#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nlw h ARG 3 N 0.00 0.33 0.00 4.33 3.08 -2.05 0.42 114.38 120.50 1nlw h ARG 3 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1nlw h ARG 3 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.98 1nlw h ARG 3 CO 0.00 0.22 0.00 -1.13 -1.07 0.00 0.00 179.97 177.99 1nlw n SER 4 N -4.47 0.00 -0.06 7.04 3.41 -1.26 -0.25 113.62 118.04 1nlw n SER 4 Ca 0.17 0.37 -0.21 0.00 -0.26 0.00 0.00 58.87 58.94 1nlw n SER 4 Cb 0.67 -0.41 -0.12 0.00 -0.26 0.00 0.00 64.21 64.09 1nlw n SER 4 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1nlw h THR 5 N 0.00 0.92 -0.22 6.66 2.02 -0.57 -3.01 112.91 118.71 1nlw h THR 5 Ca 0.00 -2.26 -0.07 0.00 0.77 0.00 0.00 66.41 64.85 1nlw h THR 5 Cb 0.10 2.42 -0.00 0.00 -1.74 0.00 0.00 68.15 68.92 1nlw h THR 5 CO 0.00 0.52 -0.15 -0.74 0.37 0.00 0.00 175.52 175.52 1nlw h HIS 6 N -0.66 0.56 -0.29 3.16 6.17 -1.35 -1.57 115.15 121.18 1nlw h HIS 6 Ca -0.34 -0.15 -0.02 0.00 0.71 0.00 0.00 60.37 60.57 1nlw h HIS 6 Cb 1.52 -0.13 -0.02 0.00 2.52 0.00 0.00 27.41 31.31 1nlw h HIS 6 CO 0.11 0.79 0.11 -0.91 0.71 0.00 0.00 177.93 178.73 1nlw h ASN 7 N 0.18 0.36 0.64 3.26 -0.26 -0.80 -1.14 115.58 117.83 1nlw h ASN 7 Ca 0.04 -0.03 -0.26 0.00 -0.56 0.00 0.00 56.30 55.49 1nlw h ASN 7 Cb 0.67 -0.09 -0.00 0.00 -1.06 0.00 0.00 38.32 37.83 1nlw h ASN 7 CO 0.04 0.34 -1.17 -0.08 -1.06 0.00 0.00 177.43 175.50 1nlw h GLU 8 N 0.41 0.25 -0.40 0.81 4.57 -1.43 -2.72 114.58 116.07 1nlw h GLU 8 Ca 0.10 -0.40 -0.10 0.00 -1.18 0.00 0.00 59.36 57.78 1nlw h GLU 8 Cb 0.10 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1nlw h GLU 8 CO -0.01 1.17 -0.14 0.52 -1.18 0.00 0.00 179.01 179.37 1nlw h MET 9 N 0.08 0.80 -0.14 1.92 2.86 -0.85 -2.43 114.93 117.17 1nlw h MET 9 Ca -0.11 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.20 1nlw h MET 9 Cb 1.89 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 33.51 1nlw h MET 9 CO 0.19 0.95 0.07 1.49 1.06 0.00 0.00 176.91 180.67 1nlw h GLU 10 N 0.61 0.20 -0.66 1.72 4.57 -1.28 0.51 114.58 120.24 1nlw h GLU 10 Ca 0.10 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.32 1nlw h GLU 10 Cb 0.68 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.19 1nlw h GLU 10 CO 0.05 0.22 0.43 -0.22 -1.18 0.00 0.00 179.01 178.32 1nlw h LYS 11 N 0.12 0.59 -0.00 1.92 3.64 -1.45 0.19 116.57 121.58 1nlw h LYS 11 Ca 0.05 -0.04 -0.20 0.00 -1.27 0.00 0.00 60.65 59.20 1nlw h LYS 11 Cb 0.09 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.76 1nlw h LYS 11 CO -0.01 0.39 -0.86 -0.97 -2.27 0.00 0.00 179.45 175.73 1nlw h ASN 12 N 0.61 0.26 -0.30 4.20 -1.24 -0.99 -2.27 115.58 115.85 1nlw h ASN 12 Ca 0.29 -0.21 -0.05 0.00 0.71 0.00 0.00 56.30 57.04 1nlw h ASN 12 Cb 0.35 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.31 1nlw h ASN 12 CO -0.09 1.01 -0.00 -0.09 -1.29 0.00 0.00 177.43 176.96 1nlw h ARG 13 N 0.12 0.53 -0.53 6.67 2.43 0.13 -2.58 114.38 121.15 1nlw h ARG 13 Ca -0.04 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 58.91 1nlw h ARG 13 Cb 1.48 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.96 1nlw h ARG 13 CO 0.13 0.68 0.16 0.00 -1.51 0.00 0.00 179.97 179.43 1nlw h ARG 14 N 0.32 0.79 -0.12 0.20 3.08 -0.70 -2.14 114.38 115.81 1nlw h ARG 14 Ca 0.08 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 1nlw h ARG 14 Cb 0.44 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 1nlw h ARG 14 CO 0.02 0.69 0.05 0.00 -1.07 0.00 0.00 179.97 179.65 1nlw h ALA 15 N 1.41 0.16 -0.61 0.04 0.00 -1.24 0.10 119.26 119.12 1nlw h ALA 15 Ca 0.18 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1nlw h ALA 15 Cb 0.24 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1nlw h ALA 15 CO -0.01 -0.26 0.36 0.45 0.00 0.00 0.00 179.25 179.79 1nlw h HIS 16 N 0.04 0.80 -0.23 0.00 3.86 -1.31 -0.42 115.15 117.88 1nlw h HIS 16 Ca 0.04 0.00 -0.12 0.00 -1.16 0.00 0.00 60.37 59.13 1nlw h HIS 16 Cb 0.17 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 28.37 1nlw h HIS 16 CO -0.02 0.54 -0.35 1.25 0.86 0.00 0.00 177.93 180.21 1nlw h LEU 17 N 0.84 0.51 -0.84 2.43 5.85 -1.09 -2.21 115.31 120.79 1nlw h LEU 17 Ca 0.22 -0.20 -0.08 0.00 0.84 0.00 0.00 57.88 58.65 1nlw h LEU 17 Cb -0.02 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 1nlw h LEU 17 CO -0.04 0.82 -0.02 -0.09 -0.34 0.00 0.00 178.44 178.77 1nlw h ARG 18 N 0.41 0.85 -0.60 1.25 2.43 0.33 -1.59 114.38 117.46 1nlw h ARG 18 Ca 0.05 -0.25 -0.08 0.00 -0.81 0.00 0.00 59.98 58.89 1nlw h ARG 18 Cb 0.81 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.25 1nlw h ARG 18 CO 0.07 0.86 0.07 -0.07 -1.51 0.00 0.00 179.97 179.38 1nlw h LEU 19 N 0.79 0.95 -0.69 3.80 3.38 -0.70 -1.15 115.31 121.67 1nlw h LEU 19 Ca 0.15 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 1nlw h LEU 19 Cb 0.50 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 1nlw h LEU 19 CO 0.02 0.97 -0.16 0.28 0.09 0.00 0.00 178.44 179.64 1nlw h SER 20 N 0.92 0.84 -0.21 -0.43 0.02 -1.02 -2.51 113.55 111.16 1nlw h SER 20 Ca 0.18 -0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 1nlw h SER 20 Cb 0.45 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 1nlw h SER 20 CO 0.02 1.00 0.02 0.25 -1.14 0.00 0.00 176.83 176.97 1nlw h LEU 21 N 0.75 0.35 -0.83 5.07 5.85 -0.94 -2.53 115.31 123.02 1nlw h LEU 21 Ca 0.11 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.57 1nlw h LEU 21 Cb 0.68 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 1nlw h LEU 21 CO 0.05 0.55 0.55 -0.33 -0.34 0.00 0.00 178.44 178.91 1nlw h GLU 22 N 0.14 1.06 0.09 1.25 4.39 -1.17 0.13 114.58 120.46 1nlw h GLU 22 Ca 0.06 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1nlw h GLU 22 Cb 0.36 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1nlw h GLU 22 CO 0.01 0.70 -0.08 -0.22 -1.16 0.00 0.00 179.01 178.26 1nlw h LYS 23 N 1.10 -0.18 -0.58 2.33 3.64 -1.36 0.37 116.57 121.88 1nlw h LYS 23 Ca 0.32 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.75 1nlw h LYS 23 Cb -0.08 0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1nlw h LYS 23 CO -0.09 -0.12 0.39 1.25 -2.27 0.00 0.00 179.45 178.61 1nlw h LEU 24 N -0.19 0.57 -1.27 5.20 5.85 -1.13 0.16 115.31 124.50 1nlw h LEU 24 Ca 0.00 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 1nlw h LEU 24 Cb 0.18 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 1nlw h LEU 24 CO -0.02 0.39 -0.01 0.50 -0.34 0.00 0.00 178.44 178.96 1nlw h LYS 25 N 0.66 0.47 -0.08 1.25 3.64 -0.02 -2.69 116.57 119.79 1nlw h LYS 25 Ca 0.24 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1nlw h LYS 25 Cb 0.12 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1nlw h LYS 25 CO -0.06 0.51 0.05 0.78 -2.27 0.00 0.00 179.45 178.46 1nlw h GLY 26 N 0.80 0.12 -0.82 5.01 0.00 0.14 -3.42 103.07 104.91 1nlw h GLY 26 Ca 0.10 -0.05 -0.44 0.00 0.00 0.00 0.00 47.33 46.94 1nlw h GLY 26 CO 0.01 0.05 0.35 1.08 0.00 0.00 0.00 176.54 178.03 1nlw s LEU 27 N -10.15 2.21 0.12 3.11 1.43 -1.01 -4.87 118.68 109.52 1nlw s LEU 27 Ca -0.13 0.44 0.00 0.00 -1.03 0.00 0.00 54.13 53.41 1nlw s LEU 27 Cb 0.07 -2.48 0.00 0.00 0.03 0.00 0.00 46.19 43.81 1nlw s LEU 27 CO 0.67 -2.95 0.00 0.52 0.23 0.00 0.00 176.35 174.83 1nlw n VAL 28 N -3.94 -6.53 -0.07 -1.59 0.31 -1.26 -4.65 118.33 100.60 1nlw n VAL 28 Ca 0.13 1.54 0.25 0.00 -0.01 0.00 0.00 64.34 66.26 1nlw n VAL 28 Cb 0.60 -3.34 0.71 0.00 -0.91 0.00 0.00 33.84 30.90 1nlw n VAL 28 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1nlw h PRO 29 N 1.89 0.00 0.00 5.55 0.13 -1.91 -3.44 132.00 134.23 1nlw h PRO 29 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1nlw h PRO 29 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1nlw h PRO 29 CO 0.00 0.00 0.00 1.47 -0.23 0.00 0.00 178.00 179.24 1nlw n LEU 30 N -3.87 0.00 -3.70 1.56 -0.00 -1.26 -4.55 117.00 105.18 1nlw n LEU 30 Ca 0.14 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 56.06 1nlw n LEU 30 Cb 0.89 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 44.28 1nlw n LEU 30 CO 0.32 0.00 0.37 -0.83 -0.00 0.00 0.00 177.39 177.25 1nlw s GLY 31 N 0.00 -0.22 -0.07 1.47 0.00 -1.26 -5.06 107.32 102.18 1nlw s GLY 31 Ca 0.00 -0.08 -0.14 0.00 0.00 0.00 0.00 44.72 44.51 1nlw s GLY 31 CO 0.00 -0.10 0.34 -4.14 0.00 0.00 0.00 173.10 169.20 1nlw s PRO 32 N -3.86 3.95 2.23 2.90 0.01 -1.26 -4.85 135.00 134.12 1nlw s PRO 32 Ca 0.08 0.25 0.00 0.00 0.01 0.00 0.00 61.00 61.34 1nlw s PRO 32 Cb -0.03 -3.28 0.00 0.00 0.01 0.00 0.00 34.50 31.20 1nlw s PRO 32 CO -0.02 0.55 0.00 -0.40 0.01 0.00 0.00 177.00 177.14 1nlw n ASP 33 N 2.42 -1.34 -4.35 2.53 5.68 -1.26 -4.73 116.55 115.49 1nlw n ASP 33 Ca -0.14 0.00 -0.56 0.00 -0.50 0.00 0.00 54.79 53.59 1nlw n ASP 33 Cb 0.53 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.41 1nlw n ASP 33 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 1nlw n SER 34 N -1.06 1.39 -4.91 -1.12 2.88 -1.26 -4.90 113.62 104.63 1nlw n SER 34 Ca 0.00 0.59 -0.28 0.00 -1.33 0.00 0.00 58.87 57.84 1nlw n SER 34 Cb 0.00 -1.06 0.08 0.00 -0.75 0.00 0.00 64.21 62.48 1nlw n SER 34 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1nlw s SER 35 N 6.44 4.75 0.08 -3.46 0.15 -1.26 -5.05 113.70 115.35 1nlw s SER 35 Ca 1.15 0.74 0.09 0.00 0.70 0.00 0.00 55.95 58.63 1nlw s SER 35 Cb -1.22 -1.34 -0.03 0.00 -1.71 0.00 0.00 66.02 61.72 1nlw s SER 35 CO 0.59 -1.72 -0.25 -0.13 1.20 0.00 0.00 173.24 172.93 1nlw s ARG 36 N -5.44 1.48 0.00 5.44 0.52 -1.26 -5.10 118.95 114.59 1nlw s ARG 36 Ca 0.61 -1.16 0.00 0.00 -0.52 0.00 0.00 55.73 54.65 1nlw s ARG 36 Cb -0.11 -1.76 0.00 0.00 0.52 0.00 0.00 34.95 33.60 1nlw s ARG 36 CO 0.48 0.44 0.00 1.58 0.02 0.00 0.00 175.30 177.82 1nlw n HIS 37 N 1.40 0.00 0.00 -0.53 -0.00 -1.26 -4.76 115.22 110.06 1nlw n HIS 37 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 1nlw n HIS 37 Cb 0.53 -0.04 0.00 0.00 -0.00 0.00 0.00 29.99 30.48 1nlw n HIS 37 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 1nlw n THR 38 N -1.30 0.00 0.00 3.57 -1.04 -1.26 -3.52 114.28 110.74 1nlw n THR 38 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1nlw n THR 38 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1nlw n THR 38 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1nlw n THR 39 N -0.60 0.00 -0.17 12.58 -1.04 -1.26 -4.39 114.28 119.39 1nlw n THR 39 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.93 1nlw n THR 39 Cb 0.00 0.00 0.01 0.00 -1.82 0.00 0.00 70.33 68.52 1nlw n THR 39 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1nlw h LEU 40 N 0.00 0.62 -1.06 -4.42 5.85 -1.99 -1.12 115.31 113.19 1nlw h LEU 40 Ca 0.00 -0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 1nlw h LEU 40 Cb 0.00 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 1nlw h LEU 40 CO 0.00 0.55 -0.34 0.77 -0.34 0.00 0.00 178.44 179.08 1nlw h SER 41 N 0.65 0.24 -0.02 1.25 4.64 -1.76 -2.04 113.55 116.51 1nlw h SER 41 Ca 0.17 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 1nlw h SER 41 Cb 0.07 -0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1nlw h SER 41 CO -0.03 0.57 -0.02 0.25 -0.87 0.00 0.00 176.83 176.74 1nlw h LEU 42 N 0.20 0.04 -1.57 5.97 5.85 -1.50 -0.94 115.31 123.37 1nlw h LEU 42 Ca 0.03 -0.49 0.01 0.00 0.84 0.00 0.00 57.88 58.27 1nlw h LEU 42 Cb 0.71 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 1nlw h LEU 42 CO 0.05 0.52 0.31 -0.07 -0.34 0.00 0.00 178.44 178.91 1nlw h LEU 43 N -0.44 0.50 0.04 2.25 3.38 -1.13 0.22 115.31 120.13 1nlw h LEU 43 Ca 0.00 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1nlw h LEU 43 Cb 0.51 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1nlw h LEU 43 CO 0.00 0.36 -0.02 0.74 0.09 0.00 0.00 178.44 179.61 1nlw h THR 44 N 0.59 1.29 -0.82 0.22 2.02 -1.31 -2.78 112.91 112.11 1nlw h THR 44 Ca 0.18 -1.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.15 1nlw h THR 44 Cb -0.01 2.06 -0.04 0.00 -1.74 0.00 0.00 68.15 68.43 1nlw h THR 44 CO -0.04 0.29 0.39 0.50 0.37 0.00 0.00 175.52 177.03 1nlw h LYS 45 N -0.59 1.19 -0.15 6.66 1.63 -0.80 -2.03 116.57 122.48 1nlw h LYS 45 Ca -0.01 -0.18 -0.00 0.00 -0.85 0.00 0.00 60.65 59.61 1nlw h LYS 45 Cb 0.53 -0.21 -0.01 0.00 -0.60 0.00 0.00 32.23 31.94 1nlw h LYS 45 CO 0.01 0.92 0.07 0.00 -3.45 0.00 0.00 179.45 177.00 1nlw h ALA 46 N 1.25 0.19 -0.15 5.00 0.00 -1.03 -0.10 119.26 124.42 1nlw h ALA 46 Ca 0.28 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.16 1nlw h ALA 46 Cb 0.13 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1nlw h ALA 46 CO -0.03 -0.26 -0.09 -0.22 0.00 0.00 0.00 179.25 178.65 1nlw h LYS 47 N 0.12 -0.08 -0.53 0.00 3.64 -1.23 -0.37 116.57 118.11 1nlw h LYS 47 Ca 0.05 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1nlw h LYS 47 Cb 0.10 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 1nlw h LYS 47 CO -0.01 -0.06 0.20 -0.07 -2.27 0.00 0.00 179.45 177.25 1nlw h LEU 48 N -0.09 0.70 -0.35 5.20 3.38 -1.21 -1.21 115.31 121.74 1nlw h LEU 48 Ca 0.09 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1nlw h LEU 48 Cb 0.21 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1nlw h LEU 48 CO -0.20 0.64 0.03 -0.74 0.09 0.00 0.00 178.44 178.26 1nlw h HIS 49 N 0.76 0.64 -0.50 1.13 2.76 -0.51 -1.20 115.15 118.23 1nlw h HIS 49 Ca 0.18 -0.10 0.03 0.00 -2.20 0.00 0.00 60.37 58.28 1nlw h HIS 49 Cb 0.17 -0.17 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 1nlw h HIS 49 CO 0.01 0.68 0.28 0.82 -1.30 0.00 0.00 177.93 178.42 1nlw h ILE 50 N 0.42 1.02 -0.79 6.26 2.04 -0.60 -0.10 117.51 125.76 1nlw h ILE 50 Ca 0.10 -0.19 0.10 0.00 1.00 0.00 0.00 64.86 65.87 1nlw h ILE 50 Cb 0.40 0.41 -0.08 0.00 -0.74 0.00 0.00 36.82 36.81 1nlw h ILE 50 CO 0.01 0.10 0.42 0.11 0.00 0.00 0.00 178.15 178.80 1nlw h LYS 51 N 0.56 0.67 -0.52 2.37 6.56 -0.92 -1.00 116.57 124.29 1nlw h LYS 51 Ca 0.21 -0.04 -0.08 0.00 -1.06 0.00 0.00 60.65 59.68 1nlw h LYS 51 Cb 0.06 -0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 31.55 1nlw h LYS 51 CO -0.11 0.44 0.03 -0.22 -2.06 0.00 0.00 179.45 177.53 1nlw h LYS 52 N 0.69 0.90 -0.85 3.15 1.63 -0.20 -1.72 116.57 120.18 1nlw h LYS 52 Ca 0.39 -0.27 -0.00 0.00 -0.85 0.00 0.00 60.65 59.92 1nlw h LYS 52 Cb 0.42 -0.09 -0.04 0.00 -0.60 0.00 0.00 32.23 31.92 1nlw h LYS 52 CO -0.28 0.91 0.52 -0.07 -3.45 0.00 0.00 179.45 177.09 1nlw h LEU 53 N 0.77 1.01 -0.41 5.20 3.38 -0.06 -1.07 115.31 124.13 1nlw h LEU 53 Ca 0.15 -0.06 -0.14 0.00 0.09 0.00 0.00 57.88 57.92 1nlw h LEU 53 Cb 0.49 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1nlw h LEU 53 CO 0.02 0.77 -0.30 -0.33 0.09 0.00 0.00 178.44 178.69 1nlw h GLU 54 N 1.16 0.92 -0.61 1.13 5.08 -1.06 -1.54 114.58 119.66 1nlw h GLU 54 Ca 0.30 -0.45 -0.06 0.00 -1.00 0.00 0.00 59.36 58.16 1nlw h GLU 54 Cb -0.07 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1nlw h GLU 54 CO -0.06 1.10 0.14 0.22 -1.00 0.00 0.00 179.01 179.41 1nlw h ASP 55 N 0.75 0.90 0.01 1.42 1.82 -1.02 -1.09 116.42 119.20 1nlw h ASP 55 Ca 0.08 -0.18 -0.13 0.00 -0.39 0.00 0.00 57.03 56.41 1nlw h ASP 55 Cb 0.88 -0.24 -0.01 0.00 0.68 0.00 0.00 39.33 40.65 1nlw h ASP 55 CO 0.08 0.88 -0.41 0.28 -1.61 0.00 0.00 179.24 178.45 1nlw h SER 56 N 0.91 0.54 0.50 2.28 0.02 -1.10 -2.14 113.55 114.56 1nlw h SER 56 Ca 0.19 -0.24 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 1nlw h SER 56 Cb 0.34 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1nlw h SER 56 CO 0.00 0.89 -0.24 -0.78 -1.14 0.00 0.00 176.83 175.56 1nlw h ASP 57 N 0.42 -0.57 -0.86 3.07 -0.00 -0.81 0.14 116.42 117.82 1nlw h ASP 57 Ca 0.04 -0.01 0.14 0.00 -0.00 0.00 0.00 57.03 57.20 1nlw h ASP 57 Cb 0.90 0.15 -0.09 0.00 -0.00 0.00 0.00 39.33 40.28 1nlw h ASP 57 CO 0.08 -0.37 0.46 0.03 -0.00 0.00 0.00 179.24 179.43 1nlw h ARG 58 N -0.73 0.64 0.00 0.28 3.08 -1.13 0.25 114.38 116.77 1nlw h ARG 58 Ca -0.07 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 59.81 1nlw h ARG 58 Cb 0.54 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 1nlw h ARG 58 CO 0.11 0.42 -0.61 0.87 -1.07 0.00 0.00 179.97 179.70 1nlw h LYS 59 N 0.66 0.00 -0.04 0.04 1.57 -1.20 -2.55 116.57 115.06 1nlw h LYS 59 Ca 0.46 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.20 1nlw h LYS 59 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1nlw h LYS 59 CO -0.35 0.61 -0.15 0.00 -0.57 0.00 0.00 179.45 179.00 1nlw h ALA 60 N 1.39 0.07 -0.84 3.86 0.00 0.48 -1.96 119.26 122.26 1nlw h ALA 60 Ca -0.01 -0.37 0.07 0.00 0.00 0.00 0.00 54.91 54.60 1nlw h ALA 60 Cb 1.15 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 1nlw h ALA 60 CO 0.08 -0.00 0.55 0.28 0.00 0.00 0.00 179.25 180.15 1nlw h VAL 61 N -0.40 1.05 -0.33 0.00 2.07 -1.03 -0.97 116.25 116.64 1nlw h VAL 61 Ca -0.01 -0.32 -0.09 0.00 0.82 0.00 0.00 66.70 67.11 1nlw h VAL 61 Cb 0.79 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1nlw h VAL 61 CO 0.03 0.17 -0.14 -0.74 0.02 0.00 0.00 177.57 176.91 1nlw h HIS 62 N 0.93 0.78 -0.23 1.57 6.17 -1.41 -2.39 115.15 120.57 1nlw h HIS 62 Ca 0.36 -0.19 -0.12 0.00 0.71 0.00 0.00 60.37 61.13 1nlw h HIS 62 Cb 0.23 -0.18 -0.01 0.00 2.52 0.00 0.00 27.41 29.97 1nlw h HIS 62 CO -0.00 0.88 -0.38 1.96 0.71 0.00 0.00 177.93 181.10 1nlw h GLN 63 N 0.46 0.51 -0.33 5.26 4.20 -0.93 -1.25 115.11 123.03 1nlw h GLN 63 Ca 0.08 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 1nlw h GLN 63 Cb 0.67 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 1nlw h GLN 63 CO 0.04 0.82 0.21 0.82 -0.67 0.00 0.00 178.83 180.05 1nlw h ILE 64 N 0.43 1.11 -0.68 2.54 2.04 -1.14 0.25 117.51 122.06 1nlw h ILE 64 Ca 0.04 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.67 1nlw h ILE 64 Cb 0.86 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1nlw h ILE 64 CO 0.07 0.10 0.43 -0.78 0.00 0.00 0.00 178.15 177.97 1nlw h ASP 65 N 0.44 0.80 -0.52 1.72 1.82 -1.18 0.20 116.42 119.69 1nlw h ASP 65 Ca 0.12 -0.04 -0.10 0.00 -0.39 0.00 0.00 57.03 56.62 1nlw h ASP 65 Cb -0.01 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 39.78 1nlw h ASP 65 CO -0.02 0.61 -0.05 1.56 -1.61 0.00 0.00 179.24 179.72 1nlw h GLN 66 N 0.92 0.96 -0.37 0.28 1.08 -0.78 -1.61 115.11 115.60 1nlw h GLN 66 Ca 0.25 -0.33 -0.06 0.00 -1.45 0.00 0.00 58.65 57.05 1nlw h GLN 66 Cb -0.06 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.28 1nlw h GLN 66 CO -0.05 1.00 -0.03 -0.07 -0.95 0.00 0.00 178.83 178.73 1nlw h LEU 67 N 0.83 0.56 -0.47 1.46 3.38 -0.10 0.21 115.31 121.19 1nlw h LEU 67 Ca 0.14 -0.12 -0.15 0.00 0.09 0.00 0.00 57.88 57.84 1nlw h LEU 67 Cb 0.60 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1nlw h LEU 67 CO 0.04 0.66 -0.35 1.56 0.09 0.00 0.00 178.44 180.44 1nlw h GLN 68 N 0.56 0.90 -0.48 1.13 4.20 -0.72 0.23 115.11 120.92 1nlw h GLN 68 Ca 0.11 -0.45 -0.12 0.00 0.06 0.00 0.00 58.65 58.26 1nlw h GLN 68 Cb 0.41 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 1nlw h GLN 68 CO 0.02 1.10 -0.17 0.00 -0.67 0.00 0.00 178.83 179.10 1nlw h ARG 69 N 0.74 0.97 -0.88 1.46 3.08 -0.95 -1.91 114.38 116.89 1nlw h ARG 69 Ca 0.07 -0.40 -0.01 0.00 0.07 0.00 0.00 59.98 59.71 1nlw h ARG 69 Cb 0.92 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.89 1nlw h ARG 69 CO 0.09 1.07 0.50 1.49 -1.07 0.00 0.00 179.97 182.04 1nlw h GLU 70 N 0.82 1.22 -0.01 0.04 4.81 -0.74 -2.29 114.58 118.43 1nlw h GLU 70 Ca 0.11 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1nlw h GLU 70 Cb 0.74 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 29.88 1nlw h GLU 70 CO 0.06 0.88 0.00 0.37 -0.73 0.00 0.00 179.01 179.59 1nlw h GLN 71 N 1.22 0.02 -0.49 1.92 4.15 -0.19 -2.30 115.11 119.44 1nlw h GLN 71 Ca 0.31 -0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.77 1nlw h GLN 71 Cb 0.00 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 1nlw h GLN 71 CO -0.05 0.25 0.33 0.00 -1.93 0.00 0.00 178.83 177.42 1nlw h ARG 72 N -0.21 0.50 -0.32 1.69 3.08 -1.23 -0.99 114.38 116.92 1nlw h ARG 72 Ca 0.00 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1nlw h ARG 72 Cb 0.24 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1nlw h ARG 72 CO 0.00 0.33 0.00 1.25 -1.07 0.00 0.00 179.97 180.49 1nlw h HIS 73 N 0.52 0.61 -0.80 3.04 2.76 -1.24 -1.45 115.15 118.59 1nlw h HIS 73 Ca 0.20 -0.10 -0.04 0.00 -2.20 0.00 0.00 60.37 58.23 1nlw h HIS 73 Cb 0.16 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 28.92 1nlw h HIS 73 CO -0.00 0.68 0.36 -0.07 -1.30 0.00 0.00 177.93 177.60 1nlw h LEU 74 N 0.36 1.07 0.07 0.26 3.38 -0.76 -0.35 115.31 119.33 1nlw h LEU 74 Ca 0.09 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1nlw h LEU 74 Cb 0.44 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1nlw h LEU 74 CO 0.02 0.92 -0.03 0.11 0.09 0.00 0.00 178.44 179.54 1nlw h LYS 75 N 1.16 -0.09 -0.62 1.13 1.79 -1.05 0.16 116.57 119.04 1nlw h LYS 75 Ca 0.27 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.73 1nlw h LYS 75 Cb 0.16 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.80 1nlw h LYS 75 CO -0.03 0.07 0.32 0.00 -1.08 0.00 0.00 179.45 178.73 1nlw h ARG 76 N -0.24 0.86 -0.06 3.15 3.08 -1.08 -2.43 114.38 117.65 1nlw h ARG 76 Ca -0.01 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1nlw h ARG 76 Cb 0.21 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1nlw h ARG 76 CO 0.02 0.65 -0.00 0.37 -1.07 0.00 0.00 179.97 179.93 1nlw h GLN 77 N 0.87 0.11 -0.01 0.04 4.15 -0.90 -2.53 115.11 116.84 1nlw h GLN 77 Ca 0.22 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.60 1nlw h GLN 77 Cb 0.06 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.74 1nlw h GLN 77 CO -0.03 0.40 0.35 1.25 -1.93 0.00 0.00 178.83 178.87 1nlw h LEU 78 N -0.19 0.00 0.09 -2.39 5.85 -0.20 0.55 115.31 119.01 1nlw h LEU 78 Ca 0.02 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1nlw h LEU 78 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 1nlw h LEU 78 CO 0.00 0.00 -0.04 -0.33 -0.34 0.00 0.00 178.44 177.73 1nlw h GLU 79 N 0.00 -0.11 0.00 1.25 4.39 -1.13 -3.51 114.58 115.47 1nlw h GLU 79 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1nlw h GLU 79 Cb 0.70 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.37 1nlw h GLU 79 CO -0.00 0.28 0.00 1.63 -1.16 0.00 0.00 179.01 179.76