#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ui0 h LEU 3 N 0.00 0.66 -0.79 3.22 5.85 -1.97 -1.76 115.31 120.52 1ui0 h LEU 3 Ca 0.00 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.44 1ui0 h LEU 3 Cb 0.00 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1ui0 h LEU 3 CO 0.00 0.79 -0.18 -0.33 -0.34 0.00 0.00 178.44 178.38 1ui0 h GLU 4 N 0.62 0.72 -0.28 1.25 4.39 -2.03 -0.14 114.58 119.11 1ui0 h GLU 4 Ca 0.11 -0.27 -0.13 0.00 0.34 0.00 0.00 59.36 59.41 1ui0 h GLU 4 Cb 0.54 -0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1ui0 h GLU 4 CO 0.03 0.85 -0.35 1.25 -1.16 0.00 0.00 179.01 179.64 1ui0 h LEU 5 N 0.64 0.79 -0.66 1.33 5.85 -1.94 -1.79 115.31 119.52 1ui0 h LEU 5 Ca 0.10 -0.49 0.03 0.00 0.84 0.00 0.00 57.88 58.35 1ui0 h LEU 5 Cb 0.66 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 1ui0 h LEU 5 CO 0.05 1.12 0.40 0.25 -0.34 0.00 0.00 178.44 179.92 1ui0 h LEU 6 N 0.47 0.65 -0.64 2.25 5.85 -1.10 0.27 115.31 123.05 1ui0 h LEU 6 Ca 0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1ui0 h LEU 6 Cb 0.93 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1ui0 h LEU 6 CO 0.08 0.45 0.35 -0.61 -0.34 0.00 0.00 178.44 178.37 1ui0 h GLN 7 N 0.79 0.89 -0.56 1.25 4.15 -0.92 -0.98 115.11 119.73 1ui0 h GLN 7 Ca 0.27 -0.11 -0.05 0.00 0.77 0.00 0.00 58.65 59.53 1ui0 h GLN 7 Cb 0.04 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 1ui0 h GLN 7 CO -0.11 0.68 0.16 0.00 -1.93 0.00 0.00 178.83 177.62 1ui0 h ALA 8 N 1.16 0.74 -0.65 3.38 0.00 -0.62 -2.95 119.26 120.32 1ui0 h ALA 8 Ca 0.22 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1ui0 h ALA 8 Cb 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1ui0 h ALA 8 CO -0.04 0.42 0.13 1.96 0.00 0.00 0.00 179.25 181.72 1ui0 h GLN 9 N 0.79 1.05 0.00 0.00 4.20 -0.67 -2.91 115.11 117.57 1ui0 h GLN 9 Ca 0.18 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1ui0 h GLN 9 Cb 0.31 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 1ui0 h GLN 9 CO -0.00 0.95 -0.00 0.00 -0.67 0.00 0.00 178.83 179.10 1ui0 h ALA 10 N 1.14 1.67 0.00 3.87 0.00 -1.01 -1.75 119.26 123.18 1ui0 h ALA 10 Ca 0.20 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1ui0 h ALA 10 Cb 0.39 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ui0 h ALA 10 CO 0.01 0.01 -0.03 1.96 0.00 0.00 0.00 179.25 181.20 1ui0 h GLN 11 N 0.00 0.00 -0.41 0.00 1.08 -1.46 -2.08 115.11 112.24 1ui0 h GLN 11 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ui0 h GLN 11 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 1ui0 h GLN 11 CO 0.00 0.03 0.00 0.09 -0.95 0.00 0.00 178.83 178.00 1ui0 n ASN 12 N -3.34 3.48 -4.75 1.46 3.02 -0.66 -4.82 115.26 109.66 1ui0 n ASN 12 Ca -0.02 -2.26 -0.41 0.00 -0.03 0.00 0.00 54.58 51.85 1ui0 n ASN 12 Cb 0.14 -0.37 -0.02 0.00 -0.61 0.00 0.00 39.78 38.92 1ui0 n ASN 12 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ui0 n THR 14 N 2.15 0.31 0.24 0.00 -2.24 -1.26 -4.89 114.28 108.59 1ui0 n THR 14 Ca 0.06 -1.18 0.11 0.00 -2.27 0.00 0.00 64.05 60.76 1ui0 n THR 14 Cb 0.41 0.76 0.58 0.00 -2.10 0.00 0.00 70.33 69.99 1ui0 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ui0 h ALA 15 N 0.86 1.13 -2.53 6.98 0.00 -2.00 -3.46 119.26 120.24 1ui0 h ALA 15 Ca -0.17 -0.17 -0.27 0.00 0.00 0.00 0.00 54.91 54.31 1ui0 h ALA 15 Cb 1.71 -0.03 -0.15 0.00 0.00 0.00 0.00 17.79 19.33 1ui0 h ALA 15 CO 0.07 0.23 -0.62 0.00 0.00 0.00 0.00 179.25 178.94 1ui0 h ARG 17 N 2.56 0.00 0.00 0.00 0.11 -1.99 -2.59 114.38 112.47 1ui0 h ARG 17 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 1ui0 h ARG 17 Cb 1.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.33 1ui0 h ARG 17 CO 0.55 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.90 1ui0 n LEU 18 N -2.60 0.57 0.25 0.08 4.77 -1.26 -1.94 117.00 116.87 1ui0 n LEU 18 Ca -0.02 0.69 0.13 0.00 -0.03 0.00 0.00 56.01 56.78 1ui0 n LEU 18 Cb 0.07 -0.66 0.55 0.00 -2.33 0.00 0.00 43.42 41.05 1ui0 n LEU 18 CO 0.15 -0.69 0.89 0.00 -1.33 0.00 0.00 177.39 176.41 1ui0 h MET 19 N 0.00 0.00 -0.53 3.23 -0.00 -1.80 -3.29 114.93 112.55 1ui0 h MET 19 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.67 1ui0 h MET 19 Cb 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.79 1ui0 h MET 19 CO 0.00 0.11 0.22 0.93 -0.00 0.00 0.00 176.91 178.17 1ui0 h GLU 20 N 0.00 0.78 -0.40 -0.10 5.08 -1.63 -3.28 114.58 115.03 1ui0 h GLU 20 Ca -0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1ui0 h GLU 20 Cb 0.65 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1ui0 h GLU 20 CO 0.01 0.68 0.00 0.41 -1.00 0.00 0.00 179.01 179.12 1ui0 n GLY 21 N -0.82 2.02 3.86 -3.84 0.00 -1.24 -5.02 105.19 100.16 1ui0 n GLY 21 Ca 0.02 -0.56 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 1ui0 n GLY 21 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ui0 s ARG 22 N -1.12 3.38 -0.19 1.61 1.70 -1.24 -4.99 118.95 118.11 1ui0 s ARG 22 Ca 0.32 0.75 -0.10 0.00 -0.47 0.00 0.00 55.73 56.22 1ui0 s ARG 22 Cb 0.18 -2.06 -0.08 0.00 -0.57 0.00 0.00 34.95 32.42 1ui0 s ARG 22 CO 0.24 -0.73 -0.26 2.41 -1.08 0.00 0.00 175.30 175.88 1ui0 n THR 23 N -2.85 1.15 -3.91 4.99 -1.04 -1.26 -5.04 114.28 106.32 1ui0 n THR 23 Ca 0.06 -0.21 -0.11 0.00 -2.04 0.00 0.00 64.05 61.75 1ui0 n THR 23 Cb 0.54 -1.82 -0.13 0.00 -1.82 0.00 0.00 70.33 67.10 1ui0 n THR 23 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1ui0 s ARG 24 N -2.41 0.14 0.24 -2.82 0.52 -0.97 -5.05 118.95 108.60 1ui0 s ARG 24 Ca -0.27 -0.23 -0.30 0.00 -0.52 0.00 0.00 55.73 54.41 1ui0 s ARG 24 Cb 0.10 0.05 -0.09 0.00 0.52 0.00 0.00 34.95 35.53 1ui0 s ARG 24 CO 0.35 -0.02 1.14 0.08 0.02 0.00 0.00 175.30 176.87 1ui0 s VAL 25 N -0.59 3.53 -0.73 3.52 1.01 -1.26 -4.72 120.40 121.16 1ui0 s VAL 25 Ca -0.07 1.41 -0.00 0.00 0.00 0.00 0.00 61.98 63.33 1ui0 s VAL 25 Cb -0.04 -3.90 0.18 0.00 0.00 0.00 0.00 36.38 32.62 1ui0 s VAL 25 CO -0.00 0.29 0.55 -0.69 0.00 0.00 0.00 175.10 175.25 1ui0 s VAL 26 N -0.67 3.68 0.05 2.92 1.01 0.67 -4.58 120.40 123.48 1ui0 s VAL 26 Ca 0.48 -3.57 -0.22 0.00 0.00 0.00 0.00 61.98 58.68 1ui0 s VAL 26 Cb -0.32 -3.37 -0.13 0.00 0.00 0.00 0.00 36.38 32.56 1ui0 s VAL 26 CO 0.39 -0.97 1.47 0.15 0.00 0.00 0.00 175.10 176.15 1ui0 h PHE 27 N 6.31 0.24 0.00 5.22 3.57 -1.81 -3.41 116.94 127.06 1ui0 h PHE 27 Ca 0.07 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1ui0 h PHE 27 Cb 0.86 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.54 1ui0 h PHE 27 CO 0.69 0.46 0.00 0.41 -2.23 0.00 0.00 178.31 177.65 1ui0 n GLY 28 N -0.27 3.51 3.36 2.40 0.00 -1.26 -4.65 105.19 108.28 1ui0 n GLY 28 Ca -0.06 -1.55 -0.12 0.00 0.00 0.00 0.00 46.02 44.30 1ui0 n GLY 28 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ui0 s GLU 29 N -2.33 1.11 0.00 1.61 -1.05 -0.30 -4.93 118.70 112.80 1ui0 s GLU 29 Ca 0.00 -0.51 0.00 0.00 -0.15 0.00 0.00 54.97 54.31 1ui0 s GLU 29 Cb 0.00 0.50 0.00 0.00 -0.44 0.00 0.00 34.13 34.19 1ui0 s GLU 29 CO 0.00 -0.44 0.00 0.41 0.95 0.00 0.00 175.26 176.18 1ui0 n GLY 30 N -0.08 0.56 3.64 -3.83 0.00 -1.26 -0.82 105.19 103.40 1ui0 n GLY 30 Ca -0.17 -2.16 -0.42 0.00 0.00 0.00 0.00 46.02 43.26 1ui0 n GLY 30 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1ui0 n ASN 31 N 0.69 3.86 0.00 1.61 2.85 -0.92 -4.87 115.26 118.48 1ui0 n ASN 31 Ca 0.00 0.66 0.05 0.00 -0.11 0.00 0.00 54.58 55.18 1ui0 n ASN 31 Cb 0.00 -1.54 0.23 0.00 1.24 0.00 0.00 39.78 39.71 1ui0 n ASN 31 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1ui0 n PRO 32 N 7.95 0.03 -1.29 1.20 -0.04 -1.26 -1.98 135.00 139.61 1ui0 n PRO 32 Ca 0.23 0.30 0.00 0.00 -0.04 0.00 0.00 63.50 64.00 1ui0 n PRO 32 Cb 0.42 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.49 1ui0 n PRO 32 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1ui0 n ASP 33 N -1.46 1.98 -4.76 3.54 2.03 -1.26 -4.22 116.55 112.39 1ui0 n ASP 33 Ca 0.03 -3.15 -0.40 0.00 0.52 0.00 0.00 54.79 51.79 1ui0 n ASP 33 Cb 0.11 -0.43 0.02 0.00 -0.72 0.00 0.00 41.12 40.11 1ui0 n ASP 33 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ui0 n ALA 34 N -0.53 2.06 0.04 -1.67 0.00 -0.84 -4.92 120.51 114.65 1ui0 n ALA 34 Ca 0.18 0.24 -0.04 0.00 0.00 0.00 0.00 53.44 53.82 1ui0 n ALA 34 Cb 0.88 -2.40 -0.09 0.00 0.00 0.00 0.00 19.45 17.83 1ui0 n ALA 34 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1ui0 h LYS 35 N 2.25 0.00 -5.17 0.00 1.57 -1.89 -3.34 116.57 109.98 1ui0 h LYS 35 Ca -0.51 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.61 1ui0 h LYS 35 Cb 1.27 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 33.29 1ui0 h LYS 35 CO 0.61 0.59 -0.77 -1.17 -0.57 0.00 0.00 179.45 178.14 1ui0 s LEU 36 N -6.25 2.65 -0.11 2.94 2.96 -1.26 -0.08 118.68 119.52 1ui0 s LEU 36 Ca -0.01 -0.41 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1ui0 s LEU 36 Cb 0.09 -1.62 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 1ui0 s LEU 36 CO 0.81 0.08 -0.20 -0.32 -1.32 0.00 0.00 176.35 175.40 1ui0 s MET 37 N 0.87 3.12 -0.18 1.98 -2.45 -0.24 -2.13 119.30 120.28 1ui0 s MET 37 Ca -0.03 -0.81 -0.04 0.00 -1.25 0.00 0.00 55.69 53.56 1ui0 s MET 37 Cb -0.15 -2.41 -0.03 0.00 1.25 0.00 0.00 34.83 33.50 1ui0 s MET 37 CO -0.00 0.22 -0.02 0.42 1.05 0.00 0.00 175.02 176.68 1ui0 s ILE 38 N 0.28 3.89 -0.18 10.11 1.01 0.32 -0.63 121.20 136.00 1ui0 s ILE 38 Ca -0.14 -0.35 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1ui0 s ILE 38 Cb -0.17 -2.73 0.03 0.00 0.01 0.00 0.00 42.46 39.60 1ui0 s ILE 38 CO 0.07 0.46 -0.14 -0.69 0.00 0.00 0.00 174.94 174.65 1ui0 s VAL 39 N 0.66 1.72 0.00 2.92 1.01 -0.45 -1.41 120.40 124.85 1ui0 s VAL 39 Ca -0.01 -0.86 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1ui0 s VAL 39 Cb -0.14 -1.67 0.00 0.00 0.00 0.00 0.00 36.38 34.57 1ui0 s VAL 39 CO 0.02 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.10 1ui0 n GLY 40 N 4.70 1.35 0.04 4.51 0.00 -0.00 -0.49 105.19 115.29 1ui0 n GLY 40 Ca -0.17 -1.97 -0.02 0.00 0.00 0.00 0.00 46.02 43.86 1ui0 n GLY 40 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ui0 h GLU 41 N 0.00 0.00 -2.27 1.61 4.81 -1.87 -1.42 114.58 115.44 1ui0 h GLU 41 Ca 0.00 0.00 0.17 0.00 -0.13 0.00 0.00 59.36 59.40 1ui0 h GLU 41 Cb 0.00 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.28 1ui0 h GLU 41 CO 0.00 0.00 0.51 0.20 -0.73 0.00 0.00 179.01 178.99 1ui0 s GLY 42 N -3.28 -0.30 0.57 1.92 0.00 -1.26 -2.50 107.32 102.48 1ui0 s GLY 42 Ca -0.05 0.37 -0.20 0.00 0.00 0.00 0.00 44.72 44.84 1ui0 s GLY 42 CO 0.08 0.09 1.22 -4.14 0.00 0.00 0.00 173.10 170.35 1ui0 s PRO 43 N -3.20 3.09 0.00 2.90 0.02 -1.26 -5.01 135.00 131.55 1ui0 s PRO 43 Ca 0.11 1.87 0.00 0.00 0.02 0.00 0.00 61.00 63.00 1ui0 s PRO 43 Cb -0.01 -2.03 0.00 0.00 0.02 0.00 0.00 34.50 32.48 1ui0 s PRO 43 CO -0.01 -1.12 0.00 0.41 -0.33 0.00 0.00 177.00 175.95 1ui0 n GLY 44 N 0.53 2.62 0.12 0.52 0.00 -1.26 -4.42 105.19 103.31 1ui0 n GLY 44 Ca 0.12 -2.09 -0.10 0.00 0.00 0.00 0.00 46.02 43.95 1ui0 n GLY 44 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ui0 h GLU 45 N 0.00 0.33 -0.11 1.61 4.81 -1.98 -1.49 114.58 117.74 1ui0 h GLU 45 Ca 0.00 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.08 1ui0 h GLU 45 Cb 0.00 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1ui0 h GLU 45 CO 0.00 0.33 -0.40 1.49 -0.73 0.00 0.00 179.01 179.71 1ui0 h GLU 46 N 0.24 0.24 -0.29 1.92 4.57 -1.96 -2.26 114.58 117.03 1ui0 h GLU 46 Ca 0.08 -0.11 -0.09 0.00 -1.18 0.00 0.00 59.36 58.06 1ui0 h GLU 46 Cb 0.11 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1ui0 h GLU 46 CO -0.01 0.60 -0.15 0.93 -1.18 0.00 0.00 179.01 179.20 1ui0 h GLU 47 N 0.20 0.62 -0.48 1.92 3.07 -1.71 -2.17 114.58 116.04 1ui0 h GLU 47 Ca 0.02 -0.28 -0.01 0.00 -0.50 0.00 0.00 59.36 58.60 1ui0 h GLU 47 Cb 0.79 -0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.66 1ui0 h GLU 47 CO 0.06 0.86 0.27 0.22 -1.40 0.00 0.00 179.01 179.02 1ui0 h ASP 48 N 0.37 0.57 0.27 1.42 3.58 -1.08 0.44 116.42 122.00 1ui0 h ASP 48 Ca 0.06 -0.03 -0.21 0.00 0.42 0.00 0.00 57.03 57.27 1ui0 h ASP 48 Cb 0.67 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 41.58 1ui0 h ASP 48 CO 0.04 0.46 -0.85 0.50 -2.88 0.00 0.00 179.24 176.51 1ui0 h LYS 49 N 0.66 0.44 0.00 0.28 3.64 -1.28 -2.57 116.57 117.74 1ui0 h LYS 49 Ca 0.17 -0.42 -0.06 0.00 -1.27 0.00 0.00 60.65 59.07 1ui0 h LYS 49 Cb 0.01 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1ui0 h LYS 49 CO -0.03 1.07 -2.02 0.25 -2.27 0.00 0.00 179.45 176.45 1ui0 n THR 50 N -3.79 0.23 -0.81 1.00 -2.24 -0.83 -4.90 114.28 102.94 1ui0 n THR 50 Ca -0.06 -0.54 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1ui0 n THR 50 Cb 0.78 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 1ui0 n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ui0 n GLY 51 N 1.40 0.71 3.59 3.38 0.00 0.15 -5.04 105.19 109.39 1ui0 n GLY 51 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1ui0 n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ui0 s ARG 52 N -0.19 2.51 0.42 1.61 0.52 -1.22 -4.32 118.95 118.29 1ui0 s ARG 52 Ca 0.00 -0.75 -0.16 0.00 -0.52 0.00 0.00 55.73 54.30 1ui0 s ARG 52 Cb 0.00 -2.48 -0.09 0.00 0.52 0.00 0.00 34.95 32.90 1ui0 s ARG 52 CO 0.00 0.59 0.87 -1.25 0.02 0.00 0.00 175.30 175.53 1ui0 s PRO 53 N -1.48 4.00 -1.04 3.54 0.04 -1.26 -4.29 135.00 134.51 1ui0 s PRO 53 Ca 0.17 0.82 -0.19 0.00 0.04 0.00 0.00 61.00 61.85 1ui0 s PRO 53 Cb -0.11 -2.28 0.02 0.00 0.04 0.00 0.00 34.50 32.17 1ui0 s PRO 53 CO 0.08 -0.05 0.67 1.19 0.04 0.00 0.00 177.00 178.93 1ui0 n PHE 54 N -0.95 -1.77 0.00 0.56 3.72 -1.26 -4.90 117.46 112.85 1ui0 n PHE 54 Ca 0.05 0.45 0.00 0.00 -0.05 0.00 0.00 57.45 57.90 1ui0 n PHE 54 Cb 0.54 -2.92 0.00 0.00 -0.94 0.00 0.00 39.48 36.15 1ui0 n PHE 54 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1ui0 n VAL 55 N -3.91 0.00 -0.20 -4.37 0.24 -1.26 -4.43 118.33 104.40 1ui0 n VAL 55 Ca -0.18 -0.34 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 1ui0 n VAL 55 Cb 0.61 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.84 1ui0 n VAL 55 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1ui0 n GLY 56 N 1.32 -0.55 0.18 7.63 0.00 -1.26 -4.58 105.19 107.92 1ui0 n GLY 56 Ca 0.00 -1.66 -0.05 0.00 0.00 0.00 0.00 46.02 44.30 1ui0 n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ui0 h LYS 57 N 0.00 0.35 -0.56 1.61 1.57 -1.99 0.56 116.57 118.11 1ui0 h LYS 57 Ca 0.00 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1ui0 h LYS 57 Cb 0.00 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1ui0 h LYS 57 CO 0.00 0.23 0.17 0.00 -0.57 0.00 0.00 179.45 179.28 1ui0 h ALA 58 N 1.26 1.24 -0.54 3.86 0.00 -1.93 -2.27 119.26 120.89 1ui0 h ALA 58 Ca 0.19 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1ui0 h ALA 58 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1ui0 h ALA 58 CO -0.17 0.54 -0.03 0.78 0.00 0.00 0.00 179.25 180.37 1ui0 h GLY 59 N 0.97 1.01 1.53 0.00 0.00 -1.51 -1.21 103.07 103.85 1ui0 h GLY 59 Ca 0.19 -0.73 -0.07 0.00 0.00 0.00 0.00 47.33 46.72 1ui0 h GLY 59 CO -0.01 0.67 -0.09 1.46 0.00 0.00 0.00 176.54 178.58 1ui0 h GLN 60 N 0.86 0.57 -0.45 4.80 1.08 -0.50 -0.74 115.11 120.73 1ui0 h GLN 60 Ca 0.15 -0.16 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 1ui0 h GLN 60 Cb 0.54 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 1ui0 h GLN 60 CO 0.03 0.66 -0.29 1.25 -0.95 0.00 0.00 178.83 179.53 1ui0 h LEU 61 N 0.53 1.03 -1.04 1.46 5.85 -1.06 -2.23 115.31 119.84 1ui0 h LEU 61 Ca 0.10 -0.42 0.01 0.00 0.84 0.00 0.00 57.88 58.41 1ui0 h LEU 61 Cb 0.48 -0.29 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 1ui0 h LEU 61 CO 0.03 1.23 0.65 0.25 -0.34 0.00 0.00 178.44 180.25 1ui0 h LEU 62 N 0.83 1.12 -0.91 2.25 5.85 -0.62 -0.83 115.31 122.99 1ui0 h LEU 62 Ca 0.09 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1ui0 h LEU 62 Cb 0.88 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.59 1ui0 h LEU 62 CO 0.08 0.81 0.41 0.78 -0.34 0.00 0.00 178.44 180.18 1ui0 h ASN 63 N 1.32 1.07 -0.54 1.25 2.35 -0.86 -0.45 115.58 119.73 1ui0 h ASN 63 Ca 0.36 -0.12 -0.07 0.00 -0.55 0.00 0.00 56.30 55.92 1ui0 h ASN 63 Cb -0.15 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 37.92 1ui0 h ASN 63 CO -0.08 0.90 0.07 0.03 -1.65 0.00 0.00 177.43 176.70 1ui0 h ARG 64 N 1.18 0.90 -0.26 0.81 3.08 -0.74 -0.86 114.38 118.48 1ui0 h ARG 64 Ca 0.29 -0.25 -0.01 0.00 0.07 0.00 0.00 59.98 60.08 1ui0 h ARG 64 Cb 0.10 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1ui0 h ARG 64 CO -0.04 0.89 0.14 0.82 -1.07 0.00 0.00 179.97 180.71 1ui0 h ILE 65 N 0.79 1.13 -0.35 2.04 2.04 -0.67 -1.10 117.51 121.40 1ui0 h ILE 65 Ca 0.16 -0.36 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 1ui0 h ILE 65 Cb 0.43 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 1ui0 h ILE 65 CO 0.01 0.13 0.05 -0.07 0.00 0.00 0.00 178.15 178.28 1ui0 h LEU 66 N 0.30 0.55 -0.33 1.44 3.38 -0.99 -2.37 115.31 117.30 1ui0 h LEU 66 Ca 0.09 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.80 1ui0 h LEU 66 Cb 0.09 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 1ui0 h LEU 66 CO -0.01 0.68 0.20 -0.08 0.09 0.00 0.00 178.44 179.32 1ui0 h GLU 67 N 0.41 0.40 -0.37 1.13 4.22 -1.07 -0.20 114.58 119.11 1ui0 h GLU 67 Ca 0.10 -0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.51 1ui0 h GLU 67 Cb 0.36 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1ui0 h GLU 67 CO 0.01 0.27 0.20 0.00 -2.18 0.00 0.00 179.01 177.31 1ui0 h ALA 68 N 1.13 1.67 0.00 2.92 0.00 -1.12 -1.42 119.26 122.44 1ui0 h ALA 68 Ca 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ui0 h ALA 68 Cb -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1ui0 h ALA 68 CO -0.04 0.28 -0.03 0.00 0.00 0.00 0.00 179.25 179.46 1ui0 n ALA 69 N -2.48 2.38 -1.14 0.00 0.00 -0.90 -4.91 120.51 113.46 1ui0 n ALA 69 Ca 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ui0 n ALA 69 Cb 0.10 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.10 1ui0 n ALA 69 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ui0 n GLY 70 N 1.44 0.57 3.30 0.00 0.00 -0.53 -4.90 105.19 105.08 1ui0 n GLY 70 Ca 0.06 -0.82 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 1ui0 n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ui0 s ILE 71 N -2.00 4.20 0.01 -0.61 1.01 -0.16 -5.02 121.20 118.63 1ui0 s ILE 71 Ca 0.00 -1.17 -0.30 0.00 0.00 0.00 0.00 60.65 59.18 1ui0 s ILE 71 Cb 0.00 -3.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.95 1ui0 s ILE 71 CO 0.00 -0.34 1.59 -2.16 0.00 0.00 0.00 174.94 174.03 1ui0 s PRO 72 N 1.45 4.21 0.34 2.79 0.04 -1.26 -4.09 135.00 138.48 1ui0 s PRO 72 Ca 0.01 2.18 0.07 0.00 0.04 0.00 0.00 61.00 63.31 1ui0 s PRO 72 Cb -0.21 -3.73 0.75 0.00 0.04 0.00 0.00 34.50 31.35 1ui0 s PRO 72 CO 0.04 -0.73 1.86 -0.09 0.04 0.00 0.00 177.00 178.11 1ui0 h ARG 73 N 8.63 0.74 0.00 4.56 2.43 -1.94 -1.36 114.38 127.45 1ui0 h ARG 73 Ca -0.40 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 58.71 1ui0 h ARG 73 Cb 1.19 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.57 1ui0 h ARG 73 CO 0.93 0.49 -0.05 1.05 -1.51 0.00 0.00 179.97 180.88 1ui0 h GLU 74 N 0.77 0.00 0.00 0.20 9.09 -1.98 -2.28 114.58 120.37 1ui0 h GLU 74 Ca 0.46 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.87 1ui0 h GLU 74 Cb 0.65 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.75 1ui0 h GLU 74 CO -0.22 0.05 -0.25 0.39 0.05 0.00 0.00 179.01 179.03 1ui0 n GLU 75 N -3.49 0.01 -3.97 1.06 1.02 -0.51 -2.69 120.64 112.06 1ui0 n GLU 75 Ca -0.02 0.01 -0.22 0.00 -0.02 0.00 0.00 57.16 56.90 1ui0 n GLU 75 Cb 0.17 -1.51 -0.05 0.00 -0.02 0.00 0.00 31.44 30.03 1ui0 n GLU 75 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1ui0 s VAL 76 N -3.01 3.46 -0.15 2.62 -7.23 -0.86 -4.51 120.40 110.73 1ui0 s VAL 76 Ca 0.12 -1.51 -0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1ui0 s VAL 76 Cb 0.18 -3.12 -0.02 0.00 0.56 0.00 0.00 36.38 33.98 1ui0 s VAL 76 CO 0.62 -0.21 -0.06 -0.47 -0.31 0.00 0.00 175.10 174.66 1ui0 s TYR 77 N -2.33 2.96 -0.09 2.82 5.04 -0.90 -2.17 117.35 122.68 1ui0 s TYR 77 Ca 0.38 -0.44 0.04 0.00 -2.44 0.00 0.00 57.07 54.61 1ui0 s TYR 77 Cb -0.05 -1.94 0.00 0.00 0.35 0.00 0.00 41.96 40.33 1ui0 s TYR 77 CO 0.25 -0.12 -0.23 0.42 -1.34 0.00 0.00 175.55 174.53 1ui0 s ILE 78 N 0.44 1.94 0.00 3.14 1.01 0.00 -0.52 121.20 127.22 1ui0 s ILE 78 Ca -0.05 -0.96 0.00 0.00 0.00 0.00 0.00 60.65 59.64 1ui0 s ILE 78 Cb -0.15 -1.68 0.00 0.00 0.01 0.00 0.00 42.46 40.64 1ui0 s ILE 78 CO 0.03 0.54 0.00 1.07 0.00 0.00 0.00 174.94 176.58 1ui0 n THR 79 N 3.49 0.00 -4.17 2.92 5.66 -0.50 -1.15 114.28 120.52 1ui0 n THR 79 Ca -0.19 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.69 1ui0 n THR 79 Cb 0.53 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.21 1ui0 n THR 79 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1ui0 s ASN 80 N -0.82 0.16 0.21 1.09 0.01 -1.26 -0.82 114.94 113.51 1ui0 s ASN 80 Ca 0.00 -1.32 -0.10 0.00 -0.71 0.00 0.00 52.86 50.73 1ui0 s ASN 80 Cb 0.00 0.38 0.16 0.00 0.41 0.00 0.00 41.25 42.20 1ui0 s ASN 80 CO 0.00 -0.84 1.85 0.40 -1.51 0.00 0.00 177.10 177.00 1ui0 h ILE 81 N 2.63 1.22 -3.53 0.60 1.08 -0.98 -3.43 117.51 115.11 1ui0 h ILE 81 Ca -0.35 -0.49 -0.65 0.00 -0.39 0.00 0.00 64.86 62.98 1ui0 h ILE 81 Cb 1.24 0.14 -0.20 0.00 -3.07 0.00 0.00 36.82 34.93 1ui0 h ILE 81 CO 0.53 0.23 -0.84 0.68 -0.69 0.00 0.00 178.15 178.06 1ui0 s VAL 82 N -5.97 2.23 -1.57 1.67 -7.23 -1.04 -4.14 120.40 104.35 1ui0 s VAL 82 Ca -0.13 -1.88 0.23 0.00 -1.81 0.00 0.00 61.98 58.39 1ui0 s VAL 82 Cb 0.15 -2.01 -0.03 0.00 0.56 0.00 0.00 36.38 35.06 1ui0 s VAL 82 CO 0.80 -0.05 1.15 0.29 -0.31 0.00 0.00 175.10 176.98 1ui0 n LYS 83 N 0.58 0.65 -5.14 4.82 4.76 -1.26 -4.30 118.16 118.26 1ui0 n LYS 83 Ca -0.15 -0.50 -0.30 0.00 -2.87 0.00 0.00 58.31 54.48 1ui0 n LYS 83 Cb 0.55 -1.49 -0.16 0.00 -1.84 0.00 0.00 35.03 32.08 1ui0 n LYS 83 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ui0 n ARG 85 N 3.15 2.05 -1.86 0.00 0.63 -1.26 -4.58 116.66 114.79 1ui0 n ARG 85 Ca -0.18 0.67 -0.33 0.00 -0.92 0.00 0.00 57.85 57.08 1ui0 n ARG 85 Cb 0.52 -2.90 0.04 0.00 0.45 0.00 0.00 32.46 30.57 1ui0 n ARG 85 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1ui0 s PRO 86 N 5.36 2.96 -0.24 -0.14 0.02 -1.26 -4.64 135.00 137.06 1ui0 s PRO 86 Ca 0.98 1.36 -0.40 0.00 0.02 0.00 0.00 61.00 62.96 1ui0 s PRO 86 Cb -0.54 -1.97 -0.16 0.00 0.02 0.00 0.00 34.50 31.85 1ui0 s PRO 86 CO 0.43 -1.12 1.71 -2.30 -0.33 0.00 0.00 177.00 175.40 1ui0 n PRO 87 N -2.26 1.18 -3.35 5.54 -0.02 -1.26 -1.72 135.00 133.10 1ui0 n PRO 87 Ca 0.10 0.43 -0.24 0.00 -2.02 0.00 0.00 63.50 61.77 1ui0 n PRO 87 Cb 0.52 -2.11 0.01 0.00 -0.02 0.00 0.00 33.50 31.90 1ui0 n PRO 87 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1ui0 n GLN 88 N 5.16 -4.20 -2.01 -0.52 1.13 -1.26 -1.95 117.38 113.72 1ui0 n GLN 88 Ca 0.26 0.62 -0.17 0.00 -1.94 0.00 0.00 57.00 55.77 1ui0 n GLN 88 Cb 0.14 -5.41 -0.03 0.00 0.11 0.00 0.00 30.24 25.05 1ui0 n GLN 88 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1ui0 n ASN 89 N -2.45 -5.03 -4.77 1.08 3.02 -0.70 -5.00 115.26 101.41 1ui0 n ASN 89 Ca -0.03 0.15 -0.31 0.00 -0.03 0.00 0.00 54.58 54.36 1ui0 n ASN 89 Cb 0.56 -4.09 0.09 0.00 -0.61 0.00 0.00 39.78 35.73 1ui0 n ASN 89 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ui0 s ARG 90 N -4.32 2.26 0.53 3.52 1.70 -0.82 -4.97 118.95 116.85 1ui0 s ARG 90 Ca 0.00 1.11 -0.19 0.00 -0.47 0.00 0.00 55.73 56.18 1ui0 s ARG 90 Cb 0.00 -1.90 -0.06 0.00 -0.57 0.00 0.00 34.95 32.41 1ui0 s ARG 90 CO 0.00 -1.62 1.08 0.00 -1.08 0.00 0.00 175.30 173.68 1ui0 s ALA 91 N -2.93 2.77 0.49 7.88 0.00 -1.26 -4.53 121.76 124.18 1ui0 s ALA 91 Ca 0.61 0.66 -0.22 0.00 0.00 0.00 0.00 51.96 53.01 1ui0 s ALA 91 Cb -0.17 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.59 1ui0 s ALA 91 CO 0.56 -0.60 1.18 -1.25 0.00 0.00 0.00 175.76 175.65 1ui0 s PRO 92 N -3.40 3.58 0.63 0.00 0.04 -1.26 -5.02 135.00 129.57 1ui0 s PRO 92 Ca 0.69 1.79 -0.11 0.00 0.04 0.00 0.00 61.00 63.40 1ui0 s PRO 92 Cb -0.19 -2.29 -0.03 0.00 0.04 0.00 0.00 34.50 32.03 1ui0 s PRO 92 CO 0.26 -0.70 1.04 -0.51 0.04 0.00 0.00 177.00 177.12 1ui0 s LEU 93 N -3.28 3.21 0.27 -3.56 1.43 -1.26 -4.84 118.68 110.65 1ui0 s LEU 93 Ca 0.67 1.44 0.00 0.00 -1.03 0.00 0.00 54.13 55.21 1ui0 s LEU 93 Cb -0.29 -4.47 0.58 0.00 0.03 0.00 0.00 46.19 42.05 1ui0 s LEU 93 CO 0.34 -0.96 1.74 1.55 0.23 0.00 0.00 176.35 179.26 1ui0 h PRO 94 N -0.38 0.54 -0.34 1.29 0.13 -1.99 -0.96 132.00 130.29 1ui0 h PRO 94 Ca -0.44 -0.03 -0.11 0.00 -0.87 0.00 0.00 66.00 64.54 1ui0 h PRO 94 Cb 1.19 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 1ui0 h PRO 94 CO 0.61 0.36 -0.26 0.38 -0.23 0.00 0.00 178.00 178.87 1ui0 h ASP 95 N 0.56 0.70 -0.27 1.44 2.03 -1.99 -1.43 116.42 117.45 1ui0 h ASP 95 Ca 0.49 -0.26 -0.06 0.00 -0.73 0.00 0.00 57.03 56.47 1ui0 h ASP 95 Cb 0.76 -0.19 -0.01 0.00 -0.83 0.00 0.00 39.33 39.06 1ui0 h ASP 95 CO -0.41 0.93 -0.07 -0.33 -1.03 0.00 0.00 179.24 178.33 1ui0 h GLU 96 N 0.59 0.52 -0.62 4.15 5.08 -1.73 -1.69 114.58 120.88 1ui0 h GLU 96 Ca 0.08 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1ui0 h GLU 96 Cb 0.74 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 1ui0 h GLU 96 CO 0.06 0.73 0.30 0.00 -1.00 0.00 0.00 179.01 179.10 1ui0 h ALA 97 N 0.77 0.80 -0.10 3.43 0.00 -1.12 -1.13 119.26 121.92 1ui0 h ALA 97 Ca 0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1ui0 h ALA 97 Cb 0.54 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ui0 h ALA 97 CO 0.03 0.37 0.03 -0.22 0.00 0.00 0.00 179.25 179.45 1ui0 h LYS 98 N 0.85 0.15 -0.21 0.00 3.64 -1.18 -1.43 116.57 118.40 1ui0 h LYS 98 Ca 0.21 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1ui0 h LYS 98 Cb 0.12 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 1ui0 h LYS 98 CO -0.03 0.31 0.12 0.82 -2.27 0.00 0.00 179.45 178.41 1ui0 h ILE 99 N -0.03 1.10 -0.54 2.00 2.04 -1.20 -0.89 117.51 119.99 1ui0 h ILE 99 Ca 0.03 -0.27 -0.10 0.00 1.00 0.00 0.00 64.86 65.53 1ui0 h ILE 99 Cb 0.22 0.89 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 1ui0 h ILE 99 CO -0.00 0.10 -0.06 0.00 0.00 0.00 0.00 178.15 178.19 1ui0 h THR 101 N 0.86 1.32 -0.56 0.00 1.35 -1.21 0.77 112.91 115.43 1ui0 h THR 101 Ca 0.14 -1.77 -0.11 0.00 -0.55 0.00 0.00 66.41 64.13 1ui0 h THR 101 Cb 0.61 1.74 -0.02 0.00 -1.73 0.00 0.00 68.15 68.75 1ui0 h THR 101 CO 0.04 0.55 -0.06 0.44 -0.25 0.00 0.00 175.52 176.24 1ui0 h ASP 102 N 0.43 1.02 0.26 5.36 3.32 -1.05 -0.71 116.42 125.05 1ui0 h ASP 102 Ca 0.01 -0.33 -0.33 0.00 0.02 0.00 0.00 57.03 56.40 1ui0 h ASP 102 Cb 1.07 -0.28 0.04 0.00 0.22 0.00 0.00 39.33 40.38 1ui0 h ASP 102 CO 0.10 1.11 -1.45 0.50 -1.72 0.00 0.00 179.24 177.78 1ui0 h LYS 103 N 0.91 0.55 0.00 3.56 3.64 -1.18 -3.43 116.57 120.61 1ui0 h LYS 103 Ca 0.15 -0.91 -0.01 0.00 -1.27 0.00 0.00 60.65 58.61 1ui0 h LYS 103 Cb 0.63 0.33 -0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1ui0 h LYS 103 CO 0.04 1.43 -0.31 0.91 -2.27 0.00 0.00 179.45 179.26 1ui0 n TRP 104 N -3.72 0.00 -0.16 1.91 7.02 0.26 -4.74 117.44 118.01 1ui0 n TRP 104 Ca -0.16 0.00 -0.02 0.00 -1.02 0.00 0.00 57.50 56.30 1ui0 n TRP 104 Cb 1.09 -0.06 0.07 0.00 -2.42 0.00 0.00 31.31 29.99 1ui0 n TRP 104 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1ui0 h LEU 105 N -0.09 -0.11 -0.95 -0.99 5.85 -1.46 -0.72 115.31 116.84 1ui0 h LEU 105 Ca -0.01 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.84 1ui0 h LEU 105 Cb 0.29 0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 1ui0 h LEU 105 CO -0.01 -0.03 0.62 -0.07 -0.34 0.00 0.00 178.44 178.61 1ui0 h LEU 106 N 0.17 1.04 -0.56 2.25 3.38 -1.40 -0.64 115.31 119.56 1ui0 h LEU 106 Ca 0.26 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.06 1ui0 h LEU 106 Cb 0.37 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ui0 h LEU 106 CO -0.38 0.73 -0.45 0.11 0.09 0.00 0.00 178.44 178.53 1ui0 h LYS 107 N 1.22 0.64 -0.42 1.13 1.57 -1.66 -1.49 116.57 117.57 1ui0 h LYS 107 Ca 0.37 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1ui0 h LYS 107 Cb -0.04 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1ui0 h LYS 107 CO -0.11 0.97 0.21 1.96 -0.57 0.00 0.00 179.45 181.91 1ui0 h GLN 108 N 0.52 0.59 -0.66 3.15 4.20 -0.53 -0.91 115.11 121.47 1ui0 h GLN 108 Ca 0.03 -0.08 -0.06 0.00 0.06 0.00 0.00 58.65 58.60 1ui0 h GLN 108 Cb 0.99 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.63 1ui0 h GLN 108 CO 0.09 0.50 0.18 0.82 -0.67 0.00 0.00 178.83 179.75 1ui0 h ILE 109 N 0.53 1.25 -0.45 2.54 2.04 -1.01 -0.35 117.51 122.07 1ui0 h ILE 109 Ca 0.14 -0.90 -0.03 0.00 1.00 0.00 0.00 64.86 65.07 1ui0 h ILE 109 Cb 0.09 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1ui0 h ILE 109 CO -0.02 0.35 0.14 -0.08 0.00 0.00 0.00 178.15 178.54 1ui0 h GLU 110 N 0.99 0.69 -0.12 2.37 4.81 -0.93 0.17 114.58 122.56 1ui0 h GLU 110 Ca 0.21 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.21 1ui0 h GLU 110 Cb 0.32 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1ui0 h GLU 110 CO -0.00 0.66 -0.27 -0.07 -0.73 0.00 0.00 179.01 178.60 1ui0 h LEU 111 N 0.58 0.46 -0.30 1.64 3.38 -0.97 -3.30 115.31 116.80 1ui0 h LEU 111 Ca 0.14 -0.57 -0.20 0.00 0.09 0.00 0.00 57.88 57.34 1ui0 h LEU 111 Cb 0.26 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 1ui0 h LEU 111 CO -0.01 0.94 -0.80 0.40 0.09 0.00 0.00 178.44 179.06 1ui0 h ILE 112 N -0.01 1.38 -5.96 1.22 2.04 -1.08 -3.48 117.51 111.62 1ui0 h ILE 112 Ca 0.00 -2.22 -0.37 0.00 1.00 0.00 0.00 64.86 63.27 1ui0 h ILE 112 Cb 0.87 2.20 0.12 0.00 -0.74 0.00 0.00 36.82 39.27 1ui0 h ILE 112 CO 0.06 0.67 -0.91 0.00 0.00 0.00 0.00 178.15 177.98 1ui0 n ALA 113 N -2.53 -2.49 -1.51 1.87 0.00 0.59 -4.41 120.51 112.03 1ui0 n ALA 113 Ca -0.05 -0.11 -0.33 0.00 0.00 0.00 0.00 53.44 52.95 1ui0 n ALA 113 Cb 0.75 -4.54 0.05 0.00 0.00 0.00 0.00 19.45 15.71 1ui0 n ALA 113 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1ui0 s PRO 114 N -5.45 2.84 -0.00 0.00 0.04 -1.25 -4.86 135.00 126.30 1ui0 s PRO 114 Ca 0.44 1.29 0.22 0.00 0.04 0.00 0.00 61.00 62.98 1ui0 s PRO 114 Cb -0.12 -1.96 -0.28 0.00 0.04 0.00 0.00 34.50 32.18 1ui0 s PRO 114 CO 0.82 -1.20 0.55 1.04 0.04 0.00 0.00 177.00 178.24 1ui0 n GLN 115 N -2.55 0.65 -3.97 4.56 6.02 0.88 -4.90 117.38 118.08 1ui0 n GLN 115 Ca 0.10 -0.13 -0.16 0.00 -0.01 0.00 0.00 57.00 56.79 1ui0 n GLN 115 Cb 0.52 -1.57 -0.16 0.00 1.02 0.00 0.00 30.24 30.06 1ui0 n GLN 115 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1ui0 s ILE 116 N -3.42 0.22 -0.13 5.09 1.01 -0.47 -2.37 121.20 121.13 1ui0 s ILE 116 Ca -0.07 0.02 0.03 0.00 0.00 0.00 0.00 60.65 60.62 1ui0 s ILE 116 Cb 0.13 -0.27 0.01 0.00 0.01 0.00 0.00 42.46 42.33 1ui0 s ILE 116 CO 0.89 0.13 -0.21 -0.63 0.00 0.00 0.00 174.94 175.11 1ui0 s ILE 117 N 0.73 1.97 -0.41 2.92 1.01 0.52 -1.07 121.20 126.86 1ui0 s ILE 117 Ca -0.07 -0.93 -0.05 0.00 0.00 0.00 0.00 60.65 59.60 1ui0 s ILE 117 Cb -0.11 -1.74 0.10 0.00 0.01 0.00 0.00 42.46 40.73 1ui0 s ILE 117 CO -0.01 0.53 0.22 -0.69 0.00 0.00 0.00 174.94 174.99 1ui0 s VAL 118 N 0.75 3.54 -0.09 2.92 1.01 0.20 -1.49 120.40 127.23 1ui0 s VAL 118 Ca -0.09 -1.88 -0.26 0.00 0.00 0.00 0.00 61.98 59.75 1ui0 s VAL 118 Cb -0.16 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 1ui0 s VAL 118 CO 0.00 -0.64 0.85 -2.16 0.00 0.00 0.00 175.10 173.16 1ui0 s PRO 119 N 1.22 4.42 -0.38 2.72 0.04 -1.25 -1.34 135.00 140.42 1ui0 s PRO 119 Ca 0.06 1.12 -0.15 0.00 0.04 0.00 0.00 61.00 62.07 1ui0 s PRO 119 Cb -0.23 -3.50 0.01 0.00 0.04 0.00 0.00 34.50 30.81 1ui0 s PRO 119 CO -0.03 -0.14 0.32 -0.51 0.04 0.00 0.00 177.00 176.68 1ui0 s LEU 120 N 1.46 4.81 0.00 -3.56 1.43 0.36 -1.78 118.68 121.39 1ui0 s LEU 120 Ca 0.43 -0.64 0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1ui0 s LEU 120 Cb -0.18 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.82 1ui0 s LEU 120 CO 0.19 -0.40 0.00 0.61 0.23 0.00 0.00 176.35 176.97 1ui0 n GLY 121 N 5.11 1.80 0.30 -3.19 0.00 -0.53 -4.15 105.19 104.52 1ui0 n GLY 121 Ca -0.10 -1.95 -0.04 0.00 0.00 0.00 0.00 46.02 43.93 1ui0 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ui0 h ALA 122 N 0.00 1.14 -0.05 4.61 0.00 -1.91 -1.41 119.26 121.65 1ui0 h ALA 122 Ca 0.00 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ui0 h ALA 122 Cb 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 1ui0 h ALA 122 CO 0.00 0.56 0.02 0.28 0.00 0.00 0.00 179.25 180.11 1ui0 h VAL 123 N 0.79 1.16 -0.43 0.00 2.07 -1.93 0.35 116.25 118.25 1ui0 h VAL 123 Ca 0.16 -0.47 -0.12 0.00 0.82 0.00 0.00 66.70 67.09 1ui0 h VAL 123 Cb 0.37 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 1ui0 h VAL 123 CO 0.01 0.13 -0.21 0.00 0.02 0.00 0.00 177.57 177.52 1ui0 h ALA 124 N 0.83 0.82 -0.78 1.67 0.00 -1.78 -2.75 119.26 117.26 1ui0 h ALA 124 Ca 0.02 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1ui0 h ALA 124 Cb 0.19 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 1ui0 h ALA 124 CO -0.00 0.65 0.33 0.00 0.00 0.00 0.00 179.25 180.23 1ui0 h ALA 125 N 1.01 1.10 -0.81 0.00 0.00 -1.13 -2.60 119.26 116.83 1ui0 h ALA 125 Ca 0.10 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1ui0 h ALA 125 Cb 0.75 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1ui0 h ALA 125 CO 0.06 0.65 0.39 1.49 0.00 0.00 0.00 179.25 181.84 1ui0 h GLU 126 N 1.13 1.17 -0.41 0.00 4.81 -0.72 -0.39 114.58 120.17 1ui0 h GLU 126 Ca 0.26 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1ui0 h GLU 126 Cb 0.19 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1ui0 h GLU 126 CO -0.03 0.89 0.27 0.35 -0.73 0.00 0.00 179.01 179.77 1ui0 h PHE 127 N 1.16 0.52 0.00 0.92 3.57 -1.18 -2.06 116.94 119.87 1ui0 h PHE 127 Ca 0.28 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.71 1ui0 h PHE 127 Cb 0.11 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 1ui0 h PHE 127 CO 0.01 0.34 -0.59 0.74 -2.23 0.00 0.00 178.31 176.59 1ui0 h PHE 128 N 0.55 0.00 -0.01 0.41 0.04 -1.31 -3.30 116.94 113.32 1ui0 h PHE 128 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 1ui0 h PHE 128 Cb -0.05 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.10 1ui0 h PHE 128 CO -0.04 0.33 -0.38 1.28 -0.60 0.00 0.00 178.31 178.90 1ui0 n LEU 129 N -3.08 0.90 0.00 1.54 4.32 -0.18 -4.64 117.00 115.86 1ui0 n LEU 129 Ca 0.00 -0.21 0.00 0.00 -0.02 0.00 0.00 56.01 55.78 1ui0 n LEU 129 Cb 0.68 -0.15 0.00 0.00 -1.62 0.00 0.00 43.42 42.33 1ui0 n LEU 129 CO 0.39 0.18 0.00 0.61 -1.22 0.00 0.00 177.39 177.35 1ui0 n GLY 130 N 1.40 0.51 3.61 -0.72 0.00 -0.78 -4.99 105.19 104.23 1ui0 n GLY 130 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.03 1ui0 n GLY 130 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ui0 s GLU 131 N -0.34 1.32 0.16 1.61 -1.05 -1.18 -5.05 118.70 114.16 1ui0 s GLU 131 Ca 0.00 -0.61 -0.31 0.00 -0.15 0.00 0.00 54.97 53.89 1ui0 s GLU 131 Cb 0.00 0.52 -0.10 0.00 -0.44 0.00 0.00 34.13 34.12 1ui0 s GLU 131 CO 0.00 -0.59 1.53 0.21 0.95 0.00 0.00 175.26 177.36 1ui0 s LYS 132 N -3.60 4.23 0.11 -4.83 2.20 -1.26 -4.44 119.74 112.15 1ui0 s LYS 132 Ca 0.06 2.31 0.02 0.00 -0.36 0.00 0.00 55.97 58.01 1ui0 s LYS 132 Cb -0.02 -3.17 -0.04 0.00 -1.51 0.00 0.00 37.83 33.08 1ui0 s LYS 132 CO -0.04 -0.57 -0.07 0.14 -0.36 0.00 0.00 175.35 174.44 1ui0 s VAL 133 N 1.11 0.77 -0.32 4.02 -7.23 -1.26 -5.06 120.40 112.42 1ui0 s VAL 133 Ca 0.69 -1.96 -0.18 0.00 -1.81 0.00 0.00 61.98 58.72 1ui0 s VAL 133 Cb -0.42 -1.71 -0.01 0.00 0.56 0.00 0.00 36.38 34.79 1ui0 s VAL 133 CO 0.31 -0.85 0.52 -0.55 -0.31 0.00 0.00 175.10 174.22 1ui0 s SER 134 N -3.06 6.37 0.40 4.85 0.15 -1.26 -4.92 113.70 116.23 1ui0 s SER 134 Ca 0.13 0.18 0.08 0.00 0.70 0.00 0.00 55.95 57.04 1ui0 s SER 134 Cb 0.05 -2.28 0.86 0.00 -1.71 0.00 0.00 66.02 62.94 1ui0 s SER 134 CO -0.04 -0.42 2.02 -0.29 1.20 0.00 0.00 173.24 175.71 1ui0 h ILE 135 N 5.55 1.05 0.00 6.45 6.09 -1.93 -1.23 117.51 133.48 1ui0 h ILE 135 Ca -0.28 -0.20 -0.06 0.00 -1.37 0.00 0.00 64.86 62.95 1ui0 h ILE 135 Cb 1.13 0.43 -0.01 0.00 0.47 0.00 0.00 36.82 38.84 1ui0 h ILE 135 CO 0.76 0.10 -0.31 0.71 -3.07 0.00 0.00 178.15 176.34 1ui0 h THR 136 N 0.57 1.17 0.02 2.19 1.35 -1.96 -1.13 112.91 115.14 1ui0 h THR 136 Ca 0.21 -1.08 -0.27 0.00 -0.55 0.00 0.00 66.41 64.72 1ui0 h THR 136 Cb 0.12 1.59 -0.04 0.00 -1.73 0.00 0.00 68.15 68.09 1ui0 h THR 136 CO -0.05 0.30 -1.48 0.11 -0.25 0.00 0.00 175.52 174.15 1ui0 h LYS 137 N 0.00 0.05 0.00 4.72 1.57 -1.68 -3.38 116.57 117.85 1ui0 h LYS 137 Ca -0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1ui0 h LYS 137 Cb 0.56 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1ui0 h LYS 137 CO 0.04 0.77 -1.25 1.33 -0.57 0.00 0.00 179.45 179.76 1ui0 n VAL 138 N -3.22 0.16 -1.89 0.50 0.24 -0.62 -4.96 118.33 108.54 1ui0 n VAL 138 Ca -0.12 -0.31 -0.39 0.00 -2.04 0.00 0.00 64.34 61.48 1ui0 n VAL 138 Cb 1.02 0.19 0.02 0.00 -1.47 0.00 0.00 33.84 33.59 1ui0 n VAL 138 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ui0 s ARG 139 N -3.27 3.50 -0.36 7.34 1.70 -0.44 -3.07 118.95 124.36 1ui0 s ARG 139 Ca 0.01 2.22 0.00 0.00 -0.47 0.00 0.00 55.73 57.49 1ui0 s ARG 139 Cb 0.14 -2.47 0.00 0.00 -0.57 0.00 0.00 34.95 32.05 1ui0 s ARG 139 CO 0.83 -0.90 0.00 0.41 -1.08 0.00 0.00 175.30 174.56 1ui0 n GLY 140 N 0.64 0.63 3.25 3.88 0.00 -0.25 -4.99 105.19 108.35 1ui0 n GLY 140 Ca 0.07 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.40 1ui0 n GLY 140 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ui0 s LYS 141 N -1.68 1.14 -0.10 1.61 1.02 -1.17 -5.05 119.74 115.51 1ui0 s LYS 141 Ca 0.00 -1.03 -0.21 0.00 0.02 0.00 0.00 55.97 54.75 1ui0 s LYS 141 Cb 0.00 -1.31 -0.04 0.00 -0.52 0.00 0.00 37.83 35.96 1ui0 s LYS 141 CO 0.00 0.32 0.59 -1.58 -0.92 0.00 0.00 175.35 173.76 1ui0 s TRP 142 N -1.04 3.53 0.31 3.18 0.52 -1.26 -4.03 118.94 120.15 1ui0 s TRP 142 Ca 0.05 1.05 0.02 0.00 0.02 0.00 0.00 56.10 57.25 1ui0 s TRP 142 Cb -0.09 -2.69 -0.01 0.00 -1.15 0.00 0.00 33.47 29.53 1ui0 s TRP 142 CO 0.03 0.10 0.08 0.66 0.02 0.00 0.00 176.95 177.84 1ui0 n TYR 143 N 3.85 0.28 -3.85 -1.98 4.02 0.62 -4.98 117.16 115.11 1ui0 n TYR 143 Ca -0.04 -1.83 -0.12 0.00 -0.01 0.00 0.00 57.90 55.90 1ui0 n TYR 143 Cb 0.51 -0.06 -0.12 0.00 -0.02 0.00 0.00 39.34 39.65 1ui0 n TYR 143 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 176.86 173.85 1ui0 s GLU 144 N -3.15 0.19 -0.14 -0.72 2.12 -1.26 -0.88 118.70 114.86 1ui0 s GLU 144 Ca 0.11 0.01 -0.04 0.00 0.36 0.00 0.00 54.97 55.41 1ui0 s GLU 144 Cb 0.01 0.09 0.06 0.00 0.26 0.00 0.00 34.13 34.54 1ui0 s GLU 144 CO 0.08 -0.03 0.13 -0.46 -0.54 0.00 0.00 175.26 174.44 1ui0 s TRP 145 N -0.28 -0.02 -1.50 5.30 -0.00 0.05 -4.88 118.94 117.61 1ui0 s TRP 145 Ca -0.03 0.10 -0.12 0.00 -0.00 0.00 0.00 56.10 56.04 1ui0 s TRP 145 Cb -0.03 -0.49 0.07 0.00 -0.00 0.00 0.00 33.47 33.03 1ui0 s TRP 145 CO 0.00 -0.44 0.97 0.72 -0.00 0.00 0.00 176.95 178.20 1ui0 n HIS 146 N 5.30 -2.31 -0.99 5.86 8.25 -1.26 -1.01 115.22 129.07 1ui0 n HIS 146 Ca -0.06 0.91 0.00 0.00 -0.26 0.00 0.00 57.72 58.31 1ui0 n HIS 146 Cb 0.49 -4.10 0.00 0.00 1.12 0.00 0.00 29.99 27.50 1ui0 n HIS 146 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ui0 n GLY 147 N -1.71 0.47 3.49 -1.41 0.00 -1.26 -5.02 105.19 99.75 1ui0 n GLY 147 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1ui0 n GLY 147 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ui0 s ILE 148 N -2.01 3.50 0.20 -0.61 1.01 -0.18 -5.07 121.20 118.05 1ui0 s ILE 148 Ca 0.00 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.82 1ui0 s ILE 148 Cb 0.00 -2.46 -0.09 0.00 0.01 0.00 0.00 42.46 39.92 1ui0 s ILE 148 CO 0.00 0.55 1.33 -0.54 0.00 0.00 0.00 174.94 176.28 1ui0 s LYS 149 N -0.19 4.37 -0.09 2.79 1.02 -1.00 -0.77 119.74 125.87 1ui0 s LYS 149 Ca 0.02 2.09 0.03 0.00 0.02 0.00 0.00 55.97 58.13 1ui0 s LYS 149 Cb -0.13 -3.18 0.01 0.00 -0.52 0.00 0.00 37.83 34.00 1ui0 s LYS 149 CO 0.03 -0.28 -0.20 0.08 -0.92 0.00 0.00 175.35 174.06 1ui0 s VAL 150 N 0.11 1.75 -0.39 3.17 1.01 -0.06 -0.35 120.40 125.64 1ui0 s VAL 150 Ca 0.57 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1ui0 s VAL 150 Cb -0.37 -1.54 0.13 0.00 0.00 0.00 0.00 36.38 34.60 1ui0 s VAL 150 CO 0.39 0.49 0.19 0.12 0.00 0.00 0.00 175.10 176.29 1ui0 s PHE 151 N 0.51 1.69 0.48 5.22 5.36 -0.56 -0.28 117.98 130.41 1ui0 s PHE 151 Ca -0.16 -2.10 -0.23 0.00 -0.96 0.00 0.00 56.93 53.48 1ui0 s PHE 151 Cb -0.17 -1.68 -0.07 0.00 -0.34 0.00 0.00 43.02 40.77 1ui0 s PHE 151 CO 0.06 -0.82 1.31 -2.14 -1.46 0.00 0.00 175.22 172.17 1ui0 s PRO 152 N 0.83 3.54 0.06 10.12 0.02 -1.26 -3.96 135.00 144.35 1ui0 s PRO 152 Ca 0.15 2.13 -0.03 0.00 0.02 0.00 0.00 61.00 63.27 1ui0 s PRO 152 Cb -0.22 -2.46 -0.03 0.00 0.02 0.00 0.00 34.50 31.81 1ui0 s PRO 152 CO -0.07 -0.83 0.04 -1.64 -0.33 0.00 0.00 177.00 174.17 1ui0 s MET 153 N -2.65 0.66 0.61 5.54 -1.94 -0.74 -1.09 119.30 119.70 1ui0 s MET 153 Ca 0.65 -1.09 -0.19 0.00 -1.71 0.00 0.00 55.69 53.35 1ui0 s MET 153 Cb -0.37 0.25 -0.03 0.00 2.01 0.00 0.00 34.83 36.68 1ui0 s MET 153 CO 0.46 -0.16 1.27 -0.06 -0.01 0.00 0.00 175.02 176.53 1ui0 s PHE 154 N -3.71 2.23 0.18 -0.03 0.08 -1.26 -1.45 117.98 114.01 1ui0 s PHE 154 Ca 0.05 1.48 -0.30 0.00 0.12 0.00 0.00 56.93 58.28 1ui0 s PHE 154 Cb 0.06 -3.63 -0.08 0.00 -0.57 0.00 0.00 43.02 38.80 1ui0 s PHE 154 CO -0.10 -2.65 1.00 -1.58 -0.10 0.00 0.00 175.22 171.79 1ui0 s HIS 155 N -1.45 3.79 0.53 0.36 5.65 -1.26 -4.43 115.29 118.47 1ui0 s HIS 155 Ca 0.79 1.78 0.25 0.00 0.25 0.00 0.00 55.06 58.13 1ui0 s HIS 155 Cb -0.35 -3.11 1.39 0.00 -1.18 0.00 0.00 32.58 29.33 1ui0 s HIS 155 CO 0.38 0.01 1.98 -1.35 -0.65 0.00 0.00 174.74 175.12 1ui0 h PRO 156 N 4.86 0.02 -0.34 2.88 0.11 -1.93 -0.48 132.00 137.12 1ui0 h PRO 156 Ca -0.44 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.62 1ui0 h PRO 156 Cb 1.21 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 1ui0 h PRO 156 CO 0.70 0.01 0.01 0.00 -0.21 0.00 0.00 178.00 178.52 1ui0 h ALA 157 N 1.71 1.38 -0.52 -0.75 0.00 -1.92 -1.69 119.26 117.47 1ui0 h ALA 157 Ca 0.28 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1ui0 h ALA 157 Cb 1.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1ui0 h ALA 157 CO -0.01 0.43 0.01 -0.92 0.00 0.00 0.00 179.25 178.76 1ui0 h TYR 158 N 0.51 0.94 -0.52 0.00 3.20 -1.47 -1.43 116.97 118.21 1ui0 h TYR 158 Ca 0.11 -0.14 -0.09 0.00 3.14 0.00 0.00 58.73 61.75 1ui0 h TYR 158 Cb 0.31 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.31 1ui0 h TYR 158 CO 0.01 0.85 -0.04 -0.07 -1.64 0.00 0.00 178.16 177.27 1ui0 h LEU 159 N 0.82 0.89 -0.77 2.82 4.07 -1.29 -0.50 115.31 121.35 1ui0 h LEU 159 Ca 0.16 -0.25 -0.12 0.00 0.08 0.00 0.00 57.88 57.75 1ui0 h LEU 159 Cb 0.48 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1ui0 h LEU 159 CO 0.02 0.97 -0.35 -0.07 -1.08 0.00 0.00 178.44 177.93 1ui0 h LEU 160 N 0.83 0.54 -0.53 1.67 3.38 -0.96 -1.64 115.31 118.60 1ui0 h LEU 160 Ca 0.15 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.79 1ui0 h LEU 160 Cb 0.55 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1ui0 h LEU 160 CO 0.03 0.85 -0.51 0.03 0.09 0.00 0.00 178.44 178.94 1ui0 h ARG 161 N 0.44 0.00 -2.28 1.13 3.08 -1.03 -3.35 114.38 112.38 1ui0 h ARG 161 Ca 0.05 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.51 1ui0 h ARG 161 Cb 0.82 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.47 1ui0 h ARG 161 CO 0.07 0.51 -0.84 0.09 -1.07 0.00 0.00 179.97 178.72 1ui0 n ASN 162 N -3.44 1.63 -0.26 7.04 3.02 -0.22 -4.99 115.26 118.05 1ui0 n ASN 162 Ca 0.00 -2.96 0.00 0.00 -0.03 0.00 0.00 54.58 51.60 1ui0 n ASN 162 Cb 0.64 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 1ui0 n ASN 162 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1ui0 n PRO 163 N 1.54 0.81 -1.65 3.52 -0.04 -0.64 -4.62 135.00 133.93 1ui0 n PRO 163 Ca 0.25 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.28 1ui0 n PRO 163 Cb 0.46 -1.21 -0.01 0.00 -0.04 0.00 0.00 33.50 32.70 1ui0 n PRO 163 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1ui0 n SER 164 N -0.19 2.08 -0.84 3.54 2.88 -1.26 -4.90 113.62 114.93 1ui0 n SER 164 Ca 0.00 1.19 0.10 0.00 -1.33 0.00 0.00 58.87 58.84 1ui0 n SER 164 Cb 0.10 -1.39 0.09 0.00 -0.75 0.00 0.00 64.21 62.27 1ui0 n SER 164 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ui0 n ARG 165 N 0.71 1.91 -1.12 -1.46 5.12 -1.26 -4.45 116.66 116.12 1ui0 n ARG 165 Ca 0.07 -1.76 -0.32 0.00 -1.93 0.00 0.00 57.85 53.90 1ui0 n ARG 165 Cb 0.34 -1.40 0.12 0.00 -1.16 0.00 0.00 32.46 30.36 1ui0 n ARG 165 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1ui0 s ALA 166 N -1.70 1.89 0.23 7.54 0.00 -1.26 -4.90 121.76 123.56 1ui0 s ALA 166 Ca 0.25 0.65 -0.32 0.00 0.00 0.00 0.00 51.96 52.55 1ui0 s ALA 166 Cb 0.17 -3.43 -0.12 0.00 0.00 0.00 0.00 23.12 19.75 1ui0 s ALA 166 CO 0.26 -2.20 1.66 -2.30 0.00 0.00 0.00 175.76 173.18 1ui0 n PRO 167 N -3.45 2.67 -0.82 0.00 -0.02 -1.26 -1.91 135.00 130.20 1ui0 n PRO 167 Ca 0.12 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.56 1ui0 n PRO 167 Cb 0.51 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 1ui0 n PRO 167 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ui0 n GLY 168 N 3.35 0.67 3.77 -1.23 0.00 -1.26 -5.04 105.19 105.46 1ui0 n GLY 168 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1ui0 n GLY 168 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ui0 s SER 169 N -2.27 4.24 0.28 1.61 1.04 -0.80 -4.73 113.70 113.08 1ui0 s SER 169 Ca 0.00 1.43 0.02 0.00 0.48 0.00 0.00 55.95 57.88 1ui0 s SER 169 Cb 0.00 -2.16 0.58 0.00 0.10 0.00 0.00 66.02 64.55 1ui0 s SER 169 CO 0.00 -2.14 1.82 -0.65 0.98 0.00 0.00 173.24 173.25 1ui0 h PRO 170 N -1.21 0.91 -0.39 4.02 0.11 -1.82 -0.27 132.00 133.35 1ui0 h PRO 170 Ca -0.47 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 1ui0 h PRO 170 Cb 1.27 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1ui0 h PRO 170 CO 0.57 0.60 -0.00 0.87 -0.21 0.00 0.00 178.00 179.82 1ui0 h LYS 171 N 0.93 0.69 -0.18 1.05 1.57 -1.83 -1.20 116.57 117.60 1ui0 h LYS 171 Ca 0.51 -0.22 -0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1ui0 h LYS 171 Cb 0.57 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 1ui0 h LYS 171 CO -0.29 0.78 0.10 1.25 -0.57 0.00 0.00 179.45 180.72 1ui0 h HIS 172 N 0.51 0.25 -0.48 -1.35 2.76 -1.62 -1.57 115.15 113.64 1ui0 h HIS 172 Ca 0.11 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.24 1ui0 h HIS 172 Cb 0.48 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.33 1ui0 h HIS 172 CO 0.04 0.23 0.14 -0.07 -1.30 0.00 0.00 177.93 176.97 1ui0 h LEU 173 N 0.19 0.65 -0.95 0.26 3.38 -1.02 -2.28 115.31 115.55 1ui0 h LEU 173 Ca 0.06 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 57.85 1ui0 h LEU 173 Cb 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1ui0 h LEU 173 CO -0.01 0.63 -0.21 0.74 0.09 0.00 0.00 178.44 179.68 1ui0 h THR 174 N 0.69 1.26 -0.44 0.22 2.02 -0.89 0.25 112.91 116.01 1ui0 h THR 174 Ca 0.16 -1.21 -0.07 0.00 0.77 0.00 0.00 66.41 66.07 1ui0 h THR 174 Cb 0.22 1.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.89 1ui0 h THR 174 CO -0.01 0.39 0.02 -0.25 0.37 0.00 0.00 175.52 176.04 1ui0 h TRP 175 N 0.47 0.83 -0.61 3.16 -0.00 -0.76 -0.36 115.95 118.68 1ui0 h TRP 175 Ca 0.07 -0.14 -0.05 0.00 -0.00 0.00 0.00 58.89 58.78 1ui0 h TRP 175 Cb 0.63 -0.22 -0.03 0.00 -0.00 0.00 0.00 29.16 29.54 1ui0 h TRP 175 CO 0.02 0.81 0.19 -0.07 -0.00 0.00 0.00 178.44 179.40 1ui0 h LEU 176 N 0.62 0.89 -0.18 0.65 3.38 -1.07 -2.77 115.31 116.83 1ui0 h LEU 176 Ca 0.13 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1ui0 h LEU 176 Cb 0.47 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ui0 h LEU 176 CO 0.02 0.86 0.08 0.44 0.09 0.00 0.00 178.44 179.93 1ui0 h ASP 177 N 0.88 0.24 0.23 -0.43 3.32 -0.67 -2.63 116.42 117.35 1ui0 h ASP 177 Ca 0.20 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 57.07 1ui0 h ASP 177 Cb 0.29 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1ui0 h ASP 177 CO -0.01 0.30 -0.22 -0.29 -1.72 0.00 0.00 179.24 177.30 1ui0 h ILE 178 N 0.16 1.14 -0.34 0.35 6.09 -1.02 -1.24 117.51 122.64 1ui0 h ILE 178 Ca 0.06 -0.77 -0.11 0.00 -1.37 0.00 0.00 64.86 62.68 1ui0 h ILE 178 Cb 0.13 1.42 -0.01 0.00 0.47 0.00 0.00 36.82 38.82 1ui0 h ILE 178 CO -0.01 0.22 -0.23 1.56 -3.07 0.00 0.00 178.15 176.62 1ui0 h GLN 179 N 0.00 0.66 -0.40 2.19 4.20 -1.30 -1.20 115.11 119.25 1ui0 h GLN 179 Ca -0.00 -0.26 -0.12 0.00 0.06 0.00 0.00 58.65 58.33 1ui0 h GLN 179 Cb 0.40 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.13 1ui0 h GLN 179 CO 0.03 0.84 -0.23 1.49 -0.67 0.00 0.00 178.83 180.29 1ui0 h GLU 180 N 0.58 0.80 -0.51 1.46 4.57 -0.91 -1.17 114.58 119.40 1ui0 h GLU 180 Ca 0.08 -0.33 -0.03 0.00 -1.18 0.00 0.00 59.36 57.90 1ui0 h GLU 180 Cb 0.71 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.24 1ui0 h GLU 180 CO 0.05 0.95 0.20 0.28 -1.18 0.00 0.00 179.01 179.32 1ui0 h VAL 181 N 0.70 1.22 -0.61 0.32 2.07 -0.91 -1.25 116.25 117.78 1ui0 h VAL 181 Ca 0.09 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1ui0 h VAL 181 Cb 0.75 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 1ui0 h VAL 181 CO 0.06 0.25 0.28 0.50 0.02 0.00 0.00 177.57 178.68 1ui0 h LYS 182 N 0.69 0.89 -0.16 1.57 1.63 -1.01 0.14 116.57 120.31 1ui0 h LYS 182 Ca 0.17 -0.14 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 1ui0 h LYS 182 Cb 0.20 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.67 1ui0 h LYS 182 CO -0.01 0.73 0.11 -0.09 -3.45 0.00 0.00 179.45 176.73 1ui0 h ARG 183 N 0.84 0.22 -0.71 1.90 2.43 -0.95 -1.42 114.38 116.69 1ui0 h ARG 183 Ca 0.21 -0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.31 1ui0 h ARG 183 Cb 0.15 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 1ui0 h ARG 183 CO -0.02 0.16 0.22 0.00 -1.51 0.00 0.00 179.97 178.81 1ui0 h ALA 184 N 1.05 1.04 -0.47 2.80 0.00 -1.01 -2.29 119.26 120.38 1ui0 h ALA 184 Ca 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1ui0 h ALA 184 Cb -0.01 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1ui0 h ALA 184 CO -0.01 0.65 0.29 1.25 0.00 0.00 0.00 179.25 181.42 1ui0 h LEU 185 N 1.06 0.56 -1.55 0.00 5.85 -0.65 -2.36 115.31 118.20 1ui0 h LEU 185 Ca 0.23 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1ui0 h LEU 185 Cb 0.30 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 1ui0 h LEU 185 CO -0.01 0.43 -0.21 0.44 -0.34 0.00 0.00 178.44 178.75 1ui0 h ASP 186 N 0.63 0.00 0.05 1.25 3.32 -1.00 -2.82 116.42 117.85 1ui0 h ASP 186 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1ui0 h ASP 186 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1ui0 h ASP 186 CO -0.03 0.21 -0.09 0.00 -1.72 0.00 0.00 179.24 177.61 1ui0 n ALA 187 N -2.32 2.75 -1.77 3.45 0.00 -0.88 -4.96 120.51 116.77 1ui0 n ALA 187 Ca -0.01 -0.47 -0.38 0.00 0.00 0.00 0.00 53.44 52.58 1ui0 n ALA 187 Cb 0.33 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.67 1ui0 n ALA 187 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ui0 s LEU 188 N -2.16 4.04 0.72 0.00 1.43 -0.94 -5.04 118.68 116.74 1ui0 s LEU 188 Ca 0.32 2.47 -0.08 0.00 -1.03 0.00 0.00 54.13 55.82 1ui0 s LEU 188 Cb 0.20 -4.15 0.06 0.00 0.03 0.00 0.00 46.19 42.33 1ui0 s LEU 188 CO 0.39 -1.01 1.05 -2.16 0.23 0.00 0.00 176.35 174.86 1ui0 s PRO 189 N -2.60 2.21 0.58 1.29 0.04 -1.26 -5.02 135.00 130.23 1ui0 s PRO 189 Ca 0.63 -0.13 -0.19 0.00 0.04 0.00 0.00 61.00 61.34 1ui0 s PRO 189 Cb -0.33 -2.12 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 1ui0 s PRO 189 CO 0.41 -1.28 1.22 -1.25 0.04 0.00 0.00 177.00 176.13 1ui0 s PRO 190 N -5.31 3.06 0.55 0.56 0.04 -1.26 -4.95 135.00 127.69 1ui0 s PRO 190 Ca 0.60 1.86 -0.21 0.00 0.04 0.00 0.00 61.00 63.29 1ui0 s PRO 190 Cb -0.11 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.38 1ui0 s PRO 190 CO 0.46 -1.14 1.32 0.15 0.04 0.00 0.00 177.00 177.82 1ui0 s LYS 191 N -3.23 3.16 -0.42 4.56 1.02 -1.26 -4.93 119.74 118.64 1ui0 s LYS 191 Ca 0.76 2.13 -0.29 0.00 0.02 0.00 0.00 55.97 58.59 1ui0 s LYS 191 Cb -0.31 -2.22 0.02 0.00 -0.52 0.00 0.00 37.83 34.80 1ui0 s LYS 191 CO 0.35 -1.14 1.21 -1.21 -0.92 0.00 0.00 175.35 173.63 1ui0 s GLU 192 N -2.95 3.77 0.00 1.68 2.02 -1.26 -5.27 118.70 116.70 1ui0 s GLU 192 Ca 0.72 0.81 0.00 0.00 0.02 0.00 0.00 54.97 56.52 1ui0 s GLU 192 Cb -0.38 -3.90 0.00 0.00 0.10 0.00 0.00 34.13 29.95 1ui0 s GLU 192 CO 0.44 -1.31 0.50 0.54 0.02 0.00 0.00 175.26 175.45