#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pzw s HIS 8 N 0.00 0.61 0.14 -1.77 -3.43 -1.26 -5.11 115.29 104.46 2pzw s HIS 8 Ca 0.00 -0.34 -0.20 0.00 -0.80 0.00 0.00 55.06 53.72 2pzw s HIS 8 Cb 0.00 -0.37 -0.07 0.00 -1.43 0.00 0.00 32.58 30.71 2pzw s HIS 8 CO 0.00 -0.05 0.64 0.15 -2.00 0.00 0.00 174.74 173.48 2pzw s LYS 9 N -1.03 4.24 0.03 -0.38 1.02 -1.26 -4.41 119.74 117.96 2pzw s LYS 9 Ca -0.05 0.81 0.06 0.00 0.02 0.00 0.00 55.97 56.81 2pzw s LYS 9 Cb -0.07 -3.10 -0.02 0.00 -0.52 0.00 0.00 37.83 34.11 2pzw s LYS 9 CO 0.00 0.54 -0.18 -1.21 -0.92 0.00 0.00 175.35 173.58 2pzw s GLU 10 N -1.47 1.26 0.55 1.68 2.02 -0.18 -4.94 118.70 117.63 2pzw s GLU 10 Ca 0.35 -0.83 -0.19 0.00 0.02 0.00 0.00 54.97 54.32 2pzw s GLU 10 Cb -0.19 -1.32 -0.05 0.00 0.10 0.00 0.00 34.13 32.67 2pzw s GLU 10 CO 0.21 0.34 1.12 -1.25 0.02 0.00 0.00 175.26 175.70 2pzw s PRO 11 N -1.03 3.32 0.17 0.39 0.04 -1.26 -0.72 135.00 135.91 2pzw s PRO 11 Ca 0.06 1.56 -0.11 0.00 0.04 0.00 0.00 61.00 62.55 2pzw s PRO 11 Cb -0.08 -2.01 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2pzw s PRO 11 CO 0.01 -0.86 0.35 0.00 0.04 0.00 0.00 177.00 176.54 2pzw s ALA 12 N -1.86 -0.28 -0.06 8.56 0.00 -0.69 -4.57 121.76 122.86 2pzw s ALA 12 Ca 0.72 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 52.02 2pzw s ALA 12 Cb -0.23 0.84 0.01 0.00 0.00 0.00 0.00 23.12 23.75 2pzw s ALA 12 CO 0.28 -0.69 -0.11 0.99 0.00 0.00 0.00 175.76 176.23 2pzw s THR 13 N -3.94 1.05 0.20 0.00 2.01 -0.74 -4.13 115.64 110.10 2pzw s THR 13 Ca 0.14 -0.43 -0.31 0.00 0.31 0.00 0.00 61.69 61.40 2pzw s THR 13 Cb 0.02 -0.97 -0.10 0.00 0.01 0.00 0.00 72.50 71.46 2pzw s THR 13 CO -0.01 0.34 1.52 -0.22 -0.69 0.00 0.00 174.62 175.55 2pzw s LEU 14 N 0.70 4.37 -0.18 4.42 1.98 -1.26 0.06 118.68 128.77 2pzw s LEU 14 Ca -0.14 2.65 -0.10 0.00 -2.89 0.00 0.00 54.13 53.64 2pzw s LEU 14 Cb -0.16 -3.61 -0.08 0.00 0.66 0.00 0.00 46.19 43.01 2pzw s LEU 14 CO 0.03 -0.78 -0.25 -0.38 -1.89 0.00 0.00 176.35 173.08 2pzw n ILE 15 N 3.28 1.14 -3.64 6.68 5.41 -0.08 -4.83 119.36 127.32 2pzw n ILE 15 Ca 0.11 -0.18 -0.08 0.00 1.00 0.00 0.00 62.75 63.60 2pzw n ILE 15 Cb 0.39 -1.83 -0.07 0.00 -0.71 0.00 0.00 39.64 37.42 2pzw n ILE 15 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2pzw s LYS 16 N -2.41 0.49 -0.04 0.38 2.20 -0.71 -5.01 119.74 114.64 2pzw s LYS 16 Ca -0.26 0.64 -0.26 0.00 -0.36 0.00 0.00 55.97 55.73 2pzw s LYS 16 Cb 0.09 0.20 -0.03 0.00 -1.51 0.00 0.00 37.83 36.58 2pzw s LYS 16 CO 0.34 -0.07 0.81 0.00 -0.36 0.00 0.00 175.35 176.06 2pzw s ALA 17 N 0.54 3.27 -0.20 3.13 0.00 -1.26 0.65 121.76 127.89 2pzw s ALA 17 Ca -0.00 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.25 2pzw s ALA 17 Cb -0.05 -3.10 -0.13 0.00 0.00 0.00 0.00 23.12 19.85 2pzw s ALA 17 CO -0.09 -0.15 -0.18 -0.89 0.00 0.00 0.00 175.76 174.45 2pzw n ILE 18 N 3.82 1.15 -3.79 0.00 5.41 -0.53 -4.92 119.36 120.50 2pzw n ILE 18 Ca 0.01 -0.43 -0.09 0.00 1.00 0.00 0.00 62.75 63.24 2pzw n ILE 18 Cb 0.51 -1.24 -0.00 0.00 -0.71 0.00 0.00 39.64 38.20 2pzw n ILE 18 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2pzw n ASP 19 N -3.14 -1.29 0.10 4.38 4.64 -0.57 -4.97 116.55 115.70 2pzw n ASP 19 Ca -0.36 -2.31 0.01 0.00 -1.38 0.00 0.00 54.79 50.76 2pzw n ASP 19 Cb 0.87 2.27 0.35 0.00 -1.04 0.00 0.00 41.12 43.58 2pzw n ASP 19 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 2pzw h GLY 20 N 1.46 0.31 -1.31 0.27 0.00 -1.82 -3.19 103.07 98.78 2pzw h GLY 20 Ca -0.22 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2pzw h GLY 20 CO 0.29 0.18 0.00 2.09 0.00 0.00 0.00 176.54 179.10 2pzw n ASP 21 N -4.25 2.44 -3.85 0.19 3.85 -1.26 -4.76 116.55 108.91 2pzw n ASP 21 Ca -0.00 -1.70 -0.15 0.00 -0.71 0.00 0.00 54.79 52.22 2pzw n ASP 21 Cb 0.29 -0.05 -0.15 0.00 -1.35 0.00 0.00 41.12 39.85 2pzw n ASP 21 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2pzw s THR 22 N -1.22 0.16 0.02 2.12 2.01 -1.21 -1.12 115.64 116.40 2pzw s THR 22 Ca 0.20 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.23 2pzw s THR 22 Cb 0.13 -0.21 -0.02 0.00 0.01 0.00 0.00 72.50 72.42 2pzw s THR 22 CO 0.19 0.10 -0.04 0.68 -0.69 0.00 0.00 174.62 174.87 2pzw s VAL 23 N 0.57 0.19 -0.24 3.82 -7.23 -0.62 -1.45 120.40 115.44 2pzw s VAL 23 Ca -0.05 -0.86 -0.12 0.00 -1.81 0.00 0.00 61.98 59.13 2pzw s VAL 23 Cb -0.08 -0.31 -0.05 0.00 0.56 0.00 0.00 36.38 36.51 2pzw s VAL 23 CO -0.01 -0.43 0.25 -0.75 -0.31 0.00 0.00 175.10 173.84 2pzw s LYS 24 N -1.34 4.08 0.11 4.82 2.36 0.21 -0.04 119.74 129.94 2pzw s LYS 24 Ca -0.13 -0.12 0.05 0.00 -2.55 0.00 0.00 55.97 53.21 2pzw s LYS 24 Cb -0.09 -3.56 -0.04 0.00 -1.05 0.00 0.00 37.83 33.09 2pzw s LYS 24 CO -0.01 -0.02 -0.12 -0.51 1.55 0.00 0.00 175.35 176.24 2pzw s LEU 25 N 1.29 2.40 -0.42 5.43 1.02 0.75 -0.90 118.68 128.26 2pzw s LEU 25 Ca 0.11 -0.81 -0.17 0.00 0.02 0.00 0.00 54.13 53.28 2pzw s LEU 25 Cb -0.14 -0.42 0.02 0.00 0.02 0.00 0.00 46.19 45.67 2pzw s LEU 25 CO 0.07 -0.21 0.43 -0.32 0.02 0.00 0.00 176.35 176.34 2pzw s MET 26 N -2.72 3.08 -0.17 1.70 -2.45 0.11 0.17 119.30 119.01 2pzw s MET 26 Ca 0.07 -0.78 0.01 0.00 -1.25 0.00 0.00 55.69 53.73 2pzw s MET 26 Cb -0.04 -3.97 0.01 0.00 1.25 0.00 0.00 34.83 32.08 2pzw s MET 26 CO 0.01 -0.85 -0.18 -0.47 1.05 0.00 0.00 175.02 174.58 2pzw s TYR 27 N 2.11 2.77 -1.47 4.11 5.04 -0.28 -1.79 117.35 127.85 2pzw s TYR 27 Ca 0.12 -1.46 -0.04 0.00 -2.44 0.00 0.00 57.07 53.25 2pzw s TYR 27 Cb -0.17 -1.91 0.03 0.00 0.35 0.00 0.00 41.96 40.26 2pzw s TYR 27 CO 0.13 -0.71 0.49 1.63 -1.34 0.00 0.00 175.55 175.76 2pzw n LYS 28 N 4.46 -3.30 0.00 4.97 5.02 -1.26 -2.11 118.16 125.93 2pzw n LYS 28 Ca -0.20 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 2pzw n LYS 28 Cb 0.51 -4.64 0.00 0.00 -0.02 0.00 0.00 35.03 30.87 2pzw n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2pzw n GLY 29 N -1.89 1.55 3.02 0.72 0.00 -1.26 -5.05 105.19 102.29 2pzw n GLY 29 Ca -0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.67 2pzw n GLY 29 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2pzw s GLN 30 N -0.58 0.44 0.46 1.61 -2.07 -0.90 -5.10 119.66 113.53 2pzw s GLN 30 Ca 0.00 -0.64 -0.25 0.00 -1.82 0.00 0.00 55.36 52.66 2pzw s GLN 30 Cb 0.00 -0.19 -0.08 0.00 -1.09 0.00 0.00 33.01 31.65 2pzw s GLN 30 CO 0.00 0.03 1.39 -1.25 -1.32 0.00 0.00 175.29 174.14 2pzw s PRO 31 N -1.35 3.62 -0.26 9.60 0.04 -1.26 -1.13 135.00 144.27 2pzw s PRO 31 Ca -0.10 2.34 -0.25 0.00 0.04 0.00 0.00 61.00 63.03 2pzw s PRO 31 Cb -0.09 -2.59 0.07 0.00 0.04 0.00 0.00 34.50 31.93 2pzw s PRO 31 CO -0.00 -0.84 0.71 1.41 0.04 0.00 0.00 177.00 178.32 2pzw s MET 32 N -2.51 0.83 -0.14 4.56 1.75 0.13 -4.87 119.30 119.05 2pzw s MET 32 Ca 0.62 0.97 -0.17 0.00 -1.25 0.00 0.00 55.69 55.86 2pzw s MET 32 Cb -0.42 0.41 -0.04 0.00 2.84 0.00 0.00 34.83 37.62 2pzw s MET 32 CO 0.53 -0.10 0.45 0.99 -0.65 0.00 0.00 175.02 176.24 2pzw s THR 33 N 0.34 5.19 -0.06 10.11 2.01 -1.26 -0.17 115.64 131.80 2pzw s THR 33 Ca -0.00 0.88 0.03 0.00 0.31 0.00 0.00 61.69 62.90 2pzw s THR 33 Cb -0.05 -3.79 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 2pzw s THR 33 CO 0.01 0.31 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.77 2pzw s PHE 34 N 0.80 2.77 -0.22 4.92 0.40 0.95 -0.50 117.98 127.09 2pzw s PHE 34 Ca 0.24 -0.15 -0.05 0.00 -0.60 0.00 0.00 56.93 56.37 2pzw s PHE 34 Cb -0.15 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 2pzw s PHE 34 CO 0.09 0.19 0.01 0.50 0.70 0.00 0.00 175.22 176.71 2pzw s ARG 35 N -0.67 3.57 0.09 0.44 6.06 0.80 -1.59 118.95 127.64 2pzw s ARG 35 Ca 0.10 -0.53 -0.31 0.00 -2.50 0.00 0.00 55.73 52.49 2pzw s ARG 35 Cb -0.11 -3.13 -0.09 0.00 0.06 0.00 0.00 34.95 31.68 2pzw s ARG 35 CO 0.01 -0.10 1.74 -0.51 -2.50 0.00 0.00 175.30 173.94 2pzw s LEU 36 N 1.29 4.38 0.54 -0.88 1.02 -0.27 -2.91 118.68 121.84 2pzw s LEU 36 Ca 0.04 2.60 -0.21 0.00 0.02 0.00 0.00 54.13 56.58 2pzw s LEU 36 Cb -0.15 -3.56 -0.05 0.00 0.02 0.00 0.00 46.19 42.45 2pzw s LEU 36 CO 0.01 -0.94 1.25 -0.76 0.02 0.00 0.00 176.35 175.93 2pzw s LEU 37 N 2.79 3.83 -1.40 1.79 1.43 -0.24 -3.88 118.68 123.01 2pzw s LEU 37 Ca 0.77 2.50 0.00 0.00 -1.03 0.00 0.00 54.13 56.38 2pzw s LEU 37 Cb -0.42 -4.38 0.00 0.00 0.03 0.00 0.00 46.19 41.42 2pzw s LEU 37 CO 0.34 -1.40 0.00 0.18 0.23 0.00 0.00 176.35 175.71 2pzw n LEU 38 N -1.08 -0.81 -4.09 1.79 4.77 -1.26 -4.93 117.00 111.39 2pzw n LEU 38 Ca 0.11 0.33 -0.20 0.00 -0.03 0.00 0.00 56.01 56.21 2pzw n LEU 38 Cb 0.47 -2.30 -0.14 0.00 -2.33 0.00 0.00 43.42 39.12 2pzw n LEU 38 CO 0.48 -0.84 -0.45 0.68 -1.33 0.00 0.00 177.39 175.92 2pzw s VAL 39 N -2.08 0.97 -0.24 4.08 -7.23 -1.25 -1.05 120.40 113.60 2pzw s VAL 39 Ca 0.00 -0.71 0.02 0.00 -1.81 0.00 0.00 61.98 59.48 2pzw s VAL 39 Cb 0.00 -0.84 0.06 0.00 0.56 0.00 0.00 36.38 36.15 2pzw s VAL 39 CO 0.00 0.13 -0.10 -1.81 -0.31 0.00 0.00 175.10 173.01 2pzw s ASP 40 N -0.66 4.03 0.22 4.85 1.01 0.06 -4.74 116.67 121.45 2pzw s ASP 40 Ca 0.03 -1.21 0.06 0.00 0.71 0.00 0.00 52.55 52.13 2pzw s ASP 40 Cb -0.06 -1.38 -0.03 0.00 1.01 0.00 0.00 42.92 42.45 2pzw s ASP 40 CO 0.00 -0.19 0.23 0.42 0.21 0.00 0.00 175.17 175.85 2pzw s THR 41 N 1.25 4.74 0.44 -1.27 -4.23 -1.26 -1.45 115.64 113.86 2pzw s THR 41 Ca -0.06 -1.16 -0.25 0.00 -1.18 0.00 0.00 61.69 59.04 2pzw s THR 41 Cb -0.19 -3.53 -0.08 0.00 1.34 0.00 0.00 72.50 70.05 2pzw s THR 41 CO -0.06 -0.27 1.31 -2.84 -0.54 0.00 0.00 174.62 172.22 2pzw s PRO 42 N -3.66 3.77 0.18 3.99 0.02 -1.26 -4.96 135.00 133.08 2pzw s PRO 42 Ca 0.33 2.16 -0.13 0.00 0.02 0.00 0.00 61.00 63.37 2pzw s PRO 42 Cb -0.09 -2.62 -0.07 0.00 0.02 0.00 0.00 34.50 31.74 2pzw s PRO 42 CO 0.26 -0.66 0.57 -2.00 -0.33 0.00 0.00 177.00 174.84 2pzw s GLU 43 N -2.43 3.94 -0.03 5.54 2.56 -1.26 -4.38 118.70 122.64 2pzw s GLU 43 Ca 0.61 0.46 0.16 0.00 0.00 0.00 0.00 54.97 56.20 2pzw s GLU 43 Cb -0.38 -2.82 -0.25 0.00 2.00 0.00 0.00 34.13 32.68 2pzw s GLU 43 CO 0.48 0.41 0.34 0.25 -0.56 0.00 0.00 175.26 176.18 2pzw n THR 44 N 0.48 0.08 -0.29 -1.70 -2.24 -1.26 -1.05 114.28 108.30 2pzw n THR 44 Ca -0.03 -0.39 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2pzw n THR 44 Cb 0.52 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 2pzw n THR 44 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 2pzw n LYS 45 N -2.11 0.92 -3.78 -0.78 2.85 -1.26 -4.82 118.16 109.19 2pzw n LYS 45 Ca -0.05 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 56.93 2pzw n LYS 45 Cb 0.47 -1.04 -0.16 0.00 -0.65 0.00 0.00 35.03 33.65 2pzw n LYS 45 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2pzw s VAL 51 N 0.14 0.82 0.70 0.58 1.01 -1.26 -5.28 120.40 117.12 2pzw s VAL 51 Ca 0.00 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 60.99 2pzw s VAL 51 Cb 0.00 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 35.07 2pzw s VAL 51 CO 0.00 -0.27 1.08 -1.61 0.00 0.00 0.00 175.10 174.29 2pzw s GLU 52 N 1.71 2.73 0.18 2.72 2.02 -0.22 -4.96 118.70 122.88 2pzw s GLU 52 Ca -0.00 1.13 -0.31 0.00 0.02 0.00 0.00 54.97 55.81 2pzw s GLU 52 Cb -0.18 -1.96 -0.09 0.00 0.10 0.00 0.00 34.13 32.01 2pzw s GLU 52 CO -0.11 -1.27 1.40 0.21 0.02 0.00 0.00 175.26 175.51 2pzw s LYS 53 N -4.71 4.32 0.00 1.61 2.20 -1.26 -1.78 119.74 120.11 2pzw s LYS 53 Ca 0.61 2.16 0.00 0.00 -0.36 0.00 0.00 55.97 58.38 2pzw s LYS 53 Cb -0.16 -3.19 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 2pzw s LYS 53 CO 0.51 -0.39 0.00 0.66 -0.36 0.00 0.00 175.35 175.76 2pzw n TYR 54 N 3.13 0.00 0.22 4.03 4.01 -1.26 -4.75 117.16 122.54 2pzw n TYR 54 Ca 0.09 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.68 2pzw n TYR 54 Cb 0.41 -0.09 -0.08 0.00 -0.31 0.00 0.00 39.34 39.28 2pzw n TYR 54 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2pzw h GLY 55 N 0.00 -0.52 2.00 2.72 0.00 -1.55 0.12 103.07 105.85 2pzw h GLY 55 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 47.33 47.48 2pzw h GLY 55 CO 0.00 -0.19 -0.19 -0.56 0.00 0.00 0.00 176.54 175.60 2pzw h PRO 56 N -0.55 0.00 -0.21 4.80 0.13 -1.88 -1.20 132.00 133.09 2pzw h PRO 56 Ca -0.05 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.99 2pzw h PRO 56 Cb 0.41 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.54 2pzw h PRO 56 CO 0.08 0.19 -0.20 0.93 -0.23 0.00 0.00 178.00 178.77 2pzw h GLU 57 N 0.00 0.51 -0.52 0.86 3.07 -1.84 -1.35 114.58 115.31 2pzw h GLU 57 Ca -0.00 -0.27 -0.03 0.00 -0.50 0.00 0.00 59.36 58.56 2pzw h GLU 57 Cb 0.40 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.30 2pzw h GLU 57 CO 0.02 0.84 0.20 0.00 -1.40 0.00 0.00 179.01 178.68 2pzw h ALA 58 N 0.65 0.68 -0.27 3.43 0.00 -0.50 -1.27 119.26 121.98 2pzw h ALA 58 Ca 0.03 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.78 2pzw h ALA 58 Cb 0.75 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2pzw h ALA 58 CO 0.05 0.30 0.18 0.77 0.00 0.00 0.00 179.25 180.55 2pzw h SER 59 N 0.71 0.31 -0.75 0.00 0.02 -1.19 -1.26 113.55 111.39 2pzw h SER 59 Ca 0.17 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.07 2pzw h SER 59 Cb 0.22 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.65 2pzw h SER 59 CO -0.01 0.23 0.31 0.00 -1.14 0.00 0.00 176.83 176.22 2pzw h ALA 60 N 1.10 0.97 0.60 3.77 0.00 -1.09 -0.29 119.26 124.32 2pzw h ALA 60 Ca 0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2pzw h ALA 60 Cb -0.04 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.46 2pzw h ALA 60 CO -0.02 0.59 -0.30 0.35 0.00 0.00 0.00 179.25 179.87 2pzw h PHE 61 N 1.08 -0.78 -0.54 0.00 3.57 -0.90 0.24 116.94 119.60 2pzw h PHE 61 Ca 0.25 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.79 2pzw h PHE 61 Cb 0.20 0.26 -0.05 0.00 2.79 0.00 0.00 35.95 39.15 2pzw h PHE 61 CO 0.02 -0.48 0.27 1.15 -2.23 0.00 0.00 178.31 177.03 2pzw h THR 62 N -0.82 0.93 0.33 4.41 2.02 -1.13 -0.33 112.91 118.31 2pzw h THR 62 Ca -0.08 -0.17 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 2pzw h THR 62 Cb 0.64 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 2pzw h THR 62 CO 0.13 0.09 -0.26 0.50 0.37 0.00 0.00 175.52 176.35 2pzw h LYS 63 N 0.51 -0.57 -0.22 6.66 3.64 -0.81 -2.23 116.57 123.55 2pzw h LYS 63 Ca 0.25 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.69 2pzw h LYS 63 Cb 0.18 0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 2pzw h LYS 63 CO -0.18 -0.38 0.05 -0.22 -2.27 0.00 0.00 179.45 176.45 2pzw h LYS 64 N -0.59 0.13 -0.91 1.90 3.64 -0.24 -0.25 116.57 120.25 2pzw h LYS 64 Ca -0.02 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2pzw h LYS 64 Cb 0.51 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.25 2pzw h LYS 64 CO -0.01 0.09 0.60 1.98 -2.27 0.00 0.00 179.45 179.83 2pzw h MET 65 N 0.13 1.14 0.12 1.90 4.05 -0.99 -1.73 114.93 119.55 2pzw h MET 65 Ca 0.10 -0.07 -0.29 0.00 -0.28 0.00 0.00 59.70 59.16 2pzw h MET 65 Cb 0.09 -0.26 0.03 0.00 -0.80 0.00 0.00 31.60 30.66 2pzw h MET 65 CO -0.13 0.75 -1.20 -0.91 0.23 0.00 0.00 176.91 175.65 2pzw h ASN 66 N 1.17 0.85 -0.21 1.39 2.35 -1.20 -3.25 115.58 116.69 2pzw h ASN 66 Ca 0.36 -0.83 -0.07 0.00 -0.55 0.00 0.00 56.30 55.21 2pzw h ASN 66 Cb -0.04 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.05 2pzw h ASN 66 CO -0.11 1.59 -0.09 -0.33 -1.65 0.00 0.00 177.43 176.85 2pzw h GLU 67 N 0.23 0.57 -0.00 0.81 5.08 -0.88 -3.01 114.58 117.37 2pzw h GLU 67 Ca -0.18 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2pzw h GLU 67 Cb 1.88 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 31.07 2pzw h GLU 67 CO 0.23 0.66 -0.11 0.09 -1.00 0.00 0.00 179.01 178.88 2pzw n ASN 68 N -4.21 0.36 -4.82 1.42 5.03 -0.66 -4.91 115.26 107.46 2pzw n ASN 68 Ca 0.01 -0.40 -0.34 0.00 0.87 0.00 0.00 54.58 54.72 2pzw n ASN 68 Cb 0.31 -0.12 -0.06 0.00 -1.02 0.00 0.00 39.78 38.89 2pzw n ASN 68 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2pzw s ALA 69 N -2.57 3.29 0.04 5.41 0.00 -1.14 -4.97 121.76 121.82 2pzw s ALA 69 Ca 0.26 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2pzw s ALA 69 Cb 0.20 -2.91 -0.26 0.00 0.00 0.00 0.00 23.12 20.15 2pzw s ALA 69 CO 0.49 0.27 1.00 0.87 0.00 0.00 0.00 175.76 178.40 2pzw h LYS 70 N 2.72 0.18 -4.21 0.00 1.57 -1.91 -3.46 116.57 111.46 2pzw h LYS 70 Ca -0.48 -0.30 -0.43 0.00 -1.87 0.00 0.00 60.65 57.57 2pzw h LYS 70 Cb 1.18 0.11 -0.33 0.00 0.08 0.00 0.00 32.23 33.28 2pzw h LYS 70 CO 0.64 1.06 -0.78 0.15 -0.57 0.00 0.00 179.45 179.95 2pzw s LYS 71 N -2.64 1.00 -0.08 3.15 1.02 -1.26 -5.04 119.74 115.89 2pzw s LYS 71 Ca -0.05 -0.20 0.04 0.00 0.02 0.00 0.00 55.97 55.78 2pzw s LYS 71 Cb 0.08 -0.94 -0.01 0.00 -0.52 0.00 0.00 37.83 36.44 2pzw s LYS 71 CO 0.85 -0.02 -0.21 0.42 -0.92 0.00 0.00 175.35 175.47 2pzw s ILE 72 N 0.71 2.42 0.04 2.17 -1.09 -1.26 -0.63 121.20 123.56 2pzw s ILE 72 Ca -0.11 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.43 2pzw s ILE 72 Cb -0.14 -1.93 -0.02 0.00 -1.58 0.00 0.00 42.46 38.80 2pzw s ILE 72 CO 0.01 0.56 -0.12 -1.61 -1.23 0.00 0.00 174.94 172.55 2pzw s GLU 73 N -0.07 0.77 0.02 2.79 2.02 -0.27 -1.70 118.70 122.27 2pzw s GLU 73 Ca -0.05 -0.76 0.08 0.00 0.02 0.00 0.00 54.97 54.26 2pzw s GLU 73 Cb -0.14 -0.73 -0.03 0.00 0.10 0.00 0.00 34.13 33.33 2pzw s GLU 73 CO 0.04 0.17 -0.22 0.14 0.02 0.00 0.00 175.26 175.42 2pzw s VAL 74 N -1.01 2.47 -0.19 2.63 -7.23 0.10 -0.21 120.40 116.97 2pzw s VAL 74 Ca -0.02 -1.20 -0.02 0.00 -1.81 0.00 0.00 61.98 58.93 2pzw s VAL 74 Cb -0.08 -1.98 0.06 0.00 0.56 0.00 0.00 36.38 34.93 2pzw s VAL 74 CO 0.01 0.41 0.01 -0.70 -0.31 0.00 0.00 175.10 174.52 2pzw s GLU 75 N -1.17 0.89 0.47 4.82 2.12 0.15 -1.01 118.70 124.97 2pzw s GLU 75 Ca 0.13 -0.49 -0.20 0.00 0.36 0.00 0.00 54.97 54.77 2pzw s GLU 75 Cb -0.10 -2.09 -0.09 0.00 0.26 0.00 0.00 34.13 32.10 2pzw s GLU 75 CO 0.03 -0.59 0.98 -0.06 -0.54 0.00 0.00 175.26 175.08 2pzw s PHE 76 N 1.77 3.24 0.00 5.30 0.40 -1.26 -1.00 117.98 126.43 2pzw s PHE 76 Ca -0.01 1.57 0.00 0.00 -0.60 0.00 0.00 56.93 57.89 2pzw s PHE 76 Cb -0.17 -2.90 0.00 0.00 0.51 0.00 0.00 43.02 40.46 2pzw s PHE 76 CO -0.07 -0.38 0.00 -3.47 0.70 0.00 0.00 175.22 172.00 2pzw n ASP 77 N -0.95 0.00 -0.46 1.36 -0.08 -1.26 -4.67 116.55 110.49 2pzw n ASP 77 Ca 0.08 -0.99 0.14 0.00 -1.51 0.00 0.00 54.79 52.51 2pzw n ASP 77 Cb 0.54 0.00 0.48 0.00 2.34 0.00 0.00 41.12 44.48 2pzw n ASP 77 CO 0.00 0.00 0.00 2.29 0.12 0.00 0.00 177.20 179.61 2pzw n LYS 78 N -0.99 1.56 0.00 -0.67 2.85 -1.26 -4.90 118.16 114.75 2pzw n LYS 78 Ca 0.00 -0.93 0.00 0.00 -1.05 0.00 0.00 58.31 56.33 2pzw n LYS 78 Cb 0.00 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 32.90 2pzw n LYS 78 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2pzw n GLY 79 N 1.21 1.55 3.74 2.58 0.00 -1.25 -4.95 105.19 108.07 2pzw n GLY 79 Ca 0.18 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 2pzw n GLY 79 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2pzw n GLN 80 N 0.00 2.55 0.00 1.61 6.02 -1.17 -4.92 117.38 121.47 2pzw n GLN 80 Ca 0.00 0.90 0.12 0.00 -0.01 0.00 0.00 57.00 58.01 2pzw n GLN 80 Cb 0.00 -2.64 0.16 0.00 1.02 0.00 0.00 30.24 28.79 2pzw n GLN 80 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2pzw n ARG 81 N 1.60 0.28 -3.89 -1.09 5.12 -1.26 -4.79 116.66 112.62 2pzw n ARG 81 Ca 0.07 -0.19 -0.11 0.00 -1.93 0.00 0.00 57.85 55.69 2pzw n ARG 81 Cb 0.36 -1.50 -0.11 0.00 -1.16 0.00 0.00 32.46 30.06 2pzw n ARG 81 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 2pzw s THR 82 N -2.85 0.08 0.43 0.55 -4.23 -1.26 -0.29 115.64 108.07 2pzw s THR 82 Ca 0.14 -0.66 -0.01 0.00 -1.18 0.00 0.00 61.69 59.97 2pzw s THR 82 Cb 0.18 -0.36 0.09 0.00 1.34 0.00 0.00 72.50 73.75 2pzw s THR 82 CO 0.69 -0.36 0.59 -0.90 -0.54 0.00 0.00 174.62 174.09 2pzw n ASP 83 N 1.68 0.71 0.28 3.99 5.68 -0.24 -4.91 116.55 123.74 2pzw n ASP 83 Ca -0.22 -1.62 0.16 0.00 -0.50 0.00 0.00 54.79 52.61 2pzw n ASP 83 Cb 0.56 -0.39 0.83 0.00 -1.14 0.00 0.00 41.12 40.98 2pzw n ASP 83 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 2pzw h LYS 84 N 0.00 0.00 -0.29 0.11 2.10 -2.02 -2.04 116.57 114.43 2pzw h LYS 84 Ca -0.19 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.46 2pzw h LYS 84 Cb 0.69 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.02 2pzw h LYS 84 CO 0.20 0.07 0.00 0.66 -2.00 0.00 0.00 179.45 178.38 2pzw n TYR 85 N -3.42 0.38 -0.93 0.07 4.02 -1.26 -4.92 117.16 111.10 2pzw n TYR 85 Ca -0.02 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.68 2pzw n TYR 85 Cb 0.21 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.53 2pzw n TYR 85 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2pzw n GLY 86 N 1.11 0.52 3.80 2.72 0.00 -0.77 -5.04 105.19 107.54 2pzw n GLY 86 Ca 0.14 -0.11 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 2pzw n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pzw s ARG 87 N -0.26 4.32 0.34 1.61 0.52 -1.26 -4.76 118.95 119.45 2pzw s ARG 87 Ca 0.00 0.86 -0.27 0.00 -0.52 0.00 0.00 55.73 55.80 2pzw s ARG 87 Cb 0.00 -3.26 -0.09 0.00 0.52 0.00 0.00 34.95 32.12 2pzw s ARG 87 CO 0.00 0.59 1.14 0.20 0.02 0.00 0.00 175.30 177.25 2pzw s GLY 88 N -1.03 2.96 -0.32 -3.53 0.00 0.34 -1.08 107.32 104.68 2pzw s GLY 88 Ca 0.31 0.94 -0.08 0.00 0.00 0.00 0.00 44.72 45.89 2pzw s GLY 88 CO 0.21 1.51 0.12 1.08 0.00 0.00 0.00 173.10 176.01 2pzw s LEU 89 N -1.94 4.09 0.29 0.66 1.43 0.60 -0.14 118.68 123.67 2pzw s LEU 89 Ca 0.50 -0.76 -0.17 0.00 -1.03 0.00 0.00 54.13 52.68 2pzw s LEU 89 Cb -0.31 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 43.99 2pzw s LEU 89 CO 0.40 -0.24 0.64 0.00 0.23 0.00 0.00 176.35 177.38 2pzw s ALA 90 N 1.52 -0.73 -0.14 4.21 0.00 -1.15 -4.37 121.76 121.11 2pzw s ALA 90 Ca 0.02 -0.62 -0.12 0.00 0.00 0.00 0.00 51.96 51.25 2pzw s ALA 90 Cb -0.18 0.92 -0.05 0.00 0.00 0.00 0.00 23.12 23.81 2pzw s ALA 90 CO 0.04 -0.96 0.24 0.71 0.00 0.00 0.00 175.76 175.79 2pzw s TYR 91 N -3.70 3.51 -0.09 0.00 2.02 -0.17 -1.07 117.35 117.86 2pzw s TYR 91 Ca 0.16 0.57 0.01 0.00 -0.37 0.00 0.00 57.07 57.44 2pzw s TYR 91 Cb -0.04 -2.20 -0.03 0.00 -0.40 0.00 0.00 41.96 39.29 2pzw s TYR 91 CO 0.09 0.41 -0.09 0.42 -1.57 0.00 0.00 175.55 174.81 2pzw s ILE 92 N -0.08 3.52 -0.09 2.71 -1.09 -1.26 -0.68 121.20 124.23 2pzw s ILE 92 Ca 0.15 -0.53 0.03 0.00 -2.23 0.00 0.00 60.65 58.07 2pzw s ILE 92 Cb -0.13 -2.45 -0.01 0.00 -1.58 0.00 0.00 42.46 38.29 2pzw s ILE 92 CO 0.04 0.57 -0.19 -0.31 -1.23 0.00 0.00 174.94 173.82 2pzw s TYR 93 N -0.46 2.62 -0.26 3.97 2.02 0.71 0.49 117.35 126.44 2pzw s TYR 93 Ca 0.06 -0.66 0.00 0.00 -0.37 0.00 0.00 57.07 56.10 2pzw s TYR 93 Cb -0.12 -1.70 0.04 0.00 -0.40 0.00 0.00 41.96 39.78 2pzw s TYR 93 CO 0.02 -0.18 -0.07 0.00 -1.57 0.00 0.00 175.55 173.74 2pzw s ALA 94 N -0.01 2.65 -1.40 3.71 0.00 0.54 -1.12 121.76 126.13 2pzw s ALA 94 Ca -0.06 -1.64 -0.04 0.00 0.00 0.00 0.00 51.96 50.22 2pzw s ALA 94 Cb -0.15 -1.68 0.03 0.00 0.00 0.00 0.00 23.12 21.32 2pzw s ALA 94 CO 0.05 -1.05 0.71 -0.25 0.00 0.00 0.00 175.76 175.22 2pzw n ASP 95 N 4.56 -1.91 0.00 0.00 10.43 0.20 -1.17 116.55 128.66 2pzw n ASP 95 Ca -0.15 -0.86 0.00 0.00 2.57 0.00 0.00 54.79 56.35 2pzw n ASP 95 Cb 0.44 -3.74 0.00 0.00 1.84 0.00 0.00 41.12 39.67 2pzw n ASP 95 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2pzw n GLY 96 N -1.68 2.73 3.69 0.44 0.00 -1.26 -5.00 105.19 104.10 2pzw n GLY 96 Ca -0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.46 2pzw n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pzw s LYS 97 N -0.00 4.11 -0.07 1.61 1.02 -0.31 -5.02 119.74 121.07 2pzw s LYS 97 Ca 0.00 -0.26 -0.30 0.00 0.02 0.00 0.00 55.97 55.43 2pzw s LYS 97 Cb 0.00 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.84 2pzw s LYS 97 CO 0.00 0.20 1.49 1.41 -0.92 0.00 0.00 175.35 177.54 2pzw s MET 98 N 0.63 4.22 0.20 1.68 -2.45 -1.26 -0.34 119.30 121.97 2pzw s MET 98 Ca 0.07 2.00 -0.09 0.00 -1.25 0.00 0.00 55.69 56.42 2pzw s MET 98 Cb -0.12 -3.83 0.14 0.00 1.25 0.00 0.00 34.83 32.27 2pzw s MET 98 CO 0.01 -0.75 1.79 0.28 1.05 0.00 0.00 175.02 177.40 2pzw h VAL 99 N 5.40 1.25 -0.37 10.11 2.07 -0.32 -2.07 116.25 132.30 2pzw h VAL 99 Ca -0.35 -0.71 0.06 0.00 0.82 0.00 0.00 66.70 66.52 2pzw h VAL 99 Cb 1.16 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 2pzw h VAL 99 CO 0.95 0.30 0.06 0.78 0.02 0.00 0.00 177.57 179.67 2pzw h ASN 100 N 1.07 -0.03 -0.31 0.57 4.21 -1.91 -1.87 115.58 117.30 2pzw h ASN 100 Ca 0.26 0.07 -0.06 0.00 1.21 0.00 0.00 56.30 57.78 2pzw h ASN 100 Cb 0.14 0.10 -0.01 0.00 -1.12 0.00 0.00 38.32 37.43 2pzw h ASN 100 CO -0.03 0.02 -0.02 -0.08 -1.29 0.00 0.00 177.43 176.03 2pzw h GLU 101 N 0.17 0.57 -0.62 0.81 4.81 -1.88 -2.88 114.58 115.56 2pzw h GLU 101 Ca 0.18 -0.19 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2pzw h GLU 101 Cb 0.22 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.50 2pzw h GLU 101 CO -0.25 0.72 0.32 0.00 -0.73 0.00 0.00 179.01 179.07 2pzw h ALA 102 N 0.83 0.82 -0.43 2.92 0.00 -1.09 0.12 119.26 122.44 2pzw h ALA 102 Ca 0.09 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.04 2pzw h ALA 102 Cb 0.48 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2pzw h ALA 102 CO 0.02 -0.04 0.26 -0.07 0.00 0.00 0.00 179.25 179.42 2pzw h LEU 103 N 0.58 0.42 -0.15 0.00 3.38 -1.27 -0.60 115.31 117.67 2pzw h LEU 103 Ca 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 2pzw h LEU 103 Cb 0.22 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2pzw h LEU 103 CO -0.20 0.30 0.01 0.58 0.09 0.00 0.00 178.44 179.21 2pzw h VAL 104 N 0.52 1.24 -0.51 1.22 2.07 -1.21 0.13 116.25 119.70 2pzw h VAL 104 Ca 0.17 -0.80 0.02 0.00 0.82 0.00 0.00 66.70 66.90 2pzw h VAL 104 Cb -0.00 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 2pzw h VAL 104 CO -0.07 0.24 0.34 -0.09 0.02 0.00 0.00 177.57 178.01 2pzw h ARG 105 N 0.02 0.64 -0.00 1.57 9.65 -0.54 0.44 114.38 126.15 2pzw h ARG 105 Ca 0.04 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2pzw h ARG 105 Cb 0.35 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 2pzw h ARG 105 CO 0.01 0.42 -0.00 0.94 2.80 0.00 0.00 179.97 184.14 2pzw n GLN 106 N -4.46 1.11 -1.98 0.20 -0.06 -0.25 -4.45 117.38 107.49 2pzw n GLN 106 Ca 0.05 -0.18 -0.09 0.00 -2.00 0.00 0.00 57.00 54.79 2pzw n GLN 106 Cb 0.08 -1.50 -0.01 0.00 -4.06 0.00 0.00 30.24 24.76 2pzw n GLN 106 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2pzw n GLY 107 N 1.04 0.22 0.92 1.69 0.00 0.14 -4.53 105.19 104.66 2pzw n GLY 107 Ca 0.23 -0.54 0.08 0.00 0.00 0.00 0.00 46.02 45.79 2pzw n GLY 107 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pzw n LEU 108 N -1.22 3.23 -3.52 0.99 4.77 0.43 -2.01 117.00 119.66 2pzw n LEU 108 Ca -0.10 -1.83 -0.12 0.00 -0.03 0.00 0.00 56.01 53.92 2pzw n LEU 108 Cb 0.52 -0.29 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2pzw n LEU 108 CO 0.12 0.78 0.61 0.00 -1.33 0.00 0.00 177.39 177.58 2pzw s ALA 109 N -1.07 -1.82 0.19 -1.18 0.00 -1.18 -4.36 121.76 112.35 2pzw s ALA 109 Ca 0.32 1.24 0.05 0.00 0.00 0.00 0.00 51.96 53.57 2pzw s ALA 109 Cb 0.18 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 2pzw s ALA 109 CO 0.23 -0.47 0.19 0.15 0.00 0.00 0.00 175.76 175.86 2pzw s LYS 110 N -1.94 3.02 0.08 0.00 1.02 -0.53 -4.41 119.74 116.98 2pzw s LYS 110 Ca -0.02 -0.87 -0.30 0.00 0.02 0.00 0.00 55.97 54.79 2pzw s LYS 110 Cb -0.01 -2.68 -0.05 0.00 -0.52 0.00 0.00 37.83 34.57 2pzw s LYS 110 CO -0.00 0.46 1.05 0.08 -0.92 0.00 0.00 175.35 176.02 2pzw s VAL 111 N -1.87 4.36 0.55 3.17 1.01 -1.26 -0.76 120.40 125.60 2pzw s VAL 111 Ca 0.32 1.83 -0.03 0.00 0.00 0.00 0.00 61.98 64.11 2pzw s VAL 111 Cb -0.10 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 32.13 2pzw s VAL 111 CO 0.25 0.22 0.82 0.00 0.00 0.00 0.00 175.10 176.38 2pzw s ALA 112 N 0.46 3.54 0.53 5.51 0.00 -0.22 -4.81 121.76 126.77 2pzw s ALA 112 Ca 0.51 -0.95 -0.21 0.00 0.00 0.00 0.00 51.96 51.31 2pzw s ALA 112 Cb -0.25 -2.36 -0.06 0.00 0.00 0.00 0.00 23.12 20.45 2pzw s ALA 112 CO 0.30 -0.71 1.18 0.71 0.00 0.00 0.00 175.76 177.24 2pzw s TYR 113 N -2.84 2.63 0.42 0.00 1.51 -1.26 -4.83 117.35 112.98 2pzw s TYR 113 Ca 0.53 1.52 -0.26 0.00 -1.01 0.00 0.00 57.07 57.85 2pzw s TYR 113 Cb -0.10 -3.41 -0.10 0.00 -0.11 0.00 0.00 41.96 38.24 2pzw s TYR 113 CO 0.41 -1.83 1.40 0.28 -1.11 0.00 0.00 175.55 174.71 2pzw n VAL 114 N -1.10 2.50 -4.03 0.71 0.31 -1.26 -4.85 118.33 110.60 2pzw n VAL 114 Ca 0.11 -0.50 -0.31 0.00 -0.01 0.00 0.00 64.34 63.63 2pzw n VAL 114 Cb 0.49 -1.80 -0.16 0.00 -0.91 0.00 0.00 33.84 31.47 2pzw n VAL 114 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 2pzw s TYR 115 N -1.17 2.60 -1.45 3.52 5.04 -1.26 -4.85 117.35 119.78 2pzw s TYR 115 Ca 0.59 -1.72 -0.04 0.00 -2.44 0.00 0.00 57.07 53.46 2pzw s TYR 115 Cb -0.48 -1.73 0.03 0.00 0.35 0.00 0.00 41.96 40.14 2pzw s TYR 115 CO 0.60 -0.77 0.53 1.63 -1.34 0.00 0.00 175.55 176.19 2pzw n LYS 116 N 4.63 -3.55 -0.90 4.97 4.76 -1.26 -2.21 118.16 124.60 2pzw n LYS 116 Ca -0.15 0.43 0.00 0.00 -2.87 0.00 0.00 58.31 55.72 2pzw n LYS 116 Cb 0.46 -4.73 0.00 0.00 -1.84 0.00 0.00 35.03 28.92 2pzw n LYS 116 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2pzw n GLY 117 N -1.85 0.77 3.44 0.72 0.00 -1.26 -3.03 105.19 103.98 2pzw n GLY 117 Ca -0.23 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.35 2pzw n GLY 117 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2pzw s ASN 118 N -2.54 6.94 0.00 1.61 0.01 -0.94 -3.93 114.94 116.10 2pzw s ASN 118 Ca 0.00 -2.75 0.00 0.00 -0.71 0.00 0.00 52.86 49.40 2pzw s ASN 118 Cb 0.00 -2.37 0.00 0.00 0.41 0.00 0.00 41.25 39.29 2pzw s ASN 118 CO 0.00 -0.78 0.68 -0.46 -1.51 0.00 0.00 177.10 175.03 2pzw n ASN 119 N 5.50 0.84 -0.27 -1.22 0.23 -1.26 -4.31 115.26 114.78 2pzw n ASN 119 Ca 0.30 -1.40 0.09 0.00 -0.53 0.00 0.00 54.58 53.03 2pzw n ASN 119 Cb 0.45 0.00 0.22 0.00 -2.08 0.00 0.00 39.78 38.37 2pzw n ASN 119 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 2pzw h THR 120 N 1.59 0.39 -0.64 5.53 2.02 -2.02 -1.86 112.91 117.92 2pzw h THR 120 Ca 0.00 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2pzw h THR 120 Cb 0.74 0.16 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 2pzw h THR 120 CO 0.00 0.04 0.00 1.41 0.37 0.00 0.00 175.52 177.34 2pzw n HIS 121 N -5.23 1.43 -0.28 3.16 8.25 -1.26 -4.59 115.22 116.70 2pzw n HIS 121 Ca 0.17 -0.61 -0.02 0.00 -0.26 0.00 0.00 57.72 57.01 2pzw n HIS 121 Cb 0.56 -0.23 0.10 0.00 1.12 0.00 0.00 29.99 31.54 2pzw n HIS 121 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2pzw h GLU 122 N 4.03 0.90 -0.37 -0.41 4.81 -1.68 -1.39 114.58 120.46 2pzw h GLU 122 Ca 0.00 -0.05 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 2pzw h GLU 122 Cb 1.42 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2pzw h GLU 122 CO 0.22 0.59 -0.09 1.96 -0.73 0.00 0.00 179.01 180.96 2pzw h GLN 123 N 0.92 0.72 -0.62 1.92 1.08 -1.81 0.17 115.11 117.50 2pzw h GLN 123 Ca 0.32 -0.28 0.08 0.00 -1.45 0.00 0.00 58.65 57.33 2pzw h GLN 123 Cb 0.07 -0.04 -0.07 0.00 -0.05 0.00 0.00 27.48 27.39 2pzw h GLN 123 CO -0.13 0.87 0.27 1.25 -0.95 0.00 0.00 178.83 180.13 2pzw h LEU 124 N 0.52 0.31 -0.38 1.46 5.85 -1.82 -0.46 115.31 120.81 2pzw h LEU 124 Ca 0.09 0.06 -0.19 0.00 0.84 0.00 0.00 57.88 58.69 2pzw h LEU 124 Cb 0.61 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.65 2pzw h LEU 124 CO 0.04 0.19 -0.67 -0.07 -0.34 0.00 0.00 178.44 177.59 2pzw h LEU 125 N 0.48 0.67 -0.90 2.25 3.38 -0.94 -2.34 115.31 117.90 2pzw h LEU 125 Ca 0.30 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2pzw h LEU 125 Cb 0.33 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2pzw h LEU 125 CO -0.27 1.16 0.53 0.03 0.09 0.00 0.00 178.44 179.98 2pzw h ARG 126 N 0.41 1.23 -0.53 1.13 2.47 -0.11 -0.57 114.38 118.42 2pzw h ARG 126 Ca -0.02 -0.12 -0.06 0.00 -1.26 0.00 0.00 59.98 58.52 2pzw h ARG 126 Cb 1.25 -0.25 -0.02 0.00 -1.65 0.00 0.00 29.97 29.30 2pzw h ARG 126 CO 0.13 0.87 0.10 0.87 0.56 0.00 0.00 179.97 182.50 2pzw h LYS 127 N 1.24 0.86 -0.70 0.04 1.57 -1.00 -1.43 116.57 117.16 2pzw h LYS 127 Ca 0.32 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2pzw h LYS 127 Cb -0.03 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 2pzw h LYS 127 CO -0.06 0.84 0.45 0.00 -0.57 0.00 0.00 179.45 180.11 2pzw h ALA 128 N 0.99 0.89 -0.54 3.86 0.00 -0.91 -2.38 119.26 121.17 2pzw h ALA 128 Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2pzw h ALA 128 Cb 0.38 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2pzw h ALA 128 CO 0.01 0.34 0.15 1.49 0.00 0.00 0.00 179.25 181.23 2pzw h GLU 129 N 0.95 0.85 -0.80 0.00 4.81 -0.89 -1.59 114.58 117.91 2pzw h GLU 129 Ca 0.25 -0.19 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2pzw h GLU 129 Cb -0.07 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.14 2pzw h GLU 129 CO -0.05 0.79 0.51 0.00 -0.73 0.00 0.00 179.01 179.53 2pzw h ALA 130 N 1.02 1.05 -0.41 2.92 0.00 -1.01 -0.01 119.26 122.83 2pzw h ALA 130 Ca 0.17 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2pzw h ALA 130 Cb 0.31 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2pzw h ALA 130 CO -0.00 0.33 0.03 0.37 0.00 0.00 0.00 179.25 179.98 2pzw h GLN 131 N 1.00 0.69 -0.42 0.00 5.75 -1.22 -0.82 115.11 120.10 2pzw h GLN 131 Ca 0.32 -0.20 -0.05 0.00 -0.15 0.00 0.00 58.65 58.56 2pzw h GLN 131 Cb 0.00 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 2pzw h GLN 131 CO -0.11 0.76 0.05 0.00 -2.65 0.00 0.00 178.83 176.88 2pzw h ALA 132 N 0.91 1.31 -0.12 3.38 0.00 -0.82 -1.80 119.26 122.11 2pzw h ALA 132 Ca 0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2pzw h ALA 132 Cb 0.43 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 2pzw h ALA 132 CO 0.01 0.48 0.02 -0.22 0.00 0.00 0.00 179.25 179.54 2pzw h LYS 133 N 0.62 0.20 -0.74 0.00 3.64 -0.75 -1.15 116.57 118.40 2pzw h LYS 133 Ca 0.14 -0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.53 2pzw h LYS 133 Cb 0.32 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 2pzw h LYS 133 CO 0.01 0.39 0.49 0.87 -2.27 0.00 0.00 179.45 178.94 2pzw h LYS 134 N -0.02 0.75 -0.01 1.90 1.57 -0.79 -0.25 116.57 119.71 2pzw h LYS 134 Ca 0.04 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2pzw h LYS 134 Cb 0.29 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.43 2pzw h LYS 134 CO 0.00 0.49 -0.05 0.39 -0.57 0.00 0.00 179.45 179.72 2pzw n GLU 135 N -4.48 1.23 -3.91 3.15 1.02 -0.71 -4.93 120.64 112.01 2pzw n GLU 135 Ca 0.11 -0.55 -0.26 0.00 -0.02 0.00 0.00 57.16 56.44 2pzw n GLU 135 Cb 0.23 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 2pzw n GLU 135 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2pzw n LYS 136 N -0.40 -4.13 -2.84 3.49 5.02 -0.11 -4.92 118.16 114.27 2pzw n LYS 136 Ca 0.18 0.50 -0.41 0.00 -2.02 0.00 0.00 58.31 56.56 2pzw n LYS 136 Cb 0.28 -4.95 -0.04 0.00 -0.02 0.00 0.00 35.03 30.30 2pzw n LYS 136 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2pzw s LEU 137 N -6.97 4.45 0.00 -0.35 1.43 -0.76 -3.62 118.68 112.86 2pzw s LEU 137 Ca 0.20 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 54.91 2pzw s LEU 137 Cb -0.11 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.70 2pzw s LEU 137 CO 0.86 -0.06 0.00 0.59 0.23 0.00 0.00 176.35 177.97 2pzw n ASN 138 N 2.98 0.00 -0.26 2.29 3.02 -1.26 -0.15 115.26 121.88 2pzw n ASN 138 Ca 0.01 0.00 0.30 0.00 -0.03 0.00 0.00 54.58 54.86 2pzw n ASN 138 Cb 0.50 0.00 0.70 0.00 -0.61 0.00 0.00 39.78 40.37 2pzw n ASN 138 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 2pzw h ILE 139 N 0.00 0.50 -0.38 2.41 2.04 -1.73 0.69 117.51 121.03 2pzw h ILE 139 Ca 0.00 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.84 2pzw h ILE 139 Cb 0.00 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2pzw h ILE 139 CO 0.00 0.01 0.00 0.79 0.00 0.00 0.00 178.15 178.95 2pzw n TRP 140 N -4.28 0.71 0.26 1.37 7.02 0.78 -5.14 117.44 118.15 2pzw n TRP 140 Ca 0.22 -0.31 0.02 0.00 -1.02 0.00 0.00 57.50 56.41 2pzw n TRP 140 Cb 1.06 -0.09 0.12 0.00 -2.42 0.00 0.00 31.31 29.97 2pzw n TRP 140 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10