#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vlw h HIS -1 N 0.00 0.04 -0.92 -1.40 2.76 -1.99 -3.16 115.15 110.48 1vlw h HIS -1 Ca 0.00 -0.02 0.10 0.00 -2.20 0.00 0.00 60.37 58.25 1vlw h HIS -1 Cb 0.00 -0.00 -0.07 0.00 1.55 0.00 0.00 27.41 28.89 1vlw h HIS -1 CO 0.00 0.91 0.59 1.25 -1.30 0.00 0.00 177.93 179.38 1vlw h HIS 0 N 0.01 1.00 -0.16 5.26 -0.00 -1.98 -1.43 115.15 117.85 1vlw h HIS 0 Ca -0.02 0.03 -0.21 0.00 -0.00 0.00 0.00 60.37 60.17 1vlw h HIS 0 Cb 1.59 -0.32 0.01 0.00 -0.00 0.00 0.00 27.41 28.69 1vlw h HIS 0 CO 0.00 0.45 -0.73 0.52 -0.00 0.00 0.00 177.93 178.17 1vlw h MET 1 N 0.91 0.74 -0.63 5.26 2.07 -1.98 0.21 114.93 121.52 1vlw h MET 1 Ca 0.43 -0.58 -0.01 0.00 -2.07 0.00 0.00 59.70 57.47 1vlw h MET 1 Cb 0.42 0.11 -0.03 0.00 -1.87 0.00 0.00 31.60 30.23 1vlw h MET 1 CO -0.19 1.19 0.35 0.87 1.07 0.00 0.00 176.91 180.20 1vlw h LYS 2 N 0.52 0.87 -0.18 1.72 1.57 -1.44 -0.69 116.57 118.94 1vlw h LYS 2 Ca -0.04 -0.10 -0.21 0.00 -1.87 0.00 0.00 60.65 58.43 1vlw h LYS 2 Cb 1.35 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 33.49 1vlw h LYS 2 CO 0.15 0.66 -0.72 1.98 -0.57 0.00 0.00 179.45 180.95 1vlw h MET 3 N 0.85 0.76 -0.67 3.15 4.05 -1.22 -1.79 114.93 120.07 1vlw h MET 3 Ca 0.22 -0.59 0.02 0.00 -0.28 0.00 0.00 59.70 59.08 1vlw h MET 3 Cb 0.04 0.11 -0.04 0.00 -0.80 0.00 0.00 31.60 30.91 1vlw h MET 3 CO -0.04 1.20 0.43 1.49 0.23 0.00 0.00 176.91 180.22 1vlw h GLU 4 N 0.54 0.82 -0.05 0.39 4.81 -0.43 -2.20 114.58 118.46 1vlw h GLU 4 Ca -0.03 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 58.98 1vlw h GLU 4 Cb 1.33 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 1vlw h GLU 4 CO 0.15 0.54 -0.70 0.93 -0.73 0.00 0.00 179.01 179.20 1vlw h GLU 5 N 0.84 0.26 -0.25 1.92 4.39 -1.00 -1.86 114.58 118.89 1vlw h GLU 5 Ca 0.26 -0.21 0.02 0.00 0.34 0.00 0.00 59.36 59.77 1vlw h GLU 5 Cb -0.02 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1vlw h GLU 5 CO -0.09 0.86 0.12 -0.07 -1.16 0.00 0.00 179.01 178.67 1vlw h LEU 6 N 0.18 0.17 -0.67 1.33 3.38 -1.15 0.21 115.31 118.76 1vlw h LEU 6 Ca -0.02 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.03 1vlw h LEU 6 Cb 1.25 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.92 1vlw h LEU 6 CO 0.11 0.13 0.36 -0.26 0.09 0.00 0.00 178.44 178.87 1vlw h PHE 7 N 0.25 0.65 -0.58 1.13 0.04 -1.16 0.13 116.94 117.42 1vlw h PHE 7 Ca 0.10 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.81 1vlw h PHE 7 Cb 0.03 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 37.96 1vlw h PHE 7 CO -0.10 0.29 0.01 -0.22 -0.60 0.00 0.00 178.31 177.70 1vlw h LYS 8 N 0.65 0.99 -0.19 1.51 3.64 -1.15 0.17 116.57 122.19 1vlw h LYS 8 Ca 0.31 -0.29 -0.15 0.00 -1.27 0.00 0.00 60.65 59.25 1vlw h LYS 8 Cb 0.23 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1vlw h LYS 8 CO -0.21 0.96 -0.46 -0.22 -2.27 0.00 0.00 179.45 177.25 1vlw h LYS 9 N 0.91 0.64 0.00 1.90 3.64 -0.07 -3.37 116.57 120.22 1vlw h LYS 9 Ca 0.17 -0.44 -0.30 0.00 -1.27 0.00 0.00 60.65 58.81 1vlw h LYS 9 Cb 0.51 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.34 1vlw h LYS 9 CO 0.02 1.06 -2.07 0.72 -2.27 0.00 0.00 179.45 176.92 1vlw n HIS 10 N -4.19 0.37 0.00 1.91 8.25 0.42 -4.97 115.22 117.01 1vlw n HIS 10 Ca -0.06 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 1vlw n HIS 10 Cb 0.57 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.67 1vlw n HIS 10 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1vlw n LYS 11 N -2.80 0.00 -4.06 -0.41 5.02 0.59 -4.86 118.16 111.64 1vlw n LYS 11 Ca -0.24 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 55.87 1vlw n LYS 11 Cb 1.05 -1.37 -0.16 0.00 -0.02 0.00 0.00 35.03 34.53 1vlw n LYS 11 CO 0.00 0.00 0.00 -1.50 -0.52 0.00 0.00 177.40 175.38 1vlw s ILE 12 N -0.42 0.38 -0.17 -0.18 2.07 -1.26 -0.24 121.20 121.37 1vlw s ILE 12 Ca 0.00 -0.03 -0.06 0.00 -1.41 0.00 0.00 60.65 59.16 1vlw s ILE 12 Cb 0.00 -0.44 -0.03 0.00 0.13 0.00 0.00 42.46 42.12 1vlw s ILE 12 CO 0.00 0.19 0.01 -0.69 -1.91 0.00 0.00 174.94 172.54 1vlw s VAL 13 N 0.98 4.31 -0.34 4.00 1.01 0.30 -4.09 120.40 126.57 1vlw s VAL 13 Ca -0.10 -0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 1vlw s VAL 13 Cb -0.14 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.33 1vlw s VAL 13 CO -0.01 0.47 1.06 0.00 0.00 0.00 0.00 175.10 176.62 1vlw s ALA 14 N 0.46 3.46 -0.49 5.51 0.00 0.16 -1.42 121.76 129.45 1vlw s ALA 14 Ca -0.00 -0.14 -0.23 0.00 0.00 0.00 0.00 51.96 51.59 1vlw s ALA 14 Cb -0.13 -3.67 0.03 0.00 0.00 0.00 0.00 23.12 19.35 1vlw s ALA 14 CO 0.02 -1.56 0.80 0.08 0.00 0.00 0.00 175.76 175.10 1vlw s VAL 15 N 3.69 4.61 -0.33 0.00 1.01 -0.39 0.04 120.40 129.04 1vlw s VAL 15 Ca 0.45 0.25 -0.03 0.00 0.00 0.00 0.00 61.98 62.65 1vlw s VAL 15 Cb -0.12 -4.38 0.06 0.00 0.00 0.00 0.00 36.38 31.94 1vlw s VAL 15 CO 0.17 -0.84 0.06 -0.22 0.00 0.00 0.00 175.10 174.27 1vlw s LEU 16 N 3.37 4.23 -0.11 3.92 2.96 0.84 -4.25 118.68 129.65 1vlw s LEU 16 Ca 0.28 -1.37 -0.12 0.00 -0.22 0.00 0.00 54.13 52.70 1vlw s LEU 16 Cb -0.13 -1.77 -0.05 0.00 0.50 0.00 0.00 46.19 44.74 1vlw s LEU 16 CO 0.20 -0.33 0.26 -0.13 -1.32 0.00 0.00 176.35 175.04 1vlw s ARG 17 N 1.27 3.89 0.00 1.98 0.52 -1.26 -0.57 118.95 124.78 1vlw s ARG 17 Ca -0.02 0.08 -0.09 0.00 -0.52 0.00 0.00 55.73 55.19 1vlw s ARG 17 Cb -0.20 -3.29 0.00 0.00 0.52 0.00 0.00 34.95 31.98 1vlw s ARG 17 CO -0.01 0.54 0.17 0.00 0.02 0.00 0.00 175.30 176.02 1vlw s ALA 18 N -0.45 -0.40 -1.64 2.13 0.00 -1.26 -5.00 121.76 115.15 1vlw s ALA 18 Ca 0.17 -0.06 0.27 0.00 0.00 0.00 0.00 51.96 52.34 1vlw s ALA 18 Cb -0.13 0.11 0.88 0.00 0.00 0.00 0.00 23.12 23.97 1vlw s ALA 18 CO 0.06 -0.22 1.64 0.09 0.00 0.00 0.00 175.76 177.33 1vlw n ASN 19 N 1.41 0.80 -4.03 0.00 3.02 -1.26 -4.89 115.26 110.31 1vlw n ASN 19 Ca -0.23 -0.71 -0.10 0.00 -0.03 0.00 0.00 54.58 53.51 1vlw n ASN 19 Cb 0.56 0.07 -0.07 0.00 -0.61 0.00 0.00 39.78 39.73 1vlw n ASN 19 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1vlw s SER 20 N -2.55 0.03 0.10 6.41 1.04 -1.26 -5.01 113.70 112.46 1vlw s SER 20 Ca 0.24 -1.10 -0.19 0.00 0.48 0.00 0.00 55.95 55.39 1vlw s SER 20 Cb 0.19 0.53 -0.07 0.00 0.10 0.00 0.00 66.02 66.77 1vlw s SER 20 CO 0.52 -1.05 1.65 0.58 0.98 0.00 0.00 173.24 175.92 1vlw h VAL 21 N 2.36 1.17 -0.70 5.02 2.07 -1.91 -2.21 116.25 122.04 1vlw h VAL 21 Ca -0.29 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 66.75 1vlw h VAL 21 Cb 1.25 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 1vlw h VAL 21 CO 0.41 0.17 0.45 -0.33 0.02 0.00 0.00 177.57 178.29 1vlw h GLU 22 N 0.25 0.88 -0.45 1.57 3.07 -1.98 -0.62 114.58 117.30 1vlw h GLU 22 Ca 0.08 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.88 1vlw h GLU 22 Cb 0.17 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 27.86 1vlw h GLU 22 CO -0.01 0.58 0.25 1.49 -1.40 0.00 0.00 179.01 179.93 1vlw h GLU 23 N 0.91 0.62 0.20 2.33 4.81 -1.95 0.77 114.58 122.28 1vlw h GLU 23 Ca 0.27 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1vlw h GLU 23 Cb -0.04 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.21 1vlw h GLU 23 CO -0.08 0.49 -0.10 0.00 -0.73 0.00 0.00 179.01 178.59 1vlw h ALA 24 N 1.10 -0.27 -0.56 2.92 0.00 -1.10 -0.27 119.26 121.09 1vlw h ALA 24 Ca 0.16 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1vlw h ALA 24 Cb 0.04 0.10 -0.10 0.00 0.00 0.00 0.00 17.79 17.83 1vlw h ALA 24 CO -0.03 -0.63 -0.07 0.87 0.00 0.00 0.00 179.25 179.40 1vlw h LYS 25 N -0.32 0.05 -0.27 0.00 1.57 -1.00 0.57 116.57 117.17 1vlw h LYS 25 Ca -0.03 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 1vlw h LYS 25 Cb 0.25 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 1vlw h LYS 25 CO 0.05 0.03 -0.27 1.05 -0.57 0.00 0.00 179.45 179.74 1vlw h GLU 26 N 0.05 0.53 0.08 3.15 4.11 -0.46 -2.22 114.58 119.83 1vlw h GLU 26 Ca 0.28 -0.21 -0.25 0.00 0.07 0.00 0.00 59.36 59.25 1vlw h GLU 26 Cb 0.44 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.66 1vlw h GLU 26 CO -0.53 0.75 -1.12 0.87 0.07 0.00 0.00 179.01 179.06 1vlw h LYS 27 N 0.46 0.25 -0.45 1.06 1.57 -0.64 -2.15 116.57 116.68 1vlw h LYS 27 Ca 0.06 -0.37 -0.06 0.00 -1.87 0.00 0.00 60.65 58.41 1vlw h LYS 27 Cb 0.71 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.14 1vlw h LYS 27 CO 0.05 1.14 0.06 0.00 -0.57 0.00 0.00 179.45 180.14 1vlw h ALA 28 N 0.71 0.59 -0.38 3.86 0.00 -0.91 -1.49 119.26 121.63 1vlw h ALA 28 Ca -0.10 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1vlw h ALA 28 Cb 1.83 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 1vlw h ALA 28 CO 0.18 0.33 0.22 1.25 0.00 0.00 0.00 179.25 181.22 1vlw h LEU 29 N 0.61 0.48 -0.01 0.00 5.85 -1.42 -1.64 115.31 119.17 1vlw h LEU 29 Ca 0.13 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1vlw h LEU 29 Cb 0.40 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.27 1vlw h LEU 29 CO 0.01 0.42 -0.21 0.00 -0.34 0.00 0.00 178.44 178.32 1vlw h ALA 30 N 1.08 -0.27 -0.60 1.25 0.00 -1.35 0.26 119.26 119.64 1vlw h ALA 30 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1vlw h ALA 30 Cb 0.04 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1vlw h ALA 30 CO -0.02 -0.71 0.39 -0.24 0.00 0.00 0.00 179.25 178.67 1vlw h VAL 31 N -0.33 1.16 -0.07 0.00 3.04 -1.27 -2.07 116.25 116.70 1vlw h VAL 31 Ca 0.06 -0.32 -0.01 0.00 -1.01 0.00 0.00 66.70 65.43 1vlw h VAL 31 Cb 0.42 0.30 -0.00 0.00 -2.01 0.00 0.00 31.29 29.99 1vlw h VAL 31 CO -0.20 0.16 0.02 0.15 -1.01 0.00 0.00 177.57 176.69 1vlw h PHE 32 N 0.81 0.11 -0.71 3.17 3.57 -1.04 -0.96 116.94 121.88 1vlw h PHE 32 Ca 0.22 -0.01 0.18 0.00 3.53 0.00 0.00 57.97 61.88 1vlw h PHE 32 Cb -0.07 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 38.60 1vlw h PHE 32 CO -0.03 0.27 0.49 0.93 -2.23 0.00 0.00 178.31 177.75 1vlw h GLU 33 N -0.08 0.17 -0.00 1.11 5.08 -0.38 0.17 114.58 120.65 1vlw h GLU 33 Ca 0.02 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1vlw h GLU 33 Cb 0.21 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1vlw h GLU 33 CO -0.00 0.11 -0.00 0.41 -1.00 0.00 0.00 179.01 178.53 1vlw n GLY 34 N -1.60 -0.84 0.00 -3.84 0.00 -0.79 -4.92 105.19 93.20 1vlw n GLY 34 Ca 0.14 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1vlw n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vlw n GLY 35 N 1.05 0.96 3.62 -0.02 0.00 0.60 -3.08 105.19 108.33 1vlw n GLY 35 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1vlw n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vlw s VAL 36 N -2.00 4.71 -0.13 1.61 1.01 -0.40 -4.91 120.40 120.29 1vlw s VAL 36 Ca 0.00 1.39 0.20 0.00 0.00 0.00 0.00 61.98 63.57 1vlw s VAL 36 Cb 0.00 -4.23 -0.28 0.00 0.00 0.00 0.00 36.38 31.87 1vlw s VAL 36 CO 0.00 -0.30 0.27 1.41 0.00 0.00 0.00 175.10 176.47 1vlw n HIS 37 N 6.39 0.04 -3.16 5.22 -0.00 -1.26 -3.40 115.22 119.05 1vlw n HIS 37 Ca 0.06 0.01 -0.41 0.00 -0.00 0.00 0.00 57.72 57.38 1vlw n HIS 37 Cb 0.48 -0.80 -0.07 0.00 -0.00 0.00 0.00 29.99 29.60 1vlw n HIS 37 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1vlw s LEU 38 N -5.11 4.24 -0.19 2.41 1.43 -1.26 0.35 118.68 120.55 1vlw s LEU 38 Ca -0.09 0.19 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 1vlw s LEU 38 Cb 0.09 -2.73 0.04 0.00 0.03 0.00 0.00 46.19 43.63 1vlw s LEU 38 CO 0.86 -0.51 -0.11 -0.63 0.23 0.00 0.00 176.35 176.19 1vlw s ILE 39 N 2.57 1.63 -0.34 -0.59 1.01 0.23 -0.66 121.20 125.04 1vlw s ILE 39 Ca 0.23 -0.96 -0.14 0.00 0.00 0.00 0.00 60.65 59.78 1vlw s ILE 39 Cb -0.15 -1.68 -0.01 0.00 0.01 0.00 0.00 42.46 40.62 1vlw s ILE 39 CO 0.13 0.20 0.33 -0.70 0.00 0.00 0.00 174.94 174.90 1vlw s GLU 40 N 1.41 3.54 -0.20 2.79 2.12 0.11 -0.68 118.70 127.79 1vlw s GLU 40 Ca -0.00 -0.48 -0.24 0.00 0.36 0.00 0.00 54.97 54.60 1vlw s GLU 40 Cb -0.16 -3.80 -0.01 0.00 0.26 0.00 0.00 34.13 30.41 1vlw s GLU 40 CO -0.08 -0.50 0.77 0.42 -0.54 0.00 0.00 175.26 175.33 1vlw s ILE 41 N 1.93 4.91 -0.11 -3.70 -1.09 0.76 -0.11 121.20 123.78 1vlw s ILE 41 Ca 0.10 1.48 -0.29 0.00 -2.23 0.00 0.00 60.65 59.71 1vlw s ILE 41 Cb -0.17 -4.08 -0.04 0.00 -1.58 0.00 0.00 42.46 36.60 1vlw s ILE 41 CO 0.11 0.02 1.50 -0.89 -1.23 0.00 0.00 174.94 174.45 1vlw s THR 42 N 2.29 3.86 -1.75 2.92 2.01 0.27 -0.55 115.64 124.69 1vlw s THR 42 Ca 0.34 1.04 0.27 0.00 0.31 0.00 0.00 61.69 63.65 1vlw s THR 42 Cb -0.16 -3.69 0.30 0.00 0.01 0.00 0.00 72.50 68.96 1vlw s THR 42 CO 0.10 -0.12 1.62 0.33 -0.69 0.00 0.00 174.62 175.86 1vlw n PHE 43 N 7.06 0.00 0.35 4.92 7.35 0.51 -3.52 117.46 134.12 1vlw n PHE 43 Ca 0.16 0.00 0.13 0.00 -0.76 0.00 0.00 57.45 56.98 1vlw n PHE 43 Cb 0.44 -0.13 0.56 0.00 0.35 0.00 0.00 39.48 40.70 1vlw n PHE 43 CO 0.00 0.00 0.00 1.79 -0.76 0.00 0.00 176.76 177.79 1vlw h THR 44 N 1.13 0.00 -3.89 -2.13 1.35 -1.77 -3.45 112.91 104.15 1vlw h THR 44 Ca 0.00 -0.26 -0.48 0.00 -0.55 0.00 0.00 66.41 65.11 1vlw h THR 44 Cb 0.48 1.04 -0.00 0.00 -1.73 0.00 0.00 68.15 67.94 1vlw h THR 44 CO 0.00 0.00 0.39 -0.69 -0.25 0.00 0.00 175.52 174.97 1vlw s VAL 45 N -3.44 3.90 0.30 6.82 1.01 -1.23 -5.01 120.40 122.76 1vlw s VAL 45 Ca 0.03 1.62 -0.29 0.00 0.00 0.00 0.00 61.98 63.33 1vlw s VAL 45 Cb 0.09 -3.91 -0.10 0.00 0.00 0.00 0.00 36.38 32.46 1vlw s VAL 45 CO 0.41 0.16 1.37 -2.16 0.00 0.00 0.00 175.10 174.88 1vlw s PRO 46 N -2.03 4.30 0.00 2.72 0.04 -1.26 -3.01 135.00 135.76 1vlw s PRO 46 Ca 0.51 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.82 1vlw s PRO 46 Cb -0.23 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.23 1vlw s PRO 46 CO 0.29 -0.31 0.00 -0.25 0.04 0.00 0.00 177.00 176.77 1vlw n ASP 47 N 1.39 -3.26 -0.35 6.66 8.00 -1.26 -4.92 116.55 122.81 1vlw n ASP 47 Ca 0.03 0.00 0.24 0.00 0.71 0.00 0.00 54.79 55.77 1vlw n ASP 47 Cb 0.41 -1.11 0.50 0.00 -0.02 0.00 0.00 41.12 40.90 1vlw n ASP 47 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vlw h ALA 48 N 0.00 2.18 -0.20 2.24 0.00 -1.85 0.69 119.26 122.32 1vlw h ALA 48 Ca 0.00 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1vlw h ALA 48 Cb 0.20 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1vlw h ALA 48 CO 0.00 -0.67 0.05 0.38 0.00 0.00 0.00 179.25 179.01 1vlw h ASP 49 N 0.37 0.31 0.03 0.00 2.03 -1.91 -1.80 116.42 115.45 1vlw h ASP 49 Ca 0.67 -0.22 -0.07 0.00 -0.73 0.00 0.00 57.03 56.67 1vlw h ASP 49 Cb 1.65 -0.08 -0.01 0.00 -0.83 0.00 0.00 39.33 40.06 1vlw h ASP 49 CO -0.41 0.45 -0.20 0.74 -1.03 0.00 0.00 179.24 178.79 1vlw h THR 50 N 0.15 1.23 0.31 1.15 2.02 -0.78 -1.54 112.91 115.45 1vlw h THR 50 Ca 0.06 -1.05 -0.00 0.00 0.77 0.00 0.00 66.41 66.19 1vlw h THR 50 Cb 0.26 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1vlw h THR 50 CO 0.00 0.33 -0.26 0.58 0.37 0.00 0.00 175.52 176.53 1vlw h VAL 51 N 0.29 0.45 -0.11 3.16 2.07 0.35 -1.22 116.25 121.24 1vlw h VAL 51 Ca 0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.60 1vlw h VAL 51 Cb 0.53 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1vlw h VAL 51 CO 0.04 0.00 -0.08 0.40 0.02 0.00 0.00 177.57 177.94 1vlw h ILE 52 N -0.59 0.75 -0.66 4.57 2.04 -1.14 -1.99 117.51 120.49 1vlw h ILE 52 Ca -0.02 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.98 1vlw h ILE 52 Cb 0.52 0.75 -0.11 0.00 -0.74 0.00 0.00 36.82 37.24 1vlw h ILE 52 CO -0.02 0.00 -0.00 0.11 0.00 0.00 0.00 178.15 178.23 1vlw h LYS 53 N -0.10 0.11 -0.01 2.37 1.57 -1.16 -1.53 116.57 117.82 1vlw h LYS 53 Ca 0.07 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1vlw h LYS 53 Cb 0.20 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1vlw h LYS 53 CO -0.16 0.07 0.00 0.39 -0.57 0.00 0.00 179.45 179.18 1vlw n GLU 54 N -5.31 1.25 -0.31 3.15 1.02 -0.47 -2.01 120.64 117.97 1vlw n GLU 54 Ca 0.10 -0.37 0.11 0.00 -0.02 0.00 0.00 57.16 56.98 1vlw n GLU 54 Cb 0.39 -1.47 0.29 0.00 -0.02 0.00 0.00 31.44 30.63 1vlw n GLU 54 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1vlw n LEU 55 N -0.53 3.49 0.28 -4.62 4.77 -0.58 -4.40 117.00 115.40 1vlw n LEU 55 Ca 0.21 -1.70 0.15 0.00 -0.03 0.00 0.00 56.01 54.63 1vlw n LEU 55 Cb 0.20 -0.41 0.87 0.00 -2.33 0.00 0.00 43.42 41.75 1vlw n LEU 55 CO 0.17 0.85 1.13 0.77 -1.33 0.00 0.00 177.39 178.97 1vlw h SER 56 N 3.94 0.00 0.18 -1.43 4.64 -1.37 -0.25 113.55 119.25 1vlw h SER 56 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1vlw h SER 56 Cb 0.89 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1vlw h SER 56 CO 0.00 0.00 -0.20 2.19 -0.87 0.00 0.00 176.83 177.95 1vlw h PHE 57 N 0.00 0.05 0.18 4.77 -0.00 -1.84 -0.75 116.94 119.35 1vlw h PHE 57 Ca 0.02 -0.00 -0.33 0.00 -0.00 0.00 0.00 57.97 57.65 1vlw h PHE 57 Cb 0.10 -0.01 0.01 0.00 -0.00 0.00 0.00 35.95 36.05 1vlw h PHE 57 CO 0.00 0.24 -1.57 1.25 -0.00 0.00 0.00 178.31 178.23 1vlw h LEU 58 N 0.04 0.60 -1.53 2.10 5.85 -1.40 -3.09 115.31 117.87 1vlw h LEU 58 Ca 0.01 -0.77 0.13 0.00 0.84 0.00 0.00 57.88 58.09 1vlw h LEU 58 Cb 0.38 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 1vlw h LEU 58 CO 0.03 1.63 0.50 0.50 -0.34 0.00 0.00 178.44 180.75 1vlw h LYS 59 N 0.10 0.46 0.00 1.25 3.64 -0.50 -0.85 116.57 120.67 1vlw h LYS 59 Ca -0.27 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.02 1vlw h LYS 59 Cb 2.08 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.79 1vlw h LYS 59 CO 0.20 0.31 -0.28 0.93 -2.27 0.00 0.00 179.45 178.34 1vlw h GLU 60 N 0.48 0.00 -0.00 1.90 4.39 -1.15 -2.48 114.58 117.71 1vlw h GLU 60 Ca 0.36 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.06 1vlw h GLU 60 Cb 0.74 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 1vlw h GLU 60 CO -0.12 0.28 -0.17 1.63 -1.16 0.00 0.00 179.01 179.47 1vlw n LYS 61 N -3.25 0.64 0.00 2.33 5.02 -0.63 -4.93 118.16 117.33 1vlw n LYS 61 Ca 0.02 -0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.04 1vlw n LYS 61 Cb 0.56 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 1vlw n LYS 61 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vlw n GLY 62 N 1.32 1.09 3.78 0.72 0.00 -0.86 -5.09 105.19 106.14 1vlw n GLY 62 Ca 0.13 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 1vlw n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vlw s ALA 63 N -2.00 3.09 -0.36 4.61 0.00 -0.42 -4.95 121.76 121.72 1vlw s ALA 63 Ca 0.00 0.81 -0.06 0.00 0.00 0.00 0.00 51.96 52.70 1vlw s ALA 63 Cb 0.00 -3.32 0.06 0.00 0.00 0.00 0.00 23.12 19.86 1vlw s ALA 63 CO 0.00 -0.36 0.15 0.42 0.00 0.00 0.00 175.76 175.96 1vlw s ILE 64 N -1.57 3.77 -0.21 0.00 -1.09 0.15 -4.25 121.20 118.01 1vlw s ILE 64 Ca 0.58 -1.33 -0.05 0.00 -2.23 0.00 0.00 60.65 57.63 1vlw s ILE 64 Cb -0.25 -3.23 -0.02 0.00 -1.58 0.00 0.00 42.46 37.37 1vlw s ILE 64 CO 0.32 -0.32 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.07 1vlw s ILE 65 N 1.36 3.80 0.45 2.92 1.01 -1.26 -0.60 121.20 128.88 1vlw s ILE 65 Ca 0.00 -0.36 0.03 0.00 0.00 0.00 0.00 60.65 60.33 1vlw s ILE 65 Cb -0.21 -2.73 -0.03 0.00 0.01 0.00 0.00 42.46 39.50 1vlw s ILE 65 CO 0.01 0.42 0.05 -0.83 0.00 0.00 0.00 174.94 174.59 1vlw s GLY 66 N 1.18 2.73 0.04 6.18 0.00 0.15 -0.41 107.32 117.19 1vlw s GLY 66 Ca 0.03 -1.08 0.09 0.00 0.00 0.00 0.00 44.72 43.76 1vlw s GLY 66 CO 0.01 -2.04 -0.24 0.00 0.00 0.00 0.00 173.10 170.83 1vlw s ALA 67 N -2.99 2.34 0.30 3.20 0.00 -0.28 -0.17 121.76 124.15 1vlw s ALA 67 Ca 0.18 -1.23 0.02 0.00 0.00 0.00 0.00 51.96 50.93 1vlw s ALA 67 Cb 0.04 -0.56 -0.05 0.00 0.00 0.00 0.00 23.12 22.55 1vlw s ALA 67 CO 0.10 0.54 0.10 0.20 0.00 0.00 0.00 175.76 176.70 1vlw s GLY 68 N -1.23 1.97 -1.45 0.00 0.00 0.29 -0.53 107.32 106.37 1vlw s GLY 68 Ca 0.12 -1.83 -0.03 0.00 0.00 0.00 0.00 44.72 42.98 1vlw s GLY 68 CO 0.03 -1.67 0.46 2.41 0.00 0.00 0.00 173.10 174.32 1vlw n THR 69 N -0.59 -2.70 -3.09 0.90 -1.04 -1.14 -0.36 114.28 106.26 1vlw n THR 69 Ca -0.01 -0.42 -0.41 0.00 -2.04 0.00 0.00 64.05 61.17 1vlw n THR 69 Cb 0.66 -2.47 -0.06 0.00 -1.82 0.00 0.00 70.33 66.64 1vlw n THR 69 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1vlw s VAL 70 N -3.88 4.94 -1.10 12.58 1.01 -0.72 -4.29 120.40 128.94 1vlw s VAL 70 Ca 0.11 0.99 0.09 0.00 0.00 0.00 0.00 61.98 63.17 1vlw s VAL 70 Cb -0.06 -3.99 0.07 0.00 0.00 0.00 0.00 36.38 32.39 1vlw s VAL 70 CO 0.90 -0.10 0.78 0.35 0.00 0.00 0.00 175.10 177.03 1vlw n THR 71 N 5.34 0.00 -3.69 3.92 -2.24 -1.26 -4.53 114.28 111.83 1vlw n THR 71 Ca -0.00 -0.50 -0.11 0.00 -2.27 0.00 0.00 64.05 61.17 1vlw n THR 71 Cb 0.49 1.18 -0.06 0.00 -2.10 0.00 0.00 70.33 69.84 1vlw n THR 71 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1vlw s SER 72 N -0.75 -0.20 0.34 3.42 1.04 -1.26 -5.04 113.70 111.25 1vlw s SER 72 Ca 0.10 -0.21 0.08 0.00 0.48 0.00 0.00 55.95 56.40 1vlw s SER 72 Cb 0.07 0.42 0.61 0.00 0.10 0.00 0.00 66.02 67.23 1vlw s SER 72 CO 0.11 -0.73 1.80 0.58 0.98 0.00 0.00 173.24 175.98 1vlw h VAL 73 N 2.78 1.25 -0.18 5.02 2.07 -1.96 -1.85 116.25 123.39 1vlw h VAL 73 Ca -0.33 -1.21 0.01 0.00 0.82 0.00 0.00 66.70 66.00 1vlw h VAL 73 Cb 1.22 1.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1vlw h VAL 73 CO 0.46 0.36 0.08 -0.08 0.02 0.00 0.00 177.57 178.41 1vlw h GLU 74 N 0.19 0.17 -0.72 1.57 4.81 -1.98 0.28 114.58 118.90 1vlw h GLU 74 Ca 0.03 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.20 1vlw h GLU 74 Cb 0.62 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1vlw h GLU 74 CO 0.05 0.11 0.25 1.96 -0.73 0.00 0.00 179.01 180.65 1vlw h GLN 75 N 0.18 1.10 -0.24 1.92 4.20 -1.83 -0.60 115.11 119.83 1vlw h GLN 75 Ca 0.07 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1vlw h GLN 75 Cb 0.03 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1vlw h GLN 75 CO -0.06 0.93 0.12 0.00 -0.67 0.00 0.00 178.83 179.15 1vlw h ARG 77 N 0.27 -0.21 -0.64 0.00 2.43 -0.17 -0.47 114.38 115.59 1vlw h ARG 77 Ca 0.08 0.01 0.08 0.00 -0.81 0.00 0.00 59.98 59.35 1vlw h ARG 77 Cb 0.10 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.64 1vlw h ARG 77 CO -0.01 -0.14 0.31 0.87 -1.51 0.00 0.00 179.97 179.49 1vlw h LYS 78 N -0.22 0.54 -0.66 0.20 1.57 -0.93 -1.70 116.57 115.38 1vlw h LYS 78 Ca 0.05 -0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1vlw h LYS 78 Cb 0.27 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 1vlw h LYS 78 CO -0.13 0.36 0.11 0.00 -0.57 0.00 0.00 179.45 179.22 1vlw h ALA 79 N 1.38 0.95 -0.22 3.86 0.00 -0.85 -0.94 119.26 123.44 1vlw h ALA 79 Ca 0.31 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1vlw h ALA 79 Cb 0.29 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1vlw h ALA 79 CO -0.24 0.66 -0.34 0.28 0.00 0.00 0.00 179.25 179.61 1vlw h VAL 80 N 1.01 1.32 -0.96 0.00 2.07 -0.75 -0.53 116.25 118.41 1vlw h VAL 80 Ca 0.20 -1.54 0.16 0.00 0.82 0.00 0.00 66.70 66.34 1vlw h VAL 80 Cb 0.43 1.78 -0.10 0.00 -1.52 0.00 0.00 31.29 31.89 1vlw h VAL 80 CO 0.01 0.48 0.57 -0.33 0.02 0.00 0.00 177.57 178.32 1vlw h GLU 81 N 0.31 0.77 -0.40 1.57 5.08 -1.15 -2.11 114.58 118.64 1vlw h GLU 81 Ca 0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1vlw h GLU 81 Cb 0.92 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1vlw h GLU 81 CO 0.08 0.51 0.19 0.77 -1.00 0.00 0.00 179.01 179.55 1vlw h SER 82 N 0.80 0.50 0.00 1.42 0.02 -0.84 -3.47 113.55 111.97 1vlw h SER 82 Ca 0.52 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.43 1vlw h SER 82 Cb 0.71 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.13 1vlw h SER 82 CO -0.34 0.43 0.00 0.61 -1.14 0.00 0.00 176.83 176.39 1vlw n GLY 83 N -1.26 1.80 3.73 -3.77 0.00 -0.79 -3.95 105.19 100.94 1vlw n GLY 83 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 1vlw n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vlw s ALA 84 N -2.00 3.79 -0.22 4.61 0.00 -0.24 -4.84 121.76 122.87 1vlw s ALA 84 Ca 0.00 1.45 0.22 0.00 0.00 0.00 0.00 51.96 53.63 1vlw s ALA 84 Cb 0.00 -3.64 -0.27 0.00 0.00 0.00 0.00 23.12 19.22 1vlw s ALA 84 CO 0.00 -0.84 0.62 0.39 0.00 0.00 0.00 175.76 175.93 1vlw n GLU 85 N 3.44 0.54 -4.15 0.00 1.02 0.45 -4.70 120.64 117.24 1vlw n GLU 85 Ca 0.12 -0.13 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1vlw n GLU 85 Cb 0.38 -1.55 -0.10 0.00 -0.02 0.00 0.00 31.44 30.15 1vlw n GLU 85 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1vlw s PHE 86 N -3.41 0.85 -0.03 -0.32 -0.71 -1.26 -4.36 117.98 108.74 1vlw s PHE 86 Ca -0.04 -1.19 0.04 0.00 -1.04 0.00 0.00 56.93 54.70 1vlw s PHE 86 Cb 0.14 -0.49 -0.00 0.00 -1.21 0.00 0.00 43.02 41.45 1vlw s PHE 86 CO 0.89 -0.46 -0.14 0.42 -1.34 0.00 0.00 175.22 174.58 1vlw s ILE 87 N -3.98 1.18 0.07 -4.49 -1.09 -0.13 -1.13 121.20 111.62 1vlw s ILE 87 Ca 0.22 -0.59 0.04 0.00 -2.23 0.00 0.00 60.65 58.09 1vlw s ILE 87 Cb 0.07 -1.01 -0.03 0.00 -1.58 0.00 0.00 42.46 39.91 1vlw s ILE 87 CO 0.00 0.34 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.25 1vlw s VAL 88 N 0.03 0.93 -0.02 2.92 1.01 0.31 -0.11 120.40 125.47 1vlw s VAL 88 Ca -0.02 -1.28 -0.12 0.00 0.00 0.00 0.00 61.98 60.56 1vlw s VAL 88 Cb -0.10 -0.97 0.02 0.00 0.00 0.00 0.00 36.38 35.33 1vlw s VAL 88 CO 0.01 -0.31 0.25 -0.94 0.00 0.00 0.00 175.10 174.11 1vlw s SER 89 N -1.78 -0.13 0.47 3.32 1.04 -1.10 -1.75 113.70 113.77 1vlw s SER 89 Ca -0.03 0.04 0.21 0.00 0.48 0.00 0.00 55.95 56.65 1vlw s SER 89 Cb -0.09 0.31 1.18 0.00 0.10 0.00 0.00 66.02 67.52 1vlw s SER 89 CO 0.01 -0.38 2.00 1.55 0.98 0.00 0.00 173.24 177.40 1vlw h PRO 90 N 4.21 0.00 0.00 4.02 0.13 -1.90 -1.52 132.00 136.94 1vlw h PRO 90 Ca -0.30 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.37 1vlw h PRO 90 Cb 1.18 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.21 1vlw h PRO 90 CO 0.39 0.18 -0.38 -2.39 -0.23 0.00 0.00 178.00 175.58 1vlw n HIS 91 N -3.89 0.27 -3.60 1.56 1.44 -1.26 -4.22 115.22 105.51 1vlw n HIS 91 Ca -0.02 -2.11 -0.40 0.00 -2.01 0.00 0.00 57.72 53.19 1vlw n HIS 91 Cb 0.28 -0.05 -0.11 0.00 0.12 0.00 0.00 29.99 30.22 1vlw n HIS 91 CO 0.00 0.00 0.00 -1.17 -2.81 0.00 0.00 176.34 172.36 1vlw s LEU 92 N 0.00 4.36 -0.26 2.39 2.96 -0.91 -1.93 118.68 125.28 1vlw s LEU 92 Ca 0.14 -0.56 -0.03 0.00 -0.22 0.00 0.00 54.13 53.46 1vlw s LEU 92 Cb 0.01 -2.06 0.02 0.00 0.50 0.00 0.00 46.19 44.66 1vlw s LEU 92 CO 0.10 -0.24 -0.02 -0.62 -1.32 0.00 0.00 176.35 174.24 1vlw s ASP 93 N 1.65 4.52 0.39 3.68 -1.08 -1.26 -5.00 116.67 119.57 1vlw s ASP 93 Ca 0.05 -0.78 0.18 0.00 -0.52 0.00 0.00 52.55 51.47 1vlw s ASP 93 Cb -0.17 -1.73 0.81 0.00 -1.46 0.00 0.00 42.92 40.37 1vlw s ASP 93 CO 0.08 -0.13 1.81 -0.33 0.52 0.00 0.00 175.17 177.12 1vlw h GLU 94 N 8.08 0.00 -0.13 4.34 5.08 -1.98 0.41 114.58 130.38 1vlw h GLU 94 Ca -0.33 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 57.85 1vlw h GLU 94 Cb 1.12 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.38 1vlw h GLU 94 CO 0.58 0.34 -0.61 0.93 -1.00 0.00 0.00 179.01 179.26 1vlw h GLU 95 N 0.00 0.64 -0.49 2.33 3.07 -1.99 -2.02 114.58 116.12 1vlw h GLU 95 Ca -0.00 -0.52 -0.12 0.00 -0.50 0.00 0.00 59.36 58.22 1vlw h GLU 95 Cb 0.74 0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.74 1vlw h GLU 95 CO 0.04 1.14 -0.15 0.82 -1.40 0.00 0.00 179.01 179.46 1vlw h ILE 96 N 0.29 1.27 -0.53 3.13 2.04 -1.89 -1.97 117.51 119.85 1vlw h ILE 96 Ca -0.04 -1.30 0.05 0.00 1.00 0.00 0.00 64.86 64.57 1vlw h ILE 96 Cb 1.25 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 38.36 1vlw h ILE 96 CO 0.13 0.45 0.26 -1.28 0.00 0.00 0.00 178.15 177.71 1vlw h SER 97 N 0.82 0.36 -0.22 1.72 0.87 -0.87 -1.74 113.55 114.49 1vlw h SER 97 Ca 0.12 0.03 -0.20 0.00 -1.23 0.00 0.00 61.79 60.51 1vlw h SER 97 Cb 0.71 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1vlw h SER 97 CO 0.05 0.25 -0.65 -0.61 -0.53 0.00 0.00 176.83 175.34 1vlw h GLN 98 N 0.50 0.83 -0.72 2.24 5.75 -1.28 -1.25 115.11 121.19 1vlw h GLN 98 Ca 0.24 -0.59 0.01 0.00 -0.15 0.00 0.00 58.65 58.15 1vlw h GLN 98 Cb 0.16 0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.77 1vlw h GLN 98 CO -0.18 1.21 0.48 0.35 -2.65 0.00 0.00 178.83 178.05 1vlw h PHE 99 N 0.61 0.91 -0.53 3.99 3.57 -1.26 0.53 116.94 124.77 1vlw h PHE 99 Ca -0.01 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.40 1vlw h PHE 99 Cb 1.26 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 1vlw h PHE 99 CO 0.08 0.57 -0.09 0.00 -2.23 0.00 0.00 178.31 176.64 1vlw h LYS 101 N 0.87 0.35 0.30 0.00 1.57 -0.96 0.17 116.57 118.87 1vlw h LYS 101 Ca 0.14 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1vlw h LYS 101 Cb 0.64 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1vlw h LYS 101 CO 0.04 0.23 -0.15 1.49 -0.57 0.00 0.00 179.45 180.50 1vlw h GLU 102 N 0.36 -0.39 0.00 3.15 4.57 -0.43 -3.09 114.58 118.74 1vlw h GLU 102 Ca 0.23 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 1vlw h GLU 102 Cb 0.23 0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1vlw h GLU 102 CO -0.23 -0.19 0.00 1.63 -1.18 0.00 0.00 179.01 179.04 1vlw n LYS 103 N -5.22 0.21 -2.76 1.92 4.76 0.09 -4.92 118.16 112.23 1vlw n LYS 103 Ca -0.10 0.37 -0.11 0.00 -2.87 0.00 0.00 58.31 55.60 1vlw n LYS 103 Cb 0.21 -1.85 0.02 0.00 -1.84 0.00 0.00 35.03 31.58 1vlw n LYS 103 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vlw n GLY 104 N 0.31 0.11 3.81 0.72 0.00 0.35 -5.06 105.19 105.44 1vlw n GLY 104 Ca 0.03 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.40 1vlw n GLY 104 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vlw s VAL 105 N -2.94 5.15 -0.16 1.61 1.01 0.24 -4.97 120.40 120.32 1vlw s VAL 105 Ca 0.19 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 1vlw s VAL 105 Cb -0.09 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.05 1vlw s VAL 105 CO 0.24 0.61 1.38 0.12 0.00 0.00 0.00 175.10 177.45 1vlw s PHE 106 N -0.93 2.59 -0.14 5.22 5.36 -1.26 -4.55 117.98 124.27 1vlw s PHE 106 Ca 0.14 0.79 0.01 0.00 -0.96 0.00 0.00 56.93 56.91 1vlw s PHE 106 Cb -0.12 -3.67 -0.00 0.00 -0.34 0.00 0.00 43.02 38.88 1vlw s PHE 106 CO 0.03 -2.24 -0.17 -0.47 -1.46 0.00 0.00 175.22 170.92 1vlw s TYR 107 N 3.86 2.74 -0.54 10.12 5.04 -1.26 -0.96 117.35 136.35 1vlw s TYR 107 Ca 0.60 -0.96 -0.04 0.00 -2.44 0.00 0.00 57.07 54.23 1vlw s TYR 107 Cb -0.24 -1.84 0.14 0.00 0.35 0.00 0.00 41.96 40.38 1vlw s TYR 107 CO 0.20 -0.40 0.36 1.41 -1.34 0.00 0.00 175.55 175.78 1vlw s MET 108 N 0.60 2.41 0.60 4.97 -2.45 0.85 -4.94 119.30 121.33 1vlw s MET 108 Ca -0.10 -2.19 -0.15 0.00 -1.25 0.00 0.00 55.69 52.00 1vlw s MET 108 Cb -0.16 -3.74 -0.04 0.00 1.25 0.00 0.00 34.83 32.15 1vlw s MET 108 CO 0.03 -1.15 1.04 -1.25 1.05 0.00 0.00 175.02 174.74 1vlw s PRO 109 N 0.53 3.41 -0.03 4.11 0.04 -1.26 -2.71 135.00 139.09 1vlw s PRO 109 Ca 0.13 1.06 -0.14 0.00 0.04 0.00 0.00 61.00 62.09 1vlw s PRO 109 Cb -0.21 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 1vlw s PRO 109 CO -0.04 -0.72 0.38 0.20 0.04 0.00 0.00 177.00 176.86 1vlw s GLY 110 N -3.16 2.43 0.06 0.56 0.00 -0.57 -0.17 107.32 106.46 1vlw s GLY 110 Ca 0.61 -0.27 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1vlw s GLY 110 CO 0.40 0.14 -0.04 -1.34 0.00 0.00 0.00 173.10 172.26 1vlw s VAL 111 N -0.91 0.35 0.00 1.40 -7.23 0.49 -2.15 120.40 112.35 1vlw s VAL 111 Ca 0.23 -1.62 0.00 0.00 -1.81 0.00 0.00 61.98 58.78 1vlw s VAL 111 Cb -0.16 -1.26 0.00 0.00 0.56 0.00 0.00 36.38 35.52 1vlw s VAL 111 CO 0.12 -0.82 0.00 0.80 -0.31 0.00 0.00 175.10 174.88 1vlw n MET 112 N 0.45 3.23 -4.27 4.82 1.56 -1.26 -2.61 117.12 119.05 1vlw n MET 112 Ca -0.16 0.00 -0.18 0.00 -0.27 0.00 0.00 57.70 57.09 1vlw n MET 112 Cb 0.59 -0.43 -0.11 0.00 2.15 0.00 0.00 33.22 35.42 1vlw n MET 112 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 1vlw s THR 113 N -0.65 1.43 0.47 1.12 -4.23 -1.26 -4.99 115.64 107.53 1vlw s THR 113 Ca 0.00 -1.87 0.12 0.00 -1.18 0.00 0.00 61.69 58.76 1vlw s THR 113 Cb 0.00 -1.69 0.27 0.00 1.34 0.00 0.00 72.50 72.42 1vlw s THR 113 CO 0.00 -0.48 2.10 -0.65 -0.54 0.00 0.00 174.62 175.05 1vlw h PRO 114 N 3.23 0.25 -0.45 3.99 0.11 -1.99 0.16 132.00 137.30 1vlw h PRO 114 Ca -0.39 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.63 1vlw h PRO 114 Cb 1.20 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1vlw h PRO 114 CO 0.54 0.17 0.01 1.15 -0.21 0.00 0.00 178.00 179.66 1vlw h THR 115 N 0.26 1.26 -0.70 -1.15 2.02 -1.99 -1.26 112.91 111.35 1vlw h THR 115 Ca 0.08 -1.02 -0.04 0.00 0.77 0.00 0.00 66.41 66.19 1vlw h THR 115 Cb 0.00 1.04 -0.03 0.00 -1.74 0.00 0.00 68.15 67.42 1vlw h THR 115 CO -0.02 0.35 0.27 -0.33 0.37 0.00 0.00 175.52 176.17 1vlw h GLU 116 N 0.63 1.03 -0.23 6.66 5.08 -1.89 -1.53 114.58 124.33 1vlw h GLU 116 Ca 0.13 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1vlw h GLU 116 Cb 0.48 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1vlw h GLU 116 CO 0.02 0.85 0.15 1.25 -1.00 0.00 0.00 179.01 180.28 1vlw h LEU 117 N 1.01 0.26 -0.37 1.33 6.46 -0.86 -2.22 115.31 120.92 1vlw h LEU 117 Ca 0.23 -0.01 -0.07 0.00 -0.12 0.00 0.00 57.88 57.91 1vlw h LEU 117 Cb 0.21 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.06 1vlw h LEU 117 CO -0.02 0.19 -0.06 0.58 -0.62 0.00 0.00 178.44 178.51 1vlw h VAL 118 N 0.31 1.27 -0.78 1.05 2.07 -1.04 0.64 116.25 119.76 1vlw h VAL 118 Ca 0.08 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.50 1vlw h VAL 118 Cb -0.04 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 1vlw h VAL 118 CO -0.02 0.37 0.49 0.50 0.02 0.00 0.00 177.57 178.93 1vlw h LYS 119 N 0.50 1.05 -0.44 1.57 3.64 -1.32 -1.95 116.57 119.62 1vlw h LYS 119 Ca 0.10 -0.08 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1vlw h LYS 119 Cb 0.55 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 1vlw h LYS 119 CO 0.03 0.72 0.20 0.00 -2.27 0.00 0.00 179.45 178.13 1vlw h ALA 120 N 1.47 0.57 -0.63 5.00 0.00 -0.89 -3.04 119.26 121.75 1vlw h ALA 120 Ca 0.28 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1vlw h ALA 120 Cb -0.07 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 1vlw h ALA 120 CO -0.06 0.16 0.39 0.52 0.00 0.00 0.00 179.25 180.26 1vlw h MET 121 N 0.57 0.75 -0.03 0.00 2.86 -0.58 -1.71 114.93 116.80 1vlw h MET 121 Ca 0.15 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.75 1vlw h MET 121 Cb 0.15 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 1vlw h MET 121 CO -0.02 0.49 0.05 0.87 1.06 0.00 0.00 176.91 179.37 1vlw h LYS 122 N 0.77 0.00 -0.68 1.72 1.57 -1.25 0.37 116.57 119.07 1vlw h LYS 122 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1vlw h LYS 122 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1vlw h LYS 122 CO -0.10 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.06 1vlw n LEU 123 N -3.52 3.88 0.00 2.94 4.77 -0.70 -4.92 117.00 119.45 1vlw n LEU 123 Ca -0.02 -1.97 0.00 0.00 -0.03 0.00 0.00 56.01 53.99 1vlw n LEU 123 Cb 0.13 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.65 1vlw n LEU 123 CO 0.24 0.53 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1vlw n GLY 124 N 0.58 0.53 3.65 -0.72 0.00 0.13 -5.03 105.19 104.33 1vlw n GLY 124 Ca 0.18 -0.38 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1vlw n GLY 124 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1vlw s HIS 125 N -2.00 3.30 0.00 1.61 3.76 -0.86 -4.89 115.29 116.21 1vlw s HIS 125 Ca 0.00 0.21 0.00 0.00 -0.15 0.00 0.00 55.06 55.12 1vlw s HIS 125 Cb 0.00 -2.30 0.00 0.00 1.11 0.00 0.00 32.58 31.39 1vlw s HIS 125 CO 0.00 0.01 0.00 0.25 -0.85 0.00 0.00 174.74 174.15 1vlw n THR 126 N 4.46 0.00 -3.71 1.30 -2.24 -1.26 -3.50 114.28 109.33 1vlw n THR 126 Ca -0.15 -0.20 -0.38 0.00 -2.27 0.00 0.00 64.05 61.05 1vlw n THR 126 Cb 0.52 0.70 -0.12 0.00 -2.10 0.00 0.00 70.33 69.33 1vlw n THR 126 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1vlw s ILE 127 N -1.59 4.38 -0.01 2.28 1.01 -1.26 -0.22 121.20 125.79 1vlw s ILE 127 Ca 0.00 -0.39 0.05 0.00 0.00 0.00 0.00 60.65 60.31 1vlw s ILE 127 Cb 0.00 -3.18 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 1vlw s ILE 127 CO 0.00 0.16 -0.15 -0.76 0.00 0.00 0.00 174.94 174.19 1vlw s LEU 128 N 1.59 2.02 -0.07 2.97 1.43 -0.22 -4.41 118.68 122.00 1vlw s LEU 128 Ca 0.05 -0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 52.57 1vlw s LEU 128 Cb -0.16 -0.79 -0.03 0.00 0.03 0.00 0.00 46.19 45.24 1vlw s LEU 128 CO 0.05 0.19 1.23 -0.75 0.23 0.00 0.00 176.35 177.29 1vlw s LYS 129 N -0.35 4.33 -0.37 1.70 2.47 0.76 -0.90 119.74 127.38 1vlw s LYS 129 Ca 0.06 1.70 -0.17 0.00 -1.56 0.00 0.00 55.97 55.99 1vlw s LYS 129 Cb -0.06 -3.59 -0.00 0.00 -1.46 0.00 0.00 37.83 32.72 1vlw s LYS 129 CO -0.01 -0.50 0.46 -1.17 0.16 0.00 0.00 175.35 174.29 1vlw s LEU 130 N 2.45 4.47 -0.11 5.43 2.96 -1.04 -0.38 118.68 132.45 1vlw s LEU 130 Ca 0.56 -0.22 -0.08 0.00 -0.22 0.00 0.00 54.13 54.17 1vlw s LEU 130 Cb -0.25 -2.48 0.04 0.00 0.50 0.00 0.00 46.19 44.00 1vlw s LEU 130 CO 0.21 -0.47 0.29 0.12 -1.32 0.00 0.00 176.35 175.17 1vlw s PHE 131 N 2.26 -0.35 -0.08 5.38 5.36 -1.07 -1.48 117.98 127.99 1vlw s PHE 131 Ca 0.16 0.83 -0.27 0.00 -0.96 0.00 0.00 56.93 56.68 1vlw s PHE 131 Cb -0.16 0.11 -0.02 0.00 -0.34 0.00 0.00 43.02 42.60 1vlw s PHE 131 CO 0.13 -0.20 0.89 -1.25 -1.46 0.00 0.00 175.22 173.34 1vlw s PRO 132 N 0.67 4.44 0.13 10.12 0.04 -1.26 -4.24 135.00 144.89 1vlw s PRO 132 Ca -0.04 1.20 0.17 0.00 0.04 0.00 0.00 61.00 62.37 1vlw s PRO 132 Cb -0.06 -3.51 0.73 0.00 0.04 0.00 0.00 34.50 31.71 1vlw s PRO 132 CO -0.04 -0.16 1.51 0.41 0.04 0.00 0.00 177.00 178.76 1vlw n GLY 133 N 3.13 -1.02 0.23 0.56 0.00 -0.12 -2.01 105.19 105.96 1vlw n GLY 133 Ca 0.05 0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.11 1vlw n GLY 133 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vlw h GLU 134 N 0.00 0.26 0.02 1.61 3.07 -1.78 -3.14 114.58 114.62 1vlw h GLU 134 Ca 0.00 -0.08 -0.38 0.00 -0.50 0.00 0.00 59.36 58.40 1vlw h GLU 134 Cb 0.23 -0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.06 1vlw h GLU 134 CO 0.00 0.46 -2.15 0.28 -1.40 0.00 0.00 179.01 176.20 1vlw n VAL 135 N -4.21 1.56 -3.64 3.13 0.31 -0.85 -4.67 118.33 109.96 1vlw n VAL 135 Ca -0.01 -0.38 -0.38 0.00 -0.01 0.00 0.00 64.34 63.56 1vlw n VAL 135 Cb 0.32 -1.80 -0.08 0.00 -0.91 0.00 0.00 33.84 31.38 1vlw n VAL 135 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1vlw s VAL 136 N -2.48 4.19 0.00 2.52 -7.23 -1.08 -5.02 120.40 111.29 1vlw s VAL 136 Ca -0.33 -3.17 0.00 0.00 -1.81 0.00 0.00 61.98 56.66 1vlw s VAL 136 Cb 0.10 -3.66 0.00 0.00 0.56 0.00 0.00 36.38 33.38 1vlw s VAL 136 CO 0.58 -0.96 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 1vlw n GLY 137 N 3.20 1.01 0.39 2.32 0.00 -1.19 -4.39 105.19 106.53 1vlw n GLY 137 Ca 0.13 -1.78 0.17 0.00 0.00 0.00 0.00 46.02 44.53 1vlw n GLY 137 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1vlw h PRO 138 N 0.00 0.48 -0.95 1.61 0.11 -1.91 0.18 132.00 131.51 1vlw h PRO 138 Ca 0.00 -0.03 0.12 0.00 0.11 0.00 0.00 66.00 66.20 1vlw h PRO 138 Cb 0.00 -0.11 -0.08 0.00 0.11 0.00 0.00 31.00 30.92 1vlw h PRO 138 CO 0.00 0.32 0.58 1.96 -0.21 0.00 0.00 178.00 180.64 1vlw h GLN 139 N 0.49 0.89 -0.37 1.05 1.08 -1.94 -0.76 115.11 115.54 1vlw h GLN 139 Ca 0.47 -0.05 -0.12 0.00 -1.45 0.00 0.00 58.65 57.49 1vlw h GLN 139 Cb 1.03 -0.20 -0.01 0.00 -0.05 0.00 0.00 27.48 28.25 1vlw h GLN 139 CO -0.20 0.59 -0.25 0.35 -0.95 0.00 0.00 178.83 178.37 1vlw h PHE 140 N 0.91 0.96 -0.18 2.96 3.04 -0.95 -1.51 116.94 122.18 1vlw h PHE 140 Ca 0.47 -0.26 -0.01 0.00 3.98 0.00 0.00 57.97 62.16 1vlw h PHE 140 Cb 0.48 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.77 1vlw h PHE 140 CO -0.02 1.03 0.09 0.28 -2.02 0.00 0.00 178.31 177.67 1vlw h VAL 141 N 0.62 1.12 -0.54 1.41 2.07 -1.20 -1.99 116.25 117.74 1vlw h VAL 141 Ca 0.07 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1vlw h VAL 141 Cb 0.82 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 1vlw h VAL 141 CO 0.07 0.11 0.34 0.50 0.02 0.00 0.00 177.57 178.61 1vlw h LYS 142 N 0.17 0.72 -0.62 1.57 3.64 -1.16 -2.29 116.57 118.60 1vlw h LYS 142 Ca 0.06 -0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.52 1vlw h LYS 142 Cb 0.10 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.73 1vlw h LYS 142 CO -0.01 0.50 0.43 0.00 -2.27 0.00 0.00 179.45 178.10 1vlw h ALA 143 N 1.18 2.21 0.00 5.00 0.00 -0.89 -2.82 119.26 123.95 1vlw h ALA 143 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1vlw h ALA 143 Cb -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vlw h ALA 143 CO -0.04 -0.38 -0.49 -1.33 0.00 0.00 0.00 179.25 177.01 1vlw n MET 144 N -4.44 0.05 -0.15 0.00 2.81 -0.78 -3.89 117.12 110.72 1vlw n MET 144 Ca 0.11 0.01 -0.11 0.00 -1.81 0.00 0.00 57.70 55.90 1vlw n MET 144 Cb 0.50 -1.53 -0.01 0.00 -0.71 0.00 0.00 33.22 31.47 1vlw n MET 144 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 1vlw h LYS 145 N 0.00 0.89 0.29 0.03 1.79 -1.45 -0.01 116.57 118.11 1vlw h LYS 145 Ca 0.00 -0.38 -0.01 0.00 -2.18 0.00 0.00 60.65 58.08 1vlw h LYS 145 Cb 0.54 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.16 1vlw h LYS 145 CO 0.00 1.03 -0.18 0.78 -1.08 0.00 0.00 179.45 180.00 1vlw h GLY 146 N 0.72 -0.67 2.00 3.86 0.00 -1.73 -2.70 103.07 104.55 1vlw h GLY 146 Ca 0.10 0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.62 1vlw h GLY 146 CO 0.06 -0.23 -0.41 -0.56 0.00 0.00 0.00 176.54 175.39 1vlw h PRO 147 N -0.43 0.00 -2.08 4.80 0.13 -1.75 -3.36 132.00 129.31 1vlw h PRO 147 Ca -0.04 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.52 1vlw h PRO 147 Cb 0.35 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.08 1vlw h PRO 147 CO 0.04 0.41 -0.93 1.19 -0.23 0.00 0.00 178.00 178.48 1vlw n PHE 148 N -4.01 1.20 0.27 1.56 3.72 -0.02 -4.97 117.46 115.21 1vlw n PHE 148 Ca -0.02 -3.80 0.12 0.00 -0.05 0.00 0.00 57.45 53.71 1vlw n PHE 148 Cb 0.44 -0.43 0.78 0.00 -0.94 0.00 0.00 39.48 39.33 1vlw n PHE 148 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1vlw h PRO 149 N 3.93 0.00 -0.02 -1.08 0.13 -1.63 -2.60 132.00 130.73 1vlw h PRO 149 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1vlw h PRO 149 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1vlw h PRO 149 CO 0.60 0.05 -0.16 0.09 -0.23 0.00 0.00 178.00 178.35 1vlw n ASN 150 N -3.96 1.79 -4.71 1.44 3.02 -1.26 -4.88 115.26 106.71 1vlw n ASN 150 Ca -0.03 -1.44 -0.41 0.00 -0.03 0.00 0.00 54.58 52.68 1vlw n ASN 150 Cb 0.14 0.13 -0.04 0.00 -0.61 0.00 0.00 39.78 39.40 1vlw n ASN 150 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1vlw s VAL 151 N -2.23 4.95 -0.11 2.41 1.01 -0.98 -4.82 120.40 120.63 1vlw s VAL 151 Ca 0.28 1.72 0.02 0.00 0.00 0.00 0.00 61.98 64.01 1vlw s VAL 151 Cb 0.20 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 1vlw s VAL 151 CO 0.43 0.18 -0.20 -0.54 0.00 0.00 0.00 175.10 174.96 1vlw s LYS 152 N 1.10 3.17 0.04 2.72 1.02 0.69 -4.93 119.74 123.55 1vlw s LYS 152 Ca 0.43 -0.81 0.02 0.00 0.02 0.00 0.00 55.97 55.64 1vlw s LYS 152 Cb -0.19 -2.42 -0.04 0.00 -0.52 0.00 0.00 37.83 34.66 1vlw s LYS 152 CO 0.21 0.19 0.04 -0.06 -0.92 0.00 0.00 175.35 174.81 1vlw s PHE 153 N 0.34 3.13 -0.37 3.18 0.08 -1.26 -1.05 117.98 122.03 1vlw s PHE 153 Ca -0.16 0.08 0.02 0.00 0.12 0.00 0.00 56.93 56.99 1vlw s PHE 153 Cb -0.17 -1.64 0.11 0.00 -0.57 0.00 0.00 43.02 40.75 1vlw s PHE 153 CO 0.08 0.50 0.13 0.08 -0.10 0.00 0.00 175.22 175.91 1vlw s VAL 154 N -1.25 1.67 0.67 -0.44 1.01 -0.08 -1.24 120.40 120.74 1vlw s VAL 154 Ca 0.25 -2.20 -0.15 0.00 0.00 0.00 0.00 61.98 59.87 1vlw s VAL 154 Cb -0.12 -2.22 0.01 0.00 0.00 0.00 0.00 36.38 34.05 1vlw s VAL 154 CO 0.16 -0.71 1.14 -2.16 0.00 0.00 0.00 175.10 173.53 1vlw s PRO 155 N 0.87 2.63 -0.07 2.72 0.04 -1.25 -2.51 135.00 137.43 1vlw s PRO 155 Ca 0.13 1.53 0.02 0.00 0.04 0.00 0.00 61.00 62.72 1vlw s PRO 155 Cb -0.21 -1.92 0.02 0.00 0.04 0.00 0.00 34.50 32.43 1vlw s PRO 155 CO -0.11 -1.41 -0.11 0.99 0.04 0.00 0.00 177.00 176.40 1vlw s THR 156 N -2.18 1.05 0.00 1.26 2.01 -0.55 -0.43 115.64 116.80 1vlw s THR 156 Ca 0.70 -0.42 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1vlw s THR 156 Cb -0.24 -0.97 0.00 0.00 0.01 0.00 0.00 72.50 71.30 1vlw s THR 156 CO 0.41 0.34 0.00 0.61 -0.69 0.00 0.00 174.62 175.29 1vlw n GLY 157 N 3.92 0.30 2.03 4.40 0.00 -1.26 -0.95 105.19 113.64 1vlw n GLY 157 Ca -0.23 -1.39 -0.01 0.00 0.00 0.00 0.00 46.02 44.40 1vlw n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vlw n GLY 158 N 1.20 0.45 3.14 -0.02 0.00 -1.26 -3.14 105.19 105.57 1vlw n GLY 158 Ca 0.00 -0.97 -0.33 0.00 0.00 0.00 0.00 46.02 44.71 1vlw n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vlw s VAL 159 N -2.03 2.26 0.28 1.61 1.01 -1.26 -4.84 120.40 117.43 1vlw s VAL 159 Ca 0.00 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 61.03 1vlw s VAL 159 Cb 0.00 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 1vlw s VAL 159 CO 0.00 0.44 0.24 0.54 0.00 0.00 0.00 175.10 176.32 1vlw s ASN 160 N 1.29 1.00 0.26 3.32 2.20 -1.26 -4.92 114.94 116.83 1vlw s ASN 160 Ca 0.03 -1.58 -0.03 0.00 -0.94 0.00 0.00 52.86 50.35 1vlw s ASN 160 Cb -0.14 0.50 0.54 0.00 -2.00 0.00 0.00 41.25 40.15 1vlw s ASN 160 CO -0.11 -1.00 1.67 -0.07 -2.94 0.00 0.00 177.10 174.66 1vlw h LEU 161 N 2.32 0.01 -1.15 3.54 3.38 -1.98 -1.03 115.31 120.40 1vlw h LEU 161 Ca -0.29 0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 1vlw h LEU 161 Cb 1.24 0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.19 1vlw h LEU 161 CO 0.43 -0.07 0.04 0.44 0.09 0.00 0.00 178.44 179.37 1vlw h ASP 162 N 0.26 0.59 -0.08 -0.43 3.32 -2.01 -3.31 116.42 114.76 1vlw h ASP 162 Ca 0.46 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1vlw h ASP 162 Cb 0.84 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1vlw h ASP 162 CO -0.56 0.64 0.00 -0.46 -1.72 0.00 0.00 179.24 177.14 1vlw n ASN 163 N -4.27 1.89 -0.21 6.45 0.23 -1.02 -4.74 115.26 113.59 1vlw n ASN 163 Ca 0.02 -1.56 0.06 0.00 -0.53 0.00 0.00 54.58 52.57 1vlw n ASN 163 Cb 0.24 -0.05 0.33 0.00 -2.08 0.00 0.00 39.78 38.22 1vlw n ASN 163 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1vlw h VAL 164 N 1.05 1.04 0.00 3.53 3.04 -1.29 -1.95 116.25 121.67 1vlw h VAL 164 Ca 0.00 -0.28 -0.10 0.00 -1.01 0.00 0.00 66.70 65.31 1vlw h VAL 164 Cb 0.40 0.14 -0.01 0.00 -2.01 0.00 0.00 31.29 29.81 1vlw h VAL 164 CO 0.00 0.15 -0.47 0.00 -1.01 0.00 0.00 177.57 176.24 1vlw h GLU 166 N 0.00 0.79 -0.23 0.00 4.81 -1.68 -0.79 114.58 117.48 1vlw h GLU 166 Ca -0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 1vlw h GLU 166 Cb 1.05 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.24 1vlw h GLU 166 CO 0.06 0.52 0.01 -1.49 -0.73 0.00 0.00 179.01 177.39 1vlw h TRP 167 N 0.81 0.42 -0.63 0.92 4.06 -1.04 -0.97 115.95 119.54 1vlw h TRP 167 Ca 0.25 -0.07 -0.06 0.00 2.06 0.00 0.00 58.89 61.06 1vlw h TRP 167 Cb -0.03 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 27.99 1vlw h TRP 167 CO -0.04 0.55 0.14 0.74 -3.56 0.00 0.00 178.44 176.27 1vlw h PHE 168 N 0.17 1.07 -1.01 0.49 0.04 -1.47 -2.75 116.94 113.49 1vlw h PHE 168 Ca 0.07 -0.13 0.10 0.00 2.80 0.00 0.00 57.97 60.80 1vlw h PHE 168 Cb 0.37 -0.30 -0.08 0.00 2.20 0.00 0.00 35.95 38.15 1vlw h PHE 168 CO 0.03 0.90 0.64 -0.22 -0.60 0.00 0.00 178.31 179.06 1vlw h LYS 169 N 0.93 1.04 -0.11 1.51 3.64 -0.90 -1.20 116.57 121.47 1vlw h LYS 169 Ca 0.19 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1vlw h LYS 169 Cb 0.38 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1vlw h LYS 169 CO 0.00 0.69 0.06 0.00 -2.27 0.00 0.00 179.45 177.93 1vlw h ALA 170 N 1.51 1.90 0.00 5.00 0.00 -0.90 -3.47 119.26 123.29 1vlw h ALA 170 Ca 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1vlw h ALA 170 Cb 0.37 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1vlw h ALA 170 CO -0.23 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.52 1vlw n GLY 171 N -1.48 1.80 3.75 0.00 0.00 -0.45 -3.91 105.19 104.90 1vlw n GLY 171 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1vlw n GLY 171 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vlw s VAL 172 N -2.00 2.44 -0.03 1.61 -7.23 -1.08 -4.60 120.40 109.51 1vlw s VAL 172 Ca 0.00 0.31 -0.24 0.00 -1.81 0.00 0.00 61.98 60.25 1vlw s VAL 172 Cb 0.00 -3.15 -0.22 0.00 0.56 0.00 0.00 36.38 33.57 1vlw s VAL 172 CO 0.00 -0.02 1.09 0.25 -0.31 0.00 0.00 175.10 176.11 1vlw h LEU 173 N 1.40 0.26 -8.39 1.32 5.85 -1.51 -3.45 115.31 110.79 1vlw h LEU 173 Ca -0.50 -0.72 -0.20 0.00 0.84 0.00 0.00 57.88 57.29 1vlw h LEU 173 Cb 1.29 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 42.18 1vlw h LEU 173 CO 0.57 0.94 -0.08 0.00 -0.34 0.00 0.00 178.44 179.54 1vlw s ALA 174 N -3.34 0.36 0.02 1.25 0.00 -1.21 -4.32 121.76 114.52 1vlw s ALA 174 Ca -0.15 -1.30 0.04 0.00 0.00 0.00 0.00 51.96 50.54 1vlw s ALA 174 Cb 0.02 1.04 -0.02 0.00 0.00 0.00 0.00 23.12 24.16 1vlw s ALA 174 CO 0.75 -0.84 -0.12 0.14 0.00 0.00 0.00 175.76 175.68 1vlw s VAL 175 N -2.95 0.98 -0.19 0.00 -7.23 0.66 -3.79 120.40 107.88 1vlw s VAL 175 Ca 0.27 -0.80 -0.06 0.00 -1.81 0.00 0.00 61.98 59.57 1vlw s VAL 175 Cb -0.02 -0.87 -0.03 0.00 0.56 0.00 0.00 36.38 36.02 1vlw s VAL 175 CO 0.18 0.07 0.04 -0.83 -0.31 0.00 0.00 175.10 174.25 1vlw s GLY 176 N -0.82 1.83 -0.08 2.32 0.00 0.42 0.11 107.32 111.09 1vlw s GLY 176 Ca 0.02 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 43.89 1vlw s GLY 176 CO 0.01 0.15 -0.11 0.14 0.00 0.00 0.00 173.10 173.29 1vlw s VAL 177 N 0.69 1.11 0.00 1.40 1.01 -0.51 -4.10 120.40 120.00 1vlw s VAL 177 Ca 0.02 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.58 1vlw s VAL 177 Cb -0.14 -1.05 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1vlw s VAL 177 CO 0.02 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.09 1vlw n GLY 178 N 4.16 0.46 0.31 4.51 0.00 -1.26 -1.26 105.19 112.10 1vlw n GLY 178 Ca -0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.79 1vlw n GLY 178 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vlw h SER 179 N 0.00 0.82 0.00 1.61 4.64 -1.97 0.24 113.55 118.89 1vlw h SER 179 Ca 0.00 -0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1vlw h SER 179 Cb 0.00 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 1vlw h SER 179 CO 0.00 0.79 0.47 0.00 -0.87 0.00 0.00 176.83 177.23 1vlw h ALA 180 N 1.32 1.42 0.00 5.18 0.00 -1.93 -2.81 119.26 122.44 1vlw h ALA 180 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 1vlw h ALA 180 Cb 0.29 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1vlw h ALA 180 CO -0.00 -0.42 -1.47 -0.11 0.00 0.00 0.00 179.25 177.24 1vlw n LEU 181 N -2.47 1.22 0.04 0.00 7.94 0.66 -4.91 117.00 119.48 1vlw n LEU 181 Ca -0.01 0.20 0.06 0.00 -1.11 0.00 0.00 56.01 55.15 1vlw n LEU 181 Cb 0.50 -0.48 -0.08 0.00 0.53 0.00 0.00 43.42 43.89 1vlw n LEU 181 CO 0.08 0.08 -0.35 1.33 -1.11 0.00 0.00 177.39 177.42 1vlw n VAL 182 N -3.78 0.70 -2.14 1.96 0.24 -0.12 -4.61 118.33 110.57 1vlw n VAL 182 Ca -0.24 -0.60 -0.41 0.00 -2.04 0.00 0.00 64.34 61.05 1vlw n VAL 182 Cb 0.59 -0.39 -0.03 0.00 -1.47 0.00 0.00 33.84 32.55 1vlw n VAL 182 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1vlw s LYS 183 N -3.21 4.36 0.00 7.34 2.36 -1.07 -4.88 119.74 124.64 1vlw s LYS 183 Ca -0.04 2.15 0.00 0.00 -2.55 0.00 0.00 55.97 55.54 1vlw s LYS 183 Cb 0.10 -3.14 0.00 0.00 -1.05 0.00 0.00 37.83 33.74 1vlw s LYS 183 CO 0.83 -0.27 0.00 0.41 1.55 0.00 0.00 175.35 177.87 1vlw n GLY 184 N 1.91 0.33 3.83 5.54 0.00 -1.26 -4.64 105.19 110.90 1vlw n GLY 184 Ca 0.05 -2.31 -0.32 0.00 0.00 0.00 0.00 46.02 43.44 1vlw n GLY 184 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vlw s THR 185 N -0.23 4.24 0.35 2.61 -4.23 -1.26 -4.78 115.64 112.34 1vlw s THR 185 Ca 0.00 0.95 0.16 0.00 -1.18 0.00 0.00 61.69 61.62 1vlw s THR 185 Cb 0.00 -3.58 0.35 0.00 1.34 0.00 0.00 72.50 70.61 1vlw s THR 185 CO 0.00 -0.73 1.68 -0.65 -0.54 0.00 0.00 174.62 174.38 1vlw h PRO 186 N 0.28 0.34 0.20 3.99 0.11 -1.95 0.25 132.00 135.21 1vlw h PRO 186 Ca -0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1vlw h PRO 186 Cb 1.20 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1vlw h PRO 186 CO 0.59 0.23 -0.09 -0.44 -0.21 0.00 0.00 178.00 178.08 1vlw h ASP 187 N 0.36 -0.22 -0.76 -2.05 3.32 -1.96 -1.98 116.42 113.12 1vlw h ASP 187 Ca 0.71 -0.17 0.09 0.00 0.02 0.00 0.00 57.03 57.68 1vlw h ASP 187 Cb 1.67 0.06 -0.07 0.00 0.22 0.00 0.00 39.33 41.21 1vlw h ASP 187 CO -0.52 0.05 0.41 -0.33 -1.72 0.00 0.00 179.24 177.13 1vlw h GLU 188 N -0.50 0.68 -0.41 3.56 5.08 -1.58 -2.38 114.58 119.03 1vlw h GLU 188 Ca -0.03 -0.04 -0.14 0.00 -1.00 0.00 0.00 59.36 58.16 1vlw h GLU 188 Cb 0.38 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1vlw h GLU 188 CO 0.04 0.45 -0.28 0.28 -1.00 0.00 0.00 179.01 178.51 1vlw h VAL 189 N 0.70 1.27 -0.56 3.13 2.07 -0.94 -1.73 116.25 120.20 1vlw h VAL 189 Ca 0.37 -1.44 -0.09 0.00 0.82 0.00 0.00 66.70 66.36 1vlw h VAL 189 Cb 0.34 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.34 1vlw h VAL 189 CO -0.25 0.48 -0.01 -0.09 0.02 0.00 0.00 177.57 177.73 1vlw h ARG 190 N 0.76 0.98 -0.17 1.57 2.43 -1.15 0.11 114.38 118.91 1vlw h ARG 190 Ca 0.09 -0.30 -0.18 0.00 -0.81 0.00 0.00 59.98 58.78 1vlw h ARG 190 Cb 0.84 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1vlw h ARG 190 CO 0.07 0.97 -0.64 0.93 -1.51 0.00 0.00 179.97 179.80 1vlw h GLU 191 N 0.90 0.60 -0.85 0.20 4.39 -1.37 -1.73 114.58 116.71 1vlw h GLU 191 Ca 0.16 -0.42 -0.02 0.00 0.34 0.00 0.00 59.36 59.42 1vlw h GLU 191 Cb 0.54 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.21 1vlw h GLU 191 CO 0.03 1.04 0.45 0.87 -1.16 0.00 0.00 179.01 180.24 1vlw h LYS 192 N 0.44 1.20 -0.12 2.33 1.57 -1.10 0.76 116.57 121.64 1vlw h LYS 192 Ca -0.01 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1vlw h LYS 192 Cb 1.21 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 1vlw h LYS 192 CO 0.12 0.89 0.05 0.00 -0.57 0.00 0.00 179.45 179.94 1vlw h ALA 193 N 1.24 0.16 -0.08 3.86 0.00 -0.83 -1.74 119.26 121.87 1vlw h ALA 193 Ca 0.30 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1vlw h ALA 193 Cb 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1vlw h ALA 193 CO -0.04 -0.25 0.05 -0.22 0.00 0.00 0.00 179.25 178.79 1vlw h LYS 194 N 0.05 0.11 -0.81 0.00 3.64 -1.00 -0.88 116.57 117.68 1vlw h LYS 194 Ca 0.04 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.51 1vlw h LYS 194 Cb 0.17 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 31.89 1vlw h LYS 194 CO -0.00 0.10 0.45 0.00 -2.27 0.00 0.00 179.45 177.73 1vlw h ALA 195 N 1.00 1.16 -0.07 5.00 0.00 -0.84 0.59 119.26 126.10 1vlw h ALA 195 Ca 0.03 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1vlw h ALA 195 Cb 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1vlw h ALA 195 CO -0.01 0.06 -0.00 0.74 0.00 0.00 0.00 179.25 180.04 1vlw h PHE 196 N 0.75 0.14 -0.93 0.00 0.04 -0.78 -0.32 116.94 115.84 1vlw h PHE 196 Ca 0.40 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 61.14 1vlw h PHE 196 Cb 0.40 -0.04 -0.04 0.00 2.20 0.00 0.00 35.95 38.47 1vlw h PHE 196 CO -0.07 0.40 0.55 0.28 -0.60 0.00 0.00 178.31 178.87 1vlw h VAL 197 N -0.16 1.26 -0.03 -0.55 2.07 -0.96 -1.10 116.25 116.77 1vlw h VAL 197 Ca 0.02 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 66.95 1vlw h VAL 197 Cb 0.34 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.06 1vlw h VAL 197 CO 0.00 0.28 0.00 -0.33 0.02 0.00 0.00 177.57 177.54 1vlw h GLU 198 N 1.29 0.05 -0.21 1.57 5.08 -0.86 -1.75 114.58 119.76 1vlw h GLU 198 Ca 0.33 -0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.72 1vlw h GLU 198 Cb -0.04 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 1vlw h GLU 198 CO -0.06 0.31 -0.06 -0.22 -1.00 0.00 0.00 179.01 177.99 1vlw h LYS 199 N -0.22 -0.01 -0.83 2.33 1.63 -0.74 -1.03 116.57 117.70 1vlw h LYS 199 Ca 0.01 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.80 1vlw h LYS 199 Cb 0.29 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.88 1vlw h LYS 199 CO 0.00 -0.01 0.47 0.82 -3.45 0.00 0.00 179.45 177.28 1vlw h ILE 200 N -0.01 1.24 -0.75 2.00 2.04 -1.22 -2.22 117.51 118.60 1vlw h ILE 200 Ca 0.10 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.35 1vlw h ILE 200 Cb 0.17 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.33 1vlw h ILE 200 CO -0.22 0.27 0.39 -0.09 0.00 0.00 0.00 178.15 178.50 1vlw h ARG 201 N 1.16 1.05 0.00 2.37 2.43 -0.91 -1.89 114.38 118.59 1vlw h ARG 201 Ca 0.29 -0.13 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 1vlw h ARG 201 Cb 0.02 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.36 1vlw h ARG 201 CO -0.05 0.79 0.00 0.41 -1.51 0.00 0.00 179.97 179.61 1vlw n GLY 202 N -1.06 -0.63 2.74 2.80 0.00 -0.42 -3.49 105.19 105.13 1vlw n GLY 202 Ca 0.07 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1vlw n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32