2.40 0.83 0.05 -1.23 0.00 -1.26 -4.90 105.19 101.08 2bbw n GLY 15 Ca 0.19 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.33 2bbw n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2bbw n SER 16 N 0.00 0.34 0.00 1.61 3.41 -0.93 -4.87 113.62 113.18 2bbw n SER 16 Ca 0.00 0.55 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 2bbw n SER 16 Cb 0.00 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 2bbw n SER 16 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bbw n GLY 17 N 0.90 1.08 0.22 5.00 0.00 -1.26 -4.94 105.19 106.19 2bbw n GLY 17 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.06 2bbw n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2bbw h LYS 18 N 0.77 0.36 -0.05 1.61 1.57 -1.91 -0.26 116.57 118.66 2bbw h LYS 18 Ca 0.00 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2bbw h LYS 18 Cb 0.00 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 2bbw h LYS 18 CO 0.00 0.24 0.02 0.78 -0.57 0.00 0.00 179.45 179.92 2bbw h GLY 19 N 0.37 0.08 0.38 3.86 0.00 -1.99 -0.08 103.07 105.69 2bbw h GLY 19 Ca 0.28 -0.04 0.05 0.00 0.00 0.00 0.00 47.33 47.62 2bbw h GLY 19 CO -0.30 0.04 -0.16 -0.84 0.00 0.00 0.00 176.54 175.28 2bbw h THR 20 N -0.05 0.56 -0.40 4.70 2.02 -1.91 -0.59 112.91 117.24 2bbw h THR 20 Ca 0.02 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.22 2bbw h THR 20 Cb 0.13 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.07 2bbw h THR 20 CO -0.00 0.00 0.23 0.58 0.37 0.00 0.00 175.52 176.69 2bbw h VAL 21 N -0.17 1.03 -0.94 3.16 2.07 -0.92 -1.88 116.25 118.60 2bbw h VAL 21 Ca 0.11 -0.16 0.06 0.00 0.82 0.00 0.00 66.70 67.54 2bbw h VAL 21 Cb 0.34 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 2bbw h VAL 21 CO -0.28 0.08 0.60 0.00 0.02 0.00 0.00 177.57 177.99 2bbw h GLN 23 N 1.10 0.86 -0.67 0.00 4.20 -0.60 -2.29 115.11 117.71 2bbw h GLN 23 Ca 0.40 -0.12 -0.05 0.00 0.06 0.00 0.00 58.65 58.94 2bbw h GLN 23 Cb 0.14 -0.16 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 2bbw h GLN 23 CO -0.17 0.68 0.21 0.00 -0.67 0.00 0.00 178.83 178.88 2bbw h ARG 24 N 0.83 1.02 -0.74 1.46 -0.00 -0.90 -1.36 114.38 114.70 2bbw h ARG 24 Ca 0.21 -0.21 -0.02 0.00 -0.50 0.00 0.00 59.98 59.46 2bbw h ARG 24 Cb 0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 29.97 29.87 2bbw h ARG 24 CO -0.03 0.88 0.36 0.82 0.00 0.00 0.00 179.97 182.00 2bbw h ILE 25 N 0.99 1.23 -0.21 2.04 2.04 -0.90 -1.18 117.51 121.52 2bbw h ILE 25 Ca 0.22 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 2bbw h ILE 25 Cb 0.28 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 2bbw h ILE 25 CO -0.01 0.27 0.05 0.00 0.00 0.00 0.00 178.15 178.46 2bbw h ALA 26 N 1.36 0.27 -0.86 1.87 0.00 -0.98 0.20 119.26 121.12 2bbw h ALA 26 Ca 0.26 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 55.04 2bbw h ALA 26 Cb 0.09 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2bbw h ALA 26 CO -0.04 -0.07 0.55 1.96 0.00 0.00 0.00 179.25 181.65 2bbw h GLN 27 N 0.14 1.04 0.00 0.00 4.20 -0.99 0.38 115.11 119.89 2bbw h GLN 27 Ca 0.06 -0.06 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 2bbw h GLN 27 Cb 0.28 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 2bbw h GLN 27 CO 0.00 0.69 -1.52 0.09 -0.67 0.00 0.00 178.83 177.42 2bbw n ASN 28 N -4.55 0.63 0.00 1.46 3.02 -0.47 -4.58 115.26 110.77 2bbw n ASN 28 Ca 0.11 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.92 2bbw n ASN 28 Cb 0.10 0.61 0.00 0.00 -0.61 0.00 0.00 39.78 39.88 2bbw n ASN 28 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2bbw n PHE 29 N -2.73 0.00 -2.10 3.10 3.72 0.68 -1.09 117.46 119.05 2bbw n PHE 29 Ca -0.09 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.20 2bbw n PHE 29 Cb 0.76 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.30 2bbw n PHE 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2bbw n GLY 30 N 1.26 0.07 3.55 1.37 0.00 0.12 -4.72 105.19 106.85 2bbw n GLY 30 Ca 0.00 -0.45 -0.39 0.00 0.00 0.00 0.00 46.02 45.18 2bbw n GLY 30 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2bbw s LEU 31 N -2.99 4.29 0.42 0.99 1.98 -1.26 -5.00 118.68 117.11 2bbw s LEU 31 Ca 0.00 -0.25 -0.24 0.00 -2.89 0.00 0.00 54.13 50.76 2bbw s LEU 31 Cb 0.00 -2.13 -0.08 0.00 0.66 0.00 0.00 46.19 44.64 2bbw s LEU 31 CO 0.00 -0.15 1.11 0.00 -1.89 0.00 0.00 176.35 175.42 2bbw s GLN 32 N 1.74 4.02 0.05 1.98 1.03 -1.26 -3.85 119.66 123.36 2bbw s GLN 32 Ca 0.06 1.66 0.04 0.00 0.04 0.00 0.00 55.36 57.16 2bbw s GLN 32 Cb -0.17 -2.53 -0.04 0.00 0.03 0.00 0.00 33.01 30.30 2bbw s GLN 32 CO 0.11 -0.30 -0.01 -3.38 -2.54 0.00 0.00 175.29 169.17 2bbw s HIS 33 N -1.57 3.01 -0.02 9.60 -3.43 -1.26 -3.96 115.29 117.66 2bbw s HIS 33 Ca 0.59 0.01 0.05 0.00 -0.80 0.00 0.00 55.06 54.91 2bbw s HIS 33 Cb -0.26 -1.59 -0.03 0.00 -1.43 0.00 0.00 32.58 29.28 2bbw s HIS 33 CO 0.32 0.46 -0.16 -0.51 -2.00 0.00 0.00 174.74 172.85 2bbw s LEU 34 N -1.97 2.66 0.01 5.38 1.02 0.78 -4.98 118.68 121.59 2bbw s LEU 34 Ca 0.23 -0.28 -0.05 0.00 0.02 0.00 0.00 54.13 54.05 2bbw s LEU 34 Cb -0.12 -1.54 -0.01 0.00 0.02 0.00 0.00 46.19 44.54 2bbw s LEU 34 CO 0.15 0.32 0.09 -0.94 0.02 0.00 0.00 176.35 175.98 2bbw s SER 35 N -0.95 0.11 0.21 2.29 1.04 -1.26 -0.32 113.70 114.83 2bbw s SER 35 Ca 0.13 -0.35 -0.04 0.00 0.48 0.00 0.00 55.95 56.16 2bbw s SER 35 Cb -0.11 0.18 0.17 0.00 0.10 0.00 0.00 66.02 66.37 2bbw s SER 35 CO 0.02 -0.38 1.59 0.77 0.98 0.00 0.00 173.24 176.22 2bbw h SER 36 N 4.22 0.73 -0.56 7.02 4.64 -1.92 -2.66 113.55 125.02 2bbw h SER 36 Ca -0.31 -0.30 0.05 0.00 -0.47 0.00 0.00 61.79 60.76 2bbw h SER 36 Cb 1.20 -0.20 -0.05 0.00 -0.31 0.00 0.00 62.40 63.03 2bbw h SER 36 CO 0.43 1.00 0.28 1.23 -0.87 0.00 0.00 176.83 178.90 2bbw h GLY 37 N 0.97 0.79 0.93 -0.77 0.00 -1.97 0.64 103.07 103.68 2bbw h GLY 37 Ca 0.06 -0.19 -0.01 0.00 0.00 0.00 0.00 47.33 47.19 2bbw h GLY 37 CO 0.07 0.11 0.14 0.84 0.00 0.00 0.00 176.54 177.69 2bbw h HIS 38 N 0.54 0.44 -0.58 5.60 6.17 -1.96 0.23 115.15 125.58 2bbw h HIS 38 Ca 0.25 -0.03 -0.04 0.00 0.71 0.00 0.00 60.37 61.27 2bbw h HIS 38 Cb 0.18 -0.13 -0.03 0.00 2.52 0.00 0.00 27.41 29.94 2bbw h HIS 38 CO -0.10 0.41 0.20 0.74 0.71 0.00 0.00 177.93 179.88 2bbw h PHE 39 N 0.34 0.86 -0.20 5.26 0.04 -1.29 -1.51 116.94 120.44 2bbw h PHE 39 Ca 0.10 -0.06 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 2bbw h PHE 39 Cb 0.14 -0.26 -0.00 0.00 2.20 0.00 0.00 35.95 38.03 2bbw h PHE 39 CO -0.01 0.69 -0.24 1.25 -0.60 0.00 0.00 178.31 179.39 2bbw h LEU 40 N 0.83 0.55 -0.40 1.54 5.85 -0.75 -2.35 115.31 120.59 2bbw h LEU 40 Ca 0.19 -0.50 0.07 0.00 0.84 0.00 0.00 57.88 58.48 2bbw h LEU 40 Cb 0.21 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.03 2bbw h LEU 40 CO -0.01 0.94 0.05 -0.09 -0.34 0.00 0.00 178.44 178.99 2bbw h ARG 41 N 0.18 0.16 -0.93 1.25 2.43 -0.80 -0.13 114.38 116.54 2bbw h ARG 41 Ca 0.03 -0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2bbw h ARG 41 Cb 0.80 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.27 2bbw h ARG 41 CO 0.06 0.11 0.61 0.93 -1.51 0.00 0.00 179.97 180.17 2bbw h GLU 42 N 0.17 1.20 -0.27 0.20 3.07 -1.26 -1.50 114.58 116.19 2bbw h GLU 42 Ca 0.19 -0.07 -0.09 0.00 -0.50 0.00 0.00 59.36 58.89 2bbw h GLU 42 Cb 0.25 -0.27 -0.01 0.00 -0.84 0.00 0.00 28.75 27.88 2bbw h GLU 42 CO -0.28 0.79 -0.18 -0.91 -1.40 0.00 0.00 179.01 177.03 2bbw h ASN 43 N 1.24 0.63 -0.43 1.42 2.35 -0.92 -0.83 115.58 119.04 2bbw h ASN 43 Ca 0.34 -0.44 0.04 0.00 -0.55 0.00 0.00 56.30 55.69 2bbw h ASN 43 Cb -0.12 -0.18 -0.04 0.00 0.05 0.00 0.00 38.32 38.04 2bbw h ASN 43 CO -0.08 0.93 0.22 0.40 -1.65 0.00 0.00 177.43 177.25 2bbw h ILE 44 N 0.33 0.97 -0.74 2.81 2.04 -0.97 -1.26 117.51 120.69 2bbw h ILE 44 Ca 0.05 -0.15 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 2bbw h ILE 44 Cb 0.72 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2bbw h ILE 44 CO 0.05 0.08 0.31 0.11 0.00 0.00 0.00 178.15 178.70 2bbw h LYS 45 N 0.43 1.10 0.00 2.37 6.56 -1.20 -2.52 116.57 123.30 2bbw h LYS 45 Ca 0.19 -0.19 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2bbw h LYS 45 Cb 0.10 -0.18 0.00 0.00 -0.57 0.00 0.00 32.23 31.57 2bbw h LYS 45 CO -0.13 0.89 0.00 0.00 -2.06 0.00 0.00 179.45 178.15 2bbw n ALA 46 N -2.41 2.03 -3.59 3.86 0.00 -0.32 -4.93 120.51 115.16 2bbw n ALA 46 Ca 0.06 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.25 2bbw n ALA 46 Cb 0.17 -1.39 0.05 0.00 0.00 0.00 0.00 19.45 18.28 2bbw n ALA 46 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2bbw n SER 47 N -1.73 -2.24 -4.85 0.00 2.88 -0.53 -5.01 113.62 102.14 2bbw n SER 47 Ca 0.05 -0.78 -0.30 0.00 -1.33 0.00 0.00 58.87 56.52 2bbw n SER 47 Cb 0.29 -4.38 0.08 0.00 -0.75 0.00 0.00 64.21 59.45 2bbw n SER 47 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 2bbw s THR 48 N -3.55 2.84 0.22 2.46 -4.23 -0.86 -4.80 115.64 107.71 2bbw s THR 48 Ca 0.08 0.27 -0.09 0.00 -1.18 0.00 0.00 61.69 60.78 2bbw s THR 48 Cb -0.02 -3.15 0.16 0.00 1.34 0.00 0.00 72.50 70.83 2bbw s THR 48 CO 0.79 -0.36 1.85 -0.08 -0.54 0.00 0.00 174.62 176.28 2bbw h GLU 49 N -1.00 0.85 -0.80 3.99 4.81 -1.95 0.20 114.58 120.67 2bbw h GLU 49 Ca -0.47 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 58.67 2bbw h GLU 49 Cb 1.29 -0.19 -0.04 0.00 0.63 0.00 0.00 28.75 30.44 2bbw h GLU 49 CO 0.62 0.56 0.32 -0.24 -0.73 0.00 0.00 179.01 179.55 2bbw h VAL 50 N 0.87 1.26 -0.32 0.32 3.04 -1.93 -0.36 116.25 119.14 2bbw h VAL 50 Ca 0.30 -0.82 0.04 0.00 -1.01 0.00 0.00 66.70 65.21 2bbw h VAL 50 Cb 0.06 0.30 -0.04 0.00 -2.01 0.00 0.00 31.29 29.60 2bbw h VAL 50 CO -0.13 0.34 0.08 1.23 -1.01 0.00 0.00 177.57 178.08 2bbw h GLY 51 N 1.17 0.38 0.84 3.17 0.00 -1.48 -0.21 103.07 106.93 2bbw h GLY 51 Ca 0.27 -0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.60 2bbw h GLY 51 CO -0.02 0.00 0.46 0.83 0.00 0.00 0.00 176.54 177.81 2bbw h GLU 52 N 0.20 0.87 -0.65 4.80 4.39 -0.42 0.14 114.58 123.91 2bbw h GLU 52 Ca 0.15 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 2bbw h GLU 52 Cb 0.14 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.56 2bbw h GLU 52 CO -0.17 0.58 0.41 0.52 -1.16 0.00 0.00 179.01 179.18 2bbw h MET 53 N 0.90 0.88 -0.28 2.33 2.86 -0.60 -1.99 114.93 119.02 2bbw h MET 53 Ca 0.30 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.87 2bbw h MET 53 Cb 0.04 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.50 2bbw h MET 53 CO -0.12 0.61 0.16 0.00 1.06 0.00 0.00 176.91 178.62 2bbw h ALA 54 N 1.21 0.36 -0.62 6.32 0.00 -0.60 -2.90 119.26 123.03 2bbw h ALA 54 Ca 0.24 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.19 2bbw h ALA 54 Cb -0.05 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 2bbw h ALA 54 CO -0.05 -0.12 0.42 0.87 0.00 0.00 0.00 179.25 180.37 2bbw h LYS 55 N 0.35 0.39 -0.44 0.00 1.57 -0.39 -2.27 116.57 115.78 2bbw h LYS 55 Ca 0.10 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.76 2bbw h LYS 55 Cb 0.04 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 2bbw h LYS 55 CO -0.02 0.25 -0.11 -0.56 -0.57 0.00 0.00 179.45 178.44 2bbw h GLN 56 N 0.40 0.86 0.05 3.15 3.07 -1.16 -0.64 115.11 120.84 2bbw h GLN 56 Ca 0.29 -0.33 -0.00 0.00 0.09 0.00 0.00 58.65 58.70 2bbw h GLN 56 Cb 0.60 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 28.12 2bbw h GLN 56 CO -0.08 0.97 -0.03 1.88 0.09 0.00 0.00 178.83 181.66 2bbw h TYR 57 N 0.69 -0.07 -0.55 0.06 0.05 -1.46 -2.76 116.97 112.93 2bbw h TYR 57 Ca 0.11 -0.00 0.07 0.00 0.05 0.00 0.00 58.73 58.96 2bbw h TYR 57 Cb 0.66 0.02 -0.06 0.00 1.01 0.00 0.00 36.73 38.36 2bbw h TYR 57 CO 0.05 0.04 0.22 0.82 -1.05 0.00 0.00 178.16 178.24 2bbw h ILE 58 N -0.16 0.83 -0.07 -2.88 1.08 -1.30 0.99 117.51 116.01 2bbw h ILE 58 Ca -0.01 -0.14 -0.06 0.00 -0.39 0.00 0.00 64.86 64.26 2bbw h ILE 58 Cb 0.14 0.38 -0.01 0.00 -3.07 0.00 0.00 36.82 34.26 2bbw h ILE 58 CO 0.01 0.08 -0.22 -0.33 -0.69 0.00 0.00 178.15 177.00 2bbw h GLU 59 N 0.42 0.11 -0.08 2.37 3.07 -1.14 -1.17 114.58 118.16 2bbw h GLU 59 Ca 0.27 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 59.10 2bbw h GLU 59 Cb 0.28 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 2bbw h GLU 59 CO -0.25 0.33 0.00 1.63 -1.40 0.00 0.00 179.01 179.32 2bbw n LYS 60 N -4.23 1.30 -2.95 2.33 5.02 -0.77 -4.92 118.16 113.94 2bbw n LYS 60 Ca -0.02 -0.45 -0.19 0.00 -2.02 0.00 0.00 58.31 55.64 2bbw n LYS 60 Cb 0.31 -1.29 0.03 0.00 -0.02 0.00 0.00 35.03 34.06 2bbw n LYS 60 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2bbw n SER 61 N -0.30 -5.46 -4.65 4.39 7.64 -0.44 -5.02 113.62 109.78 2bbw n SER 61 Ca 0.13 -0.26 -0.30 0.00 1.01 0.00 0.00 58.87 59.45 2bbw n SER 61 Cb 0.16 -4.28 -0.08 0.00 -1.01 0.00 0.00 64.21 59.00 2bbw n SER 61 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2bbw s LEU 62 N -5.76 3.32 0.35 -3.43 1.43 0.27 -5.00 118.68 109.86 2bbw s LEU 62 Ca 0.28 -0.27 -0.28 0.00 -1.03 0.00 0.00 54.13 52.83 2bbw s LEU 62 Cb -0.12 -2.06 -0.11 0.00 0.03 0.00 0.00 46.19 43.93 2bbw s LEU 62 CO 0.34 0.16 1.40 -0.76 0.23 0.00 0.00 176.35 177.72 2bbw s LEU 63 N -2.37 4.37 0.06 1.79 1.43 -1.26 -3.73 118.68 118.97 2bbw s LEU 63 Ca 0.25 2.87 -0.31 0.00 -1.03 0.00 0.00 54.13 55.91 2bbw s LEU 63 Cb -0.11 -3.66 -0.07 0.00 0.03 0.00 0.00 46.19 42.37 2bbw s LEU 63 CO 0.17 -0.71 1.53 -0.69 0.23 0.00 0.00 176.35 176.88 2bbw s VAL 64 N -1.13 3.26 0.54 -1.59 1.01 -1.26 -4.91 120.40 116.31 2bbw s VAL 64 Ca 0.51 0.74 -0.22 0.00 0.00 0.00 0.00 61.98 63.01 2bbw s VAL 64 Cb -0.43 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 2bbw s VAL 64 CO 0.58 0.01 1.34 -2.84 0.00 0.00 0.00 175.10 174.19 2bbw s PRO 65 N 2.22 3.20 0.46 2.72 0.02 -1.26 -4.89 135.00 137.48 2bbw s PRO 65 Ca 0.69 2.18 0.20 0.00 0.02 0.00 0.00 61.00 64.09 2bbw s PRO 65 Cb -0.37 -2.27 1.19 0.00 0.02 0.00 0.00 34.50 33.07 2bbw s PRO 65 CO 0.30 -1.12 1.93 -0.44 -0.33 0.00 0.00 177.00 177.33 2bbw h ASP 66 N 1.51 0.26 0.26 2.53 3.32 -2.00 -1.82 116.42 120.49 2bbw h ASP 66 Ca -0.51 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 56.47 2bbw h ASP 66 Cb 1.29 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 2bbw h ASP 66 CO 0.57 0.13 -0.37 1.12 -1.72 0.00 0.00 179.24 178.97 2bbw h HIS 67 N 0.27 0.18 -0.13 4.55 2.07 -1.99 0.13 115.15 120.23 2bbw h HIS 67 Ca 0.36 -0.04 -0.02 0.00 -2.85 0.00 0.00 60.37 57.81 2bbw h HIS 67 Cb 1.02 -0.04 -0.00 0.00 2.57 0.00 0.00 27.41 30.96 2bbw h HIS 67 CO -0.00 0.51 -0.02 0.28 -3.07 0.00 0.00 177.93 175.63 2bbw h VAL 68 N 0.13 1.27 -0.68 6.12 2.07 -1.70 -1.94 116.25 121.53 2bbw h VAL 68 Ca 0.01 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.60 2bbw h VAL 68 Cb 0.72 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.07 2bbw h VAL 68 CO 0.05 0.26 0.28 0.40 0.02 0.00 0.00 177.57 178.58 2bbw h ILE 69 N -0.06 1.24 -0.26 4.57 2.04 -1.43 -1.76 117.51 121.86 2bbw h ILE 69 Ca 0.03 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.16 2bbw h ILE 69 Cb 0.41 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2bbw h ILE 69 CO 0.01 0.30 0.15 0.74 0.00 0.00 0.00 178.15 179.35 2bbw h THR 70 N 0.96 1.04 -0.33 -0.27 2.02 -0.70 0.22 112.91 115.85 2bbw h THR 70 Ca 0.23 -0.11 0.00 0.00 0.77 0.00 0.00 66.41 67.30 2bbw h THR 70 Cb 0.20 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2bbw h THR 70 CO -0.02 0.06 0.21 -0.09 0.37 0.00 0.00 175.52 176.05 2bbw h ARG 71 N 0.32 0.44 -0.10 6.66 2.43 -1.16 0.25 114.38 123.22 2bbw h ARG 71 Ca 0.10 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.24 2bbw h ARG 71 Cb -0.01 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.44 2bbw h ARG 71 CO -0.04 0.30 0.06 1.25 -1.51 0.00 0.00 179.97 180.03 2bbw h LEU 72 N 0.44 0.12 -0.56 3.80 5.85 -1.16 -2.07 115.31 121.73 2bbw h LEU 72 Ca 0.12 -0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2bbw h LEU 72 Cb -0.04 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2bbw h LEU 72 CO -0.03 0.14 0.28 -0.03 -0.34 0.00 0.00 178.44 178.46 2bbw h MET 73 N 0.09 0.80 -0.78 1.25 4.05 -0.69 -0.88 114.93 118.77 2bbw h MET 73 Ca 0.03 -0.11 -0.01 0.00 -0.28 0.00 0.00 59.70 59.34 2bbw h MET 73 Cb 0.05 -0.15 -0.04 0.00 -0.80 0.00 0.00 31.60 30.66 2bbw h MET 73 CO -0.01 0.65 0.46 0.52 0.23 0.00 0.00 176.91 178.76 2bbw h MET 74 N 0.76 1.06 -0.40 0.39 2.86 -0.91 -0.68 114.93 118.01 2bbw h MET 74 Ca 0.19 -0.10 -0.11 0.00 -2.06 0.00 0.00 59.70 57.62 2bbw h MET 74 Cb 0.10 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 2bbw h MET 74 CO -0.03 0.76 -0.19 0.66 1.06 0.00 0.00 176.91 179.18 2bbw h SER 75 N 1.07 0.76 -0.42 1.22 4.64 -1.05 -0.49 113.55 119.28 2bbw h SER 75 Ca 0.28 -0.26 -0.10 0.00 -0.47 0.00 0.00 61.79 61.24 2bbw h SER 75 Cb -0.02 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 2bbw h SER 75 CO -0.05 0.94 -0.13 -0.33 -0.87 0.00 0.00 176.83 176.40 2bbw h GLU 76 N 0.67 0.82 -0.02 4.77 4.39 -0.71 -2.76 114.58 121.75 2bbw h GLU 76 Ca 0.10 -0.33 -0.13 0.00 0.34 0.00 0.00 59.36 59.34 2bbw h GLU 76 Cb 0.68 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.28 2bbw h GLU 76 CO 0.05 0.95 -0.60 -0.07 -1.16 0.00 0.00 179.01 178.18 2bbw h LEU 77 N 0.64 0.07 -0.60 1.33 3.38 -1.05 -2.56 115.31 116.51 2bbw h LEU 77 Ca 0.10 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2bbw h LEU 77 Cb 0.67 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2bbw h LEU 77 CO 0.05 0.65 0.00 -0.62 0.09 0.00 0.00 178.44 178.61 2bbw n GLU 78 N -3.84 0.16 0.00 1.13 1.02 -0.20 -1.43 120.64 117.48 2bbw n GLU 78 Ca -0.02 0.40 0.13 0.00 -0.02 0.00 0.00 57.16 57.65 2bbw n GLU 78 Cb 0.60 -1.81 0.33 0.00 -0.02 0.00 0.00 31.44 30.54 2bbw n GLU 78 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2bbw n ASN 79 N -2.12 1.26 -1.89 1.62 4.05 -0.97 -4.39 115.26 112.82 2bbw n ASN 79 Ca 0.02 -1.07 -0.01 0.00 0.45 0.00 0.00 54.58 53.97 2bbw n ASN 79 Cb 0.21 0.17 0.06 0.00 1.23 0.00 0.00 39.78 41.45 2bbw n ASN 79 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 2bbw n ARG 80 N -0.43 1.40 0.05 1.20 1.74 -0.51 -4.87 116.66 115.23 2bbw n ARG 80 Ca 0.12 -3.06 0.02 0.00 -0.77 0.00 0.00 57.85 54.17 2bbw n ARG 80 Cb 0.37 -1.16 0.36 0.00 -1.02 0.00 0.00 32.46 31.02 2bbw n ARG 80 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2bbw h ARG 81 N 1.73 0.41 -0.28 5.56 -0.00 -1.75 -2.40 114.38 117.65 2bbw h ARG 81 Ca -0.07 -0.07 0.00 0.00 -0.50 0.00 0.00 59.98 59.34 2bbw h ARG 81 Cb 1.49 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 31.39 2bbw h ARG 81 CO 0.21 0.44 0.00 0.41 0.00 0.00 0.00 179.97 181.03 2bbw n GLY 82 N -1.01 0.08 3.64 0.04 0.00 -1.26 -4.89 105.19 101.79 2bbw n GLY 82 Ca 0.01 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.59 2bbw n GLY 82 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2bbw s GLN 83 N -1.72 2.33 0.18 1.61 -0.21 -0.91 -5.08 119.66 115.86 2bbw s GLN 83 Ca 0.11 -1.16 -0.30 0.00 0.02 0.00 0.00 55.36 54.02 2bbw s GLN 83 Cb 0.06 -2.30 -0.08 0.00 1.00 0.00 0.00 33.01 31.68 2bbw s GLN 83 CO 0.07 0.44 1.30 -1.01 -2.12 0.00 0.00 175.29 173.97 2bbw s HIS 84 N -1.77 3.28 -0.12 0.91 3.76 -1.26 -4.74 115.29 115.35 2bbw s HIS 84 Ca 0.27 1.23 -0.03 0.00 -0.15 0.00 0.00 55.06 56.38 2bbw s HIS 84 Cb -0.09 -3.58 -0.03 0.00 1.11 0.00 0.00 32.58 29.99 2bbw s HIS 84 CO 0.18 -1.81 0.00 -1.58 -0.85 0.00 0.00 174.74 170.68 2bbw s TRP 85 N 0.21 3.14 -0.23 1.40 0.51 -0.22 -4.86 118.94 118.89 2bbw s TRP 85 Ca 0.57 0.04 -0.01 0.00 -2.12 0.00 0.00 56.10 54.58 2bbw s TRP 85 Cb -0.36 -1.88 0.07 0.00 -0.81 0.00 0.00 33.47 30.49 2bbw s TRP 85 CO 0.37 0.28 0.01 -1.17 -0.51 0.00 0.00 176.95 175.93 2bbw s LEU 86 N -0.33 2.03 -0.20 2.99 2.96 -1.25 -1.76 118.68 123.10 2bbw s LEU 86 Ca 0.07 -1.14 -0.10 0.00 -0.22 0.00 0.00 54.13 52.73 2bbw s LEU 86 Cb -0.12 -0.91 -0.05 0.00 0.50 0.00 0.00 46.19 45.61 2bbw s LEU 86 CO 0.02 -0.30 0.15 -0.76 -1.32 0.00 0.00 176.35 174.14 2bbw s LEU 87 N 1.60 4.20 -0.39 -0.68 1.43 -0.46 -0.16 118.68 124.22 2bbw s LEU 87 Ca -0.01 0.23 -0.12 0.00 -1.03 0.00 0.00 54.13 53.20 2bbw s LEU 87 Cb -0.18 -2.11 0.03 0.00 0.03 0.00 0.00 46.19 43.96 2bbw s LEU 87 CO -0.10 0.16 0.24 -0.62 0.23 0.00 0.00 176.35 176.26 2bbw s ASP 88 N 0.47 5.86 -0.63 2.29 3.68 0.57 -0.53 116.67 128.38 2bbw s ASP 88 Ca 0.09 -1.00 0.00 0.00 2.13 0.00 0.00 52.55 53.76 2bbw s ASP 88 Cb -0.12 -2.07 0.00 0.00 -1.45 0.00 0.00 42.92 39.29 2bbw s ASP 88 CO -0.01 -0.42 0.00 0.61 0.13 0.00 0.00 175.17 175.48 2bbw n GLY 89 N 5.05 0.81 2.98 2.66 0.00 -0.07 -4.47 105.19 112.15 2bbw n GLY 89 Ca -0.11 -0.47 -0.22 0.00 0.00 0.00 0.00 46.02 45.21 2bbw n GLY 89 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bbw s PHE 90 N -2.11 1.12 0.50 1.61 5.36 -1.26 -3.92 117.98 119.28 2bbw s PHE 90 Ca 0.00 -0.36 -0.20 0.00 -0.96 0.00 0.00 56.93 55.41 2bbw s PHE 90 Cb 0.00 -0.85 -0.08 0.00 -0.34 0.00 0.00 43.02 41.75 2bbw s PHE 90 CO 0.00 -0.20 1.04 -1.25 -1.46 0.00 0.00 175.22 173.35 2bbw s PRO 91 N 0.61 3.73 -0.19 10.12 0.04 -1.26 -4.78 135.00 143.26 2bbw s PRO 91 Ca -0.11 1.35 0.15 0.00 0.04 0.00 0.00 61.00 62.43 2bbw s PRO 91 Cb -0.14 -2.08 -0.24 0.00 0.04 0.00 0.00 34.50 32.08 2bbw s PRO 91 CO 0.02 -0.49 0.10 -2.13 0.04 0.00 0.00 177.00 174.54 2bbw n ARG 92 N -1.12 0.68 -4.47 4.56 0.63 -1.25 -4.93 116.66 110.76 2bbw n ARG 92 Ca 0.09 0.05 -0.24 0.00 -0.92 0.00 0.00 57.85 56.83 2bbw n ARG 92 Cb 0.52 -1.55 -0.10 0.00 0.45 0.00 0.00 32.46 31.78 2bbw n ARG 92 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 2bbw s THR 93 N -2.51 2.48 0.23 5.15 -4.23 -1.26 -4.29 115.64 111.20 2bbw s THR 93 Ca -0.13 -2.40 -0.07 0.00 -1.18 0.00 0.00 61.69 57.92 2bbw s THR 93 Cb 0.07 -2.30 0.19 0.00 1.34 0.00 0.00 72.50 71.80 2bbw s THR 93 CO 0.80 -0.39 1.73 -0.07 -0.54 0.00 0.00 174.62 176.14 2bbw h LEU 94 N 2.30 0.20 -1.09 4.79 3.38 -1.94 -0.87 115.31 122.08 2bbw h LEU 94 Ca -0.40 0.10 0.06 0.00 0.09 0.00 0.00 57.88 57.73 2bbw h LEU 94 Cb 1.26 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 42.05 2bbw h LEU 94 CO 0.60 0.09 0.62 1.23 0.09 0.00 0.00 178.44 181.06 2bbw h GLY 95 N 0.39 1.40 1.54 0.83 0.00 -1.98 -0.03 103.07 105.22 2bbw h GLY 95 Ca 0.37 -0.45 -0.15 0.00 0.00 0.00 0.00 47.33 47.10 2bbw h GLY 95 CO -0.39 0.33 -0.55 1.46 0.00 0.00 0.00 176.54 177.40 2bbw h GLN 96 N 1.11 0.49 -0.08 4.80 4.20 -1.71 -2.32 115.11 121.60 2bbw h GLN 96 Ca 0.40 -0.31 -0.11 0.00 0.06 0.00 0.00 58.65 58.70 2bbw h GLN 96 Cb 0.15 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 2bbw h GLN 96 CO -0.15 0.91 -0.45 0.00 -0.67 0.00 0.00 178.83 178.47 2bbw h ALA 97 N 1.03 1.09 -0.16 3.87 0.00 -0.58 -1.37 119.26 123.14 2bbw h ALA 97 Ca 0.01 -0.43 -0.18 0.00 0.00 0.00 0.00 54.91 54.30 2bbw h ALA 97 Cb 1.08 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.78 2bbw h ALA 97 CO 0.10 0.61 -0.64 0.93 0.00 0.00 0.00 179.25 180.25 2bbw h GLU 98 N 0.16 0.60 -0.24 0.00 5.08 -0.91 -1.88 114.58 117.39 2bbw h GLU 98 Ca 0.01 -0.42 -0.01 0.00 -1.00 0.00 0.00 59.36 57.93 2bbw h GLU 98 Cb 0.86 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.17 2bbw h GLU 98 CO 0.07 1.04 0.09 0.00 -1.00 0.00 0.00 179.01 179.21 2bbw h ALA 99 N 0.86 0.31 -0.76 3.43 0.00 -1.27 -3.03 119.26 118.79 2bbw h ALA 99 Ca -0.01 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.84 2bbw h ALA 99 Cb 1.21 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 2bbw h ALA 99 CO 0.12 -0.09 0.44 1.25 0.00 0.00 0.00 179.25 180.97 2bbw h LEU 100 N 0.23 0.66 -1.18 0.00 5.85 -1.26 -2.25 115.31 117.37 2bbw h LEU 100 Ca 0.08 0.03 0.22 0.00 0.84 0.00 0.00 57.88 59.05 2bbw h LEU 100 Cb 0.19 -0.10 -0.10 0.00 0.37 0.00 0.00 40.66 41.02 2bbw h LEU 100 CO -0.01 0.42 0.62 0.44 -0.34 0.00 0.00 178.44 179.57 2bbw h ASP 101 N 0.80 0.62 0.52 1.25 5.19 -1.22 -1.80 116.42 121.77 2bbw h ASP 101 Ca 0.34 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.85 2bbw h ASP 101 Cb 0.22 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.71 2bbw h ASP 101 CO -0.19 0.18 0.00 0.11 -3.12 0.00 0.00 179.24 176.22 2bbw h LYS 102 N 0.58 0.00 0.00 3.56 1.57 -1.36 -3.26 116.57 117.66 2bbw h LYS 102 Ca 0.58 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.36 2bbw h LYS 102 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 2bbw h LYS 102 CO -0.34 0.00 -0.74 0.44 -0.57 0.00 0.00 179.45 178.24 2bbw n ILE 103 N -2.91 0.00 -3.81 1.86 -5.35 -0.71 -5.08 119.36 103.35 2bbw n ILE 103 Ca -0.01 -0.23 -0.09 0.00 -0.27 0.00 0.00 62.75 62.15 2bbw n ILE 103 Cb 0.18 0.67 -0.03 0.00 -1.74 0.00 0.00 39.64 38.72 2bbw n ILE 103 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2bbw s GLU 105 N -3.91 3.28 -0.26 0.00 8.01 -1.26 -4.30 118.70 120.27 2bbw s GLU 105 Ca 0.12 -0.79 -0.29 0.00 0.01 0.00 0.00 54.97 54.02 2bbw s GLU 105 Cb -0.03 -3.80 -0.01 0.00 -4.31 0.00 0.00 34.13 25.98 2bbw s GLU 105 CO 0.03 -0.54 1.48 0.08 0.01 0.00 0.00 175.26 176.32 2bbw s VAL 106 N 1.68 3.89 -0.76 2.63 1.01 -1.26 -4.74 120.40 122.84 2bbw s VAL 106 Ca 0.05 1.00 0.23 0.00 0.00 0.00 0.00 61.98 63.26 2bbw s VAL 106 Cb -0.18 -3.90 -0.10 0.00 0.00 0.00 0.00 36.38 32.20 2bbw s VAL 106 CO 0.09 -0.37 1.11 -0.90 0.00 0.00 0.00 175.10 175.03 2bbw n ASP 107 N 8.09 0.65 -3.59 3.32 5.68 -0.48 -4.90 116.55 125.33 2bbw n ASP 107 Ca 0.17 -0.33 -0.05 0.00 -0.50 0.00 0.00 54.79 54.08 2bbw n ASP 107 Cb 0.46 0.68 -0.07 0.00 -1.14 0.00 0.00 41.12 41.04 2bbw n ASP 107 CO 0.00 0.00 0.00 -0.22 -1.33 0.00 0.00 177.20 175.65 2bbw s LEU 108 N -3.57 -0.87 -0.13 -2.12 0.20 -1.07 -4.87 118.68 106.26 2bbw s LEU 108 Ca 0.06 1.10 0.01 0.00 0.69 0.00 0.00 54.13 55.99 2bbw s LEU 108 Cb 0.15 1.70 0.02 0.00 -0.43 0.00 0.00 46.19 47.63 2bbw s LEU 108 CO 0.78 -0.24 -0.15 -0.69 -0.29 0.00 0.00 176.35 175.77 2bbw s VAL 109 N 2.72 1.55 -0.20 1.68 1.01 -0.28 -1.13 120.40 125.74 2bbw s VAL 109 Ca 0.00 -0.65 -0.07 0.00 0.00 0.00 0.00 61.98 61.27 2bbw s VAL 109 Cb -0.13 -1.43 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2bbw s VAL 109 CO -0.16 0.45 0.05 -0.63 0.00 0.00 0.00 175.10 174.82 2bbw s ILE 110 N 1.22 4.51 -0.17 2.22 1.01 0.10 -0.06 121.20 130.03 2bbw s ILE 110 Ca -0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.51 2bbw s ILE 110 Cb -0.14 -3.05 -0.00 0.00 0.01 0.00 0.00 42.46 39.28 2bbw s ILE 110 CO -0.06 0.43 -0.12 -0.55 0.00 0.00 0.00 174.94 174.63 2bbw s SER 111 N 0.76 3.85 -0.49 3.58 0.15 -0.48 0.35 113.70 121.42 2bbw s SER 111 Ca 0.03 -0.43 -0.19 0.00 0.70 0.00 0.00 55.95 56.05 2bbw s SER 111 Cb -0.14 -1.61 0.05 0.00 -1.71 0.00 0.00 66.02 62.61 2bbw s SER 111 CO 0.02 0.07 0.62 -0.76 1.20 0.00 0.00 173.24 174.39 2bbw s LEU 112 N 0.92 4.87 -0.87 3.45 1.43 -0.49 -0.69 118.68 127.30 2bbw s LEU 112 Ca -0.03 -0.79 -0.15 0.00 -1.03 0.00 0.00 54.13 52.13 2bbw s LEU 112 Cb -0.15 -2.49 0.20 0.00 0.03 0.00 0.00 46.19 43.79 2bbw s LEU 112 CO -0.01 -0.85 0.87 0.21 0.23 0.00 0.00 176.35 176.80 2bbw s ASN 113 N 2.50 6.78 -0.07 2.29 2.47 0.29 -4.35 114.94 124.86 2bbw s ASN 113 Ca 0.16 -2.62 0.01 0.00 0.42 0.00 0.00 52.86 50.83 2bbw s ASN 113 Cb -0.18 -2.25 -0.03 0.00 -1.45 0.00 0.00 41.25 37.34 2bbw s ASN 113 CO 0.13 -0.66 -0.08 -0.63 -3.72 0.00 0.00 177.10 172.15 2bbw s ILE 114 N 0.61 3.63 0.37 -5.21 1.09 -1.26 -3.08 121.20 117.35 2bbw s ILE 114 Ca 0.22 -0.50 -0.28 0.00 -1.10 0.00 0.00 60.65 58.99 2bbw s ILE 114 Cb -0.09 -2.48 -0.11 0.00 -1.06 0.00 0.00 42.46 38.72 2bbw s ILE 114 CO -0.09 0.60 1.44 -2.65 -0.10 0.00 0.00 174.94 174.14 2bbw n PRO 115 N 2.27 2.54 0.06 2.79 -0.02 -1.26 -4.86 135.00 136.52 2bbw n PRO 115 Ca -0.18 0.89 0.07 0.00 -2.02 0.00 0.00 63.50 62.26 2bbw n PRO 115 Cb 0.53 -2.59 0.50 0.00 -0.02 0.00 0.00 33.50 31.92 2bbw n PRO 115 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2bbw h PHE 116 N 2.83 0.34 0.00 6.00 0.05 -1.99 -1.22 116.94 122.95 2bbw h PHE 116 Ca -0.50 0.01 -0.10 0.00 3.82 0.00 0.00 57.97 61.20 2bbw h PHE 116 Cb 1.25 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 39.07 2bbw h PHE 116 CO 0.52 0.21 -0.48 1.49 -0.18 0.00 0.00 178.31 179.87 2bbw h GLU 117 N 0.36 0.00 -0.29 1.51 4.57 -2.00 -1.45 114.58 117.28 2bbw h GLU 117 Ca 0.13 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 58.24 2bbw h GLU 117 Cb 0.06 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.64 2bbw h GLU 117 CO -0.03 0.48 -0.09 1.15 -1.18 0.00 0.00 179.01 179.35 2bbw h THR 118 N 0.00 1.28 -0.58 0.32 2.02 -1.61 -2.87 112.91 111.48 2bbw h THR 118 Ca -0.00 -1.14 0.04 0.00 0.77 0.00 0.00 66.41 66.07 2bbw h THR 118 Cb 0.87 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 68.66 2bbw h THR 118 CO 0.06 0.36 0.34 -0.07 0.37 0.00 0.00 175.52 176.58 2bbw h LEU 119 N 0.33 0.53 -0.18 2.58 3.38 -1.09 0.27 115.31 121.13 2bbw h LEU 119 Ca 0.07 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2bbw h LEU 119 Cb 0.58 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2bbw h LEU 119 CO 0.03 0.36 0.07 0.11 0.09 0.00 0.00 178.44 179.11 2bbw h LYS 120 N 0.65 0.27 -0.33 1.13 1.57 -1.32 -0.33 116.57 118.22 2bbw h LYS 120 Ca 0.24 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 59.02 2bbw h LYS 120 Cb 0.08 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.30 2bbw h LYS 120 CO -0.13 0.35 0.08 0.22 -0.57 0.00 0.00 179.45 179.40 2bbw h ASP 121 N 0.14 0.04 0.06 0.86 3.58 -1.35 -0.12 116.42 119.63 2bbw h ASP 121 Ca 0.06 0.05 0.01 0.00 0.42 0.00 0.00 57.03 57.56 2bbw h ASP 121 Cb 0.18 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.27 2bbw h ASP 121 CO -0.00 0.06 -0.08 0.03 -2.88 0.00 0.00 179.24 176.37 2bbw h ARG 122 N 0.20 -0.16 -0.30 0.28 3.08 -0.67 -2.94 114.38 113.87 2bbw h ARG 122 Ca 0.15 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 2bbw h ARG 122 Cb 0.16 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2bbw h ARG 122 CO -0.19 -0.11 0.01 -0.07 -1.07 0.00 0.00 179.97 178.55 2bbw h LEU 123 N -0.16 0.41 -1.63 3.04 3.38 -0.85 -1.44 115.31 118.06 2bbw h LEU 123 Ca 0.01 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2bbw h LEU 123 Cb 0.17 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2bbw h LEU 123 CO -0.04 0.47 0.00 0.77 0.09 0.00 0.00 178.44 179.73 2bbw h SER 124 N 0.43 0.00 -0.17 -0.43 4.64 -0.84 -2.79 113.55 114.39 2bbw h SER 124 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2bbw h SER 124 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2bbw h SER 124 CO 0.01 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.51 2bbw n ARG 125 N -2.71 2.56 -3.30 4.77 1.74 -0.56 -5.01 116.66 114.16 2bbw n ARG 125 Ca -0.00 -2.31 -0.38 0.00 -0.77 0.00 0.00 57.85 54.38 2bbw n ARG 125 Cb 0.18 -1.45 -0.06 0.00 -1.02 0.00 0.00 32.46 30.11 2bbw n ARG 125 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2bbw s ARG 126 N -1.99 4.22 0.03 5.56 3.52 -1.05 -3.05 118.95 126.19 2bbw s ARG 126 Ca 0.27 0.61 0.05 0.00 -0.13 0.00 0.00 55.73 56.53 2bbw s ARG 126 Cb 0.20 -3.32 -0.02 0.00 -1.56 0.00 0.00 34.95 30.25 2bbw s ARG 126 CO 0.08 0.44 -0.15 -1.58 -0.81 0.00 0.00 175.30 173.28 2bbw s TRP 127 N -0.37 1.30 0.11 5.12 0.52 -0.82 -4.60 118.94 120.21 2bbw s TRP 127 Ca 0.28 -0.34 0.05 0.00 0.02 0.00 0.00 56.10 56.12 2bbw s TRP 127 Cb -0.17 -0.78 -0.04 0.00 -1.15 0.00 0.00 33.47 31.33 2bbw s TRP 127 CO 0.15 0.03 -0.13 0.96 0.02 0.00 0.00 176.95 177.98 2bbw s ILE 128 N -0.76 1.25 -0.55 2.03 -0.00 0.02 -0.15 121.20 123.03 2bbw s ILE 128 Ca 0.03 -1.68 -0.19 0.00 -0.00 0.00 0.00 60.65 58.81 2bbw s ILE 128 Cb -0.08 -1.48 0.09 0.00 -0.00 0.00 0.00 42.46 40.99 2bbw s ILE 128 CO 0.01 -0.43 0.66 -2.28 -0.00 0.00 0.00 174.94 172.89 2bbw s HIS 129 N -2.15 3.03 0.23 1.37 5.65 -0.30 -0.81 115.29 122.30 2bbw s HIS 129 Ca 0.08 -0.81 -0.07 0.00 0.25 0.00 0.00 55.06 54.50 2bbw s HIS 129 Cb -0.05 -3.80 0.36 0.00 -1.18 0.00 0.00 32.58 27.92 2bbw s HIS 129 CO 0.02 -1.17 1.75 -1.35 -0.65 0.00 0.00 174.74 173.34 2bbw h PRO 130 N 9.09 0.46 0.00 2.88 0.11 -1.87 0.32 132.00 142.98 2bbw h PRO 130 Ca -0.29 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.77 2bbw h PRO 130 Cb 1.09 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.09 2bbw h PRO 130 CO 1.04 0.31 -0.12 -1.35 -0.21 0.00 0.00 178.00 177.66 2bbw h PRO 131 N 0.48 0.00 0.00 1.05 0.11 -1.96 -3.24 132.00 128.44 2bbw h PRO 131 Ca 0.36 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.46 2bbw h PRO 131 Cb 0.47 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.58 2bbw h PRO 131 CO -0.33 0.12 -1.63 -1.13 -0.21 0.00 0.00 178.00 174.82 2bbw n SER 132 N -4.33 1.90 0.00 -2.05 3.41 -0.95 -5.00 113.62 106.59 2bbw n SER 132 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 2bbw n SER 132 Cb 0.20 1.58 0.00 0.00 -0.26 0.00 0.00 64.21 65.73 2bbw n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2bbw n GLY 133 N 1.75 0.52 3.70 5.00 0.00 0.11 -5.01 105.19 111.26 2bbw n GLY 133 Ca -0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 2bbw n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bbw n ARG 134 N -2.19 2.54 -4.92 1.61 1.74 -1.23 -4.80 116.66 109.40 2bbw n ARG 134 Ca 0.00 0.91 -0.33 0.00 -0.77 0.00 0.00 57.85 57.67 2bbw n ARG 134 Cb 0.07 -2.73 -0.14 0.00 -1.02 0.00 0.00 32.46 28.64 2bbw n ARG 134 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2bbw s VAL 135 N 1.05 2.91 0.24 1.55 1.01 -1.26 -1.15 120.40 124.75 2bbw s VAL 135 Ca 0.76 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 62.06 2bbw s VAL 135 Cb -0.57 -2.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 2bbw s VAL 135 CO 0.35 0.57 -0.11 -0.31 0.00 0.00 0.00 175.10 175.59 2bbw s TYR 136 N -0.36 1.86 0.39 5.22 1.51 0.79 -5.00 117.35 121.77 2bbw s TYR 136 Ca 0.03 -0.61 0.04 0.00 -1.01 0.00 0.00 57.07 55.52 2bbw s TYR 136 Cb -0.12 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.75 2bbw s TYR 136 CO 0.02 0.35 0.14 1.21 -1.11 0.00 0.00 175.55 176.16 2bbw s ASN 137 N -3.39 2.57 -0.09 2.29 3.84 -0.87 -1.94 114.94 117.35 2bbw s ASN 137 Ca 0.26 -1.65 -0.21 0.00 0.21 0.00 0.00 52.86 51.47 2bbw s ASN 137 Cb 0.01 0.46 -0.28 0.00 -0.55 0.00 0.00 41.25 40.89 2bbw s ASN 137 CO 0.10 -0.92 0.72 0.25 -2.79 0.00 0.00 177.10 174.46 2bbw h LEU 138 N 1.87 0.33 0.00 3.21 5.85 -1.84 -3.13 115.31 121.60 2bbw h LEU 138 Ca -0.35 -0.90 -0.30 0.00 0.84 0.00 0.00 57.88 57.17 2bbw h LEU 138 Cb 1.27 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2bbw h LEU 138 CO 0.56 1.41 -1.78 0.47 -0.34 0.00 0.00 178.44 178.75 2bbw n ASP 139 N -4.17 0.84 -0.06 1.25 8.00 -1.26 -4.49 116.55 116.66 2bbw n ASP 139 Ca -0.18 0.37 -0.07 0.00 0.71 0.00 0.00 54.79 55.63 2bbw n ASP 139 Cb 0.78 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.86 2bbw n ASP 139 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2bbw n PHE 140 N -3.03 0.00 -3.54 1.24 -0.00 -1.26 -4.78 117.46 106.09 2bbw n PHE 140 Ca -0.19 0.00 -0.27 0.00 -0.00 0.00 0.00 57.45 56.99 2bbw n PHE 140 Cb 1.06 -0.36 -0.09 0.00 -0.00 0.00 0.00 39.48 40.09 2bbw n PHE 140 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 2bbw n ASN 141 N -4.08 2.50 -4.77 -2.13 4.05 -1.26 -4.98 115.26 104.58 2bbw n ASN 141 Ca -0.10 -3.13 -0.36 0.00 0.45 0.00 0.00 54.58 51.44 2bbw n ASN 141 Cb 0.38 -0.68 0.00 0.00 1.23 0.00 0.00 39.78 40.71 2bbw n ASN 141 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 2bbw s PRO 142 N -1.67 3.45 0.67 1.20 0.04 -1.18 -2.05 135.00 135.45 2bbw s PRO 142 Ca 0.34 1.68 -0.14 0.00 0.04 0.00 0.00 61.00 62.91 2bbw s PRO 142 Cb 0.08 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2bbw s PRO 142 CO -0.10 -0.79 1.10 -1.25 0.04 0.00 0.00 177.00 176.00 2bbw s PRO 143 N -3.11 2.78 0.26 0.56 0.04 -1.26 -4.93 135.00 129.33 2bbw s PRO 143 Ca 0.70 1.32 -0.04 0.00 0.04 0.00 0.00 61.00 63.03 2bbw s PRO 143 Cb -0.26 -1.95 0.34 0.00 0.04 0.00 0.00 34.50 32.67 2bbw s PRO 143 CO 0.30 -1.26 1.90 1.25 0.04 0.00 0.00 177.00 179.23 2bbw h HIS 144 N -0.13 1.22 -3.70 0.56 -0.00 -1.95 -3.40 115.15 107.75 2bbw h HIS 144 Ca -0.46 0.03 -0.65 0.00 -0.00 0.00 0.00 60.37 59.29 2bbw h HIS 144 Cb 1.24 -0.41 -0.32 0.00 -0.00 0.00 0.00 27.41 27.92 2bbw h HIS 144 CO 0.56 0.69 -0.87 0.08 -0.00 0.00 0.00 177.93 178.38 2bbw s VAL 145 N -6.07 1.87 0.09 5.26 1.01 -1.26 -5.10 120.40 116.20 2bbw s VAL 145 Ca -0.13 -0.94 -0.35 0.00 0.00 0.00 0.00 61.98 60.56 2bbw s VAL 145 Cb 0.19 -1.61 -0.14 0.00 0.00 0.00 0.00 36.38 34.82 2bbw s VAL 145 CO 0.82 0.52 1.56 1.57 0.00 0.00 0.00 175.10 179.56 2bbw n HIS 146 N 3.26 2.06 -1.00 5.22 -0.00 -1.26 -1.85 115.22 121.65 2bbw n HIS 146 Ca -0.19 0.35 -0.00 0.00 0.46 0.00 0.00 57.72 58.34 2bbw n HIS 146 Cb 0.52 -2.50 -0.00 0.00 -0.12 0.00 0.00 29.99 27.90 2bbw n HIS 146 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2bbw n GLY 147 N 3.32 0.40 3.11 1.57 0.00 -1.26 -5.00 105.19 107.33 2bbw n GLY 147 Ca 0.18 -0.01 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 2bbw n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bbw s ILE 148 N -1.79 1.47 0.09 -0.61 -1.09 -0.77 -0.84 121.20 117.66 2bbw s ILE 148 Ca 0.00 -0.70 -0.31 0.00 -2.23 0.00 0.00 60.65 57.41 2bbw s ILE 148 Cb 0.00 -1.28 -0.09 0.00 -1.58 0.00 0.00 42.46 39.51 2bbw s ILE 148 CO 0.00 0.43 1.70 -0.62 -1.23 0.00 0.00 174.94 175.22 2bbw s ASP 149 N 0.33 6.55 0.42 3.58 2.15 -0.20 -4.53 116.67 124.97 2bbw s ASP 149 Ca -0.11 2.57 0.09 0.00 0.43 0.00 0.00 52.55 55.53 2bbw s ASP 149 Cb -0.15 -2.56 0.92 0.00 -0.30 0.00 0.00 42.92 40.83 2bbw s ASP 149 CO 0.04 -0.92 2.05 0.44 -0.17 0.00 0.00 175.17 176.61 2bbw h ASP 150 N 8.36 0.42 0.00 -0.34 3.32 -1.92 -0.86 116.42 125.40 2bbw h ASP 150 Ca -0.44 -0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.58 2bbw h ASP 150 Cb 1.21 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.65 2bbw h ASP 150 CO 0.93 0.29 -0.14 0.58 -1.72 0.00 0.00 179.24 179.18 2bbw h VAL 151 N 0.49 1.44 0.00 -1.35 2.07 -1.97 -3.40 116.25 113.52 2bbw h VAL 151 Ca 0.17 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.56 2bbw h VAL 151 Cb 0.08 2.77 0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2bbw h VAL 151 CO -0.04 0.49 -1.47 0.35 0.02 0.00 0.00 177.57 176.92 2bbw n THR 152 N -4.61 0.05 -1.06 2.57 -2.24 -1.23 -4.97 114.28 102.78 2bbw n THR 152 Ca -0.11 -0.29 -0.02 0.00 -2.27 0.00 0.00 64.05 61.36 2bbw n THR 152 Cb 0.43 0.36 -0.01 0.00 -2.10 0.00 0.00 70.33 69.02 2bbw n THR 152 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bbw n GLY 153 N 1.36 0.44 3.92 3.38 0.00 -0.33 -5.03 105.19 108.93 2bbw n GLY 153 Ca -0.00 -0.11 -0.26 0.00 0.00 0.00 0.00 46.02 45.65 2bbw n GLY 153 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bbw s GLU 154 N -1.42 3.54 0.57 1.61 2.02 -1.26 -4.76 118.70 118.99 2bbw s GLU 154 Ca 0.00 -0.13 -0.20 0.00 0.02 0.00 0.00 54.97 54.66 2bbw s GLU 154 Cb 0.00 -2.60 -0.04 0.00 0.10 0.00 0.00 34.13 31.58 2bbw s GLU 154 CO 0.00 0.10 1.22 -1.25 0.02 0.00 0.00 175.26 175.36 2bbw s PRO 155 N -4.16 3.12 0.19 0.39 0.04 -1.26 -1.04 135.00 132.27 2bbw s PRO 155 Ca 0.42 1.88 0.02 0.00 0.04 0.00 0.00 61.00 63.36 2bbw s PRO 155 Cb -0.10 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 2bbw s PRO 155 CO 0.36 -1.10 0.34 -0.51 0.04 0.00 0.00 177.00 176.13 2bbw s LEU 156 N -3.83 4.29 0.22 -3.56 1.43 -0.02 -4.69 118.68 112.53 2bbw s LEU 156 Ca 0.75 0.24 0.04 0.00 -1.03 0.00 0.00 54.13 54.13 2bbw s LEU 156 Cb -0.32 -3.00 -0.05 0.00 0.03 0.00 0.00 46.19 42.85 2bbw s LEU 156 CO 0.35 -0.01 -0.03 0.68 0.23 0.00 0.00 176.35 177.57 2bbw s VAL 157 N -1.84 1.15 -0.10 -1.59 -7.23 0.01 -4.89 120.40 105.91 2bbw s VAL 157 Ca 0.36 -2.05 -0.02 0.00 -1.81 0.00 0.00 61.98 58.45 2bbw s VAL 157 Cb -0.11 -2.26 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 2bbw s VAL 157 CO 0.29 -0.40 -0.02 -1.10 -0.31 0.00 0.00 175.10 173.56 2bbw s GLN 158 N -3.82 3.16 0.19 4.82 -0.21 -1.26 -0.80 119.66 121.74 2bbw s GLN 158 Ca 0.26 -0.46 -0.13 0.00 0.02 0.00 0.00 55.36 55.06 2bbw s GLN 158 Cb 0.05 -2.81 -0.07 0.00 1.00 0.00 0.00 33.01 31.18 2bbw s GLN 158 CO 0.08 0.56 0.57 -0.65 -2.12 0.00 0.00 175.29 173.73 2bbw s GLN 159 N -0.51 3.91 0.62 2.91 -0.21 -1.26 -4.97 119.66 120.16 2bbw s GLN 159 Ca 0.08 0.42 0.35 0.00 0.02 0.00 0.00 55.36 56.23 2bbw s GLN 159 Cb -0.12 -2.78 1.98 0.00 1.00 0.00 0.00 33.01 33.09 2bbw s GLN 159 CO 0.02 0.39 2.23 1.05 -2.12 0.00 0.00 175.29 176.86 2bbw h GLU 160 N 3.05 0.00 -0.00 2.91 4.11 -2.00 -1.67 114.58 120.98 2bbw h GLU 160 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2bbw h GLU 160 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2bbw h GLU 160 CO 0.67 0.00 -0.22 -0.40 0.07 0.00 0.00 179.01 179.14 2bbw n ASP 161 N -3.48 0.34 -0.76 3.06 3.85 -1.26 -3.33 116.55 114.97 2bbw n ASP 161 Ca -0.02 -0.10 0.11 0.00 -0.71 0.00 0.00 54.79 54.08 2bbw n ASP 161 Cb 0.16 -0.10 0.31 0.00 -1.35 0.00 0.00 41.12 40.15 2bbw n ASP 161 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 2bbw n ASP 162 N -1.33 2.29 -4.74 -1.12 8.00 -0.63 -3.42 116.55 115.61 2bbw n ASP 162 Ca 0.09 -1.81 -0.30 0.00 0.71 0.00 0.00 54.79 53.48 2bbw n ASP 162 Cb 0.32 -0.14 0.12 0.00 -0.02 0.00 0.00 41.12 41.40 2bbw n ASP 162 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2bbw s LYS 163 N -1.71 1.55 0.20 -1.24 -2.85 -1.21 -4.06 119.74 110.42 2bbw s LYS 163 Ca 0.34 0.87 -0.12 0.00 -1.00 0.00 0.00 55.97 56.06 2bbw s LYS 163 Cb 0.19 -1.84 0.24 0.00 -2.06 0.00 0.00 37.83 34.37 2bbw s LYS 163 CO 0.28 -2.05 1.68 -1.35 0.10 0.00 0.00 175.35 174.02 2bbw h PRO 164 N -1.41 0.14 0.05 1.78 0.11 -1.92 -1.25 132.00 129.51 2bbw h PRO 164 Ca -0.48 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.41 2bbw h PRO 164 Cb 1.27 -0.03 0.02 0.00 0.11 0.00 0.00 31.00 32.37 2bbw h PRO 164 CO 0.55 0.09 -0.84 0.93 -0.21 0.00 0.00 178.00 178.52 2bbw h GLU 165 N 0.15 0.47 -0.43 1.05 5.08 -1.95 -2.61 114.58 116.34 2bbw h GLU 165 Ca 0.29 -0.58 0.01 0.00 -1.00 0.00 0.00 59.36 58.08 2bbw h GLU 165 Cb 0.44 0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.85 2bbw h GLU 165 CO -0.44 1.22 0.27 0.00 -1.00 0.00 0.00 179.01 179.06 2bbw h ALA 166 N 0.27 0.55 0.02 3.43 0.00 -1.82 -0.51 119.26 121.21 2bbw h ALA 166 Ca -0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 2bbw h ALA 166 Cb 1.56 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2bbw h ALA 166 CO 0.16 -0.04 -0.01 0.28 0.00 0.00 0.00 179.25 179.64 2bbw h VAL 167 N 0.54 1.03 -0.76 0.00 2.07 -1.24 -0.21 116.25 117.68 2bbw h VAL 167 Ca 0.17 -0.16 0.12 0.00 0.82 0.00 0.00 66.70 67.64 2bbw h VAL 167 Cb -0.02 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 30.81 2bbw h VAL 167 CO -0.06 0.04 0.36 0.00 0.02 0.00 0.00 177.57 177.93 2bbw h ALA 168 N 0.88 1.07 -0.77 1.67 0.00 -1.32 0.18 119.26 120.97 2bbw h ALA 168 Ca -0.00 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2bbw h ALA 168 Cb 0.09 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2bbw h ALA 168 CO 0.00 -0.10 0.33 0.00 0.00 0.00 0.00 179.25 179.49 2bbw h ALA 169 N 1.49 1.00 -0.18 0.00 0.00 -0.82 -2.55 119.26 118.20 2bbw h ALA 169 Ca 0.39 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 2bbw h ALA 169 Cb 0.51 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2bbw h ALA 169 CO -0.33 0.60 -0.41 0.00 0.00 0.00 0.00 179.25 179.11 2bbw h ARG 170 N 1.10 0.41 -0.47 0.00 3.08 0.01 -1.73 114.38 116.79 2bbw h ARG 170 Ca 0.26 -0.21 -0.11 0.00 0.07 0.00 0.00 59.98 60.00 2bbw h ARG 170 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 2bbw h ARG 170 CO -0.03 0.76 -0.13 -0.07 -1.07 0.00 0.00 179.97 179.43 2bbw h LEU 171 N 0.34 0.93 0.10 3.04 3.38 -0.90 -1.79 115.31 120.40 2bbw h LEU 171 Ca 0.03 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 2bbw h LEU 171 Cb 0.87 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2bbw h LEU 171 CO 0.07 1.08 -0.05 -0.09 0.09 0.00 0.00 178.44 179.55 2bbw h ARG 172 N 0.76 -0.13 -0.71 1.13 9.65 -1.34 0.31 114.38 124.05 2bbw h ARG 172 Ca 0.12 0.01 0.15 0.00 -1.10 0.00 0.00 59.98 59.16 2bbw h ARG 172 Cb 0.69 0.03 -0.11 0.00 -1.39 0.00 0.00 29.97 29.19 2bbw h ARG 172 CO 0.05 0.09 0.16 0.37 2.80 0.00 0.00 179.97 183.43 2bbw h GLN 173 N -0.33 0.25 0.32 0.20 4.15 -1.33 -2.43 115.11 115.93 2bbw h GLN 173 Ca -0.01 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.38 2bbw h GLN 173 Cb 0.28 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.92 2bbw h GLN 173 CO 0.02 0.16 -0.15 -0.92 -1.93 0.00 0.00 178.83 176.01 2bbw h TYR 174 N 0.26 -0.40 -0.48 3.99 3.20 -1.12 -2.90 116.97 119.52 2bbw h TYR 174 Ca 0.39 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.35 2bbw h TYR 174 Cb 0.66 0.13 -0.10 0.00 1.54 0.00 0.00 36.73 38.96 2bbw h TYR 174 CO -0.27 -0.15 -0.24 -0.22 -1.64 0.00 0.00 178.16 175.64 2bbw h LYS 175 N -0.58 -0.13 -0.53 1.82 3.64 -0.51 0.11 116.57 120.39 2bbw h LYS 175 Ca -0.04 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.29 2bbw h LYS 175 Cb 0.43 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 2bbw h LYS 175 CO 0.07 -0.09 0.12 -0.44 -2.27 0.00 0.00 179.45 176.84 2bbw h ASP 176 N -0.14 0.77 0.66 4.20 3.32 -1.48 -2.74 116.42 121.01 2bbw h ASP 176 Ca 0.22 -0.14 -0.26 0.00 0.02 0.00 0.00 57.03 56.87 2bbw h ASP 176 Cb 0.48 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.79 2bbw h ASP 176 CO -0.56 0.76 -1.46 1.62 -1.72 0.00 0.00 179.24 177.88 2bbw h VAL 177 N 0.79 1.16 0.00 -1.35 3.04 -1.20 -3.40 116.25 115.29 2bbw h VAL 177 Ca 0.17 -2.95 -0.24 0.00 -1.01 0.00 0.00 66.70 62.66 2bbw h VAL 177 Cb 0.31 2.58 -0.04 0.00 -2.01 0.00 0.00 31.29 32.13 2bbw h VAL 177 CO 0.00 0.67 -1.62 0.00 -1.01 0.00 0.00 177.57 175.61 2bbw n ALA 178 N -2.49 1.67 -0.12 3.17 0.00 0.34 -4.20 120.51 118.88 2bbw n ALA 178 Ca -0.11 -0.70 -0.05 0.00 0.00 0.00 0.00 53.44 52.58 2bbw n ALA 178 Cb 1.01 -0.87 0.01 0.00 0.00 0.00 0.00 19.45 19.61 2bbw n ALA 178 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2bbw h LYS 179 N 0.00 0.00 -0.90 0.00 1.79 -1.69 -0.63 116.57 115.14 2bbw h LYS 179 Ca -0.25 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.23 2bbw h LYS 179 Cb 1.85 -0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.46 2bbw h LYS 179 CO 0.06 0.00 0.60 -1.35 -1.08 0.00 0.00 179.45 177.68 2bbw h PRO 180 N 0.00 1.17 -0.09 3.15 0.11 -1.82 -0.67 132.00 133.85 2bbw h PRO 180 Ca 0.19 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.23 2bbw h PRO 180 Cb 0.29 -0.27 -0.00 0.00 0.11 0.00 0.00 31.00 31.13 2bbw h PRO 180 CO -0.41 0.78 0.05 0.28 -0.21 0.00 0.00 178.00 178.48 2bbw h VAL 181 N 1.21 1.07 -0.56 3.15 2.07 -1.53 0.77 116.25 122.43 2bbw h VAL 181 Ca 0.33 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 67.61 2bbw h VAL 181 Cb -0.13 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 2bbw h VAL 181 CO -0.08 0.06 0.19 0.40 0.02 0.00 0.00 177.57 178.17 2bbw h ILE 182 N 0.07 1.23 -0.32 4.57 2.04 -1.02 -2.14 117.51 121.95 2bbw h ILE 182 Ca 0.03 -0.76 -0.06 0.00 1.00 0.00 0.00 64.86 65.07 2bbw h ILE 182 Cb 0.06 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 2bbw h ILE 182 CO -0.01 0.29 -0.07 -0.08 0.00 0.00 0.00 178.15 178.29 2bbw h GLU 183 N 0.77 0.52 -0.34 2.37 4.57 -0.98 0.25 114.58 121.74 2bbw h GLU 183 Ca 0.18 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.21 2bbw h GLU 183 Cb 0.25 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.76 2bbw h GLU 183 CO -0.01 0.59 0.13 1.25 -1.18 0.00 0.00 179.01 179.80 2bbw h LEU 184 N 0.49 0.47 -0.49 1.64 5.85 -0.55 -1.77 115.31 120.95 2bbw h LEU 184 Ca 0.10 -0.17 -0.16 0.00 0.84 0.00 0.00 57.88 58.48 2bbw h LEU 184 Cb 0.42 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2bbw h LEU 184 CO 0.02 0.51 -0.56 1.88 -0.34 0.00 0.00 178.44 179.95 2bbw h TYR 185 N 0.40 0.73 -0.25 1.25 0.05 -1.16 -2.63 116.97 115.36 2bbw h TYR 185 Ca 0.11 -0.26 0.06 0.00 0.05 0.00 0.00 58.73 58.69 2bbw h TYR 185 Cb 0.19 -0.14 -0.06 0.00 1.01 0.00 0.00 36.73 37.74 2bbw h TYR 185 CO -0.00 1.00 -0.11 -0.22 -1.05 0.00 0.00 178.16 177.78 2bbw h LYS 186 N 0.44 -0.08 0.00 4.88 3.64 -0.92 -2.45 116.57 122.08 2bbw h LYS 186 Ca 0.01 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2bbw h LYS 186 Cb 1.11 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2bbw h LYS 186 CO 0.11 -0.05 0.00 0.66 -2.27 0.00 0.00 179.45 177.90 2bbw h SER 187 N -0.08 0.00 0.63 4.20 4.64 -1.19 -2.33 113.55 119.41 2bbw h SER 187 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2bbw h SER 187 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 2bbw h SER 187 CO -0.30 0.00 -0.21 0.54 -0.87 0.00 0.00 176.83 175.99 2bbw n ARG 188 N -2.95 0.22 -0.80 4.77 1.74 -0.95 -4.95 116.66 113.74 2bbw n ARG 188 Ca 0.00 -0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2bbw n ARG 188 Cb 0.24 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.18 2bbw n ARG 188 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2bbw n GLY 189 N 1.43 0.55 0.25 -0.13 0.00 -0.88 -4.94 105.19 101.47 2bbw n GLY 189 Ca 0.09 -0.49 0.02 0.00 0.00 0.00 0.00 46.02 45.64 2bbw n GLY 189 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bbw n VAL 190 N -2.80 0.56 -3.00 1.61 0.24 -1.11 -5.01 118.33 108.82 2bbw n VAL 190 Ca 0.00 -0.78 -0.40 0.00 -2.04 0.00 0.00 64.34 61.12 2bbw n VAL 190 Cb 0.00 0.76 -0.05 0.00 -1.47 0.00 0.00 33.84 33.09 2bbw n VAL 190 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2bbw s LEU 191 N -0.74 4.35 -0.22 1.34 2.96 -1.22 -1.13 118.68 124.02 2bbw s LEU 191 Ca 0.08 1.29 0.01 0.00 -0.22 0.00 0.00 54.13 55.29 2bbw s LEU 191 Cb 0.05 -3.16 0.05 0.00 0.50 0.00 0.00 46.19 43.63 2bbw s LEU 191 CO 0.07 -0.09 -0.07 -1.00 -1.32 0.00 0.00 176.35 173.93 2bbw s HIS 192 N 0.60 2.39 -0.15 5.38 3.76 0.92 -4.96 115.29 123.23 2bbw s HIS 192 Ca 0.39 -1.68 -0.05 0.00 -0.15 0.00 0.00 55.06 53.57 2bbw s HIS 192 Cb -0.19 -1.59 -0.04 0.00 1.11 0.00 0.00 32.58 31.87 2bbw s HIS 192 CO 0.20 -0.76 0.04 -1.14 -0.85 0.00 0.00 174.74 172.23 2bbw s GLN 193 N 1.40 3.63 -0.17 1.40 0.74 -1.26 -1.38 119.66 124.02 2bbw s GLN 193 Ca -0.04 -0.37 0.01 0.00 0.05 0.00 0.00 55.36 55.01 2bbw s GLN 193 Cb -0.18 -3.05 0.02 0.00 1.10 0.00 0.00 33.01 30.90 2bbw s GLN 193 CO -0.07 0.43 -0.17 -0.06 -0.55 0.00 0.00 175.29 174.87 2bbw s PHE 194 N -0.08 2.55 0.11 1.67 0.08 0.14 -4.96 117.98 117.48 2bbw s PHE 194 Ca 0.05 -1.52 0.06 0.00 0.12 0.00 0.00 56.93 55.64 2bbw s PHE 194 Cb -0.12 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 2bbw s PHE 194 CO 0.01 -0.76 -0.01 -1.12 -0.10 0.00 0.00 175.22 173.24 2bbw s SER 195 N 1.36 4.90 0.00 1.36 0.01 -1.26 -0.54 113.70 119.52 2bbw s SER 195 Ca 0.04 -0.24 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2bbw s SER 195 Cb -0.14 -1.12 0.00 0.00 0.21 0.00 0.00 66.02 64.98 2bbw s SER 195 CO -0.11 0.16 0.00 0.61 0.41 0.00 0.00 173.24 174.31 2bbw n GLY 196 N 0.47 -0.32 0.00 3.44 0.00 -1.18 -4.94 105.19 102.67 2bbw n GLY 196 Ca -0.11 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.41 2bbw n GLY 196 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2bbw n THR 197 N 9.00 0.00 -4.27 2.61 -2.24 -1.26 -4.22 114.28 113.90 2bbw n THR 197 Ca 0.00 -0.21 -0.30 0.00 -2.27 0.00 0.00 64.05 61.27 2bbw n THR 197 Cb 0.00 1.03 -0.16 0.00 -2.10 0.00 0.00 70.33 69.10 2bbw n THR 197 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2bbw s GLU 198 N -0.39 2.50 0.41 -0.78 0.41 -1.26 -5.01 118.70 114.58 2bbw s GLU 198 Ca 0.00 -0.65 0.15 0.00 -0.41 0.00 0.00 54.97 54.06 2bbw s GLU 198 Cb 0.00 -2.16 1.02 0.00 -1.78 0.00 0.00 34.13 31.21 2bbw s GLU 198 CO 0.00 -0.15 1.90 1.15 -0.49 0.00 0.00 175.26 177.67 2bbw h THR 199 N 5.97 0.78 0.00 3.63 2.02 -1.95 -2.20 112.91 121.16 2bbw h THR 199 Ca -0.36 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.66 2bbw h THR 199 Cb 1.16 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 2bbw h THR 199 CO 0.54 0.08 0.00 0.78 0.37 0.00 0.00 175.52 177.29 2bbw h ASN 200 N 0.45 0.00 0.48 4.18 2.35 -2.00 -0.68 115.58 120.37 2bbw h ASN 200 Ca 0.40 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.97 2bbw h ASN 200 Cb 0.90 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.24 2bbw h ASN 200 CO -0.14 0.00 -1.67 0.29 -1.65 0.00 0.00 177.43 174.26 2bbw n LYS 201 N -2.57 0.64 0.13 0.81 4.01 -0.85 -4.28 118.16 116.05 2bbw n LYS 201 Ca 0.02 0.13 -0.22 0.00 -0.51 0.00 0.00 58.31 57.74 2bbw n LYS 201 Cb 0.32 -1.72 -0.15 0.00 -0.51 0.00 0.00 35.03 32.97 2bbw n LYS 201 CO 0.00 0.00 0.00 0.82 -1.11 0.00 0.00 177.40 177.11 2bbw h ILE 202 N 0.00 1.35 -0.51 -0.18 2.04 -1.26 -3.39 117.51 115.56 2bbw h ILE 202 Ca -0.22 -2.78 0.06 0.00 1.00 0.00 0.00 64.86 62.92 2bbw h ILE 202 Cb 1.64 2.97 -0.05 0.00 -0.74 0.00 0.00 36.82 40.64 2bbw h ILE 202 CO 0.04 0.83 0.21 -0.25 0.00 0.00 0.00 178.15 178.98 2bbw h TRP 203 N 0.14 0.37 -0.77 1.37 2.91 -1.31 -1.60 115.95 117.07 2bbw h TRP 203 Ca -0.21 0.02 0.15 0.00 1.13 0.00 0.00 58.89 59.98 2bbw h TRP 203 Cb 2.08 -0.09 -0.05 0.00 -0.51 0.00 0.00 29.16 30.59 2bbw h TRP 203 CO 0.11 0.15 0.51 -1.35 -1.03 0.00 0.00 178.44 176.83 2bbw h PRO 204 N 0.41 0.41 -0.18 2.65 0.11 -1.79 0.29 132.00 133.90 2bbw h PRO 204 Ca 0.24 -0.02 -0.19 0.00 0.11 0.00 0.00 66.00 66.13 2bbw h PRO 204 Cb 0.22 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.24 2bbw h PRO 204 CO -0.21 0.27 -0.62 1.88 -0.21 0.00 0.00 178.00 179.10 2bbw h TYR 205 N 0.42 0.97 -0.73 0.65 0.05 -1.54 -2.16 116.97 114.63 2bbw h TYR 205 Ca 0.38 -0.40 -0.06 0.00 0.05 0.00 0.00 58.73 58.70 2bbw h TYR 205 Cb 0.87 -0.16 -0.03 0.00 1.01 0.00 0.00 36.73 38.42 2bbw h TYR 205 CO -0.00 1.21 0.22 0.28 -1.05 0.00 0.00 178.16 178.82 2bbw h VAL 206 N 0.46 1.26 -0.19 -2.88 2.07 -0.96 -2.35 116.25 113.65 2bbw h VAL 206 Ca -0.03 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 2bbw h VAL 206 Cb 1.25 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.47 2bbw h VAL 206 CO 0.13 0.36 0.12 0.22 0.02 0.00 0.00 177.57 178.42 2bbw h TYR 207 N 1.08 0.25 -0.78 1.57 3.20 -0.38 -2.23 116.97 119.68 2bbw h TYR 207 Ca 0.23 0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.16 2bbw h TYR 207 Cb 0.31 -0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.44 2bbw h TYR 207 CO 0.03 0.19 0.48 1.15 -1.64 0.00 0.00 178.16 178.36 2bbw h THR 208 N 0.24 1.04 0.22 1.81 2.02 -1.27 -0.04 112.91 116.93 2bbw h THR 208 Ca 0.07 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.94 2bbw h THR 208 Cb 0.01 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.49 2bbw h THR 208 CO -0.01 0.16 -0.12 0.25 0.37 0.00 0.00 175.52 176.17 2bbw h LEU 209 N 0.88 -0.29 -1.14 2.58 6.46 -1.14 -2.60 115.31 120.06 2bbw h LEU 209 Ca 0.34 0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 58.04 2bbw h LEU 209 Cb 0.14 0.08 -0.02 0.00 -0.73 0.00 0.00 40.66 40.13 2bbw h LEU 209 CO -0.16 -0.20 -0.12 -0.26 -0.62 0.00 0.00 178.44 177.08 2bbw h PHE 210 N -0.32 0.48 0.00 1.25 -1.00 -1.15 -2.69 116.94 113.52 2bbw h PHE 210 Ca -0.03 -0.07 -0.03 0.00 2.81 0.00 0.00 57.97 60.66 2bbw h PHE 210 Cb 0.25 -0.13 -0.00 0.00 3.61 0.00 0.00 35.95 39.68 2bbw h PHE 210 CO -0.07 0.57 -0.12 0.66 -1.61 0.00 0.00 178.31 177.73 2bbw h SER 211 N 0.42 0.00 1.25 2.17 4.64 -0.80 0.29 113.55 121.52 2bbw h SER 211 Ca 0.08 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.39 2bbw h SER 211 Cb 0.47 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.56 2bbw h SER 211 CO 0.03 0.12 -0.03 0.78 -0.87 0.00 0.00 176.83 176.86 2bbw h ASN 212 N 0.00 0.00 0.00 4.97 2.35 -1.11 -3.37 115.58 118.42 2bbw h ASN 212 Ca -0.00 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 2bbw h ASN 212 Cb 0.38 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 2bbw h ASN 212 CO 0.02 0.03 -1.46 0.29 -1.65 0.00 0.00 177.43 174.65 2bbw n LYS 213 N -3.13 2.79 -3.89 0.81 4.01 -0.33 -5.03 118.16 113.39 2bbw n LYS 213 Ca 0.01 -0.01 -0.11 0.00 -0.51 0.00 0.00 58.31 57.70 2bbw n LYS 213 Cb 0.38 -1.18 -0.11 0.00 -0.51 0.00 0.00 35.03 33.62 2bbw n LYS 213 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 2bbw s ILE 214 N -2.18 0.08 0.03 -0.18 -4.36 0.87 -5.00 121.20 110.46 2bbw s ILE 214 Ca -0.03 -0.63 -0.30 0.00 -0.26 0.00 0.00 60.65 59.42 2bbw s ILE 214 Cb 0.02 -0.35 -0.07 0.00 1.25 0.00 0.00 42.46 43.32 2bbw s ILE 214 CO 0.28 -0.35 1.51 -0.89 0.24 0.00 0.00 174.94 175.73 2bbw s THR 215 N -1.17 3.44 0.55 8.37 2.01 -1.26 -4.17 115.64 123.42 2bbw s THR 215 Ca -0.13 0.85 -0.19 0.00 0.31 0.00 0.00 61.69 62.53 2bbw s THR 215 Cb -0.07 -3.54 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 2bbw s THR 215 CO 0.01 -0.00 1.13 -2.16 -0.69 0.00 0.00 174.62 172.90 2bbw s PRO 216 N 2.54 3.31 0.19 4.92 0.04 -1.26 -4.86 135.00 139.87 2bbw s PRO 216 Ca 0.68 1.61 -0.31 0.00 0.04 0.00 0.00 61.00 63.02 2bbw s PRO 216 Cb -0.35 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.10 2bbw s PRO 216 CO 0.29 -0.89 1.44 0.42 0.04 0.00 0.00 177.00 178.30 2bbw s ILE 217 N -1.80 2.90 0.22 0.56 1.01 -0.25 -5.00 121.20 118.85 2bbw s ILE 217 Ca 0.73 0.69 -0.06 0.00 0.00 0.00 0.00 60.65 62.01 2bbw s ILE 217 Cb -0.24 -3.44 -0.06 0.00 0.01 0.00 0.00 42.46 38.73 2bbw s ILE 217 CO 0.28 0.08 0.49 -1.10 0.00 0.00 0.00 174.94 174.69 2bbw s GLN 218 N 0.43 3.68 0.36 2.79 -1.52 -1.26 -4.98 119.66 119.16 2bbw s GLN 218 Ca 0.63 0.05 -0.28 0.00 -1.95 0.00 0.00 55.36 53.80 2bbw s GLN 218 Cb -0.40 -2.72 -0.11 0.00 -0.22 0.00 0.00 33.01 29.56 2bbw s GLN 218 CO 0.36 0.34 1.43 0.45 -0.25 0.00 0.00 175.29 177.62 2bbw s SER 219 N -2.68 6.48 0.65 5.90 0.15 -1.26 -4.89 113.70 118.05 2bbw s SER 219 Ca 0.44 2.94 0.42 0.00 0.70 0.00 0.00 55.95 60.45 2bbw s SER 219 Cb -0.11 -2.66 2.31 0.00 -1.71 0.00 0.00 66.02 63.85 2bbw s SER 219 CO 0.25 -0.77 2.30 0.07 1.20 0.00 0.00 173.24 176.29 2bbw h LYS 220 N 3.15 0.00 -0.64 5.44 -0.00 -2.06 -1.65 116.57 120.80 2bbw h LYS 220 Ca -0.50 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.15 2bbw h LYS 220 Cb 1.23 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.46 2bbw h LYS 220 CO 0.65 0.00 0.00 0.39 -0.00 0.00 0.00 179.45 180.49 2bbw n GLU 221 N -3.01 3.76 -3.12 0.07 4.71 -1.26 -4.84 120.64 116.94 2bbw n GLU 221 Ca -0.03 -2.52 -0.45 0.00 -0.01 0.00 0.00 57.16 54.16 2bbw n GLU 221 Cb 0.09 -1.96 -0.00 0.00 -1.01 0.00 0.00 31.44 28.55 2bbw n GLU 221 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2bbw s ALA 222 N -2.11 4.22 0.00 0.62 0.00 -0.62 -5.28 121.76 118.58 2bbw s ALA 222 Ca 0.44 -3.47 0.00 0.00 0.00 0.00 0.00 51.96 48.93 2bbw s ALA 222 Cb 0.31 -3.86 0.00 0.00 0.00 0.00 0.00 23.12 19.57 2bbw s ALA 222 CO 0.17 -2.54 0.00 2.48 0.00 0.00 0.00 175.76 175.87