#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fbw s THR 3 N 0.00 1.74 0.71 0.00 2.01 -1.26 -5.13 115.64 113.71 2fbw s THR 3 Ca 0.00 -1.23 -0.11 0.00 0.31 0.00 0.00 61.69 60.66 2fbw s THR 3 Cb 0.00 -1.51 0.02 0.00 0.01 0.00 0.00 72.50 71.02 2fbw s THR 3 CO 0.00 0.23 1.07 0.42 -0.69 0.00 0.00 174.62 175.65 2fbw s THR 4 N -0.80 3.77 0.26 -0.82 -4.23 -1.26 -4.85 115.64 107.71 2fbw s THR 4 Ca 0.08 0.58 -0.04 0.00 -1.18 0.00 0.00 61.69 61.13 2fbw s THR 4 Cb -0.09 -3.42 0.26 0.00 1.34 0.00 0.00 72.50 70.59 2fbw s THR 4 CO 0.02 -0.75 1.89 0.00 -0.54 0.00 0.00 174.62 175.23 2fbw h ALA 5 N -0.74 1.34 -0.59 3.99 0.00 -2.00 -0.54 119.26 120.72 2fbw h ALA 5 Ca -0.45 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 2fbw h ALA 5 Cb 1.23 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 2fbw h ALA 5 CO 0.60 0.46 0.12 0.87 0.00 0.00 0.00 179.25 181.30 2fbw h LYS 6 N 1.18 0.96 -0.42 0.00 1.57 -1.99 -0.68 116.57 117.19 2fbw h LYS 6 Ca 0.41 -0.24 -0.10 0.00 -1.87 0.00 0.00 60.65 58.84 2fbw h LYS 6 Cb 0.10 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 2fbw h LYS 6 CO -0.15 0.89 -0.17 0.93 -0.57 0.00 0.00 179.45 180.38 2fbw h GLU 7 N 0.86 0.78 -0.48 3.15 5.08 -1.80 -1.99 114.58 120.19 2fbw h GLU 7 Ca 0.18 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2fbw h GLU 7 Cb 0.38 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2fbw h GLU 7 CO 0.01 0.90 0.16 0.93 -1.00 0.00 0.00 179.01 180.01 2fbw h GLU 8 N 0.70 0.74 -0.45 2.33 5.08 -0.72 -0.81 114.58 121.44 2fbw h GLU 8 Ca 0.11 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2fbw h GLU 8 Cb 0.67 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2fbw h GLU 8 CO 0.05 0.69 0.28 0.52 -1.00 0.00 0.00 179.01 179.55 2fbw h MET 9 N 0.64 0.61 -0.71 2.33 2.86 -0.96 0.52 114.93 120.20 2fbw h MET 9 Ca 0.16 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 2fbw h MET 9 Cb 0.25 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.75 2fbw h MET 9 CO -0.01 0.43 0.33 0.00 1.06 0.00 0.00 176.91 178.72 2fbw h ALA 10 N 1.14 0.92 -0.22 6.32 0.00 -1.09 -2.15 119.26 124.18 2fbw h ALA 10 Ca 0.16 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 2fbw h ALA 10 Cb -0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2fbw h ALA 10 CO -0.03 0.50 -0.36 0.07 0.00 0.00 0.00 179.25 179.42 2fbw h ARG 11 N 1.00 0.48 -0.25 0.00 0.11 -0.85 -1.16 114.38 113.71 2fbw h ARG 11 Ca 0.24 -0.22 0.06 0.00 0.10 0.00 0.00 59.98 60.16 2fbw h ARG 11 Cb 0.14 -0.01 -0.06 0.00 1.11 0.00 0.00 29.97 31.16 2fbw h ARG 11 CO -0.03 0.78 -0.11 0.35 0.10 0.00 0.00 179.97 181.06 2fbw h PHE 12 N 0.40 -0.26 -0.21 4.08 3.57 -0.35 0.14 116.94 124.31 2fbw h PHE 12 Ca 0.04 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.42 2fbw h PHE 12 Cb 0.82 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 2fbw h PHE 12 CO 0.03 -0.17 -0.50 -1.49 -2.23 0.00 0.00 178.31 173.95 2fbw h TRP 13 N -0.08 0.69 -0.32 0.41 4.06 -1.17 -1.69 115.95 117.85 2fbw h TRP 13 Ca 0.13 -0.23 -0.03 0.00 2.06 0.00 0.00 58.89 60.82 2fbw h TRP 13 Cb 0.27 -0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.28 2fbw h TRP 13 CO -0.29 0.95 0.08 1.49 -3.56 0.00 0.00 178.44 177.11 2fbw h GLU 14 N 0.44 0.52 0.80 0.49 4.22 -0.88 -1.14 114.58 119.04 2fbw h GLU 14 Ca 0.02 -0.12 -0.04 0.00 0.08 0.00 0.00 59.36 59.30 2fbw h GLU 14 Cb 1.03 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.22 2fbw h GLU 14 CO 0.09 0.58 -0.39 -0.22 -2.18 0.00 0.00 179.01 176.90 2fbw h LYS 15 N 0.37 -1.04 -0.42 1.92 3.64 -0.67 -3.12 116.57 117.25 2fbw h LYS 15 Ca 0.10 0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 59.45 2fbw h LYS 15 Cb 0.29 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 2fbw h LYS 15 CO 0.00 -0.69 -0.14 -0.91 -2.27 0.00 0.00 179.45 175.45 2fbw h ASN 16 N -1.12 0.85 0.10 4.20 2.35 -1.32 -2.42 115.58 118.22 2fbw h ASN 16 Ca -0.11 -0.38 -0.01 0.00 -0.55 0.00 0.00 56.30 55.25 2fbw h ASN 16 Cb 0.83 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.97 2fbw h ASN 16 CO 0.18 1.03 -0.06 0.71 -1.65 0.00 0.00 177.43 177.64 2fbw h THR 17 N 0.66 0.83 -0.33 2.81 1.35 -1.32 -1.42 112.91 115.49 2fbw h THR 17 Ca 0.10 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 2fbw h THR 17 Cb 0.68 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 68.24 2fbw h THR 17 CO 0.05 0.06 0.00 2.29 -0.25 0.00 0.00 175.52 177.67 2fbw n LYS 18 N -4.15 2.37 -2.56 4.72 2.85 -1.14 -4.95 118.16 115.31 2fbw n LYS 18 Ca -0.03 -2.06 -0.24 0.00 -1.05 0.00 0.00 58.31 54.93 2fbw n LYS 18 Cb 0.15 -1.49 0.11 0.00 -0.65 0.00 0.00 35.03 33.15 2fbw n LYS 18 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 2fbw s SER 19 N -1.54 4.30 -0.06 -5.58 1.04 -0.53 -4.99 113.70 106.33 2fbw s SER 19 Ca 0.37 -0.33 0.19 0.00 0.48 0.00 0.00 55.95 56.65 2fbw s SER 19 Cb 0.22 -0.03 0.63 0.00 0.10 0.00 0.00 66.02 66.93 2fbw s SER 19 CO 0.31 -1.90 1.54 -1.54 0.98 0.00 0.00 173.24 172.62 2fbw n SER 20 N -2.87 4.18 -4.73 7.02 3.41 -1.26 -4.97 113.62 114.39 2fbw n SER 20 Ca 0.15 -2.25 -0.42 0.00 -0.26 0.00 0.00 58.87 56.09 2fbw n SER 20 Cb 0.61 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 64.03 2fbw n SER 20 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2fbw s ARG 21 N -1.47 4.32 0.63 4.33 0.52 -1.26 -5.01 118.95 121.01 2fbw s ARG 21 Ca 0.46 2.16 -0.09 0.00 -0.52 0.00 0.00 55.73 57.74 2fbw s ARG 21 Cb 0.27 -3.18 -0.00 0.00 0.52 0.00 0.00 34.95 32.56 2fbw s ARG 21 CO 0.26 -0.38 0.98 -1.25 0.02 0.00 0.00 175.30 174.93 2fbw s PRO 22 N 0.26 3.06 -0.12 3.54 0.04 -1.26 -5.04 135.00 135.47 2fbw s PRO 22 Ca 0.61 0.30 -0.16 0.00 0.04 0.00 0.00 61.00 61.79 2fbw s PRO 22 Cb -0.39 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 2fbw s PRO 22 CO 0.37 -0.76 0.41 -1.17 0.04 0.00 0.00 177.00 175.88 2fbw s LEU 23 N -5.14 4.28 0.45 -3.56 2.96 -1.26 -5.05 118.68 111.37 2fbw s LEU 23 Ca 0.55 0.72 -0.23 0.00 -0.22 0.00 0.00 54.13 54.95 2fbw s LEU 23 Cb -0.11 -2.57 -0.08 0.00 0.50 0.00 0.00 46.19 43.93 2fbw s LEU 23 CO 0.49 0.07 1.15 -0.94 -1.32 0.00 0.00 176.35 175.79 2fbw s SER 24 N 0.40 6.27 0.71 3.68 1.04 -1.26 -4.97 113.70 119.57 2fbw s SER 24 Ca 0.22 2.27 -0.16 0.00 0.48 0.00 0.00 55.95 58.76 2fbw s SER 24 Cb -0.14 -2.60 0.02 0.00 0.10 0.00 0.00 66.02 63.40 2fbw s SER 24 CO 0.08 -0.85 1.20 -0.81 0.98 0.00 0.00 173.24 173.85 2fbw n PRO 25 N -0.41 0.70 0.00 4.02 -0.04 -1.26 -4.96 135.00 133.04 2fbw n PRO 25 Ca 0.07 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 63.83 2fbw n PRO 25 Cb 0.48 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 2fbw n PRO 25 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2fbw n HIS 26 N -2.47 0.00 -0.29 0.54 1.44 -1.26 -4.83 115.22 108.34 2fbw n HIS 26 Ca 0.15 0.00 0.06 0.00 -2.01 0.00 0.00 57.72 55.92 2fbw n HIS 26 Cb 0.49 0.17 0.28 0.00 0.12 0.00 0.00 29.99 31.04 2fbw n HIS 26 CO 0.00 0.00 0.00 0.97 -2.81 0.00 0.00 176.34 174.50 2fbw h ILE 27 N 0.00 1.00 0.00 0.61 2.10 -1.94 0.02 117.51 119.30 2fbw h ILE 27 Ca 0.00 -0.32 0.00 0.00 1.08 0.00 0.00 64.86 65.62 2fbw h ILE 27 Cb 0.00 -0.02 0.00 0.00 -1.09 0.00 0.00 36.82 35.71 2fbw h ILE 27 CO 0.00 0.17 0.00 -1.54 -1.08 0.00 0.00 178.15 175.70 2fbw n SER 28 N -4.52 0.00 0.00 2.19 3.41 -1.26 -3.98 113.62 109.46 2fbw n SER 28 Ca 0.15 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.24 2fbw n SER 28 Cb 0.27 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 2fbw n SER 28 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2fbw n ILE 29 N -1.49 0.00 -2.43 -1.33 -6.64 -0.89 -5.06 119.36 101.51 2fbw n ILE 29 Ca 0.07 -0.33 -0.41 0.00 -1.77 0.00 0.00 62.75 60.31 2fbw n ILE 29 Cb 0.31 0.97 -0.04 0.00 -1.44 0.00 0.00 39.64 39.44 2fbw n ILE 29 CO 0.00 0.00 0.00 -0.47 -1.77 0.00 0.00 176.55 174.31 2fbw s TYR 30 N -0.73 3.51 0.22 4.28 5.04 -0.06 -4.99 117.35 124.62 2fbw s TYR 30 Ca 0.00 1.56 -0.30 0.00 -2.44 0.00 0.00 57.07 55.89 2fbw s TYR 30 Cb 0.00 -3.35 -0.08 0.00 0.35 0.00 0.00 41.96 38.87 2fbw s TYR 30 CO 0.00 -0.86 1.16 0.21 -1.34 0.00 0.00 175.55 174.73 2fbw s LYS 31 N -0.72 4.54 0.60 4.97 2.20 -1.26 -5.00 119.74 125.05 2fbw s LYS 31 Ca 0.49 1.85 -0.09 0.00 -0.36 0.00 0.00 55.97 57.86 2fbw s LYS 31 Cb -0.32 -3.22 -0.03 0.00 -1.51 0.00 0.00 37.83 32.75 2fbw s LYS 31 CO 0.38 0.01 0.97 -1.58 -0.36 0.00 0.00 175.35 174.77 2fbw s TRP 32 N -0.43 3.53 0.08 4.03 0.52 -1.26 -5.10 118.94 120.31 2fbw s TRP 32 Ca 0.50 1.07 -0.06 0.00 0.02 0.00 0.00 56.10 57.63 2fbw s TRP 32 Cb -0.32 -2.67 -0.01 0.00 -1.15 0.00 0.00 33.47 29.31 2fbw s TRP 32 CO 0.38 -0.67 0.13 -1.54 0.02 0.00 0.00 176.95 175.27 2fbw s SER 33 N -4.20 0.22 0.19 2.95 1.04 -1.26 -5.04 113.70 107.61 2fbw s SER 33 Ca 0.53 -0.77 -0.11 0.00 0.48 0.00 0.00 55.95 56.08 2fbw s SER 33 Cb -0.11 0.30 0.12 0.00 0.10 0.00 0.00 66.02 66.44 2fbw s SER 33 CO 0.51 -0.70 1.84 0.25 0.98 0.00 0.00 173.24 176.12 2fbw h LEU 34 N 2.85 0.81 -1.03 2.42 5.85 -1.99 -1.31 115.31 122.92 2fbw h LEU 34 Ca -0.34 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.30 2fbw h LEU 34 Cb 1.18 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.98 2fbw h LEU 34 CO 0.59 0.62 0.31 -0.65 -0.34 0.00 0.00 178.44 178.96 2fbw h PRO 35 N 0.92 1.00 -0.45 5.25 0.11 -1.96 0.60 132.00 137.46 2fbw h PRO 35 Ca 0.25 -0.15 -0.08 0.00 0.11 0.00 0.00 66.00 66.13 2fbw h PRO 35 Cb -0.05 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 30.87 2fbw h PRO 35 CO -0.05 0.79 -0.01 1.98 -0.21 0.00 0.00 178.00 180.50 2fbw h MET 36 N 0.99 0.81 -0.65 1.05 4.05 -1.87 -2.01 114.93 117.29 2fbw h MET 36 Ca 0.24 -0.26 -0.09 0.00 -0.28 0.00 0.00 59.70 59.30 2fbw h MET 36 Cb 0.14 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 30.85 2fbw h MET 36 CO -0.03 0.88 0.07 0.00 0.23 0.00 0.00 176.91 178.05 2fbw h ALA 37 N 0.91 0.88 -0.11 0.39 0.00 -0.84 -2.49 119.26 117.99 2fbw h ALA 37 Ca 0.13 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2fbw h ALA 37 Cb 0.52 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2fbw h ALA 37 CO 0.03 0.67 -0.21 0.52 0.00 0.00 0.00 179.25 180.26 2fbw h MET 38 N 1.03 0.18 -0.14 0.00 2.86 -0.79 -1.22 114.93 116.86 2fbw h MET 38 Ca 0.19 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.77 2fbw h MET 38 Cb 0.49 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 2fbw h MET 38 CO 0.02 0.39 0.02 1.03 1.06 0.00 0.00 176.91 179.43 2fbw h SER 39 N 0.17 0.22 -0.32 1.22 0.87 -0.98 0.22 113.55 114.94 2fbw h SER 39 Ca 0.03 -0.25 -0.08 0.00 -1.23 0.00 0.00 61.79 60.25 2fbw h SER 39 Cb 0.47 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.35 2fbw h SER 39 CO 0.03 0.42 -0.08 0.16 -0.53 0.00 0.00 176.83 176.83 2fbw h ILE 40 N 0.01 1.25 -0.38 2.23 3.07 -1.15 -2.78 117.51 119.75 2fbw h ILE 40 Ca 0.04 -1.08 -0.08 0.00 1.55 0.00 0.00 64.86 65.29 2fbw h ILE 40 Cb 0.29 1.01 -0.02 0.00 -0.27 0.00 0.00 36.82 37.83 2fbw h ILE 40 CO 0.00 0.37 -0.09 0.74 -1.05 0.00 0.00 178.15 178.13 2fbw h THR 41 N 0.66 1.24 -0.45 0.16 2.02 -0.90 0.16 112.91 115.81 2fbw h THR 41 Ca 0.12 -1.05 -0.07 0.00 0.77 0.00 0.00 66.41 66.18 2fbw h THR 41 Cb 0.52 1.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.96 2fbw h THR 41 CO 0.03 0.36 -0.01 -0.74 0.37 0.00 0.00 175.52 175.53 2fbw h HIS 42 N 0.60 0.77 -0.16 3.16 -0.00 -0.31 0.42 115.15 119.63 2fbw h HIS 42 Ca 0.11 -0.10 -0.12 0.00 -0.00 0.00 0.00 60.37 60.25 2fbw h HIS 42 Cb 0.50 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 27.70 2fbw h HIS 42 CO 0.02 0.73 -0.38 -0.09 -0.00 0.00 0.00 177.93 178.21 2fbw h ARG 43 N 0.69 0.54 -0.60 5.26 2.43 -1.18 -2.12 114.38 119.39 2fbw h ARG 43 Ca 0.14 -0.37 0.01 0.00 -0.81 0.00 0.00 59.98 58.95 2fbw h ARG 43 Cb 0.43 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 2fbw h ARG 43 CO 0.02 0.98 0.40 0.78 -1.51 0.00 0.00 179.97 180.64 2fbw h GLY 44 N 0.18 0.85 1.18 2.80 0.00 -0.38 -1.67 103.07 106.04 2fbw h GLY 44 Ca -0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 47.33 46.87 2fbw h GLY 44 CO 0.08 0.30 -0.31 -0.91 0.00 0.00 0.00 176.54 175.71 2fbw h THR 45 N 0.81 1.27 -0.69 4.70 1.35 -0.94 -1.36 112.91 118.06 2fbw h THR 45 Ca 0.22 -1.47 0.02 0.00 -0.55 0.00 0.00 66.41 64.63 2fbw h THR 45 Cb -0.08 1.28 -0.04 0.00 -1.73 0.00 0.00 68.15 67.58 2fbw h THR 45 CO -0.05 0.50 0.44 1.23 -0.25 0.00 0.00 175.52 177.38 2fbw h GLY 46 N 0.86 0.98 1.12 5.82 0.00 -1.07 0.18 103.07 110.96 2fbw h GLY 46 Ca 0.08 -0.34 -0.14 0.00 0.00 0.00 0.00 47.33 46.93 2fbw h GLY 46 CO 0.08 0.30 -0.28 -2.08 0.00 0.00 0.00 176.54 174.56 2fbw h VAL 47 N 0.87 1.27 -0.51 4.60 2.07 -1.21 -1.25 116.25 122.09 2fbw h VAL 47 Ca 0.27 -1.45 -0.04 0.00 0.82 0.00 0.00 66.70 66.31 2fbw h VAL 47 Cb -0.02 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 2fbw h VAL 47 CO -0.09 0.49 0.17 0.00 0.02 0.00 0.00 177.57 178.17 2fbw h ALA 48 N 0.83 0.66 -0.74 1.67 0.00 -0.77 -0.48 119.26 120.43 2fbw h ALA 48 Ca 0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 2fbw h ALA 48 Cb 0.86 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2fbw h ALA 48 CO 0.08 0.30 0.37 -0.07 0.00 0.00 0.00 179.25 179.93 2fbw h LEU 49 N 0.68 0.94 -0.38 0.00 3.38 -0.50 -0.42 115.31 119.02 2fbw h LEU 49 Ca 0.17 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 2fbw h LEU 49 Cb 0.25 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2fbw h LEU 49 CO -0.01 0.79 -0.24 0.28 0.09 0.00 0.00 178.44 179.35 2fbw h SER 50 N 1.05 0.87 0.53 -0.43 0.02 -0.75 -1.55 113.55 113.28 2fbw h SER 50 Ca 0.26 -0.43 -0.07 0.00 -0.84 0.00 0.00 61.79 60.71 2fbw h SER 50 Cb 0.08 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 2fbw h SER 50 CO -0.04 1.11 -0.32 -0.07 -1.14 0.00 0.00 176.83 176.37 2fbw h LEU 51 N 0.64 0.00 0.02 5.07 3.38 -0.77 -1.32 115.31 122.33 2fbw h LEU 51 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2fbw h LEU 51 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 2fbw h LEU 51 CO 0.07 0.32 -0.01 1.23 0.09 0.00 0.00 178.44 180.14 2fbw h GLY 52 N 1.39 -0.03 1.03 0.83 0.00 -0.69 -1.02 103.07 104.58 2fbw h GLY 52 Ca -0.00 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.33 2fbw h GLY 52 CO 0.04 -0.01 0.54 -2.08 0.00 0.00 0.00 176.54 175.03 2fbw h VAL 53 N -0.43 1.26 -0.38 4.60 2.07 -1.06 -1.52 116.25 120.80 2fbw h VAL 53 Ca -0.00 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.87 2fbw h VAL 53 Cb 0.41 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2fbw h VAL 53 CO 0.00 0.28 0.04 0.28 0.02 0.00 0.00 177.57 178.20 2fbw h SER 54 N 1.29 0.61 -0.89 0.57 0.02 -1.18 -1.23 113.55 112.74 2fbw h SER 54 Ca 0.33 -0.27 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2fbw h SER 54 Cb -0.02 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.31 2fbw h SER 54 CO -0.06 0.73 0.53 -0.07 -1.14 0.00 0.00 176.83 176.83 2fbw h LEU 55 N 0.47 1.07 -0.29 5.07 3.38 -0.90 -0.59 115.31 123.52 2fbw h LEU 55 Ca 0.11 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.91 2fbw h LEU 55 Cb 0.39 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2fbw h LEU 55 CO 0.01 0.83 -0.22 0.15 0.09 0.00 0.00 178.44 179.30 2fbw h PHE 56 N 1.23 0.79 -0.84 1.13 3.57 -1.18 -1.09 116.94 120.54 2fbw h PHE 56 Ca 0.32 -0.22 0.01 0.00 3.53 0.00 0.00 57.97 61.61 2fbw h PHE 56 Cb -0.04 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 38.48 2fbw h PHE 56 CO 0.01 0.94 0.55 1.03 -2.23 0.00 0.00 178.31 178.61 2fbw h SER 57 N 0.41 0.97 0.68 0.41 0.87 -0.84 -0.19 113.55 115.86 2fbw h SER 57 Ca 0.06 -0.03 -0.14 0.00 -1.23 0.00 0.00 61.79 60.45 2fbw h SER 57 Cb 0.77 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.47 2fbw h SER 57 CO 0.06 0.70 -0.65 1.62 -0.53 0.00 0.00 176.83 178.03 2fbw h VAL 58 N 1.14 1.45 -0.18 2.23 3.04 -1.05 -2.87 116.25 120.01 2fbw h VAL 58 Ca 0.31 -2.25 -0.18 0.00 -1.01 0.00 0.00 66.70 63.57 2fbw h VAL 58 Cb -0.13 2.22 -0.00 0.00 -2.01 0.00 0.00 31.29 31.37 2fbw h VAL 58 CO -0.07 0.64 -0.61 0.00 -1.01 0.00 0.00 177.57 176.52 2fbw h ALA 59 N 1.35 0.59 -0.12 3.17 0.00 -0.43 -1.69 119.26 122.13 2fbw h ALA 59 Ca -0.01 -0.54 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 2fbw h ALA 59 Cb 1.17 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2fbw h ALA 59 CO 0.08 0.70 -0.22 0.00 0.00 0.00 0.00 179.25 179.82 2fbw h ALA 60 N 0.86 1.42 0.00 0.00 0.00 -0.96 0.23 119.26 120.80 2fbw h ALA 60 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2fbw h ALA 60 Cb 1.18 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2fbw h ALA 60 CO 0.12 0.41 -0.68 -0.07 0.00 0.00 0.00 179.25 179.03 2fbw h LEU 61 N 0.19 0.00 0.00 0.00 3.38 -1.38 -3.40 115.31 114.10 2fbw h LEU 61 Ca 0.03 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 57.82 2fbw h LEU 61 Cb 0.50 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 2fbw h LEU 61 CO 0.03 0.02 -1.54 0.18 0.09 0.00 0.00 178.44 177.22 2fbw n LEU 62 N -2.65 0.00 -4.76 1.67 4.77 -0.65 -5.03 117.00 110.35 2fbw n LEU 62 Ca 0.02 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.63 2fbw n LEU 62 Cb 0.52 0.19 0.01 0.00 -2.33 0.00 0.00 43.42 41.82 2fbw n LEU 62 CO 0.38 0.19 0.87 -0.76 -1.33 0.00 0.00 177.39 176.74 2fbw s LEU 63 N -4.57 3.90 0.04 2.23 1.43 0.78 -4.97 118.68 117.52 2fbw s LEU 63 Ca -0.04 2.44 -0.27 0.00 -1.03 0.00 0.00 54.13 55.23 2fbw s LEU 63 Cb 0.02 -4.33 -0.17 0.00 0.03 0.00 0.00 46.19 41.75 2fbw s LEU 63 CO 0.33 -1.23 1.46 -0.65 0.23 0.00 0.00 176.35 176.49 2fbw h PRO 64 N 1.65 -0.43 -7.16 1.29 0.11 -1.95 -3.46 132.00 122.04 2fbw h PRO 64 Ca -0.50 0.03 -0.45 0.00 0.11 0.00 0.00 66.00 65.19 2fbw h PRO 64 Cb 1.27 0.10 0.07 0.00 0.11 0.00 0.00 31.00 32.55 2fbw h PRO 64 CO 0.58 -0.18 0.15 -1.21 -0.21 0.00 0.00 178.00 177.14 2fbw s GLU 65 N -5.36 2.33 0.61 1.05 0.41 -1.26 -5.11 118.70 111.38 2fbw s GLU 65 Ca -0.15 -0.38 -0.01 0.00 -0.41 0.00 0.00 54.97 54.01 2fbw s GLU 65 Cb 0.03 -2.26 0.05 0.00 -1.78 0.00 0.00 34.13 30.17 2fbw s GLU 65 CO 0.60 -1.06 0.87 -0.65 -0.49 0.00 0.00 175.26 174.52 2fbw s GLN 66 N -5.10 2.36 0.13 1.61 -1.52 -1.26 -5.00 119.66 110.89 2fbw s GLN 66 Ca 0.59 -0.64 -0.21 0.00 -1.95 0.00 0.00 55.36 53.15 2fbw s GLN 66 Cb -0.11 -2.37 -0.01 0.00 -0.22 0.00 0.00 33.01 30.30 2fbw s GLN 66 CO 0.43 -0.94 1.68 0.35 -0.25 0.00 0.00 175.29 176.56 2fbw h PHE 67 N -0.19 -0.30 -0.91 0.91 3.57 -1.99 -2.59 116.94 115.44 2fbw h PHE 67 Ca -0.42 0.02 0.19 0.00 3.53 0.00 0.00 57.97 61.29 2fbw h PHE 67 Cb 1.30 0.16 -0.07 0.00 2.79 0.00 0.00 35.95 40.13 2fbw h PHE 67 CO 0.31 -0.18 0.59 -1.35 -2.23 0.00 0.00 178.31 175.45 2fbw h PRO 68 N -0.13 0.46 -0.04 6.41 0.11 -1.99 -1.79 132.00 135.04 2fbw h PRO 68 Ca 0.10 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.21 2fbw h PRO 68 Cb 0.28 -0.10 -0.03 0.00 0.11 0.00 0.00 31.00 31.25 2fbw h PRO 68 CO -0.24 0.31 -0.12 1.25 -0.21 0.00 0.00 178.00 178.99 2fbw h HIS 69 N 0.48 -0.30 -0.03 0.65 -0.00 -1.86 0.15 115.15 114.25 2fbw h HIS 69 Ca 0.48 0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 60.77 2fbw h HIS 69 Cb 1.08 0.14 -0.01 0.00 -0.00 0.00 0.00 27.41 28.61 2fbw h HIS 69 CO -0.00 -0.18 -0.40 1.88 -0.00 0.00 0.00 177.93 179.23 2fbw h TYR 70 N -0.18 0.06 -0.17 5.26 -1.99 -1.39 -1.21 116.97 117.35 2fbw h TYR 70 Ca 0.06 -0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 2fbw h TYR 70 Cb 0.26 -0.01 -0.01 0.00 2.00 0.00 0.00 36.73 38.96 2fbw h TYR 70 CO -0.20 0.45 0.04 0.28 -0.00 0.00 0.00 178.16 178.74 2fbw h VAL 71 N 0.05 1.21 -0.39 -2.88 2.07 -0.89 -2.03 116.25 113.39 2fbw h VAL 71 Ca 0.00 -0.66 0.01 0.00 0.82 0.00 0.00 66.70 66.87 2fbw h VAL 71 Cb 0.73 1.31 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 2fbw h VAL 71 CO 0.05 0.20 0.26 0.00 0.02 0.00 0.00 177.57 178.10 2fbw h ALA 72 N 0.84 0.50 -0.69 1.67 0.00 -0.67 -0.94 119.26 119.97 2fbw h ALA 72 Ca 0.05 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.04 2fbw h ALA 72 Cb 0.27 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.83 2fbw h ALA 72 CO 0.00 -0.05 0.31 0.28 0.00 0.00 0.00 179.25 179.79 2fbw h VAL 73 N 0.53 0.80 -0.18 0.00 2.07 -1.12 0.93 116.25 119.28 2fbw h VAL 73 Ca 0.15 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 2fbw h VAL 73 Cb -0.05 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 29.94 2fbw h VAL 73 CO -0.04 0.10 0.04 0.58 0.02 0.00 0.00 177.57 178.27 2fbw h VAL 74 N 0.52 1.20 -0.69 2.57 2.07 -0.82 -2.86 116.25 118.25 2fbw h VAL 74 Ca 0.35 -0.65 0.04 0.00 0.82 0.00 0.00 66.70 67.25 2fbw h VAL 74 Cb 0.41 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 2fbw h VAL 74 CO -0.30 0.20 0.46 0.11 0.02 0.00 0.00 177.57 178.06 2fbw h LYS 75 N 0.09 0.78 0.00 1.57 1.57 -0.40 -1.80 116.57 118.39 2fbw h LYS 75 Ca 0.06 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 2fbw h LYS 75 Cb 0.27 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2fbw h LYS 75 CO 0.00 0.51 -0.13 0.66 -0.57 0.00 0.00 179.45 179.93 2fbw h SER 76 N 0.80 0.00 0.56 0.86 4.64 -0.62 -2.32 113.55 117.48 2fbw h SER 76 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2fbw h SER 76 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2fbw h SER 76 CO -0.08 0.13 0.00 0.18 -0.87 0.00 0.00 176.83 176.18 2fbw n LEU 77 N -3.69 0.00 -3.84 5.97 4.77 -0.67 -4.92 117.00 114.62 2fbw n LEU 77 Ca -0.02 0.44 -0.33 0.00 -0.03 0.00 0.00 56.01 56.08 2fbw n LEU 77 Cb 0.24 -0.44 0.02 0.00 -2.33 0.00 0.00 43.42 40.91 2fbw n LEU 77 CO 0.31 -0.16 -0.14 -1.20 -1.33 0.00 0.00 177.39 174.86 2fbw n SER 78 N -1.44 -3.60 -4.81 -1.43 7.64 -0.87 -4.93 113.62 104.18 2fbw n SER 78 Ca 0.06 -1.07 -0.33 0.00 1.01 0.00 0.00 58.87 58.54 2fbw n SER 78 Cb 0.20 -2.95 0.00 0.00 -1.01 0.00 0.00 64.21 60.45 2fbw n SER 78 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2fbw s LEU 79 N -6.80 3.55 0.18 -3.43 1.43 -1.26 -4.96 118.68 107.39 2fbw s LEU 79 Ca 0.34 1.80 -0.33 0.00 -1.03 0.00 0.00 54.13 54.91 2fbw s LEU 79 Cb -0.14 -4.53 -0.13 0.00 0.03 0.00 0.00 46.19 41.42 2fbw s LEU 79 CO 0.89 -1.06 1.63 -0.24 0.23 0.00 0.00 176.35 177.81 2fbw n SER 80 N -1.86 3.43 0.26 2.29 2.88 -1.26 -4.86 113.62 114.49 2fbw n SER 80 Ca 0.09 1.07 0.09 0.00 -1.33 0.00 0.00 58.87 58.79 2fbw n SER 80 Cb 0.53 -1.48 0.65 0.00 -0.75 0.00 0.00 64.21 63.16 2fbw n SER 80 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2fbw h PRO 81 N 6.24 0.00 -0.27 -1.46 0.11 -1.98 -1.01 132.00 133.63 2fbw h PRO 81 Ca -0.44 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 2fbw h PRO 81 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2fbw h PRO 81 CO 0.91 0.00 0.13 0.00 -0.21 0.00 0.00 178.00 178.84 2fbw h ALA 82 N 1.99 0.35 -0.70 -0.75 0.00 -1.99 0.21 119.26 118.37 2fbw h ALA 82 Ca 0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2fbw h ALA 82 Cb 0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2fbw h ALA 82 CO -0.00 -0.10 0.29 1.25 0.00 0.00 0.00 179.25 180.69 2fbw h LEU 83 N 0.31 0.96 -0.91 0.00 5.85 -1.75 0.06 115.31 119.83 2fbw h LEU 83 Ca 0.09 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.55 2fbw h LEU 83 Cb 0.10 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 2fbw h LEU 83 CO -0.01 0.86 -0.25 0.40 -0.34 0.00 0.00 178.44 179.10 2fbw h ILE 84 N 0.99 1.27 -0.52 4.05 2.04 -0.88 -1.59 117.51 122.87 2fbw h ILE 84 Ca 0.23 -1.28 -0.04 0.00 1.00 0.00 0.00 64.86 64.77 2fbw h ILE 84 Cb 0.20 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 2fbw h ILE 84 CO -0.02 0.41 0.16 0.22 0.00 0.00 0.00 178.15 178.91 2fbw h TYR 85 N 0.45 0.84 -0.46 1.37 3.20 0.00 -1.53 116.97 120.85 2fbw h TYR 85 Ca 0.07 -0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.86 2fbw h TYR 85 Cb 0.68 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 2fbw h TYR 85 CO 0.02 0.72 0.28 0.77 -1.64 0.00 0.00 178.16 178.32 2fbw h SER 86 N 0.71 0.47 -0.45 -2.11 0.02 -0.68 -1.05 113.55 110.45 2fbw h SER 86 Ca 0.17 -0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.08 2fbw h SER 86 Cb 0.28 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 2fbw h SER 86 CO -0.00 0.33 0.17 0.00 -1.14 0.00 0.00 176.83 176.19 2fbw h ALA 87 N 1.19 1.34 -0.59 3.77 0.00 -1.08 -0.95 119.26 122.94 2fbw h ALA 87 Ca 0.18 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 2fbw h ALA 87 Cb -0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2fbw h ALA 87 CO -0.07 0.48 0.03 0.87 0.00 0.00 0.00 179.25 180.56 2fbw h LYS 88 N 0.73 1.03 0.14 0.00 1.57 -0.68 -1.27 116.57 118.10 2fbw h LYS 88 Ca 0.17 -0.31 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 2fbw h LYS 88 Cb 0.20 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2fbw h LYS 88 CO -0.01 1.00 -0.07 0.35 -0.57 0.00 0.00 179.45 180.15 2fbw h PHE 89 N 0.93 -0.17 -0.28 -1.35 3.57 -0.40 -1.23 116.94 118.01 2fbw h PHE 89 Ca 0.17 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.68 2fbw h PHE 89 Cb 0.52 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.30 2fbw h PHE 89 CO 0.04 -0.06 0.18 0.00 -2.23 0.00 0.00 178.31 176.24 2fbw h ALA 90 N 0.62 1.88 -0.05 2.41 0.00 -1.06 0.35 119.26 123.41 2fbw h ALA 90 Ca -0.02 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 2fbw h ALA 90 Cb 0.19 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.90 2fbw h ALA 90 CO 0.03 0.10 -0.55 -0.07 0.00 0.00 0.00 179.25 178.75 2fbw h LEU 91 N 0.31 0.58 0.00 0.00 3.38 -0.82 -3.32 115.31 115.44 2fbw h LEU 91 Ca 0.11 -0.70 -0.06 0.00 0.09 0.00 0.00 57.88 57.32 2fbw h LEU 91 Cb 0.06 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2fbw h LEU 91 CO -0.02 1.19 -0.30 1.62 0.09 0.00 0.00 178.44 181.01 2fbw h VAL 92 N 0.02 0.50 0.21 1.22 3.04 -0.85 -3.39 116.25 117.00 2fbw h VAL 92 Ca -0.05 -1.71 0.01 0.00 -1.01 0.00 0.00 66.70 63.94 2fbw h VAL 92 Cb 1.23 2.24 -0.04 0.00 -2.01 0.00 0.00 31.29 32.71 2fbw h VAL 92 CO 0.11 0.28 -0.52 0.15 -1.01 0.00 0.00 177.57 176.59 2fbw h PHE 93 N 0.00 -1.49 -0.69 3.17 3.57 -1.04 -0.39 116.94 120.08 2fbw h PHE 93 Ca -0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.61 2fbw h PHE 93 Cb 1.23 0.62 -0.04 0.00 2.79 0.00 0.00 35.95 40.55 2fbw h PHE 93 CO 0.00 -0.61 0.45 -1.00 -2.23 0.00 0.00 178.31 174.92 2fbw h PRO 94 N -0.81 0.63 -0.05 6.41 0.13 -1.76 0.23 132.00 136.78 2fbw h PRO 94 Ca -0.02 -0.04 -0.16 0.00 -0.87 0.00 0.00 66.00 64.92 2fbw h PRO 94 Cb 0.79 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.76 2fbw h PRO 94 CO -0.24 0.42 -0.66 1.25 -0.23 0.00 0.00 178.00 178.53 2fbw h LEU 95 N 0.65 0.25 -0.11 1.56 5.85 -1.67 -1.44 115.31 120.39 2fbw h LEU 95 Ca 0.30 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.75 2fbw h LEU 95 Cb 0.35 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2fbw h LEU 95 CO -0.10 0.84 -0.41 -1.28 -0.34 0.00 0.00 178.44 177.14 2fbw h SER 96 N 0.15 0.56 0.50 1.25 0.87 -0.31 -1.86 113.55 114.71 2fbw h SER 96 Ca -0.01 -0.62 -0.02 0.00 -1.23 0.00 0.00 61.79 59.91 2fbw h SER 96 Cb 1.19 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.99 2fbw h SER 96 CO 0.10 1.08 -0.29 0.22 -0.53 0.00 0.00 176.83 177.42 2fbw h TYR 97 N 0.07 -0.75 -0.90 2.24 3.20 -0.93 -1.26 116.97 118.64 2fbw h TYR 97 Ca -0.02 -0.01 0.07 0.00 3.14 0.00 0.00 58.73 61.91 2fbw h TYR 97 Cb 1.05 0.26 -0.06 0.00 1.54 0.00 0.00 36.73 39.52 2fbw h TYR 97 CO 0.11 -0.45 0.59 1.25 -1.64 0.00 0.00 178.16 178.02 2fbw h HIS 98 N -0.74 1.03 0.11 -3.82 2.76 -1.31 0.05 115.15 113.23 2fbw h HIS 98 Ca -0.06 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.13 2fbw h HIS 98 Cb 0.59 -0.34 0.00 0.00 1.55 0.00 0.00 27.41 29.22 2fbw h HIS 98 CO -0.08 0.54 -0.05 1.15 -1.30 0.00 0.00 177.93 178.18 2fbw h THR 99 N 1.01 1.06 -0.39 6.26 2.02 -1.11 0.27 112.91 122.02 2fbw h THR 99 Ca 0.39 -0.66 -0.06 0.00 0.77 0.00 0.00 66.41 66.85 2fbw h THR 99 Cb 0.22 1.47 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 2fbw h THR 99 CO -0.15 0.16 -0.00 -0.50 0.37 0.00 0.00 175.52 175.40 2fbw h TRP 100 N -0.45 0.76 -0.19 3.16 4.06 -0.98 -1.98 115.95 120.33 2fbw h TRP 100 Ca -0.01 -0.13 -0.09 0.00 2.06 0.00 0.00 58.89 60.71 2fbw h TRP 100 Cb 0.37 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.32 2fbw h TRP 100 CO 0.03 0.78 -0.29 -0.97 -3.56 0.00 0.00 178.44 174.42 2fbw h ASN 101 N 0.52 0.37 -0.78 -3.49 -0.00 -1.02 -1.79 115.58 109.39 2fbw h ASN 101 Ca 0.11 -0.13 -0.01 0.00 -0.00 0.00 0.00 56.30 56.27 2fbw h ASN 101 Cb 0.47 -0.10 -0.04 0.00 -0.00 0.00 0.00 38.32 38.66 2fbw h ASN 101 CO 0.02 0.66 0.45 1.23 -0.00 0.00 0.00 177.43 179.79 2fbw h GLY 102 N 1.05 1.15 1.35 1.57 0.00 -0.25 0.34 103.07 108.28 2fbw h GLY 102 Ca 0.05 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.81 2fbw h GLY 102 CO 0.05 0.48 0.07 -2.22 0.00 0.00 0.00 176.54 174.93 2fbw h ILE 103 N 1.08 1.23 -0.57 2.60 2.04 -0.76 -1.06 117.51 122.07 2fbw h ILE 103 Ca 0.28 -0.89 0.01 0.00 1.00 0.00 0.00 64.86 65.25 2fbw h ILE 103 Cb -0.00 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 2fbw h ILE 103 CO -0.05 0.32 0.38 -0.09 0.00 0.00 0.00 178.15 178.71 2fbw h ARG 104 N 0.77 0.75 -0.74 2.37 2.43 -0.34 -1.18 114.38 118.45 2fbw h ARG 104 Ca 0.16 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.28 2fbw h ARG 104 Cb 0.36 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 29.71 2fbw h ARG 104 CO 0.01 0.49 0.44 0.45 -1.51 0.00 0.00 179.97 179.85 2fbw h HIS 105 N 0.77 0.98 -0.07 2.20 3.86 -0.32 -2.25 115.15 120.32 2fbw h HIS 105 Ca 0.21 -0.01 -0.07 0.00 -1.16 0.00 0.00 60.37 59.34 2fbw h HIS 105 Cb -0.08 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.06 2fbw h HIS 105 CO -0.04 0.67 -0.28 -0.07 0.86 0.00 0.00 177.93 179.07 2fbw h LEU 106 N 1.01 0.13 -0.74 2.43 3.38 -0.54 -0.48 115.31 120.51 2fbw h LEU 106 Ca 0.26 -0.04 -0.13 0.00 0.09 0.00 0.00 57.88 58.07 2fbw h LEU 106 Cb -0.02 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2fbw h LEU 106 CO -0.05 0.41 -0.40 0.58 0.09 0.00 0.00 178.44 179.08 2fbw h VAL 107 N 0.12 1.30 -0.47 1.22 2.07 -0.88 -2.66 116.25 116.96 2fbw h VAL 107 Ca 0.02 -1.55 -0.11 0.00 0.82 0.00 0.00 66.70 65.87 2fbw h VAL 107 Cb 0.56 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 2fbw h VAL 107 CO 0.04 0.48 -0.16 -0.50 0.02 0.00 0.00 177.57 177.46 2fbw h TRP 108 N 0.41 1.01 0.00 1.57 6.55 -0.75 -1.70 115.95 123.04 2fbw h TRP 108 Ca 0.04 -0.21 0.00 0.00 0.95 0.00 0.00 58.89 59.66 2fbw h TRP 108 Cb 0.88 -0.25 0.00 0.00 -0.86 0.00 0.00 29.16 28.93 2fbw h TRP 108 CO 0.03 0.98 0.00 -0.44 -1.05 0.00 0.00 178.44 177.96 2fbw h ASP 109 N 0.79 0.00 -0.12 -3.49 3.32 -0.91 0.50 116.42 116.52 2fbw h ASP 109 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2fbw h ASP 109 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.24 2fbw h ASP 109 CO 0.05 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.80 2fbw n MET 110 N -2.74 1.68 -1.36 3.56 2.81 -0.77 -4.90 117.12 115.40 2fbw n MET 110 Ca -0.00 -1.01 -0.00 0.00 -1.81 0.00 0.00 57.70 54.87 2fbw n MET 110 Cb 0.19 -1.42 -0.00 0.00 -0.71 0.00 0.00 33.22 31.28 2fbw n MET 110 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2fbw n GLY 111 N 1.13 0.38 3.54 3.03 0.00 0.18 -5.06 105.19 108.39 2fbw n GLY 111 Ca 0.17 -1.02 -0.29 0.00 0.00 0.00 0.00 46.02 44.88 2fbw n GLY 111 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2fbw s LYS 112 N -2.72 1.97 -0.10 1.61 1.02 -0.71 -4.74 119.74 116.07 2fbw s LYS 112 Ca 0.00 -1.14 -0.00 0.00 0.02 0.00 0.00 55.97 54.85 2fbw s LYS 112 Cb 0.00 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 2fbw s LYS 112 CO 0.00 0.48 0.02 0.41 -0.92 0.00 0.00 175.35 175.34 2fbw n GLY 113 N 0.61 0.47 0.00 -3.33 0.00 -1.26 -3.75 105.19 97.93 2fbw n GLY 113 Ca -0.14 -0.78 0.12 0.00 0.00 0.00 0.00 46.02 45.22 2fbw n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2fbw n PHE 114 N -3.64 0.01 -2.07 1.61 3.01 -1.26 -3.89 117.46 111.22 2fbw n PHE 114 Ca -0.01 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.05 2fbw n PHE 114 Cb 0.51 -0.26 -0.02 0.00 -0.01 0.00 0.00 39.48 39.70 2fbw n PHE 114 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 2fbw s LYS 115 N -3.00 4.25 0.35 -1.08 1.02 -1.26 -4.80 119.74 115.22 2fbw s LYS 115 Ca 0.11 2.24 0.12 0.00 0.02 0.00 0.00 55.97 58.46 2fbw s LYS 115 Cb 0.18 -2.99 0.94 0.00 -0.52 0.00 0.00 37.83 35.44 2fbw s LYS 115 CO 0.69 -0.29 1.76 1.25 -0.92 0.00 0.00 175.35 177.85 2fbw h LEU 116 N 3.18 0.60 -0.76 3.17 5.85 -1.99 0.15 115.31 125.51 2fbw h LEU 116 Ca -0.49 0.10 -0.10 0.00 0.84 0.00 0.00 57.88 58.23 2fbw h LEU 116 Cb 1.23 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.25 2fbw h LEU 116 CO 0.65 0.14 -0.19 0.77 -0.34 0.00 0.00 178.44 179.47 2fbw h SER 117 N 0.55 0.74 0.10 1.25 4.64 -1.96 -2.15 113.55 116.72 2fbw h SER 117 Ca 0.60 -0.25 -0.16 0.00 -0.47 0.00 0.00 61.79 61.51 2fbw h SER 117 Cb 1.25 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 2fbw h SER 117 CO -0.37 0.92 -0.59 1.56 -0.87 0.00 0.00 176.83 177.48 2fbw h GLN 118 N 0.66 0.50 -0.49 4.77 4.20 -1.08 -1.15 115.11 122.52 2fbw h GLN 118 Ca 0.10 -0.33 -0.00 0.00 0.06 0.00 0.00 58.65 58.47 2fbw h GLN 118 Cb 0.67 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 2fbw h GLN 118 CO 0.05 0.95 0.30 0.28 -0.67 0.00 0.00 178.83 179.73 2fbw h VAL 119 N 0.37 1.15 -0.28 -0.54 2.07 -0.91 0.14 116.25 118.26 2fbw h VAL 119 Ca -0.00 -0.33 -0.09 0.00 0.82 0.00 0.00 66.70 67.09 2fbw h VAL 119 Cb 1.14 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 2fbw h VAL 119 CO 0.11 0.15 -0.19 -0.33 0.02 0.00 0.00 177.57 177.33 2fbw h GLU 120 N 0.65 0.61 -0.12 1.57 4.39 -1.33 -2.75 114.58 117.60 2fbw h GLU 120 Ca 0.18 -0.29 -0.01 0.00 0.34 0.00 0.00 59.36 59.57 2fbw h GLU 120 Cb -0.01 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2fbw h GLU 120 CO -0.03 0.88 0.04 1.96 -1.16 0.00 0.00 179.01 180.70 2fbw h GLN 121 N 0.35 0.18 -0.57 2.33 4.20 -0.95 -2.44 115.11 118.21 2fbw h GLN 121 Ca 0.05 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 58.74 2fbw h GLN 121 Cb 0.73 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.45 2fbw h GLN 121 CO 0.05 0.30 0.38 0.66 -0.67 0.00 0.00 178.83 179.55 2fbw h SER 122 N 0.03 0.63 -0.42 1.46 4.64 -0.79 -0.40 113.55 118.70 2fbw h SER 122 Ca 0.04 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.25 2fbw h SER 122 Cb 0.19 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 2fbw h SER 122 CO -0.00 0.45 -0.09 1.23 -0.87 0.00 0.00 176.83 177.54 2fbw h GLY 123 N 0.74 0.94 1.47 -0.77 0.00 -1.28 -0.52 103.07 103.64 2fbw h GLY 123 Ca 0.21 -0.72 -0.16 0.00 0.00 0.00 0.00 47.33 46.66 2fbw h GLY 123 CO -0.05 0.66 -0.56 -2.08 0.00 0.00 0.00 176.54 174.50 2fbw h VAL 124 N 0.79 1.32 -0.54 4.60 2.07 -0.83 -2.40 116.25 121.25 2fbw h VAL 124 Ca 0.13 -1.82 -0.04 0.00 0.82 0.00 0.00 66.70 65.79 2fbw h VAL 124 Cb 0.60 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2fbw h VAL 124 CO 0.04 0.57 0.16 0.58 0.02 0.00 0.00 177.57 178.94 2fbw h VAL 125 N 0.43 1.24 -0.49 2.57 2.07 -0.83 -2.15 116.25 119.08 2fbw h VAL 125 Ca 0.00 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.73 2fbw h VAL 125 Cb 1.11 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 2fbw h VAL 125 CO 0.11 0.30 0.32 0.58 0.02 0.00 0.00 177.57 178.90 2fbw h VAL 126 N 0.76 1.10 -0.21 2.57 2.07 -0.96 -0.86 116.25 120.72 2fbw h VAL 126 Ca 0.17 -0.22 -0.16 0.00 0.82 0.00 0.00 66.70 67.32 2fbw h VAL 126 Cb 0.29 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 2fbw h VAL 126 CO -0.00 0.11 -0.53 -0.07 0.02 0.00 0.00 177.57 177.10 2fbw h LEU 127 N 0.63 0.67 -0.11 2.57 3.38 -0.92 -1.72 115.31 119.81 2fbw h LEU 127 Ca 0.18 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.74 2fbw h LEU 127 Cb -0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 2fbw h LEU 127 CO -0.04 1.08 -0.18 0.40 0.09 0.00 0.00 178.44 179.79 2fbw h ILE 128 N 0.47 1.38 -0.51 1.22 2.04 -0.94 -2.23 117.51 118.95 2fbw h ILE 128 Ca 0.01 -1.43 0.02 0.00 1.00 0.00 0.00 64.86 64.47 2fbw h ILE 128 Cb 1.08 2.06 -0.03 0.00 -0.74 0.00 0.00 36.82 39.20 2fbw h ILE 128 CO 0.10 0.41 0.34 -0.07 0.00 0.00 0.00 178.15 178.93 2fbw h LEU 129 N -0.12 0.52 -0.28 1.44 3.38 -1.19 -0.31 115.31 118.75 2fbw h LEU 129 Ca 0.01 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2fbw h LEU 129 Cb 0.74 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2fbw h LEU 129 CO 0.04 0.37 -0.07 0.74 0.09 0.00 0.00 178.44 179.61 2fbw h THR 130 N 0.61 1.28 -0.32 0.22 2.02 -1.21 -2.00 112.91 113.51 2fbw h THR 130 Ca 0.20 -1.10 -0.14 0.00 0.77 0.00 0.00 66.41 66.13 2fbw h THR 130 Cb 0.04 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 2fbw h THR 130 CO -0.05 0.35 -0.38 -0.07 0.37 0.00 0.00 175.52 175.74 2fbw h LEU 131 N 0.31 0.81 0.46 2.58 3.38 -0.76 -1.90 115.31 120.19 2fbw h LEU 131 Ca 0.07 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.66 2fbw h LEU 131 Cb 0.55 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2fbw h LEU 131 CO 0.03 1.10 -0.22 -0.07 0.09 0.00 0.00 178.44 179.37 2fbw h LEU 132 N 0.63 -0.52 -1.05 1.67 3.38 -1.07 -1.95 115.31 116.39 2fbw h LEU 132 Ca 0.06 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 57.99 2fbw h LEU 132 Cb 0.93 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.75 2fbw h LEU 132 CO 0.09 -0.14 0.63 0.77 0.09 0.00 0.00 178.44 179.88 2fbw h SER 133 N -0.98 1.02 -0.47 -0.43 4.64 -1.45 0.10 113.55 115.99 2fbw h SER 133 Ca -0.06 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.17 2fbw h SER 133 Cb 0.58 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 2fbw h SER 133 CO 0.10 0.66 -0.04 0.28 -0.87 0.00 0.00 176.83 176.97 2fbw h SER 134 N 1.16 0.89 0.18 4.97 0.02 -1.35 0.59 113.55 120.02 2fbw h SER 134 Ca 0.41 -0.25 -0.18 0.00 -0.84 0.00 0.00 61.79 60.92 2fbw h SER 134 Cb 0.13 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.42 2fbw h SER 134 CO -0.15 0.98 -0.71 0.00 -1.14 0.00 0.00 176.83 175.81 2fbw h ALA 135 N 1.11 0.58 -0.39 3.77 0.00 -0.65 -1.56 119.26 122.12 2fbw h ALA 135 Ca 0.15 -0.59 -0.10 0.00 0.00 0.00 0.00 54.91 54.37 2fbw h ALA 135 Cb 0.55 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2fbw h ALA 135 CO 0.03 0.74 -0.13 0.78 0.00 0.00 0.00 179.25 180.67 2fbw h GLY 136 N 1.17 0.85 1.43 0.00 0.00 -0.55 -3.13 103.07 102.84 2fbw h GLY 136 Ca -0.03 -0.72 -0.19 0.00 0.00 0.00 0.00 47.33 46.39 2fbw h GLY 136 CO 0.13 0.66 -0.69 -2.22 0.00 0.00 0.00 176.54 174.42 2fbw h ILE 137 N 0.59 1.33 0.00 2.60 2.04 -0.88 -3.12 117.51 120.07 2fbw h ILE 137 Ca 0.10 -1.99 -0.01 0.00 1.00 0.00 0.00 64.86 63.96 2fbw h ILE 137 Cb 0.66 1.97 -0.00 0.00 -0.74 0.00 0.00 36.82 38.71 2fbw h ILE 137 CO 0.05 0.61 -0.03 0.00 0.00 0.00 0.00 178.15 178.78 2fbw h ALA 138 N 0.84 1.79 -0.25 1.87 0.00 -1.28 0.43 119.26 122.65 2fbw h ALA 138 Ca -0.02 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2fbw h ALA 138 Cb 1.27 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2fbw h ALA 138 CO 0.13 0.04 0.02 0.00 0.00 0.00 0.00 179.25 179.44 2fbw n ALA 139 N -2.46 3.14 -1.26 0.00 0.00 -1.18 -4.81 120.51 113.94 2fbw n ALA 139 Ca -0.03 -0.83 -0.00 0.00 0.00 0.00 0.00 53.44 52.58 2fbw n ALA 139 Cb 0.12 -1.06 -0.00 0.00 0.00 0.00 0.00 19.45 18.50 2fbw n ALA 139 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2fbw n ILE 140 N 0.23 -2.98 -0.54 0.00 5.41 0.15 -5.09 119.36 116.54 2fbw n ILE 140 Ca 0.13 0.17 0.00 0.00 1.00 0.00 0.00 62.75 64.04 2fbw n ILE 140 Cb 0.67 -3.36 0.00 0.00 -0.71 0.00 0.00 39.64 36.25 2fbw n ILE 140 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31