#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2zm6 s ILE 4 N 0.00 4.01 -0.25 -0.18 1.01 -0.37 -4.53 121.20 120.90 2zm6 s ILE 4 Ca 0.00 0.94 -0.24 0.00 0.00 0.00 0.00 60.65 61.34 2zm6 s ILE 4 Cb 0.00 -4.63 -0.00 0.00 0.01 0.00 0.00 42.46 37.83 2zm6 s ILE 4 CO 0.00 -1.22 0.83 -0.60 0.00 0.00 0.00 174.94 173.95 2zm6 s ARG 5 N 4.93 4.15 -0.29 2.79 3.52 -1.04 -2.96 118.95 130.06 2zm6 s ARG 5 Ca 0.46 0.89 0.00 0.00 -0.13 0.00 0.00 55.73 56.95 2zm6 s ARG 5 Cb -0.08 -3.66 0.06 0.00 -1.56 0.00 0.00 34.95 29.71 2zm6 s ARG 5 CO 0.27 -0.55 -0.03 0.42 -0.81 0.00 0.00 175.30 174.61 2zm6 s ILE 6 N 2.88 2.70 -0.09 4.11 1.01 -1.17 -3.16 121.20 127.47 2zm6 s ILE 6 Ca 0.35 -1.54 -0.10 0.00 0.00 0.00 0.00 60.65 59.36 2zm6 s ILE 6 Cb -0.15 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.68 2zm6 s ILE 6 CO 0.08 -0.13 0.22 -0.75 0.00 0.00 0.00 174.94 174.37 2zm6 s LYS 7 N 1.18 3.66 -0.27 2.79 2.20 -1.10 -2.50 119.74 125.70 2zm6 s LYS 7 Ca -0.05 0.03 0.00 0.00 -0.36 0.00 0.00 55.97 55.59 2zm6 s LYS 7 Cb -0.20 -3.22 0.08 0.00 -1.51 0.00 0.00 37.83 32.98 2zm6 s LYS 7 CO -0.03 0.70 0.02 -0.51 -0.36 0.00 0.00 175.35 175.17 2zm6 s LEU 8 N -0.88 2.65 -0.15 5.43 1.43 0.12 -3.22 118.68 124.06 2zm6 s LEU 8 Ca 0.17 -1.44 -0.03 0.00 -1.03 0.00 0.00 54.13 51.80 2zm6 s LEU 8 Cb -0.13 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 44.98 2zm6 s LEU 8 CO 0.06 -0.33 -0.05 0.00 0.23 0.00 0.00 176.35 176.27 2zm6 s ARG 9 N 1.44 3.58 0.00 1.70 1.70 -0.97 -0.23 118.95 126.17 2zm6 s ARG 9 Ca 0.02 -0.54 0.00 0.00 -0.47 0.00 0.00 55.73 54.74 2zm6 s ARG 9 Cb -0.18 -2.86 0.00 0.00 -0.57 0.00 0.00 34.95 31.34 2zm6 s ARG 9 CO -0.13 0.27 0.00 0.41 -1.08 0.00 0.00 175.30 174.77 2zm6 n GLY 10 N 3.43 2.78 0.02 3.88 0.00 -0.64 -2.31 105.19 112.36 2zm6 n GLY 10 Ca -0.18 -1.17 -0.02 0.00 0.00 0.00 0.00 46.02 44.65 2zm6 n GLY 10 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2zm6 n PHE 11 N 0.00 0.00 -4.25 1.61 0.99 -1.25 -1.48 117.46 113.07 2zm6 n PHE 11 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.45 57.11 2zm6 n PHE 11 Cb 0.00 -0.22 -0.11 0.00 -1.00 0.00 0.00 39.48 38.15 2zm6 n PHE 11 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 2zm6 s ASP 12 N -3.63 5.10 0.45 4.37 2.15 -1.26 -4.79 116.67 119.06 2zm6 s ASP 12 Ca -0.03 -0.05 0.29 0.00 0.43 0.00 0.00 52.55 53.19 2zm6 s ASP 12 Cb 0.01 -1.85 1.03 0.00 -0.30 0.00 0.00 42.92 41.82 2zm6 s ASP 12 CO 0.17 0.17 1.84 1.12 -0.17 0.00 0.00 175.17 178.31 2zm6 h HIS 13 N 6.71 0.00 0.16 -5.34 2.07 -1.94 -2.71 115.15 114.10 2zm6 h HIS 13 Ca -0.33 0.00 -0.33 0.00 -2.85 0.00 0.00 60.37 56.85 2zm6 h HIS 13 Cb 1.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 2zm6 h HIS 13 CO 0.54 0.00 -1.66 0.87 -3.07 0.00 0.00 177.93 174.61 2zm6 h LYS 14 N 0.00 0.34 -0.84 5.12 1.57 -1.99 -2.41 116.57 118.37 2zm6 h LYS 14 Ca 0.00 -0.58 0.02 0.00 -1.87 0.00 0.00 60.65 58.22 2zm6 h LYS 14 Cb 0.61 0.22 -0.05 0.00 0.08 0.00 0.00 32.23 33.09 2zm6 h LYS 14 CO 0.00 1.23 0.54 0.00 -0.57 0.00 0.00 179.45 180.66 2zm6 h THR 15 N 0.09 1.16 -0.03 -0.16 1.03 -1.96 -1.81 112.91 111.23 2zm6 h THR 15 Ca -0.30 -0.37 -0.08 0.00 -0.01 0.00 0.00 66.41 65.65 2zm6 h THR 15 Cb 2.07 -0.01 0.01 0.00 -1.07 0.00 0.00 68.15 69.14 2zm6 h THR 15 CO 0.17 0.20 -0.30 -0.07 -0.01 0.00 0.00 175.52 175.51 2zm6 h LEU 16 N 1.08 0.31 -0.67 0.00 3.38 -1.58 -1.71 115.31 116.12 2zm6 h LEU 16 Ca 0.32 -0.71 0.12 0.00 0.09 0.00 0.00 57.88 57.71 2zm6 h LEU 16 Cb -0.04 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 40.49 2zm6 h LEU 16 CO -0.10 0.98 -0.27 0.44 0.09 0.00 0.00 178.44 179.58 2zm6 h ASP 17 N -0.33 -0.97 0.77 -0.43 3.32 -1.18 1.93 116.42 119.53 2zm6 h ASP 17 Ca -0.03 0.23 -0.04 0.00 0.02 0.00 0.00 57.03 57.21 2zm6 h ASP 17 Cb 1.00 0.53 0.01 0.00 0.22 0.00 0.00 39.33 41.09 2zm6 h ASP 17 CO 0.06 -0.28 -0.37 0.00 -1.72 0.00 0.00 179.24 176.93 2zm6 h ALA 18 N 1.32 -1.10 -0.92 3.45 0.00 -1.38 0.54 119.26 121.16 2zm6 h ALA 18 Ca 0.29 -0.23 0.27 0.00 0.00 0.00 0.00 54.91 55.24 2zm6 h ALA 18 Cb 0.55 0.40 -0.15 0.00 0.00 0.00 0.00 17.79 18.59 2zm6 h ALA 18 CO -0.72 -1.02 0.32 1.03 0.00 0.00 0.00 179.25 178.86 2zm6 h SER 19 N -1.21 0.12 -0.35 0.00 0.87 -0.45 0.94 113.55 113.48 2zm6 h SER 19 Ca -0.11 0.20 -0.17 0.00 -1.23 0.00 0.00 61.79 60.49 2zm6 h SER 19 Cb 0.80 0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 63.00 2zm6 h SER 19 CO 0.17 -0.17 -0.44 0.00 -0.53 0.00 0.00 176.83 175.86 2zm6 h ALA 20 N 1.82 0.52 -0.58 6.23 0.00 0.33 -2.95 119.26 124.63 2zm6 h ALA 20 Ca 0.62 -0.47 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2zm6 h ALA 20 Cb 1.31 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2zm6 h ALA 20 CO -0.66 0.66 -0.06 0.37 0.00 0.00 0.00 179.25 179.56 2zm6 h GLN 21 N 0.71 1.06 -0.12 0.00 4.15 0.56 -2.08 115.11 119.39 2zm6 h GLN 21 Ca 0.04 -0.37 0.04 0.00 0.77 0.00 0.00 58.65 59.13 2zm6 h GLN 21 Cb 1.04 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.64 2zm6 h GLN 21 CO 0.10 1.07 0.16 0.87 -1.93 0.00 0.00 178.83 179.10 2zm6 h LYS 22 N 0.95 0.00 0.00 1.69 1.57 0.67 0.35 116.57 121.80 2zm6 h LYS 22 Ca 0.16 0.00 -0.29 0.00 -1.87 0.00 0.00 60.65 58.65 2zm6 h LYS 22 Cb 0.63 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.89 2zm6 h LYS 22 CO 0.04 0.00 -1.64 0.82 -0.57 0.00 0.00 179.45 178.10 2zm6 h ILE 23 N 0.00 0.93 -0.34 1.86 5.03 -1.31 -3.33 117.51 120.35 2zm6 h ILE 23 Ca 0.06 -2.77 -0.07 0.00 -0.12 0.00 0.00 64.86 61.96 2zm6 h ILE 23 Cb 0.38 2.47 -0.01 0.00 -3.03 0.00 0.00 36.82 36.63 2zm6 h ILE 23 CO -0.00 0.55 -0.06 0.58 -0.68 0.00 0.00 178.15 178.54 2zm6 h VAL 24 N 0.00 1.27 0.59 1.67 2.07 0.29 -3.17 116.25 118.98 2zm6 h VAL 24 Ca -0.26 -1.09 -0.03 0.00 0.82 0.00 0.00 66.70 66.14 2zm6 h VAL 24 Cb 1.99 1.28 0.01 0.00 -1.52 0.00 0.00 31.29 33.05 2zm6 h VAL 24 CO 0.09 0.36 -0.28 -0.33 0.02 0.00 0.00 177.57 177.42 2zm6 h GLU 25 N 0.44 -0.76 -0.28 1.57 5.08 -1.25 -3.16 114.58 116.21 2zm6 h GLU 25 Ca 0.09 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2zm6 h GLU 25 Cb 0.55 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.97 2zm6 h GLU 25 CO 0.03 -0.51 0.00 0.00 -1.00 0.00 0.00 179.01 177.53 2zm6 n ALA 26 N -2.46 2.18 -0.05 3.43 0.00 -1.25 -2.60 120.51 119.76 2zm6 n ALA 26 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 2zm6 n ALA 26 Cb 0.31 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 18.64 2zm6 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zm6 n ALA 27 N -0.25 2.01 0.12 0.00 0.00 -1.20 -4.31 120.51 116.88 2zm6 n ALA 27 Ca 0.00 -0.75 0.12 0.00 0.00 0.00 0.00 53.44 52.81 2zm6 n ALA 27 Cb 0.07 -0.25 0.01 0.00 0.00 0.00 0.00 19.45 19.27 2zm6 n ALA 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2zm6 h ARG 28 N 0.00 0.00 -0.01 0.00 3.08 -1.48 -1.45 114.38 114.53 2zm6 h ARG 28 Ca -0.25 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.60 2zm6 h ARG 28 Cb 1.45 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.50 2zm6 h ARG 28 CO 0.01 0.00 -0.87 0.00 -1.07 0.00 0.00 179.97 178.04 2zm6 h ARG 29 N 0.00 0.27 0.00 0.04 3.08 -1.77 -3.37 114.38 112.63 2zm6 h ARG 29 Ca 0.00 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.77 2zm6 h ARG 29 Cb 0.99 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2zm6 h ARG 29 CO 0.00 0.99 -0.10 0.43 -1.07 0.00 0.00 179.97 180.21 2zm6 n SER 30 N -3.70 0.51 0.00 7.04 7.64 -1.26 -5.06 113.62 118.78 2zm6 n SER 30 Ca -0.04 -0.45 0.00 0.00 1.01 0.00 0.00 58.87 59.39 2zm6 n SER 30 Cb 0.80 1.00 0.00 0.00 -1.01 0.00 0.00 64.21 65.00 2zm6 n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2zm6 n GLY 31 N 1.15 3.44 3.37 0.23 0.00 -0.54 -3.98 105.19 108.86 2zm6 n GLY 31 Ca 0.00 -1.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.07 2zm6 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2zm6 s ALA 32 N -2.52 -1.19 0.00 4.61 0.00 -1.25 -4.82 121.76 116.59 2zm6 s ALA 32 Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.07 2zm6 s ALA 32 Cb 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 23.12 22.65 2zm6 s ALA 32 CO 0.00 -0.26 0.00 0.94 0.00 0.00 0.00 175.76 176.44 2zm6 n GLN 33 N 2.15 -0.64 -4.50 0.00 7.27 -1.26 -4.43 117.38 115.98 2zm6 n GLN 33 Ca -0.16 0.64 -0.33 0.00 0.07 0.00 0.00 57.00 57.22 2zm6 n GLN 33 Cb 0.57 -0.46 -0.12 0.00 2.41 0.00 0.00 30.24 32.63 2zm6 n GLN 33 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2zm6 s VAL 34 N -0.07 3.70 -1.83 1.69 1.01 -1.26 -3.92 120.40 119.71 2zm6 s VAL 34 Ca 0.00 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.60 2zm6 s VAL 34 Cb 0.00 -2.60 0.14 0.00 0.00 0.00 0.00 36.38 33.92 2zm6 s VAL 34 CO 0.00 0.51 0.86 -1.20 0.00 0.00 0.00 175.10 175.27 2zm6 n SER 35 N 3.43 0.00 -0.29 3.32 7.64 -0.94 -4.97 113.62 121.81 2zm6 n SER 35 Ca -0.18 -0.06 0.04 0.00 1.01 0.00 0.00 58.87 59.68 2zm6 n SER 35 Cb 0.53 -0.08 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 2zm6 n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2zm6 n GLY 36 N -0.71 -2.30 3.70 0.23 0.00 -1.26 -4.85 105.19 99.99 2zm6 n GLY 36 Ca 0.04 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 2zm6 n GLY 36 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2zm6 s PRO 37 N -2.57 4.45 -0.03 1.61 0.04 -1.25 -4.15 135.00 133.10 2zm6 s PRO 37 Ca 0.00 1.30 0.06 0.00 0.04 0.00 0.00 61.00 62.39 2zm6 s PRO 37 Cb 0.00 -3.51 -0.01 0.00 0.04 0.00 0.00 34.50 31.02 2zm6 s PRO 37 CO 0.00 -0.19 -0.20 0.96 0.04 0.00 0.00 177.00 177.61 2zm6 s ILE 38 N 1.58 1.57 0.99 0.56 -4.36 0.94 -4.91 121.20 117.56 2zm6 s ILE 38 Ca 0.47 -0.83 -0.15 0.00 -0.26 0.00 0.00 60.65 59.88 2zm6 s ILE 38 Cb -0.19 -1.32 0.19 0.00 1.25 0.00 0.00 42.46 42.39 2zm6 s ILE 38 CO 0.20 0.45 1.19 -2.16 0.24 0.00 0.00 174.94 174.86 2zm6 s PRO 39 N -0.32 0.50 0.00 0.37 0.04 -1.26 -0.71 135.00 133.62 2zm6 s PRO 39 Ca 0.04 -0.03 0.00 0.00 0.04 0.00 0.00 61.00 61.05 2zm6 s PRO 39 Cb -0.09 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.66 2zm6 s PRO 39 CO 0.00 -2.57 0.00 1.28 0.04 0.00 0.00 177.00 175.75 2zm6 n LEU 40 N -3.96 0.00 -0.00 -3.56 4.77 -0.95 -4.82 117.00 108.48 2zm6 n LEU 40 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2zm6 n LEU 40 Cb 0.59 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 2zm6 n LEU 40 CO 0.51 0.00 0.00 -2.65 -1.33 0.00 0.00 177.39 173.92 2zm6 n PRO 41 N 0.00 0.00 -3.47 3.23 -0.02 -1.26 -5.13 135.00 128.35 2zm6 n PRO 41 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.49 2zm6 n PRO 41 Cb 0.00 -0.00 -0.05 0.00 -0.02 0.00 0.00 33.50 33.43 2zm6 n PRO 41 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2zm6 s THR 42 N -0.81 -0.15 -0.25 3.45 2.01 -1.26 -4.34 115.64 114.29 2zm6 s THR 42 Ca 0.00 0.00 -0.11 0.00 0.31 0.00 0.00 61.69 61.89 2zm6 s THR 42 Cb 0.00 -1.00 -0.05 0.00 0.01 0.00 0.00 72.50 71.46 2zm6 s THR 42 CO 0.00 0.00 0.17 -0.13 -0.69 0.00 0.00 174.62 173.97 2zm6 s ARG 43 N 1.73 4.04 0.07 4.92 0.52 -1.23 -4.92 118.95 124.08 2zm6 s ARG 43 Ca -0.05 -0.27 -0.10 0.00 -0.52 0.00 0.00 55.73 54.79 2zm6 s ARG 43 Cb -0.03 -3.57 -0.06 0.00 0.52 0.00 0.00 34.95 31.81 2zm6 s ARG 43 CO -0.15 -0.00 0.40 0.08 0.02 0.00 0.00 175.30 175.65 2zm6 s VAL 44 N 1.24 5.09 -0.70 3.52 1.01 -1.26 -2.04 120.40 127.25 2zm6 s VAL 44 Ca 0.08 0.50 0.05 0.00 0.00 0.00 0.00 61.98 62.61 2zm6 s VAL 44 Cb -0.14 -3.65 0.18 0.00 0.00 0.00 0.00 36.38 32.77 2zm6 s VAL 44 CO 0.06 0.32 0.53 0.54 0.00 0.00 0.00 175.10 176.55 2zm6 n ARG 45 N 1.01 1.93 -1.84 2.72 5.12 -1.13 -4.90 116.66 119.57 2zm6 n ARG 45 Ca -0.09 -4.52 -0.38 0.00 -1.93 0.00 0.00 57.85 50.93 2zm6 n ARG 45 Cb 0.52 -2.29 0.03 0.00 -1.16 0.00 0.00 32.46 29.57 2zm6 n ARG 45 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2zm6 s ARG 46 N -1.60 3.23 -0.18 5.56 1.81 -1.26 -3.71 118.95 122.80 2zm6 s ARG 46 Ca 0.27 2.18 -0.04 0.00 -1.72 0.00 0.00 55.73 56.42 2zm6 s ARG 46 Cb -0.02 -2.28 0.06 0.00 -0.45 0.00 0.00 34.95 32.26 2zm6 s ARG 46 CO -0.15 -1.10 0.06 -0.06 -0.68 0.00 0.00 175.30 173.36 2zm6 s PHE 47 N -1.33 0.65 -0.67 -0.53 0.40 0.24 -4.97 117.98 111.77 2zm6 s PHE 47 Ca 0.70 -0.59 -0.16 0.00 -0.60 0.00 0.00 56.93 56.29 2zm6 s PHE 47 Cb -0.39 -0.87 0.16 0.00 0.51 0.00 0.00 43.02 42.43 2zm6 s PHE 47 CO 0.46 -0.55 0.65 0.99 0.70 0.00 0.00 175.22 177.47 2zm6 s THR 48 N 1.99 5.29 0.15 0.64 2.01 -1.26 -1.46 115.64 122.99 2zm6 s THR 48 Ca 0.01 -1.80 0.08 0.00 0.31 0.00 0.00 61.69 60.28 2zm6 s THR 48 Cb -0.16 -4.42 -0.04 0.00 0.01 0.00 0.00 72.50 67.88 2zm6 s THR 48 CO -0.08 -0.98 -0.09 -0.69 -0.69 0.00 0.00 174.62 172.09 2zm6 s VAL 49 N 1.24 3.32 -0.02 3.82 1.01 -0.82 -4.95 120.40 124.00 2zm6 s VAL 49 Ca 0.11 -1.46 -0.30 0.00 0.00 0.00 0.00 61.98 60.33 2zm6 s VAL 49 Cb -0.21 -2.61 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 2zm6 s VAL 49 CO -0.01 -0.01 0.97 -0.63 0.00 0.00 0.00 175.10 175.42 2zm6 s ILE 50 N -1.48 4.86 0.05 2.22 1.01 -1.26 0.17 121.20 126.77 2zm6 s ILE 50 Ca 0.23 2.03 -0.20 0.00 0.00 0.00 0.00 60.65 62.71 2zm6 s ILE 50 Cb -0.10 -4.31 -0.10 0.00 0.01 0.00 0.00 42.46 37.97 2zm6 s ILE 50 CO 0.15 0.14 1.31 0.03 0.00 0.00 0.00 174.94 176.57 2zm6 h ARG 51 N 6.85 -0.55 -6.94 2.79 3.08 -1.85 -3.43 114.38 114.34 2zm6 h ARG 51 Ca -0.39 0.04 -0.49 0.00 0.07 0.00 0.00 59.98 59.20 2zm6 h ARG 51 Cb 1.21 0.12 0.03 0.00 0.08 0.00 0.00 29.97 31.41 2zm6 h ARG 51 CO 0.77 -0.37 0.45 0.20 -1.07 0.00 0.00 179.97 179.95 2zm6 s GLY 52 N -1.62 2.83 0.11 0.04 0.00 -1.26 -4.94 107.32 102.47 2zm6 s GLY 52 Ca -0.10 0.82 0.25 0.00 0.00 0.00 0.00 44.72 45.69 2zm6 s GLY 52 CO 0.34 1.30 1.78 -1.55 0.00 0.00 0.00 173.10 174.97 2zm6 n PRO 53 N 0.13 0.12 -0.03 2.90 -0.04 -1.26 -4.49 135.00 132.32 2zm6 n PRO 53 Ca 0.04 0.17 -0.01 0.00 -0.04 0.00 0.00 63.50 63.66 2zm6 n PRO 53 Cb 0.48 -1.66 -0.00 0.00 -0.04 0.00 0.00 33.50 32.28 2zm6 n PRO 53 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2zm6 h PHE 54 N 0.00 0.00 0.00 0.54 3.57 -1.95 -3.49 116.94 115.60 2zm6 h PHE 54 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2zm6 h PHE 54 Cb 0.53 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.27 2zm6 h PHE 54 CO 0.00 0.00 0.00 0.36 -2.23 0.00 0.00 178.31 176.44 2zm6 n LYS 55 N -3.60 0.00 -2.99 1.11 2.85 -1.26 -5.11 118.16 109.15 2zm6 n LYS 55 Ca -0.02 0.00 -0.06 0.00 -1.05 0.00 0.00 58.31 57.18 2zm6 n LYS 55 Cb 0.06 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.42 2zm6 n LYS 55 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 177.40 176.34 2zm6 s HIS 56 N 0.00 -1.25 0.20 5.58 3.76 -1.26 -5.04 115.29 117.28 2zm6 s HIS 56 Ca 0.00 -0.57 -0.14 0.00 -0.15 0.00 0.00 55.06 54.20 2zm6 s HIS 56 Cb 0.00 0.13 0.22 0.00 1.11 0.00 0.00 32.58 34.04 2zm6 s HIS 56 CO 0.00 -1.18 1.65 1.57 -0.85 0.00 0.00 174.74 175.93 2zm6 h LYS 57 N 5.75 0.03 0.00 1.40 2.10 -1.99 -1.14 116.57 122.72 2zm6 h LYS 57 Ca 0.08 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.73 2zm6 h LYS 57 Cb 1.10 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 2zm6 h LYS 57 CO 0.09 0.02 0.02 -0.25 -2.00 0.00 0.00 179.45 177.33 2zm6 n ASP 58 N -5.36 0.00 0.00 7.07 8.00 -1.26 -3.93 116.55 121.07 2zm6 n ASP 58 Ca 0.07 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.64 2zm6 n ASP 58 Cb 0.31 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.34 2zm6 n ASP 58 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2zm6 n SER 59 N -0.97 0.00 -2.16 -2.24 7.64 -0.43 -5.07 113.62 110.38 2zm6 n SER 59 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2zm6 n SER 59 Cb 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.22 2zm6 n SER 59 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2zm6 n ARG 60 N 0.00 -5.41 -4.21 1.43 1.74 -1.23 -4.74 116.66 104.24 2zm6 n ARG 60 Ca 0.00 3.83 -0.32 0.00 -0.77 0.00 0.00 57.85 60.59 2zm6 n ARG 60 Cb 0.00 -4.31 -0.08 0.00 -1.02 0.00 0.00 32.46 27.05 2zm6 n ARG 60 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2zm6 s GLU 61 N -0.52 2.87 -0.29 5.56 2.12 0.44 -4.75 118.70 124.13 2zm6 s GLU 61 Ca 0.00 -0.58 -0.05 0.00 0.36 0.00 0.00 54.97 54.69 2zm6 s GLU 61 Cb 0.00 -2.73 0.02 0.00 0.26 0.00 0.00 34.13 31.68 2zm6 s GLU 61 CO 0.00 0.63 0.04 -1.01 -0.54 0.00 0.00 175.26 174.38 2zm6 s HIS 62 N -1.14 3.14 -0.10 5.30 3.76 -1.26 -1.95 115.29 123.04 2zm6 s HIS 62 Ca 0.21 -1.21 -0.00 0.00 -0.15 0.00 0.00 55.06 53.91 2zm6 s HIS 62 Cb -0.12 -2.20 -0.03 0.00 1.11 0.00 0.00 32.58 31.35 2zm6 s HIS 62 CO 0.12 -0.64 -0.08 -0.06 -0.85 0.00 0.00 174.74 173.23 2zm6 s PHE 63 N 1.43 2.90 0.47 1.40 2.99 -0.53 -4.95 117.98 121.70 2zm6 s PHE 63 Ca 0.01 -0.22 0.04 0.00 0.00 0.00 0.00 56.93 56.77 2zm6 s PHE 63 Cb -0.17 -1.79 -0.03 0.00 0.00 0.00 0.00 43.02 41.03 2zm6 s PHE 63 CO 0.00 0.11 0.10 -1.83 -0.00 0.00 0.00 175.22 173.61 2zm6 s GLU 64 N -0.28 2.15 -0.36 0.44 -1.05 -1.26 0.83 118.70 119.17 2zm6 s GLU 64 Ca 0.03 -2.17 0.06 0.00 -0.15 0.00 0.00 54.97 52.74 2zm6 s GLU 64 Cb -0.13 -1.73 0.18 0.00 -0.44 0.00 0.00 34.13 32.01 2zm6 s GLU 64 CO 0.03 -0.28 0.54 -1.17 0.95 0.00 0.00 175.26 175.32 2zm6 s LEU 65 N -3.90 -1.14 -0.29 1.83 0.20 -1.24 -4.87 118.68 109.27 2zm6 s LEU 65 Ca 0.24 -0.71 -0.27 0.00 0.69 0.00 0.00 54.13 54.07 2zm6 s LEU 65 Cb 0.03 1.56 0.01 0.00 -0.43 0.00 0.00 46.19 47.36 2zm6 s LEU 65 CO 0.13 -0.24 0.97 -0.13 -0.29 0.00 0.00 176.35 176.79 2zm6 s ARG 66 N 2.04 4.10 -1.11 1.98 0.52 -1.26 -2.84 118.95 122.38 2zm6 s ARG 66 Ca 0.14 1.01 -0.08 0.00 -0.52 0.00 0.00 55.73 56.29 2zm6 s ARG 66 Cb -0.09 -3.70 0.29 0.00 0.52 0.00 0.00 34.95 31.97 2zm6 s ARG 66 CO -0.13 -0.74 1.21 2.41 0.02 0.00 0.00 175.30 178.07 2zm6 n THR 67 N 5.58 4.77 -1.75 0.02 -1.04 -0.86 -4.38 114.28 116.62 2zm6 n THR 67 Ca 0.09 -5.52 -0.40 0.00 -2.04 0.00 0.00 64.05 56.18 2zm6 n THR 67 Cb 0.47 -2.46 0.03 0.00 -1.82 0.00 0.00 70.33 66.54 2zm6 n THR 67 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 2zm6 n HIS 68 N 2.35 2.47 -4.25 -1.42 -0.00 -0.55 -3.56 115.22 110.25 2zm6 n HIS 68 Ca 0.25 0.44 -0.29 0.00 -0.00 0.00 0.00 57.72 58.12 2zm6 n HIS 68 Cb 0.38 -2.41 -0.17 0.00 -0.00 0.00 0.00 29.99 27.79 2zm6 n HIS 68 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.34 175.54 2zm6 s ASN 69 N -0.64 2.55 0.02 0.41 0.01 -1.26 -1.62 114.94 114.41 2zm6 s ASN 69 Ca 0.65 -0.45 0.07 0.00 -0.71 0.00 0.00 52.86 52.42 2zm6 s ASN 69 Cb -0.44 -1.13 -0.02 0.00 0.41 0.00 0.00 41.25 40.06 2zm6 s ASN 69 CO 0.54 -0.02 -0.21 -0.13 -1.51 0.00 0.00 177.10 175.77 2zm6 s ARG 70 N 1.22 1.54 -0.01 -0.60 1.81 0.68 -2.25 118.95 121.35 2zm6 s ARG 70 Ca -0.01 -0.89 0.03 0.00 -1.72 0.00 0.00 55.73 53.14 2zm6 s ARG 70 Cb -0.14 -1.60 -0.01 0.00 -0.45 0.00 0.00 34.95 32.75 2zm6 s ARG 70 CO -0.06 0.42 -0.11 -1.17 -0.68 0.00 0.00 175.30 173.70 2zm6 s LEU 71 N -0.94 2.02 -0.12 2.53 1.98 0.11 0.11 118.68 124.37 2zm6 s LEU 71 Ca 0.08 -0.20 -0.03 0.00 -2.89 0.00 0.00 54.13 51.09 2zm6 s LEU 71 Cb -0.09 -0.58 0.05 0.00 0.66 0.00 0.00 46.19 46.23 2zm6 s LEU 71 CO 0.01 0.14 0.06 -0.69 -1.89 0.00 0.00 176.35 173.97 2zm6 s VAL 72 N -0.26 0.10 -0.11 1.68 1.01 -1.04 -0.04 120.40 121.74 2zm6 s VAL 72 Ca 0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.93 2zm6 s VAL 72 Cb -0.04 -0.53 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 2zm6 s VAL 72 CO -0.00 -0.04 0.18 -1.81 0.00 0.00 0.00 175.10 173.43 2zm6 s ASP 73 N 2.07 6.44 -0.21 3.32 1.11 -1.26 -3.06 116.67 125.08 2zm6 s ASP 73 Ca 0.03 0.53 -0.01 0.00 0.18 0.00 0.00 52.55 53.28 2zm6 s ASP 73 Cb -0.14 -2.09 0.06 0.00 1.07 0.00 0.00 42.92 41.81 2zm6 s ASP 73 CO -0.06 0.39 -0.01 -0.63 1.18 0.00 0.00 175.17 176.04 2zm6 s ILE 74 N -1.01 1.03 0.02 0.77 1.01 -1.15 -2.23 121.20 119.63 2zm6 s ILE 74 Ca 0.16 -0.88 -0.02 0.00 0.00 0.00 0.00 60.65 59.92 2zm6 s ILE 74 Cb -0.13 -1.41 -0.04 0.00 0.01 0.00 0.00 42.46 40.90 2zm6 s ILE 74 CO 0.05 -0.14 0.19 -0.63 0.00 0.00 0.00 174.94 174.40 2zm6 s ILE 75 N 1.63 5.38 -0.49 2.92 1.01 -1.25 -1.23 121.20 129.16 2zm6 s ILE 75 Ca -0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.34 2zm6 s ILE 75 Cb -0.18 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 2zm6 s ILE 75 CO -0.07 0.26 0.44 0.59 0.00 0.00 0.00 174.94 176.16 2zm6 n ASN 76 N 0.73 -4.76 -4.59 3.58 3.02 -1.26 -4.57 115.26 107.42 2zm6 n ASN 76 Ca -0.09 -0.23 -0.43 0.00 -0.03 0.00 0.00 54.58 53.81 2zm6 n ASN 76 Cb 0.52 -3.14 -0.02 0.00 -0.61 0.00 0.00 39.78 36.52 2zm6 n ASN 76 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2zm6 s PRO 77 N -3.42 3.47 0.34 3.52 0.04 -1.26 -4.44 135.00 133.26 2zm6 s PRO 77 Ca 0.14 0.82 0.02 0.00 0.04 0.00 0.00 61.00 62.02 2zm6 s PRO 77 Cb -0.02 -4.06 -0.03 0.00 0.04 0.00 0.00 34.50 30.43 2zm6 s PRO 77 CO 0.40 -1.70 0.53 1.21 0.04 0.00 0.00 177.00 177.48 2zm6 s ASN 78 N 4.24 6.22 0.32 6.66 3.84 -1.26 -4.97 114.94 129.99 2zm6 s ASN 78 Ca 0.60 0.32 0.26 0.00 0.21 0.00 0.00 52.86 54.25 2zm6 s ASN 78 Cb -0.13 -1.88 1.09 0.00 -0.55 0.00 0.00 41.25 39.77 2zm6 s ASN 78 CO 0.31 -0.32 1.77 0.03 -2.79 0.00 0.00 177.10 176.10 2zm6 h ARG 79 N 0.79 0.00 0.10 0.43 3.08 -1.96 -2.48 114.38 114.34 2zm6 h ARG 79 Ca -0.49 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 59.27 2zm6 h ARG 79 Cb 1.23 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 2zm6 h ARG 79 CO 0.60 0.00 -1.45 0.87 -1.07 0.00 0.00 179.97 178.92 2zm6 h LYS 80 N 0.00 0.21 -0.33 0.04 1.57 -1.93 -3.29 116.57 112.84 2zm6 h LYS 80 Ca 0.00 -0.36 -0.04 0.00 -1.87 0.00 0.00 60.65 58.38 2zm6 h LYS 80 Cb 0.37 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 2zm6 h LYS 80 CO 0.00 1.07 0.04 1.15 -0.57 0.00 0.00 179.45 181.14 2zm6 h THR 81 N 0.06 1.24 0.00 -0.16 2.02 -1.58 -2.67 112.91 111.82 2zm6 h THR 81 Ca -0.21 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 66.10 2zm6 h THR 81 Cb 1.99 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 69.57 2zm6 h THR 81 CO 0.16 0.29 0.00 -0.38 0.37 0.00 0.00 175.52 175.96 2zm6 n ILE 82 N -4.58 1.64 0.06 3.11 5.41 -1.08 -2.27 119.36 121.65 2zm6 n ILE 82 Ca -0.02 0.46 -0.04 0.00 1.00 0.00 0.00 62.75 64.15 2zm6 n ILE 82 Cb 0.23 -1.40 -0.02 0.00 -0.71 0.00 0.00 39.64 37.74 2zm6 n ILE 82 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 176.55 176.47 2zm6 h GLU 83 N 0.00 -0.23 -0.85 0.38 4.57 -1.54 -2.39 114.58 114.52 2zm6 h GLU 83 Ca 0.00 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.25 2zm6 h GLU 83 Cb 0.07 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.66 2zm6 h GLU 83 CO 0.00 -0.15 0.56 1.96 -1.18 0.00 0.00 179.01 180.20 2zm6 h GLN 84 N -0.83 0.95 -1.00 1.92 1.08 -1.60 -1.98 115.11 113.65 2zm6 h GLN 84 Ca -0.02 -0.06 -0.68 0.00 -1.45 0.00 0.00 58.65 56.44 2zm6 h GLN 84 Cb 0.18 -0.21 -0.29 0.00 -0.05 0.00 0.00 27.48 27.11 2zm6 h GLN 84 CO 0.04 0.63 0.88 1.28 -0.95 0.00 0.00 178.83 180.70 2zm6 n LEU 85 N -4.48 7.70 0.00 1.46 4.77 -0.96 -4.22 117.00 121.27 2zm6 n LEU 85 Ca 0.12 -4.28 0.00 0.00 -0.03 0.00 0.00 56.01 51.83 2zm6 n LEU 85 Cb 0.19 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.30 2zm6 n LEU 85 CO 0.33 1.46 0.00 0.80 -1.33 0.00 0.00 177.39 178.65 2zm6 n MET 86 N -0.92 0.00 -3.22 3.23 1.56 -0.74 -4.82 117.12 112.20 2zm6 n MET 86 Ca 0.63 0.00 -0.24 0.00 -0.27 0.00 0.00 57.70 57.82 2zm6 n MET 86 Cb 0.68 -0.42 -0.07 0.00 2.15 0.00 0.00 33.22 35.56 2zm6 n MET 86 CO 0.00 0.00 0.00 2.41 -0.73 0.00 0.00 175.97 177.65 2zm6 n THR 87 N -2.33 -0.04 -2.62 1.12 -1.04 -1.26 -4.90 114.28 103.20 2zm6 n THR 87 Ca 0.00 -4.32 -0.12 0.00 -2.04 0.00 0.00 64.05 57.57 2zm6 n THR 87 Cb 0.00 -1.77 0.03 0.00 -1.82 0.00 0.00 70.33 66.77 2zm6 n THR 87 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2zm6 n LEU 88 N 1.14 2.23 -4.85 -4.42 4.77 -1.26 -5.10 117.00 109.50 2zm6 n LEU 88 Ca 0.23 -4.00 -0.21 0.00 -0.03 0.00 0.00 56.01 52.01 2zm6 n LEU 88 Cb 0.52 0.23 -0.04 0.00 -2.33 0.00 0.00 43.42 41.80 2zm6 n LEU 88 CO 0.22 1.67 -0.05 1.51 -1.33 0.00 0.00 177.39 179.41 2zm6 s ASP 89 N -3.28 5.12 0.00 -1.43 -4.77 -1.26 -5.01 116.67 106.04 2zm6 s ASP 89 Ca 0.32 -0.64 0.00 0.00 -3.30 0.00 0.00 52.55 48.93 2zm6 s ASP 89 Cb 0.43 -0.76 0.00 0.00 -1.09 0.00 0.00 42.92 41.50 2zm6 s ASP 89 CO -0.01 -0.49 0.00 0.18 0.70 0.00 0.00 175.17 175.54 2zm6 n LEU 90 N -1.44 0.00 -4.75 2.11 4.77 -1.26 -5.13 117.00 111.30 2zm6 n LEU 90 Ca 0.01 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.62 2zm6 n LEU 90 Cb 0.61 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.73 2zm6 n LEU 90 CO 0.43 0.00 0.89 -2.16 -1.33 0.00 0.00 177.39 175.22 2zm6 s PRO 91 N -0.94 3.16 -0.20 3.23 0.04 -1.26 -4.99 135.00 134.05 2zm6 s PRO 91 Ca 0.00 1.98 -0.05 0.00 0.04 0.00 0.00 61.00 62.96 2zm6 s PRO 91 Cb 0.00 -2.14 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 2zm6 s PRO 91 CO 0.00 -1.09 -0.22 2.41 0.04 0.00 0.00 177.00 178.14 2zm6 n THR 92 N -1.18 1.10 0.17 1.26 -1.04 -1.26 -4.59 114.28 108.74 2zm6 n THR 92 Ca 0.11 -0.34 -0.08 0.00 -2.04 0.00 0.00 64.05 61.71 2zm6 n THR 92 Cb 0.48 -1.52 0.05 0.00 -1.82 0.00 0.00 70.33 67.51 2zm6 n THR 92 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2zm6 n GLY 93 N 2.09 2.87 3.24 3.41 0.00 -1.26 -4.82 105.19 110.72 2zm6 n GLY 93 Ca -0.37 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 44.95 2zm6 n GLY 93 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2zm6 s VAL 94 N -1.07 2.04 -0.11 1.61 1.01 -1.26 -3.96 120.40 118.66 2zm6 s VAL 94 Ca 0.18 -1.04 0.02 0.00 0.00 0.00 0.00 61.98 61.14 2zm6 s VAL 94 Cb 0.15 -1.74 -0.01 0.00 0.00 0.00 0.00 36.38 34.78 2zm6 s VAL 94 CO 0.03 0.56 -0.18 -0.70 0.00 0.00 0.00 175.10 174.81 2zm6 s GLU 95 N 0.04 3.19 0.14 2.72 2.12 -0.98 -5.04 118.70 120.90 2zm6 s GLU 95 Ca -0.10 -0.77 0.09 0.00 0.36 0.00 0.00 54.97 54.55 2zm6 s GLU 95 Cb -0.15 -2.47 -0.04 0.00 0.26 0.00 0.00 34.13 31.73 2zm6 s GLU 95 CO 0.06 0.22 -0.21 0.42 -0.54 0.00 0.00 175.26 175.21 2zm6 s ILE 96 N 0.29 1.91 -0.11 -3.70 1.01 -1.26 -2.30 121.20 117.04 2zm6 s ILE 96 Ca -0.13 -1.78 -0.09 0.00 0.00 0.00 0.00 60.65 58.65 2zm6 s ILE 96 Cb -0.16 -1.80 0.03 0.00 0.01 0.00 0.00 42.46 40.54 2zm6 s ILE 96 CO 0.07 -0.14 0.29 -1.61 0.00 0.00 0.00 174.94 173.54 2zm6 s GLU 97 N -2.37 0.32 -0.02 2.79 2.02 -1.20 -5.05 118.70 115.19 2zm6 s GLU 97 Ca 0.13 0.44 0.06 0.00 0.02 0.00 0.00 54.97 55.62 2zm6 s GLU 97 Cb -0.08 0.11 -0.01 0.00 0.10 0.00 0.00 34.13 34.25 2zm6 s GLU 97 CO 0.06 -0.06 -0.21 0.42 0.02 0.00 0.00 175.26 175.48 2zm6 s ILE 98 N 0.38 1.69 -0.04 -1.63 1.01 -1.26 -2.71 121.20 118.64 2zm6 s ILE 98 Ca -0.02 -0.90 -0.01 0.00 0.00 0.00 0.00 60.65 59.71 2zm6 s ILE 98 Cb -0.04 -1.41 0.03 0.00 0.01 0.00 0.00 42.46 41.06 2zm6 s ILE 98 CO -0.02 0.48 0.07 -0.54 0.00 0.00 0.00 174.94 174.94 2zm6 s LYS 99 N -0.41 -0.01 0.00 2.79 1.02 -1.19 -5.04 119.74 116.89 2zm6 s LYS 99 Ca 0.06 0.31 0.00 0.00 0.02 0.00 0.00 55.97 56.35 2zm6 s LYS 99 Cb -0.09 -0.29 0.00 0.00 -0.52 0.00 0.00 37.83 36.93 2zm6 s LYS 99 CO -0.00 -0.22 0.50 -2.37 -0.92 0.00 0.00 175.35 172.34