#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nlw s ASP 2 N 0.00 6.77 -0.09 1.61 1.11 -1.26 -4.99 116.67 119.82 2nlw s ASP 2 Ca 0.00 1.29 0.14 0.00 0.18 0.00 0.00 52.55 54.16 2nlw s ASP 2 Cb 0.00 -2.38 -0.20 0.00 1.07 0.00 0.00 42.92 41.41 2nlw s ASP 2 CO 0.00 -0.23 0.18 1.33 1.18 0.00 0.00 175.17 177.63 2nlw n VAL 3 N -0.44 0.53 -0.11 -1.27 0.24 -1.26 -4.14 118.33 111.87 2nlw n VAL 3 Ca 0.04 -0.49 -0.20 0.00 -2.04 0.00 0.00 64.34 61.65 2nlw n VAL 3 Cb 0.53 -0.27 -0.09 0.00 -1.47 0.00 0.00 33.84 32.55 2nlw n VAL 3 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2nlw n LEU 4 N -2.30 2.20 -0.03 1.34 4.77 -1.26 -4.57 117.00 117.16 2nlw n LEU 4 Ca -0.14 0.10 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 2nlw n LEU 4 Cb 0.70 -0.69 0.02 0.00 -2.33 0.00 0.00 43.42 41.12 2nlw n LEU 4 CO 0.31 0.64 0.46 0.11 -1.33 0.00 0.00 177.39 177.57 2nlw h LYS 5 N -0.45 0.68 -5.97 3.23 1.57 -2.00 -3.39 116.57 110.24 2nlw h LYS 5 Ca -0.52 -0.43 -0.60 0.00 -1.87 0.00 0.00 60.65 57.23 2nlw h LYS 5 Cb 1.60 0.05 -0.11 0.00 0.08 0.00 0.00 32.23 33.84 2nlw h LYS 5 CO -0.22 1.05 0.63 0.34 -0.57 0.00 0.00 179.45 180.68 2nlw s ASP 6 N -6.94 6.35 -0.03 0.86 2.15 -1.26 -4.97 116.67 112.83 2nlw s ASP 6 Ca -0.09 -0.30 -0.03 0.00 0.43 0.00 0.00 52.55 52.57 2nlw s ASP 6 Cb 0.11 -2.46 0.01 0.00 -0.30 0.00 0.00 42.92 40.28 2nlw s ASP 6 CO 0.86 -1.28 0.08 -0.13 -0.17 0.00 0.00 175.17 174.54 2nlw s ARG 7 N 4.13 0.09 0.00 4.34 1.81 -1.26 -4.56 118.95 123.50 2nlw s ARG 7 Ca 0.32 0.14 -0.30 0.00 -1.72 0.00 0.00 55.73 54.17 2nlw s ARG 7 Cb -0.12 0.01 -0.04 0.00 -0.45 0.00 0.00 34.95 34.35 2nlw s ARG 7 CO 0.20 -0.03 1.16 -1.25 -0.68 0.00 0.00 175.30 174.70 2nlw s PRO 8 N 0.18 4.42 0.19 3.54 0.04 -1.26 -5.03 135.00 137.09 2nlw s PRO 8 Ca -0.01 1.67 0.05 0.00 0.04 0.00 0.00 61.00 62.74 2nlw s PRO 8 Cb -0.02 -3.45 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 2nlw s PRO 8 CO -0.01 -0.29 0.25 -1.14 0.04 0.00 0.00 177.00 175.85 2nlw s GLN 9 N 1.49 3.21 0.00 4.56 2.00 -1.26 -4.97 119.66 124.70 2nlw s GLN 9 Ca 0.56 -0.79 0.00 0.00 -2.00 0.00 0.00 55.36 53.14 2nlw s GLN 9 Cb -0.26 -2.80 0.00 0.00 0.80 0.00 0.00 33.01 30.75 2nlw s GLN 9 CO 0.26 0.47 0.39 0.39 -0.50 0.00 0.00 175.29 176.30 2nlw n GLU 10 N -0.82 0.74 -2.38 1.67 -0.58 -1.26 -4.66 120.64 113.36 2nlw n GLU 10 Ca -0.08 0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.28 2nlw n GLU 10 Cb 0.56 -1.36 -0.03 0.00 -0.57 0.00 0.00 31.44 30.03 2nlw n GLU 10 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2nlw s ALA 11 N -1.04 2.43 -0.19 0.62 0.00 -1.26 -4.84 121.76 117.49 2nlw s ALA 11 Ca 0.00 -1.66 0.00 0.00 0.00 0.00 0.00 51.96 50.31 2nlw s ALA 11 Cb 0.00 -4.43 0.02 0.00 0.00 0.00 0.00 23.12 18.70 2nlw s ALA 11 CO 0.00 -3.81 -0.18 0.34 0.00 0.00 0.00 175.76 172.11 2nlw s ASP 12 N 5.70 3.33 0.00 0.00 2.15 -1.26 -4.75 116.67 121.83 2nlw s ASP 12 Ca 0.51 -0.64 0.00 0.00 0.43 0.00 0.00 52.55 52.85 2nlw s ASP 12 Cb -0.05 -1.52 0.00 0.00 -0.30 0.00 0.00 42.92 41.05 2nlw s ASP 12 CO 0.03 -0.01 0.00 0.61 -0.17 0.00 0.00 175.17 175.63 2nlw n GLY 13 N 4.64 1.86 2.99 2.66 0.00 -1.26 -4.70 105.19 111.39 2nlw n GLY 13 Ca -0.20 -0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.35 2nlw n GLY 13 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2nlw s ILE 14 N -0.00 1.22 -0.18 -0.61 1.10 -1.26 -4.98 121.20 116.49 2nlw s ILE 14 Ca 0.00 -0.47 0.13 0.00 -0.51 0.00 0.00 60.65 59.80 2nlw s ILE 14 Cb 0.00 -1.15 -0.19 0.00 0.15 0.00 0.00 42.46 41.27 2nlw s ILE 14 CO 0.00 0.39 0.36 -0.67 -2.11 0.00 0.00 174.94 172.91 2nlw n ASP 15 N 4.35 1.61 -0.21 4.50 2.03 -1.26 -4.65 116.55 122.92 2nlw n ASP 15 Ca -0.18 -0.22 0.15 0.00 0.52 0.00 0.00 54.79 55.05 2nlw n ASP 15 Cb 0.51 1.43 0.69 0.00 -0.72 0.00 0.00 41.12 43.03 2nlw n ASP 15 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2nlw n SER 16 N -1.77 0.69 -4.26 1.67 7.64 -1.26 -3.46 113.62 112.86 2nlw n SER 16 Ca -0.01 -1.05 -0.33 0.00 1.01 0.00 0.00 58.87 58.49 2nlw n SER 16 Cb 0.30 -0.02 -0.16 0.00 -1.01 0.00 0.00 64.21 63.32 2nlw n SER 16 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2nlw s VAL 17 N -2.15 2.45 -0.07 0.44 1.01 -1.26 -0.61 120.40 120.21 2nlw s VAL 17 Ca 0.38 -0.87 -0.14 0.00 0.00 0.00 0.00 61.98 61.36 2nlw s VAL 17 Cb 0.21 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.55 2nlw s VAL 17 CO 0.39 0.54 0.35 -0.63 0.00 0.00 0.00 175.10 175.75 2nlw s ILE 18 N 0.49 5.18 -0.08 2.22 -1.09 0.62 -4.90 121.20 123.65 2nlw s ILE 18 Ca -0.13 0.69 -0.02 0.00 -2.23 0.00 0.00 60.65 58.96 2nlw s ILE 18 Cb -0.17 -3.66 0.03 0.00 -1.58 0.00 0.00 42.46 37.09 2nlw s ILE 18 CO 0.05 0.52 0.01 -0.69 -1.23 0.00 0.00 174.94 173.60 2nlw s VAL 19 N -0.54 0.33 -0.06 2.92 1.01 -1.26 -1.47 120.40 121.33 2nlw s VAL 19 Ca 0.21 0.12 0.04 0.00 0.00 0.00 0.00 61.98 62.35 2nlw s VAL 19 Cb -0.15 -0.52 0.00 0.00 0.00 0.00 0.00 36.38 35.71 2nlw s VAL 19 CO 0.09 0.22 -0.18 0.68 0.00 0.00 0.00 175.10 175.92 2nlw s VAL 20 N 1.99 1.52 -0.13 2.92 -7.23 -1.18 -3.28 120.40 115.02 2nlw s VAL 20 Ca 0.05 -0.75 -0.11 0.00 -1.81 0.00 0.00 61.98 59.36 2nlw s VAL 20 Cb -0.13 -1.32 -0.05 0.00 0.56 0.00 0.00 36.38 35.45 2nlw s VAL 20 CO -0.05 0.44 0.22 -0.62 -0.31 0.00 0.00 175.10 174.78 2nlw s ASP 21 N 0.20 6.44 -0.27 4.85 2.15 0.11 -2.84 116.67 127.31 2nlw s ASP 21 Ca -0.08 0.52 -0.13 0.00 0.43 0.00 0.00 52.55 53.28 2nlw s ASP 21 Cb -0.14 -2.13 0.02 0.00 -0.30 0.00 0.00 42.92 40.37 2nlw s ASP 21 CO 0.04 0.27 0.28 -0.46 -0.17 0.00 0.00 175.17 175.13 2nlw n ASN 22 N 2.66 -6.89 -4.91 -0.34 2.04 0.13 -2.76 115.26 105.19 2nlw n ASN 22 Ca -0.16 0.53 -0.28 0.00 -0.44 0.00 0.00 54.58 54.23 2nlw n ASN 22 Cb 0.53 -3.17 0.08 0.00 -2.53 0.00 0.00 39.78 34.70 2nlw n ASN 22 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 2nlw s VAL 23 N -1.56 2.16 0.20 3.53 -7.23 -1.26 -3.63 120.40 112.62 2nlw s VAL 23 Ca 0.14 -0.08 -0.30 0.00 -1.81 0.00 0.00 61.98 59.94 2nlw s VAL 23 Cb -0.02 -3.02 -0.16 0.00 0.56 0.00 0.00 36.38 33.73 2nlw s VAL 23 CO 0.55 -0.03 0.83 -0.81 -0.31 0.00 0.00 175.10 175.33 2nlw n PRO 24 N -3.16 0.59 -1.74 4.82 -0.04 -1.26 -4.85 135.00 129.36 2nlw n PRO 24 Ca 0.08 0.21 -0.33 0.00 -0.04 0.00 0.00 63.50 63.42 2nlw n PRO 24 Cb 0.61 -1.45 0.05 0.00 -0.04 0.00 0.00 33.50 32.66 2nlw n PRO 24 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 2nlw s GLN 25 N -0.95 2.77 0.08 0.54 0.00 -1.26 -4.94 119.66 115.89 2nlw s GLN 25 Ca 0.67 1.41 0.08 0.00 -0.00 0.00 0.00 55.36 57.52 2nlw s GLN 25 Cb -0.88 -1.94 -0.03 0.00 0.00 0.00 0.00 33.01 30.15 2nlw s GLN 25 CO 0.57 -1.28 -0.22 0.08 0.00 0.00 0.00 175.29 174.44 2nlw s VAL 26 N -2.31 1.76 0.45 3.63 1.01 -1.26 -5.05 120.40 118.63 2nlw s VAL 26 Ca 0.67 -1.41 0.03 0.00 0.00 0.00 0.00 61.98 61.27 2nlw s VAL 26 Cb -0.21 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 2nlw s VAL 26 CO 0.42 0.08 0.03 -0.83 0.00 0.00 0.00 175.10 174.79 2nlw s GLY 27 N -1.59 2.76 0.09 4.51 0.00 -1.26 -4.78 107.32 107.05 2nlw s GLY 27 Ca 0.08 -1.16 -0.34 0.00 0.00 0.00 0.00 44.72 43.30 2nlw s GLY 27 CO 0.03 -2.09 1.69 -1.55 0.00 0.00 0.00 173.10 171.17 2nlw n PRO 28 N -1.09 2.22 -1.27 2.90 -0.04 -1.26 -1.65 135.00 134.82 2nlw n PRO 28 Ca -0.12 0.81 -0.09 0.00 -0.04 0.00 0.00 63.50 64.05 2nlw n PRO 28 Cb 0.67 -2.61 -0.04 0.00 -0.04 0.00 0.00 33.50 31.48 2nlw n PRO 28 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2nlw n ASP 29 N 4.50 -4.57 -0.29 3.54 8.00 -1.26 -4.84 116.55 121.63 2nlw n ASP 29 Ca 0.19 0.23 0.09 0.00 0.71 0.00 0.00 54.79 56.00 2nlw n ASP 29 Cb 0.30 -2.88 -0.03 0.00 -0.02 0.00 0.00 41.12 38.49 2nlw n ASP 29 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2nlw n ARG 30 N -2.12 1.51 0.13 -1.24 1.74 -0.66 -4.28 116.66 111.75 2nlw n ARG 30 Ca -0.09 -0.63 0.01 0.00 -0.77 0.00 0.00 57.85 56.37 2nlw n ARG 30 Cb 0.38 -1.32 0.32 0.00 -1.02 0.00 0.00 32.46 30.82 2nlw n ARG 30 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2nlw h LEU 31 N 1.43 0.16 -0.92 0.55 7.12 -1.89 -3.14 115.31 118.63 2nlw h LEU 31 Ca 0.00 -0.05 -0.01 0.00 0.13 0.00 0.00 57.88 57.95 2nlw h LEU 31 Cb 0.55 -0.04 -0.04 0.00 -0.53 0.00 0.00 40.66 40.59 2nlw h LEU 31 CO 0.00 0.46 0.53 -0.33 -0.13 0.00 0.00 178.44 178.97 2nlw h GLU 32 N 0.14 1.28 0.00 1.25 4.39 -1.95 -1.20 114.58 118.48 2nlw h GLU 32 Ca 0.02 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2nlw h GLU 32 Cb 0.61 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2nlw h GLU 32 CO 0.04 0.92 -0.30 0.36 -1.16 0.00 0.00 179.01 178.87 2nlw n LYS 33 N -4.34 0.20 0.15 2.33 2.85 -1.21 -2.93 118.16 115.22 2nlw n LYS 33 Ca 0.10 0.11 0.01 0.00 -1.05 0.00 0.00 58.31 57.48 2nlw n LYS 33 Cb 0.08 -1.67 0.22 0.00 -0.65 0.00 0.00 35.03 33.01 2nlw n LYS 33 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 2nlw h LEU 34 N 0.00 0.00 -2.07 -5.58 6.46 -1.19 -2.51 115.31 110.42 2nlw h LEU 34 Ca 0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.75 2nlw h LEU 34 Cb 0.67 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.60 2nlw h LEU 34 CO 0.00 0.54 -0.05 0.11 -0.62 0.00 0.00 178.44 178.41 2nlw h LYS 35 N 0.00 0.00 0.16 1.25 1.57 -1.29 -2.94 116.57 115.32 2nlw h LYS 35 Ca -0.01 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.56 2nlw h LYS 35 Cb 1.06 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.39 2nlw h LYS 35 CO 0.07 0.05 -0.93 -0.97 -0.57 0.00 0.00 179.45 177.10 2nlw h ASN 36 N 0.00 0.55 0.30 0.86 -0.73 -1.57 -3.28 115.58 111.71 2nlw h ASN 36 Ca -0.00 -0.94 -0.02 0.00 1.87 0.00 0.00 56.30 57.21 2nlw h ASN 36 Cb 0.30 -0.18 -0.00 0.00 0.27 0.00 0.00 38.32 38.71 2nlw h ASN 36 CO 0.01 1.45 -0.09 1.62 -0.37 0.00 0.00 177.43 180.04 2nlw h VAL 37 N -0.26 0.52 0.56 2.57 3.04 -1.51 -2.73 116.25 118.45 2nlw h VAL 37 Ca -0.16 -0.41 -0.02 0.00 -1.01 0.00 0.00 66.70 65.10 2nlw h VAL 37 Cb 1.73 1.27 -0.02 0.00 -2.01 0.00 0.00 31.29 32.26 2nlw h VAL 37 CO 0.17 0.09 -0.50 0.40 -1.01 0.00 0.00 177.57 176.72 2nlw h ILE 38 N 0.00 0.01 0.00 3.17 1.08 -1.61 -1.10 117.51 119.06 2nlw h ILE 38 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2nlw h ILE 38 Cb 0.26 0.01 0.00 0.00 -3.07 0.00 0.00 36.82 34.03 2nlw h ILE 38 CO 0.01 0.00 0.00 1.12 -0.69 0.00 0.00 178.15 178.59 2nlw h HIS 39 N -1.05 0.00 0.10 1.37 2.07 -1.65 0.12 115.15 116.12 2nlw h HIS 39 Ca -0.07 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.44 2nlw h HIS 39 Cb 0.90 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.88 2nlw h HIS 39 CO -0.23 0.00 -0.05 0.87 -3.07 0.00 0.00 177.93 175.46 2nlw h LYS 40 N 0.00 -0.13 0.00 5.12 1.79 -1.25 -3.25 116.57 118.85 2nlw h LYS 40 Ca 0.00 0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2nlw h LYS 40 Cb 0.56 0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.24 2nlw h LYS 40 CO 0.00 0.36 -0.00 0.82 -1.08 0.00 0.00 179.45 179.54 2nlw h ILE 41 N -0.70 1.34 0.00 1.86 2.04 -1.07 -3.37 117.51 117.61 2nlw h ILE 41 Ca -0.01 -2.01 0.00 0.00 1.00 0.00 0.00 64.86 63.84 2nlw h ILE 41 Cb 0.54 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.16 2nlw h ILE 41 CO 0.02 0.46 0.00 0.49 0.00 0.00 0.00 178.15 179.12 2nlw n PHE 42 N -4.65 0.00 0.32 1.37 3.72 0.41 -2.24 117.46 116.40 2nlw n PHE 42 Ca -0.08 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.48 2nlw n PHE 42 Cb 0.36 -0.32 0.56 0.00 -0.94 0.00 0.00 39.48 39.14 2nlw n PHE 42 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2nlw h SER 43 N 0.00 0.00 0.29 4.37 4.64 -1.72 -2.06 113.55 119.07 2nlw h SER 43 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nlw h SER 43 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 2nlw h SER 43 CO 0.00 0.00 -0.09 0.29 -0.87 0.00 0.00 176.83 176.16 2nlw n LYS 44 N -2.82 0.81 -0.06 4.77 4.76 -0.95 -3.48 118.16 121.19 2nlw n LYS 44 Ca 0.02 -0.29 0.08 0.00 -2.87 0.00 0.00 58.31 55.26 2nlw n LYS 44 Cb 0.32 -1.49 0.12 0.00 -1.84 0.00 0.00 35.03 32.13 2nlw n LYS 44 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2nlw n PHE 45 N -0.84 0.00 0.00 2.13 3.72 -0.78 -5.02 117.46 116.66 2nlw n PHE 45 Ca 0.16 -0.92 0.00 0.00 -0.05 0.00 0.00 57.45 56.64 2nlw n PHE 45 Cb 0.27 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.68 2nlw n PHE 45 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2nlw n GLY 46 N -1.29 0.99 3.81 1.37 0.00 -1.21 -4.49 105.19 104.38 2nlw n GLY 46 Ca 0.14 -1.95 -0.36 0.00 0.00 0.00 0.00 46.02 43.85 2nlw n GLY 46 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nlw s LYS 47 N -1.47 3.44 -1.00 1.61 2.47 -1.26 -4.26 119.74 119.28 2nlw s LYS 47 Ca 0.00 -0.21 -0.23 0.00 -1.56 0.00 0.00 55.97 53.97 2nlw s LYS 47 Cb 0.00 -3.13 0.01 0.00 -1.46 0.00 0.00 37.83 33.25 2nlw s LYS 47 CO 0.00 0.70 1.68 0.42 0.16 0.00 0.00 175.35 178.30 2nlw s ILE 48 N -0.81 3.74 -0.13 5.43 -1.09 -1.26 -4.59 121.20 122.49 2nlw s ILE 48 Ca 0.13 -0.69 -0.14 0.00 -2.23 0.00 0.00 60.65 57.73 2nlw s ILE 48 Cb -0.12 -4.65 -0.12 0.00 -1.58 0.00 0.00 42.46 36.00 2nlw s ILE 48 CO 0.03 -1.53 0.28 0.74 -1.23 0.00 0.00 174.94 173.23 2nlw h THR 49 N 6.87 0.75 -3.92 2.92 2.02 -1.95 -3.48 112.91 116.12 2nlw h THR 49 Ca 0.18 -1.61 -0.27 0.00 0.77 0.00 0.00 66.41 65.48 2nlw h THR 49 Cb 1.00 1.46 -0.24 0.00 -1.74 0.00 0.00 68.15 68.62 2nlw h THR 49 CO 1.34 0.25 -0.73 0.20 0.37 0.00 0.00 175.52 176.95 2nlw s ASN 50 N -5.94 0.58 -0.01 4.18 -0.87 0.02 -5.04 114.94 107.87 2nlw s ASN 50 Ca -0.11 -0.34 0.01 0.00 -1.57 0.00 0.00 52.86 50.85 2nlw s ASN 50 Cb -0.00 0.01 0.01 0.00 -0.02 0.00 0.00 41.25 41.25 2nlw s ASN 50 CO 0.33 -0.11 -0.02 1.51 -2.57 0.00 0.00 177.10 176.24 2nlw s ASP 51 N -0.92 0.45 -0.22 -1.22 -4.77 -1.26 -0.54 116.67 108.18 2nlw s ASP 51 Ca -0.06 -0.05 -0.00 0.00 -3.30 0.00 0.00 52.55 49.13 2nlw s ASP 51 Cb -0.06 -0.13 0.06 0.00 -1.09 0.00 0.00 42.92 41.69 2nlw s ASP 51 CO -0.00 -0.01 -0.03 -0.36 0.70 0.00 0.00 175.17 175.46 2nlw s PHE 52 N 0.37 1.98 -0.41 2.11 0.08 0.26 -4.99 117.98 117.39 2nlw s PHE 52 Ca -0.04 -1.46 -0.10 0.00 0.12 0.00 0.00 56.93 55.46 2nlw s PHE 52 Cb -0.07 -1.42 0.07 0.00 -0.57 0.00 0.00 43.02 41.03 2nlw s PHE 52 CO -0.01 -0.72 0.25 0.71 -0.10 0.00 0.00 175.22 175.35 2nlw s TYR 53 N 1.53 3.31 0.87 0.36 2.02 -1.26 -1.67 117.35 122.50 2nlw s TYR 53 Ca -0.04 -1.37 -0.13 0.00 -0.37 0.00 0.00 57.07 55.16 2nlw s TYR 53 Cb -0.18 -2.82 0.13 0.00 -0.40 0.00 0.00 41.96 38.70 2nlw s TYR 53 CO -0.07 -0.80 1.23 -1.25 -1.57 0.00 0.00 175.55 173.09 2nlw s PRO 54 N 1.46 1.39 0.23 -1.71 0.04 -1.26 -5.06 135.00 130.09 2nlw s PRO 54 Ca 0.02 -0.17 -0.09 0.00 0.04 0.00 0.00 61.00 60.80 2nlw s PRO 54 Cb -0.22 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 2nlw s PRO 54 CO 0.03 -1.93 0.38 -1.83 0.04 0.00 0.00 177.00 173.69 2nlw s GLU 55 N -5.69 1.45 -0.34 4.56 -1.05 -1.26 -4.68 118.70 111.69 2nlw s GLU 55 Ca 0.67 -1.36 0.04 0.00 -0.15 0.00 0.00 54.97 54.17 2nlw s GLU 55 Cb -0.08 0.41 0.10 0.00 -0.44 0.00 0.00 34.13 34.13 2nlw s GLU 55 CO 0.50 -0.57 0.06 -1.21 0.95 0.00 0.00 175.26 174.99 2nlw s GLU 56 N -4.06 1.45 -1.32 -4.83 0.41 -1.16 -4.76 118.70 104.43 2nlw s GLU 56 Ca 0.27 -1.85 -0.22 0.00 -0.41 0.00 0.00 54.97 52.76 2nlw s GLU 56 Cb 0.02 -3.14 0.03 0.00 -1.78 0.00 0.00 34.13 29.25 2nlw s GLU 56 CO 0.10 -0.95 0.42 -3.47 -0.49 0.00 0.00 175.26 170.87 2nlw n ASP 57 N 4.26 -2.14 0.00 -0.19 2.03 -1.26 -0.34 116.55 118.90 2nlw n ASP 57 Ca 0.04 -1.28 0.00 0.00 0.52 0.00 0.00 54.79 54.06 2nlw n ASP 57 Cb 0.42 -1.56 0.00 0.00 -0.72 0.00 0.00 41.12 39.26 2nlw n ASP 57 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2nlw n GLY 58 N -2.28 1.16 3.01 0.27 0.00 -1.26 -4.95 105.19 101.15 2nlw n GLY 58 Ca -0.19 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 2nlw n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2nlw n LYS 59 N -2.00 0.69 -1.58 1.61 5.02 0.54 -5.03 118.16 117.42 2nlw n LYS 59 Ca 0.00 -2.41 -0.55 0.00 -2.02 0.00 0.00 58.31 53.33 2nlw n LYS 59 Cb 0.00 -0.19 -0.07 0.00 -0.02 0.00 0.00 35.03 34.76 2nlw n LYS 59 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2nlw n THR 60 N -1.98 0.02 -2.78 -0.18 -1.04 -1.26 -3.00 114.28 104.06 2nlw n THR 60 Ca 0.13 -0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.87 2nlw n THR 60 Cb 0.46 -0.60 -0.00 0.00 -1.82 0.00 0.00 70.33 68.37 2nlw n THR 60 CO 0.00 0.00 0.00 -1.59 -0.64 0.00 0.00 175.07 172.84 2nlw s LYS 61 N 0.58 3.50 -0.04 -2.82 -2.85 -1.26 -4.16 119.74 112.70 2nlw s LYS 61 Ca 0.88 0.08 0.07 0.00 -1.00 0.00 0.00 55.97 55.99 2nlw s LYS 61 Cb -1.06 -2.43 0.12 0.00 -2.06 0.00 0.00 37.83 32.40 2nlw s LYS 61 CO 0.52 -0.16 1.06 0.41 0.10 0.00 0.00 175.35 177.27 2nlw n GLY 62 N -2.18 1.65 3.60 0.59 0.00 -1.26 -4.57 105.19 103.02 2nlw n GLY 62 Ca -0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 2nlw n GLY 62 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2nlw s TYR 63 N -0.73 -0.31 0.15 1.61 1.13 -1.26 0.17 117.35 118.10 2nlw s TYR 63 Ca 0.12 0.58 -0.02 0.00 -1.41 0.00 0.00 57.07 56.34 2nlw s TYR 63 Cb 0.11 0.45 -0.03 0.00 -1.10 0.00 0.00 41.96 41.38 2nlw s TYR 63 CO -0.01 -0.26 0.11 0.96 -2.51 0.00 0.00 175.55 173.84 2nlw s ILE 64 N -0.86 0.08 -0.02 -3.49 -4.36 -1.13 -4.39 121.20 107.02 2nlw s ILE 64 Ca 0.01 -1.83 0.01 0.00 -0.26 0.00 0.00 60.65 58.58 2nlw s ILE 64 Cb -0.01 -2.09 0.01 0.00 1.25 0.00 0.00 42.46 41.62 2nlw s ILE 64 CO -0.02 -0.36 -0.03 -0.36 0.24 0.00 0.00 174.94 174.41 2nlw s PHE 65 N -4.05 0.46 0.06 1.37 0.08 -0.67 -3.08 117.98 112.13 2nlw s PHE 65 Ca 0.25 -0.08 0.09 0.00 0.12 0.00 0.00 56.93 57.32 2nlw s PHE 65 Cb 0.07 -0.40 -0.03 0.00 -0.57 0.00 0.00 43.02 42.08 2nlw s PHE 65 CO 0.03 -0.09 -0.26 -0.51 -0.10 0.00 0.00 175.22 174.30 2nlw s LEU 66 N 0.49 2.19 -0.19 -0.37 1.02 -0.54 -0.57 118.68 120.71 2nlw s LEU 66 Ca -0.05 -0.61 0.01 0.00 0.02 0.00 0.00 54.13 53.50 2nlw s LEU 66 Cb -0.09 -1.24 0.04 0.00 0.02 0.00 0.00 46.19 44.92 2nlw s LEU 66 CO -0.01 0.23 -0.11 -0.70 0.02 0.00 0.00 176.35 175.78 2nlw s GLU 67 N -1.36 2.12 0.43 1.70 2.56 0.29 -0.27 118.70 124.16 2nlw s GLU 67 Ca 0.12 -0.77 0.06 0.00 0.00 0.00 0.00 54.97 54.38 2nlw s GLU 67 Cb -0.10 -2.34 -0.06 0.00 2.00 0.00 0.00 34.13 33.64 2nlw s GLU 67 CO 0.03 -0.37 0.06 0.71 -0.56 0.00 0.00 175.26 175.12 2nlw s TYR 68 N 1.42 2.41 -0.13 5.30 2.02 0.22 -0.80 117.35 127.79 2nlw s TYR 68 Ca 0.00 -0.70 0.09 0.00 -0.37 0.00 0.00 57.07 56.09 2nlw s TYR 68 Cb -0.15 -1.80 0.16 0.00 -0.40 0.00 0.00 41.96 39.77 2nlw s TYR 68 CO -0.09 0.33 1.10 0.00 -1.57 0.00 0.00 175.55 175.32 2nlw n ALA 69 N -1.10 2.17 -1.61 3.71 0.00 -1.26 -4.73 120.51 117.68 2nlw n ALA 69 Ca -0.06 -1.69 -0.31 0.00 0.00 0.00 0.00 53.44 51.38 2nlw n ALA 69 Cb 0.66 -0.21 0.05 0.00 0.00 0.00 0.00 19.45 19.94 2nlw n ALA 69 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2nlw s SER 70 N -1.75 5.48 0.00 0.00 0.01 -1.26 -4.93 113.70 111.25 2nlw s SER 70 Ca 0.16 1.58 0.00 0.00 1.31 0.00 0.00 55.95 59.00 2nlw s SER 70 Cb 0.13 -2.48 0.00 0.00 0.21 0.00 0.00 66.02 63.89 2nlw s SER 70 CO 0.03 -1.37 0.00 -2.65 0.41 0.00 0.00 173.24 169.65 2nlw n PRO 71 N -3.08 0.00 -0.95 12.44 -0.02 -1.26 -4.18 135.00 137.95 2nlw n PRO 71 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.55 2nlw n PRO 71 Cb 0.54 -1.12 0.00 0.00 -0.02 0.00 0.00 33.50 32.89 2nlw n PRO 71 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2nlw n ALA 72 N -0.12 -0.74 -0.08 3.55 0.00 -1.26 -5.06 120.51 116.79 2nlw n ALA 72 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2nlw n ALA 72 Cb 0.00 -0.10 -0.13 0.00 0.00 0.00 0.00 19.45 19.21 2nlw n ALA 72 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2nlw n HIS 73 N -0.73 0.36 0.20 0.00 1.44 -1.26 -4.36 115.22 110.86 2nlw n HIS 73 Ca 0.00 0.09 0.10 0.00 -2.01 0.00 0.00 57.72 55.90 2nlw n HIS 73 Cb 0.32 -1.05 0.13 0.00 0.12 0.00 0.00 29.99 29.51 2nlw n HIS 73 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2nlw h ALA 74 N 0.32 0.91 -0.06 1.59 0.00 -1.78 0.55 119.26 120.78 2nlw h ALA 74 Ca -0.51 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.33 2nlw h ALA 74 Cb 2.01 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.79 2nlw h ALA 74 CO -0.01 0.11 0.04 -0.24 0.00 0.00 0.00 179.25 179.15 2nlw h VAL 75 N 0.00 0.97 0.02 0.00 3.04 -1.80 0.50 116.25 118.98 2nlw h VAL 75 Ca -0.00 -0.00 -0.10 0.00 -1.01 0.00 0.00 66.70 65.58 2nlw h VAL 75 Cb 1.07 0.96 -0.01 0.00 -2.01 0.00 0.00 31.29 31.30 2nlw h VAL 75 CO 0.01 0.00 -0.54 -0.78 -1.01 0.00 0.00 177.57 175.25 2nlw h ASP 76 N 0.01 0.05 -0.81 3.17 3.58 -1.51 -3.36 116.42 117.55 2nlw h ASP 76 Ca 0.03 -0.83 0.09 0.00 0.42 0.00 0.00 57.03 56.73 2nlw h ASP 76 Cb 0.10 -0.02 -0.07 0.00 1.72 0.00 0.00 39.33 41.07 2nlw h ASP 76 CO -0.00 1.22 0.46 0.00 -2.88 0.00 0.00 179.24 178.04 2nlw h ALA 77 N -0.16 1.14 0.00 -0.78 0.00 -0.36 0.07 119.26 119.17 2nlw h ALA 77 Ca -0.14 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2nlw h ALA 77 Cb 1.18 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 2nlw h ALA 77 CO -0.06 0.10 -0.10 0.28 0.00 0.00 0.00 179.25 179.48 2nlw h VAL 78 N 0.79 0.36 0.05 0.00 2.07 -0.19 0.26 116.25 119.58 2nlw h VAL 78 Ca 0.38 -0.58 -0.19 0.00 0.82 0.00 0.00 66.70 67.13 2nlw h VAL 78 Cb 0.33 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2nlw h VAL 78 CO -0.23 0.10 -0.99 0.50 0.02 0.00 0.00 177.57 176.96 2nlw h LYS 79 N 0.00 0.10 0.00 1.57 3.64 -1.38 -3.36 116.57 117.14 2nlw h LYS 79 Ca -0.00 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 2nlw h LYS 79 Cb 0.42 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2nlw h LYS 79 CO 0.01 1.08 -0.38 0.09 -2.27 0.00 0.00 179.45 177.98 2nlw n ASN 80 N -4.28 0.47 -0.14 4.20 3.02 -0.11 -3.21 115.26 115.21 2nlw n ASN 80 Ca -0.23 0.08 0.04 0.00 -0.03 0.00 0.00 54.58 54.44 2nlw n ASN 80 Cb 0.72 -0.03 0.07 0.00 -0.61 0.00 0.00 39.78 39.93 2nlw n ASN 80 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2nlw n ALA 81 N -1.61 2.15 -2.53 5.41 0.00 0.87 -5.00 120.51 119.80 2nlw n ALA 81 Ca 0.05 -1.53 -0.42 0.00 0.00 0.00 0.00 53.44 51.54 2nlw n ALA 81 Cb 0.37 -0.19 -0.02 0.00 0.00 0.00 0.00 19.45 19.60 2nlw n ALA 81 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2nlw s ASP 82 N -1.56 6.38 -0.21 0.00 2.15 -1.20 -4.12 116.67 118.12 2nlw s ASP 82 Ca 0.14 0.21 -0.00 0.00 0.43 0.00 0.00 52.55 53.32 2nlw s ASP 82 Cb 0.11 -2.55 -0.00 0.00 -0.30 0.00 0.00 42.92 40.18 2nlw s ASP 82 CO 0.03 -1.52 0.17 0.61 -0.17 0.00 0.00 175.17 174.30 2nlw n GLY 83 N 5.09 0.34 3.38 2.66 0.00 0.11 -4.89 105.19 111.87 2nlw n GLY 83 Ca 0.10 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 2nlw n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2nlw s TYR 84 N -3.06 3.26 -0.72 1.61 1.51 -0.81 -4.81 117.35 114.32 2nlw s TYR 84 Ca 0.01 -0.99 -0.27 0.00 -1.01 0.00 0.00 57.07 54.82 2nlw s TYR 84 Cb -0.00 -3.00 0.02 0.00 -0.11 0.00 0.00 41.96 38.87 2nlw s TYR 84 CO 0.13 -0.77 1.43 0.15 -1.11 0.00 0.00 175.55 175.39 2nlw s LYS 85 N 1.60 3.06 0.09 -0.62 3.01 -1.26 -1.31 119.74 124.31 2nlw s LYS 85 Ca 0.04 -0.06 -0.26 0.00 -1.01 0.00 0.00 55.97 54.68 2nlw s LYS 85 Cb -0.23 -4.27 -0.15 0.00 -1.01 0.00 0.00 37.83 32.17 2nlw s LYS 85 CO 0.06 -2.31 1.70 -0.07 0.51 0.00 0.00 175.35 175.24 2nlw h LEU 86 N 13.90 -0.30 0.00 3.17 3.38 -0.72 -3.47 115.31 131.27 2nlw h LEU 86 Ca -0.26 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.73 2nlw h LEU 86 Cb 1.08 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2nlw h LEU 86 CO 1.27 -0.21 0.00 -0.67 0.09 0.00 0.00 178.44 178.92 2nlw n ASP 87 N -5.24 0.00 0.00 -0.43 2.03 -1.26 -5.07 116.55 106.58 2nlw n ASP 87 Ca -0.09 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.22 2nlw n ASP 87 Cb 0.16 0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 2nlw n ASP 87 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2nlw n LYS 88 N -1.58 0.00 -0.08 -0.67 4.76 -1.26 -4.88 118.16 114.45 2nlw n LYS 88 Ca 0.00 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.56 2nlw n LYS 88 Cb 0.00 0.00 0.35 0.00 -1.84 0.00 0.00 35.03 33.54 2nlw n LYS 88 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2nlw n GLN 89 N 0.00 1.92 -2.82 1.97 -0.00 -1.26 -4.69 117.38 112.50 2nlw n GLN 89 Ca 0.00 -1.37 -0.43 0.00 -0.00 0.00 0.00 57.00 55.20 2nlw n GLN 89 Cb 0.00 -1.44 -0.03 0.00 -0.00 0.00 0.00 30.24 28.77 2nlw n GLN 89 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.06 176.05 2nlw s HIS 90 N -1.79 2.74 -0.07 2.61 0.09 -1.26 -4.75 115.29 112.86 2nlw s HIS 90 Ca 0.34 -0.75 -0.00 0.00 -0.00 0.00 0.00 55.06 54.65 2nlw s HIS 90 Cb 0.19 -4.36 0.02 0.00 -0.00 0.00 0.00 32.58 28.44 2nlw s HIS 90 CO 0.29 -1.67 -0.04 0.99 -0.00 0.00 0.00 174.74 174.31 2nlw s THR 91 N 3.95 0.62 -0.53 1.30 2.01 -1.24 0.12 115.64 121.87 2nlw s THR 91 Ca 0.28 -0.09 -0.16 0.00 0.31 0.00 0.00 61.69 62.03 2nlw s THR 91 Cb -0.11 -0.68 0.11 0.00 0.01 0.00 0.00 72.50 71.82 2nlw s THR 91 CO 0.04 0.28 0.51 -0.36 -0.69 0.00 0.00 174.62 174.39 2nlw s PHE 92 N 1.46 3.20 -0.18 4.92 0.08 -0.42 -4.51 117.98 122.52 2nlw s PHE 92 Ca -0.02 -1.09 -0.16 0.00 0.12 0.00 0.00 56.93 55.78 2nlw s PHE 92 Cb -0.13 -3.63 -0.04 0.00 -0.57 0.00 0.00 43.02 38.64 2nlw s PHE 92 CO -0.03 -1.00 0.41 1.03 -0.10 0.00 0.00 175.22 175.53 2nlw s ARG 93 N 1.83 4.21 0.16 0.44 3.00 -1.11 0.04 118.95 127.52 2nlw s ARG 93 Ca 0.05 0.25 -0.05 0.00 0.00 0.00 0.00 55.73 55.98 2nlw s ARG 93 Cb -0.27 -3.51 -0.05 0.00 0.00 0.00 0.00 34.95 31.12 2nlw s ARG 93 CO 0.05 0.01 0.39 0.14 0.00 0.00 0.00 175.30 175.89 2nlw s VAL 94 N 1.14 5.15 0.33 3.52 -7.23 -1.26 0.09 120.40 122.14 2nlw s VAL 94 Ca 0.20 0.01 -0.13 0.00 -1.81 0.00 0.00 61.98 60.25 2nlw s VAL 94 Cb -0.15 -3.64 0.02 0.00 0.56 0.00 0.00 36.38 33.18 2nlw s VAL 94 CO 0.08 -0.00 0.65 0.21 -0.31 0.00 0.00 175.10 175.72 2nlw s ASN 95 N -2.53 0.12 1.26 4.85 2.47 -1.21 -4.89 114.94 115.01 2nlw s ASN 95 Ca 0.41 -1.06 -0.20 0.00 0.42 0.00 0.00 52.86 52.44 2nlw s ASN 95 Cb -0.12 0.73 0.31 0.00 -1.45 0.00 0.00 41.25 40.72 2nlw s ASN 95 CO 0.25 -1.42 1.05 -0.76 -3.72 0.00 0.00 177.10 172.50 2nlw s LEU 96 N -3.06 0.23 0.00 3.21 2.01 -1.26 -4.47 118.68 115.34 2nlw s LEU 96 Ca 0.19 0.76 0.00 0.00 0.01 0.00 0.00 54.13 55.09 2nlw s LEU 96 Cb -0.03 -2.43 0.00 0.00 0.01 0.00 0.00 46.19 43.73 2nlw s LEU 96 CO 0.12 -4.45 0.00 0.33 1.01 0.00 0.00 176.35 173.36 2nlw n PHE 97 N -5.00 0.00 0.18 0.29 7.35 -1.26 -4.48 117.46 114.55 2nlw n PHE 97 Ca 0.12 0.00 0.06 0.00 -0.76 0.00 0.00 57.45 56.87 2nlw n PHE 97 Cb 0.59 0.00 0.29 0.00 0.35 0.00 0.00 39.48 40.72 2nlw n PHE 97 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 2nlw h THR 98 N 0.00 0.80 0.00 -2.13 1.35 -1.94 -3.21 112.91 107.78 2nlw h THR 98 Ca 0.00 -1.59 0.00 0.00 -0.55 0.00 0.00 66.41 64.27 2nlw h THR 98 Cb 0.32 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 2nlw h THR 98 CO 0.00 0.36 -1.47 -0.67 -0.25 0.00 0.00 175.52 173.50 2nlw n ASP 99 N -3.43 2.34 -4.59 5.36 2.03 -1.26 -5.02 116.55 111.97 2nlw n ASP 99 Ca 0.00 -0.04 -0.27 0.00 0.52 0.00 0.00 54.79 55.00 2nlw n ASP 99 Cb 0.54 1.49 -0.09 0.00 -0.72 0.00 0.00 41.12 42.34 2nlw n ASP 99 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2nlw s PHE 100 N -2.75 2.71 0.00 -0.67 0.40 -1.21 -5.06 117.98 111.40 2nlw s PHE 100 Ca -0.04 -0.19 0.00 0.00 -0.60 0.00 0.00 56.93 56.11 2nlw s PHE 100 Cb 0.07 -1.34 0.00 0.00 0.51 0.00 0.00 43.02 42.26 2nlw s PHE 100 CO 0.47 0.49 0.00 -3.47 0.70 0.00 0.00 175.22 173.41 2nlw n ASP 101 N 0.15 0.00 -4.50 1.36 2.03 -1.26 -4.68 116.55 109.65 2nlw n ASP 101 Ca -0.11 0.00 -0.42 0.00 0.52 0.00 0.00 54.79 54.78 2nlw n ASP 101 Cb 0.55 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.96 2nlw n ASP 101 CO 0.00 0.00 0.00 2.29 -1.92 0.00 0.00 177.20 177.57 2nlw n LYS 102 N 0.00 0.77 -2.95 -0.67 -0.00 -1.26 -4.88 118.16 109.16 2nlw n LYS 102 Ca 0.00 0.28 -0.44 0.00 -0.00 0.00 0.00 58.31 58.15 2nlw n LYS 102 Cb 0.00 -1.66 -0.04 0.00 -0.00 0.00 0.00 35.03 33.34 2nlw n LYS 102 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.40 176.93 2nlw s TYR 103 N -1.41 2.88 -0.50 5.58 5.04 -1.26 -4.94 117.35 122.74 2nlw s TYR 103 Ca 0.64 -0.86 -0.06 0.00 -2.44 0.00 0.00 57.07 54.34 2nlw s TYR 103 Cb -0.59 -4.20 0.13 0.00 0.35 0.00 0.00 41.96 37.65 2nlw s TYR 103 CO 0.57 -1.50 0.34 1.41 -1.34 0.00 0.00 175.55 175.03 2nlw s MET 104 N 3.31 2.39 0.00 4.97 -2.45 -1.26 -5.35 119.30 120.91 2nlw s MET 104 Ca 0.21 -1.97 0.00 0.00 -1.25 0.00 0.00 55.69 52.68 2nlw s MET 104 Cb -0.17 -3.80 0.00 0.00 1.25 0.00 0.00 34.83 32.11 2nlw s MET 104 CO 0.05 -1.16 0.00 2.41 1.05 0.00 0.00 175.02 177.37