#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sl8 h PRO 12 N 0.00 0.34 -0.06 3.52 0.13 -2.00 -0.77 132.00 133.16 1sl8 h PRO 12 Ca 0.00 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.03 1sl8 h PRO 12 Cb 0.00 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.07 1sl8 h PRO 12 CO 0.00 0.34 -0.14 0.87 -0.23 0.00 0.00 178.00 178.84 1sl8 h LYS 13 N 0.34 0.21 -0.45 0.86 1.57 -2.00 -0.17 116.57 116.94 1sl8 h LYS 13 Ca 0.08 -0.14 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1sl8 h LYS 13 Cb 0.17 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 1sl8 h LYS 13 CO -0.00 0.74 0.26 2.35 -0.57 0.00 0.00 179.45 182.23 1sl8 h TRP 14 N -0.29 0.49 -0.84 -1.35 7.01 -1.83 -0.97 115.95 118.17 1sl8 h TRP 14 Ca 0.00 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.00 1sl8 h TRP 14 Cb 0.74 -0.16 -0.04 0.00 -2.10 0.00 0.00 29.16 27.60 1sl8 h TRP 14 CO 0.12 0.28 0.47 0.82 -2.79 0.00 0.00 178.44 177.34 1sl8 h ILE 15 N 0.52 1.25 -0.42 2.65 1.08 -1.11 -1.15 117.51 120.33 1sl8 h ILE 15 Ca 0.18 -0.59 -0.01 0.00 -0.39 0.00 0.00 64.86 64.04 1sl8 h ILE 15 Cb 0.02 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 33.85 1sl8 h ILE 15 CO -0.09 0.27 0.21 1.23 -0.69 0.00 0.00 178.15 179.08 1sl8 h GLY 16 N 1.17 0.64 0.99 5.37 0.00 -0.71 0.39 103.07 110.93 1sl8 h GLY 16 Ca 0.30 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.32 1sl8 h GLY 16 CO -0.05 0.30 0.20 3.21 0.00 0.00 0.00 176.54 180.19 1sl8 h ARG 17 N 0.54 0.41 -0.36 4.80 3.08 -0.93 -1.14 114.38 120.77 1sl8 h ARG 17 Ca 0.15 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.10 1sl8 h ARG 17 Cb 0.10 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 1sl8 h ARG 17 CO -0.02 0.29 -0.07 0.45 -1.07 0.00 0.00 179.97 179.55 1sl8 h HIS 18 N 0.41 0.65 -0.55 3.04 3.86 -0.91 -0.50 115.15 121.15 1sl8 h HIS 18 Ca 0.11 -0.09 -0.08 0.00 -1.16 0.00 0.00 60.37 59.15 1sl8 h HIS 18 Cb -0.03 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.25 1sl8 h HIS 18 CO -0.05 0.67 0.02 -0.22 0.86 0.00 0.00 177.93 179.20 1sl8 h LYS 19 N 0.57 0.95 -0.56 2.45 1.63 0.16 -0.81 116.57 120.96 1sl8 h LYS 19 Ca 0.11 -0.29 -0.07 0.00 -0.85 0.00 0.00 60.65 59.55 1sl8 h LYS 19 Cb 0.47 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.98 1sl8 h LYS 19 CO 0.02 0.95 0.08 0.45 -3.45 0.00 0.00 179.45 177.51 1sl8 h HIS 20 N 0.83 0.96 -0.30 1.91 3.86 -0.86 -1.43 115.15 120.12 1sl8 h HIS 20 Ca 0.16 -0.12 -0.18 0.00 -1.16 0.00 0.00 60.37 59.07 1sl8 h HIS 20 Cb 0.51 -0.27 -0.00 0.00 1.06 0.00 0.00 27.41 28.71 1sl8 h HIS 20 CO 0.04 0.82 -0.51 1.98 0.86 0.00 0.00 177.93 181.12 1sl8 h MET 21 N 0.86 0.86 -0.10 2.45 1.85 -0.95 -0.21 114.93 119.69 1sl8 h MET 21 Ca 0.18 -0.53 0.02 0.00 -0.61 0.00 0.00 59.70 58.76 1sl8 h MET 21 Cb 0.39 0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.45 1sl8 h MET 21 CO 0.01 1.16 -0.04 0.35 -0.40 0.00 0.00 176.91 177.99 1sl8 h PHE 22 N 0.67 -0.10 -0.77 1.39 3.57 -0.91 -0.66 116.94 120.13 1sl8 h PHE 22 Ca 0.02 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.60 1sl8 h PHE 22 Cb 1.11 0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.85 1sl8 h PHE 22 CO 0.07 -0.07 0.46 -0.91 -2.23 0.00 0.00 178.31 175.63 1sl8 h ASN 23 N -0.03 0.70 -0.77 0.41 4.21 -1.15 0.37 115.58 119.32 1sl8 h ASN 23 Ca 0.06 0.03 -0.04 0.00 1.21 0.00 0.00 56.30 57.55 1sl8 h ASN 23 Cb 0.11 -0.12 -0.04 0.00 -1.12 0.00 0.00 38.32 37.16 1sl8 h ASN 23 CO -0.12 0.44 0.33 0.15 -1.29 0.00 0.00 177.43 176.94 1sl8 h PHE 24 N 0.83 1.15 0.00 1.19 3.57 -0.36 -3.08 116.94 120.24 1sl8 h PHE 24 Ca 0.35 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.77 1sl8 h PHE 24 Cb 0.20 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1sl8 h PHE 24 CO -0.05 0.86 -0.59 1.28 -2.23 0.00 0.00 178.31 177.57 1sl8 n LEU 25 N -4.29 0.56 -4.50 0.59 4.77 -0.32 -4.66 117.00 109.15 1sl8 n LEU 25 Ca 0.07 0.05 -0.39 0.00 -0.03 0.00 0.00 56.01 55.72 1sl8 n LEU 25 Cb 0.17 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.02 1sl8 n LEU 25 CO 0.40 0.07 1.89 -0.67 -1.33 0.00 0.00 177.39 177.76 1sl8 n ASP 26 N -1.70 4.28 -0.32 -1.43 2.03 0.09 -4.11 116.55 115.39 1sl8 n ASP 26 Ca 0.05 -2.85 0.10 0.00 0.52 0.00 0.00 54.79 52.61 1sl8 n ASP 26 Cb 0.37 -1.72 0.32 0.00 -0.72 0.00 0.00 41.12 39.36 1sl8 n ASP 26 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 1sl8 h VAL 27 N 5.61 0.85 -0.15 5.18 2.07 -1.84 0.22 116.25 128.18 1sl8 h VAL 27 Ca 0.39 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.63 1sl8 h VAL 27 Cb 0.87 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1sl8 h VAL 27 CO 1.43 0.15 0.00 -0.46 0.02 0.00 0.00 177.57 178.71 1sl8 n ASN 28 N -4.61 2.33 -3.13 0.57 0.23 -1.26 -4.97 115.26 104.42 1sl8 n ASN 28 Ca 0.19 -1.79 -0.23 0.00 -0.53 0.00 0.00 54.58 52.22 1sl8 n ASN 28 Cb 0.44 -0.09 0.03 0.00 -2.08 0.00 0.00 39.78 38.08 1sl8 n ASN 28 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1sl8 n HIS 29 N 0.78 -1.99 1.02 -2.53 8.25 0.06 -4.88 115.22 115.92 1sl8 n HIS 29 Ca 0.17 0.54 0.11 0.00 -0.26 0.00 0.00 57.72 58.28 1sl8 n HIS 29 Cb 0.46 -4.22 0.01 0.00 1.12 0.00 0.00 29.99 27.36 1sl8 n HIS 29 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1sl8 n ASN 30 N -2.51 1.91 0.00 0.41 6.94 -1.26 -4.96 115.26 115.79 1sl8 n ASN 30 Ca -0.09 -1.45 0.00 0.00 -0.02 0.00 0.00 54.58 53.02 1sl8 n ASN 30 Cb 0.60 0.49 0.00 0.00 -2.36 0.00 0.00 39.78 38.51 1sl8 n ASN 30 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1sl8 n GLY 31 N 1.42 0.72 3.29 4.83 0.00 -1.26 -5.04 105.19 109.16 1sl8 n GLY 31 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1sl8 n GLY 31 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sl8 s ARG 32 N -0.38 1.14 -0.00 1.61 0.52 -1.26 -4.45 118.95 116.13 1sl8 s ARG 32 Ca 0.00 -1.20 0.03 0.00 -0.52 0.00 0.00 55.73 54.04 1sl8 s ARG 32 Cb 0.00 -1.35 -0.01 0.00 0.52 0.00 0.00 34.95 34.11 1sl8 s ARG 32 CO 0.00 0.31 -0.09 -1.50 0.02 0.00 0.00 175.30 174.04 1sl8 s ILE 33 N -1.33 0.69 0.33 1.52 2.07 0.22 -4.86 121.20 119.83 1sl8 s ILE 33 Ca 0.08 -0.44 0.09 0.00 -1.41 0.00 0.00 60.65 58.97 1sl8 s ILE 33 Cb -0.09 -0.59 -0.05 0.00 0.13 0.00 0.00 42.46 41.86 1sl8 s ILE 33 CO 0.05 0.15 0.04 -0.94 -1.91 0.00 0.00 174.94 172.32 1sl8 s SER 34 N -0.33 4.36 0.46 4.50 1.04 -1.26 0.34 113.70 122.80 1sl8 s SER 34 Ca 0.02 -0.87 0.13 0.00 0.48 0.00 0.00 55.95 55.71 1sl8 s SER 34 Cb -0.04 -0.63 1.04 0.00 0.10 0.00 0.00 66.02 66.49 1sl8 s SER 34 CO -0.00 -0.20 2.04 0.25 0.98 0.00 0.00 173.24 176.30 1sl8 h LEU 35 N 1.76 0.09 -0.31 2.42 5.85 -1.65 -1.89 115.31 121.58 1sl8 h LEU 35 Ca -0.43 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.28 1sl8 h LEU 35 Cb 1.25 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 1sl8 h LEU 35 CO 0.64 0.17 0.19 0.44 -0.34 0.00 0.00 178.44 179.55 1sl8 h ASP 36 N 0.10 0.37 -0.03 1.25 3.32 -1.91 0.03 116.42 119.57 1sl8 h ASP 36 Ca 0.02 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1sl8 h ASP 36 Cb 0.18 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 1sl8 h ASP 36 CO 0.01 0.31 0.02 -0.33 -1.72 0.00 0.00 179.24 177.53 1sl8 h GLU 37 N 0.40 0.04 -0.19 3.56 5.08 -1.67 -0.51 114.58 121.29 1sl8 h GLU 37 Ca 0.11 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1sl8 h GLU 37 Cb 0.01 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1sl8 h GLU 37 CO -0.02 0.06 0.08 0.52 -1.00 0.00 0.00 179.01 178.64 1sl8 h MET 38 N 0.01 0.29 -0.20 2.33 2.86 -1.16 -0.68 114.93 118.37 1sl8 h MET 38 Ca 0.01 -0.05 -0.18 0.00 -2.06 0.00 0.00 59.70 57.42 1sl8 h MET 38 Cb 0.03 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 1sl8 h MET 38 CO -0.00 0.36 -0.60 0.28 1.06 0.00 0.00 176.91 178.01 1sl8 h VAL 39 N 0.15 1.31 0.06 -2.22 2.07 -1.02 -2.33 116.25 114.26 1sl8 h VAL 39 Ca 0.06 -1.84 0.02 0.00 0.82 0.00 0.00 66.70 65.77 1sl8 h VAL 39 Cb 0.18 1.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.71 1sl8 h VAL 39 CO -0.00 0.58 -0.19 0.22 0.02 0.00 0.00 177.57 178.20 1sl8 h TYR 40 N 0.51 -0.49 -0.38 1.57 3.20 -0.80 -1.30 116.97 119.26 1sl8 h TYR 40 Ca -0.00 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 1sl8 h TYR 40 Cb 1.18 0.21 -0.02 0.00 1.54 0.00 0.00 36.73 39.64 1sl8 h TYR 40 CO 0.06 -0.27 0.08 -0.22 -1.64 0.00 0.00 178.16 176.17 1sl8 h LYS 41 N -0.34 0.62 -0.79 1.82 1.63 -1.10 -0.72 116.57 117.69 1sl8 h LYS 41 Ca 0.04 -0.16 0.05 0.00 -0.85 0.00 0.00 60.65 59.73 1sl8 h LYS 41 Cb 0.38 -0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 31.88 1sl8 h LYS 41 CO -0.13 0.67 0.49 0.00 -3.45 0.00 0.00 179.45 177.02 1sl8 h ALA 42 N 0.93 1.06 -0.33 5.00 0.00 -1.40 -1.63 119.26 122.89 1sl8 h ALA 42 Ca 0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1sl8 h ALA 42 Cb 0.33 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1sl8 h ALA 42 CO 0.00 0.25 -0.17 0.77 0.00 0.00 0.00 179.25 180.10 1sl8 h SER 43 N 0.92 0.72 -0.98 0.00 0.02 -1.03 -2.17 113.55 111.03 1sl8 h SER 43 Ca 0.33 -0.41 0.09 0.00 -0.84 0.00 0.00 61.79 60.97 1sl8 h SER 43 Cb 0.11 -0.20 -0.08 0.00 0.14 0.00 0.00 62.40 62.37 1sl8 h SER 43 CO -0.15 0.98 0.62 -0.78 -1.14 0.00 0.00 176.83 176.36 1sl8 h ASP 44 N 0.47 0.94 -0.12 3.07 3.58 -0.85 -1.07 116.42 122.44 1sl8 h ASP 44 Ca 0.07 0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.49 1sl8 h ASP 44 Cb 0.71 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.60 1sl8 h ASP 44 CO 0.05 0.55 -0.19 0.40 -2.88 0.00 0.00 179.24 177.17 1sl8 h ILE 45 N 1.05 1.37 -0.58 2.25 2.04 -1.17 0.04 117.51 122.50 1sl8 h ILE 45 Ca 0.46 -1.42 -0.05 0.00 1.00 0.00 0.00 64.86 64.85 1sl8 h ILE 45 Cb 0.34 2.00 -0.03 0.00 -0.74 0.00 0.00 36.82 38.39 1sl8 h ILE 45 CO -0.22 0.41 0.15 -0.37 0.00 0.00 0.00 178.15 178.12 1sl8 h VAL 46 N -0.06 1.23 0.07 1.67 -1.51 -1.04 0.49 116.25 117.09 1sl8 h VAL 46 Ca 0.01 -0.83 -0.00 0.00 -1.23 0.00 0.00 66.70 64.65 1sl8 h VAL 46 Cb 0.75 0.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.53 1sl8 h VAL 46 CO 0.04 0.31 -0.03 0.40 -1.23 0.00 0.00 177.57 177.06 1sl8 h ILE 47 N 0.86 1.21 0.00 7.19 2.04 -1.20 -0.53 117.51 127.08 1sl8 h ILE 47 Ca 0.19 -1.45 -0.16 0.00 1.00 0.00 0.00 64.86 64.44 1sl8 h ILE 47 Cb 0.29 2.08 -0.03 0.00 -0.74 0.00 0.00 36.82 38.43 1sl8 h ILE 47 CO -0.00 0.33 -1.56 0.59 0.00 0.00 0.00 178.15 177.51 1sl8 n ASN 48 N -4.81 0.66 -0.07 1.72 3.02 -0.00 -2.62 115.26 113.16 1sl8 n ASN 48 Ca -0.08 0.29 -0.13 0.00 -0.03 0.00 0.00 54.58 54.63 1sl8 n ASN 48 Cb 0.31 0.48 -0.14 0.00 -0.61 0.00 0.00 39.78 39.81 1sl8 n ASN 48 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1sl8 n ASN 49 N -2.79 0.90 -0.51 6.41 4.13 0.09 -4.61 115.26 118.88 1sl8 n ASN 49 Ca -0.11 0.13 0.06 0.00 1.68 0.00 0.00 54.58 56.34 1sl8 n ASN 49 Cb 0.83 0.17 0.06 0.00 -1.54 0.00 0.00 39.78 39.30 1sl8 n ASN 49 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1sl8 n LEU 50 N -3.03 2.11 -2.83 3.41 4.77 -0.76 -5.00 117.00 115.67 1sl8 n LEU 50 Ca -0.30 -1.09 -0.19 0.00 -0.03 0.00 0.00 56.01 54.39 1sl8 n LEU 50 Cb 1.08 -0.02 0.05 0.00 -2.33 0.00 0.00 43.42 42.20 1sl8 n LEU 50 CO 0.41 0.41 0.11 0.61 -1.33 0.00 0.00 177.39 177.60 1sl8 n GLY 51 N 0.68 -0.31 3.75 -0.72 0.00 -0.86 -4.90 105.19 102.83 1sl8 n GLY 51 Ca 0.08 0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1sl8 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sl8 s ALA 52 N -3.18 3.68 0.83 4.61 0.00 -0.26 -4.99 121.76 122.44 1sl8 s ALA 52 Ca 0.38 1.44 -0.10 0.00 0.00 0.00 0.00 51.96 53.68 1sl8 s ALA 52 Cb -0.17 -3.60 0.09 0.00 0.00 0.00 0.00 23.12 19.45 1sl8 s ALA 52 CO 0.47 -0.86 1.11 0.95 0.00 0.00 0.00 175.76 177.43 1sl8 s THR 53 N -0.06 2.84 0.30 0.00 -4.23 -1.26 -4.70 115.64 108.54 1sl8 s THR 53 Ca 0.61 0.27 0.04 0.00 -1.18 0.00 0.00 61.69 61.44 1sl8 s THR 53 Cb -0.45 -2.58 0.31 0.00 1.34 0.00 0.00 72.50 71.12 1sl8 s THR 53 CO 0.46 -0.36 1.66 -0.65 -0.54 0.00 0.00 174.62 175.19 1sl8 h PRO 54 N -1.42 0.25 -0.04 3.99 0.11 -1.98 0.32 132.00 133.23 1sl8 h PRO 54 Ca -0.43 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 1sl8 h PRO 54 Cb 1.25 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1sl8 h PRO 54 CO 0.48 0.17 0.01 1.49 -0.21 0.00 0.00 178.00 179.93 1sl8 h GLU 55 N 0.26 0.07 -0.37 1.05 4.81 -2.00 -1.36 114.58 117.05 1sl8 h GLU 55 Ca 0.58 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 59.85 1sl8 h GLU 55 Cb 1.20 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.52 1sl8 h GLU 55 CO -0.63 0.30 0.06 1.96 -0.73 0.00 0.00 179.01 179.98 1sl8 h GLN 56 N -0.18 0.17 -0.46 1.92 4.20 -1.72 -2.15 115.11 116.89 1sl8 h GLN 56 Ca 0.01 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.64 1sl8 h GLN 56 Cb 0.27 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 1sl8 h GLN 56 CO 0.00 0.11 -0.02 0.00 -0.67 0.00 0.00 178.83 178.26 1sl8 h ALA 57 N 1.28 1.11 -0.29 3.87 0.00 -0.27 -0.89 119.26 124.07 1sl8 h ALA 57 Ca 0.18 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 1sl8 h ALA 57 Cb 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1sl8 h ALA 57 CO -0.24 0.56 -0.19 -0.22 0.00 0.00 0.00 179.25 179.16 1sl8 h LYS 58 N 0.71 0.65 -0.62 0.00 3.64 -1.03 0.64 116.57 120.56 1sl8 h LYS 58 Ca 0.14 -0.30 0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1sl8 h LYS 58 Cb 0.46 -0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.22 1sl8 h LYS 58 CO 0.02 0.89 0.35 -0.09 -2.27 0.00 0.00 179.45 178.35 1sl8 h ARG 59 N 0.39 0.64 -0.41 1.90 2.43 -1.24 -1.42 114.38 116.66 1sl8 h ARG 59 Ca 0.06 -0.04 -0.13 0.00 -0.81 0.00 0.00 59.98 59.06 1sl8 h ARG 59 Cb 0.73 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 1sl8 h ARG 59 CO 0.05 0.43 -0.26 1.25 -1.51 0.00 0.00 179.97 179.92 1sl8 h HIS 60 N 0.66 1.01 -0.64 2.20 2.76 -1.05 -2.29 115.15 117.80 1sl8 h HIS 60 Ca 0.27 -0.25 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 1sl8 h HIS 60 Cb 0.12 -0.23 -0.03 0.00 1.55 0.00 0.00 27.41 28.82 1sl8 h HIS 60 CO -0.08 1.03 0.33 -0.22 -1.30 0.00 0.00 177.93 177.70 1sl8 h LYS 61 N 0.74 0.92 -0.23 5.26 3.64 -0.42 0.20 116.57 126.67 1sl8 h LYS 61 Ca 0.09 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.29 1sl8 h LYS 61 Cb 0.82 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1sl8 h LYS 61 CO 0.07 0.72 -0.09 -0.44 -2.27 0.00 0.00 179.45 177.43 1sl8 h ASP 62 N 0.88 0.48 -0.39 4.20 3.32 -1.16 -1.38 116.42 122.37 1sl8 h ASP 62 Ca 0.22 -0.40 -0.12 0.00 0.02 0.00 0.00 57.03 56.76 1sl8 h ASP 62 Cb 0.09 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1sl8 h ASP 62 CO -0.03 0.77 -0.21 0.00 -1.72 0.00 0.00 179.24 178.05 1sl8 h ALA 63 N 0.73 0.56 -0.30 3.45 0.00 -1.17 -2.42 119.26 120.11 1sl8 h ALA 63 Ca 0.05 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 1sl8 h ALA 63 Cb 0.58 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1sl8 h ALA 63 CO 0.03 0.52 -0.33 -0.24 0.00 0.00 0.00 179.25 179.23 1sl8 h VAL 64 N 0.64 1.29 -0.86 0.00 3.04 -0.55 -1.17 116.25 118.64 1sl8 h VAL 64 Ca 0.09 -1.47 0.08 0.00 -1.01 0.00 0.00 66.70 64.39 1sl8 h VAL 64 Cb 0.77 1.42 -0.07 0.00 -2.01 0.00 0.00 31.29 31.40 1sl8 h VAL 64 CO 0.06 0.47 0.52 -0.08 -1.01 0.00 0.00 177.57 177.53 1sl8 h GLU 65 N 0.55 0.87 -0.00 4.17 4.81 -1.25 0.51 114.58 124.24 1sl8 h GLU 65 Ca 0.06 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.08 1sl8 h GLU 65 Cb 0.84 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1sl8 h GLU 65 CO 0.07 0.58 -0.75 0.00 -0.73 0.00 0.00 179.01 178.18 1sl8 h ALA 66 N 1.44 0.75 0.35 2.92 0.00 -1.09 -0.37 119.26 123.26 1sl8 h ALA 66 Ca 0.40 -0.67 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 1sl8 h ALA 66 Cb 0.29 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1sl8 h ALA 66 CO -0.21 0.90 -0.17 0.35 0.00 0.00 0.00 179.25 180.12 1sl8 h PHE 67 N 0.03 -0.44 -0.76 0.00 3.57 -0.81 -1.61 116.94 116.93 1sl8 h PHE 67 Ca -0.01 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 1sl8 h PHE 67 Cb 1.32 0.14 -0.04 0.00 2.79 0.00 0.00 35.95 40.17 1sl8 h PHE 67 CO 0.01 -0.24 0.45 0.74 -2.23 0.00 0.00 178.31 177.04 1sl8 h PHE 68 N -1.11 0.99 -0.59 0.41 0.04 -1.02 -2.06 116.94 113.60 1sl8 h PHE 68 Ca -0.05 0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.77 1sl8 h PHE 68 Cb 0.39 -0.33 -0.03 0.00 2.20 0.00 0.00 35.95 38.18 1sl8 h PHE 68 CO 0.01 0.66 0.39 0.78 -0.60 0.00 0.00 178.31 179.55 1sl8 h GLY 69 N 1.07 0.74 2.00 -1.45 0.00 -1.10 -1.92 103.07 102.40 1sl8 h GLY 69 Ca 0.27 -0.24 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 1sl8 h GLY 69 CO -0.05 0.19 -0.13 -1.33 0.00 0.00 0.00 176.54 175.22 1sl8 h GLY 70 N 0.61 0.00 1.43 4.60 0.00 -0.55 -0.07 103.07 109.08 1sl8 h GLY 70 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 1sl8 h GLY 70 CO -0.07 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.47 1sl8 n ALA 71 N -2.47 2.49 0.00 3.60 0.00 -0.73 -4.59 120.51 118.82 1sl8 n ALA 71 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1sl8 n ALA 71 Cb 0.21 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.18 1sl8 n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sl8 n GLY 72 N 1.13 1.00 3.83 0.00 0.00 -0.04 -3.98 105.19 107.13 1sl8 n GLY 72 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 1sl8 n GLY 72 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sl8 s MET 73 N -0.79 4.12 0.05 1.61 1.00 -1.19 -5.03 119.30 119.07 1sl8 s MET 73 Ca 0.00 0.82 0.01 0.00 0.00 0.00 0.00 55.69 56.52 1sl8 s MET 73 Cb 0.00 -2.50 -0.03 0.00 0.00 0.00 0.00 34.83 32.31 1sl8 s MET 73 CO 0.00 0.18 -0.06 0.15 0.00 0.00 0.00 175.02 175.29 1sl8 s LYS 74 N -2.77 0.55 0.21 2.03 1.02 -1.26 -4.34 119.74 115.18 1sl8 s LYS 74 Ca 0.53 -0.87 -0.30 0.00 0.02 0.00 0.00 55.97 55.35 1sl8 s LYS 74 Cb -0.12 -0.16 -0.09 0.00 -0.52 0.00 0.00 37.83 36.94 1sl8 s LYS 74 CO 0.18 0.01 1.28 0.71 -0.92 0.00 0.00 175.35 176.60 1sl8 s TYR 75 N -2.01 3.29 0.00 3.18 2.02 -1.26 -2.47 117.35 120.09 1sl8 s TYR 75 Ca -0.06 1.29 0.00 0.00 -0.37 0.00 0.00 57.07 57.93 1sl8 s TYR 75 Cb -0.06 -3.56 0.00 0.00 -0.40 0.00 0.00 41.96 37.94 1sl8 s TYR 75 CO -0.02 -1.70 0.00 0.41 -1.57 0.00 0.00 175.55 172.67 1sl8 n GLY 76 N 2.18 1.05 3.19 0.71 0.00 -1.26 -4.97 105.19 106.09 1sl8 n GLY 76 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.78 1sl8 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1sl8 s VAL 77 N -3.30 1.75 -0.05 1.61 1.01 -1.18 -5.12 120.40 115.12 1sl8 s VAL 77 Ca 0.00 -0.88 -0.14 0.00 0.00 0.00 0.00 61.98 60.96 1sl8 s VAL 77 Cb 0.00 -1.50 -0.05 0.00 0.00 0.00 0.00 36.38 34.83 1sl8 s VAL 77 CO 0.00 0.49 0.37 -1.61 0.00 0.00 0.00 175.10 174.35 1sl8 s GLU 78 N 0.10 3.96 -0.05 2.72 2.02 -1.26 -4.17 118.70 122.02 1sl8 s GLU 78 Ca -0.08 0.31 0.06 0.00 0.02 0.00 0.00 54.97 55.28 1sl8 s GLU 78 Cb -0.14 -3.27 -0.01 0.00 0.10 0.00 0.00 34.13 30.81 1sl8 s GLU 78 CO 0.04 0.58 -0.25 0.99 0.02 0.00 0.00 175.26 176.64 1sl8 s THR 79 N -0.66 2.05 0.51 3.63 2.01 0.15 -4.88 115.64 118.45 1sl8 s THR 79 Ca 0.22 -1.07 -0.02 0.00 0.31 0.00 0.00 61.69 61.12 1sl8 s THR 79 Cb -0.15 -1.72 -0.00 0.00 0.01 0.00 0.00 72.50 70.63 1sl8 s THR 79 CO 0.11 0.57 0.76 -1.61 -0.69 0.00 0.00 174.62 173.76 1sl8 s GLU 80 N -0.25 3.03 0.18 4.92 2.02 -1.26 -0.61 118.70 126.72 1sl8 s GLU 80 Ca -0.01 -0.27 -0.17 0.00 0.02 0.00 0.00 54.97 54.55 1sl8 s GLU 80 Cb -0.13 -2.44 0.13 0.00 0.10 0.00 0.00 34.13 31.79 1sl8 s GLU 80 CO 0.03 -0.43 1.65 2.35 0.02 0.00 0.00 175.26 178.88 1sl8 h TRP 81 N 0.17 -0.31 -0.83 1.61 2.91 -1.99 -1.18 115.95 116.33 1sl8 h TRP 81 Ca -0.46 0.04 0.09 0.00 1.13 0.00 0.00 58.89 59.69 1sl8 h TRP 81 Cb 1.25 0.21 -0.07 0.00 -0.51 0.00 0.00 29.16 30.04 1sl8 h TRP 81 CO 0.47 -0.22 0.48 -1.35 -1.03 0.00 0.00 178.44 176.78 1sl8 h PRO 82 N -0.03 0.79 -0.09 2.65 0.11 -1.98 0.41 132.00 133.86 1sl8 h PRO 82 Ca 0.22 -0.05 -0.24 0.00 0.11 0.00 0.00 66.00 66.04 1sl8 h PRO 82 Cb 0.37 -0.18 0.01 0.00 0.11 0.00 0.00 31.00 31.31 1sl8 h PRO 82 CO -0.49 0.52 -0.89 0.93 -0.21 0.00 0.00 178.00 177.86 1sl8 h GLU 83 N 0.81 0.75 0.07 1.05 3.07 -1.89 -1.47 114.58 116.97 1sl8 h GLU 83 Ca 0.39 -0.69 0.02 0.00 -0.50 0.00 0.00 59.36 58.59 1sl8 h GLU 83 Cb 0.34 0.17 -0.04 0.00 -0.84 0.00 0.00 28.75 28.38 1sl8 h GLU 83 CO -0.24 1.28 -0.27 -0.92 -1.40 0.00 0.00 179.01 177.47 1sl8 h TYR 84 N 0.48 -0.72 -0.09 4.33 3.20 -0.58 -0.98 116.97 122.61 1sl8 h TYR 84 Ca -0.09 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.64 1sl8 h TYR 84 Cb 1.53 0.31 -0.01 0.00 1.54 0.00 0.00 36.73 40.10 1sl8 h TYR 84 CO 0.09 -0.37 -0.64 0.97 -1.64 0.00 0.00 178.16 176.57 1sl8 h ILE 85 N -0.45 1.37 -0.76 1.81 6.09 -0.90 -1.96 117.51 122.72 1sl8 h ILE 85 Ca 0.04 -2.01 -0.03 0.00 -1.37 0.00 0.00 64.86 61.49 1sl8 h ILE 85 Cb 0.50 2.00 -0.03 0.00 0.47 0.00 0.00 36.82 39.76 1sl8 h ILE 85 CO -0.19 0.60 0.35 -0.08 -3.07 0.00 0.00 178.15 175.77 1sl8 h GLU 86 N 0.26 1.11 -0.71 2.19 4.57 -1.17 -0.55 114.58 120.28 1sl8 h GLU 86 Ca -0.01 -0.17 0.10 0.00 -1.18 0.00 0.00 59.36 58.09 1sl8 h GLU 86 Cb 1.18 -0.19 -0.07 0.00 -0.16 0.00 0.00 28.75 29.51 1sl8 h GLU 86 CO 0.11 0.87 0.34 0.78 -1.18 0.00 0.00 179.01 179.93 1sl8 h GLY 87 N 1.08 1.07 1.08 1.92 0.00 -0.82 -1.69 103.07 105.70 1sl8 h GLY 87 Ca 0.26 -0.21 -0.15 0.00 0.00 0.00 0.00 47.33 47.23 1sl8 h GLY 87 CO -0.03 0.04 -0.35 1.49 0.00 0.00 0.00 176.54 177.69 1sl8 h TRP 88 N 0.58 1.04 -0.88 5.60 4.06 -0.90 -1.98 115.95 123.46 1sl8 h TRP 88 Ca 0.35 -0.31 0.13 0.00 2.06 0.00 0.00 58.89 61.12 1sl8 h TRP 88 Cb 0.39 -0.22 -0.09 0.00 -1.00 0.00 0.00 29.16 28.25 1sl8 h TRP 88 CO -0.11 1.12 0.50 0.87 -3.56 0.00 0.00 178.44 177.25 1sl8 h LYS 89 N 0.66 0.73 -0.17 0.49 1.57 -0.72 -0.02 116.57 119.11 1sl8 h LYS 89 Ca 0.06 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.67 1sl8 h LYS 89 Cb 0.94 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1sl8 h LYS 89 CO 0.09 0.48 -0.38 0.00 -0.57 0.00 0.00 179.45 179.06 1sl8 h ARG 90 N 0.75 0.55 -0.27 3.15 3.08 -1.14 -1.47 114.38 119.03 1sl8 h ARG 90 Ca 0.46 -0.37 -0.00 0.00 0.07 0.00 0.00 59.98 60.14 1sl8 h ARG 90 Cb 0.57 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.66 1sl8 h ARG 90 CO -0.32 0.99 0.15 1.25 -1.07 0.00 0.00 179.97 180.98 1sl8 h LEU 91 N 0.20 0.33 -0.33 3.04 5.85 -1.15 -1.94 115.31 121.30 1sl8 h LEU 91 Ca -0.00 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.66 1sl8 h LEU 91 Cb 0.99 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.92 1sl8 h LEU 91 CO 0.08 0.30 0.20 0.00 -0.34 0.00 0.00 178.44 178.68 1sl8 h ALA 92 N 1.04 0.41 -0.73 1.25 0.00 -0.92 0.13 119.26 120.45 1sl8 h ALA 92 Ca 0.09 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1sl8 h ALA 92 Cb 0.04 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1sl8 h ALA 92 CO -0.02 -0.15 0.43 1.03 0.00 0.00 0.00 179.25 180.54 1sl8 h SER 93 N 0.41 0.89 -0.33 0.00 0.87 -1.08 0.79 113.55 115.10 1sl8 h SER 93 Ca 0.13 -0.07 -0.10 0.00 -1.23 0.00 0.00 61.79 60.51 1sl8 h SER 93 Cb -0.01 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 61.72 1sl8 h SER 93 CO -0.05 0.70 -0.20 -0.08 -0.53 0.00 0.00 176.83 176.66 1sl8 h GLU 94 N 1.00 0.72 -0.20 2.24 4.57 -0.88 -2.80 114.58 119.23 1sl8 h GLU 94 Ca 0.26 -0.33 -0.15 0.00 -1.18 0.00 0.00 59.36 57.96 1sl8 h GLU 94 Cb -0.02 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.55 1sl8 h GLU 94 CO -0.05 0.94 -0.48 0.93 -1.18 0.00 0.00 179.01 179.17 1sl8 h GLU 95 N 0.48 0.54 0.00 1.92 4.39 -0.55 -2.23 114.58 119.13 1sl8 h GLU 95 Ca 0.07 -0.31 -0.07 0.00 0.34 0.00 0.00 59.36 59.39 1sl8 h GLU 95 Cb 0.75 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.41 1sl8 h GLU 95 CO 0.06 0.90 -0.34 -0.07 -1.16 0.00 0.00 179.01 178.39 1sl8 h LEU 96 N 0.43 0.00 -0.24 1.33 3.38 -0.79 -0.28 115.31 119.14 1sl8 h LEU 96 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1sl8 h LEU 96 Cb 1.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1sl8 h LEU 96 CO 0.09 0.34 0.07 0.11 0.09 0.00 0.00 178.44 179.14 1sl8 h LYS 97 N 0.00 0.37 -0.45 1.13 1.57 -1.26 -0.44 116.57 117.49 1sl8 h LYS 97 Ca -0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1sl8 h LYS 97 Cb 0.66 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1sl8 h LYS 97 CO 0.04 0.46 0.28 0.00 -0.57 0.00 0.00 179.45 179.67 1sl8 h ARG 98 N 0.21 0.60 -0.79 3.15 3.08 -0.87 -2.20 114.38 117.56 1sl8 h ARG 98 Ca 0.08 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1sl8 h ARG 98 Cb 0.25 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.13 1sl8 h ARG 98 CO -0.00 0.42 0.42 -0.92 -1.07 0.00 0.00 179.97 178.82 1sl8 h TYR 99 N 0.60 1.09 0.00 3.04 3.20 -1.02 -0.13 116.97 123.75 1sl8 h TYR 99 Ca 0.16 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.97 1sl8 h TYR 99 Cb -0.04 -0.35 -0.00 0.00 1.54 0.00 0.00 36.73 37.88 1sl8 h TYR 99 CO -0.04 0.77 -0.14 1.03 -1.64 0.00 0.00 178.16 178.13 1sl8 h SER 100 N 1.11 0.00 -0.47 -2.11 0.87 -0.63 -0.62 113.55 111.69 1sl8 h SER 100 Ca 0.28 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.84 1sl8 h SER 100 Cb 0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 1sl8 h SER 100 CO -0.04 0.14 0.00 0.29 -0.53 0.00 0.00 176.83 176.69 1sl8 n LYS 101 N -4.31 2.13 -2.73 2.24 5.02 -0.85 -4.92 118.16 114.74 1sl8 n LYS 101 Ca -0.03 -1.71 -0.18 0.00 -2.02 0.00 0.00 58.31 54.37 1sl8 n LYS 101 Cb 0.21 -1.38 0.02 0.00 -0.02 0.00 0.00 35.03 33.86 1sl8 n LYS 101 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1sl8 n ASN 102 N 0.88 -5.23 -4.92 4.39 5.15 -0.24 -5.00 115.26 110.29 1sl8 n ASN 102 Ca 0.16 -0.18 -0.21 0.00 -0.60 0.00 0.00 54.58 53.75 1sl8 n ASN 102 Cb 0.41 -4.13 -0.02 0.00 -0.53 0.00 0.00 39.78 35.50 1sl8 n ASN 102 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1sl8 s GLN 103 N -5.31 3.13 0.36 1.20 -0.21 -0.12 -5.01 119.66 113.71 1sl8 s GLN 103 Ca 0.18 -0.97 -0.28 0.00 0.02 0.00 0.00 55.36 54.31 1sl8 s GLN 103 Cb -0.08 -2.73 -0.10 0.00 1.00 0.00 0.00 33.01 31.10 1sl8 s GLN 103 CO 0.23 0.29 1.38 0.42 -2.12 0.00 0.00 175.29 175.48 1sl8 s ILE 104 N -2.11 2.43 0.28 1.08 -1.09 -1.26 -4.23 121.20 116.31 1sl8 s ILE 104 Ca 0.37 0.42 0.11 0.00 -2.23 0.00 0.00 60.65 59.32 1sl8 s ILE 104 Cb -0.08 -3.27 -0.05 0.00 -1.58 0.00 0.00 42.46 37.48 1sl8 s ILE 104 CO 0.28 0.09 -0.17 0.42 -1.23 0.00 0.00 174.94 174.34 1sl8 s THR 105 N -1.15 2.31 0.27 2.92 -4.23 -1.26 -4.88 115.64 109.61 1sl8 s THR 105 Ca 0.52 -2.33 -0.03 0.00 -1.18 0.00 0.00 61.69 58.66 1sl8 s THR 105 Cb -0.42 -2.35 0.26 0.00 1.34 0.00 0.00 72.50 71.33 1sl8 s THR 105 CO 0.56 -0.38 1.93 -0.07 -0.54 0.00 0.00 174.62 176.13 1sl8 h LEU 106 N 2.25 1.05 -0.93 4.79 3.38 -1.96 -2.05 115.31 121.84 1sl8 h LEU 106 Ca -0.40 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.44 1sl8 h LEU 106 Cb 1.25 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 1sl8 h LEU 106 CO 0.63 0.74 -0.44 -0.29 0.09 0.00 0.00 178.44 179.17 1sl8 h ILE 107 N 1.23 1.32 -0.46 1.22 2.10 -1.95 -1.04 117.51 119.93 1sl8 h ILE 107 Ca 0.36 -1.58 -0.10 0.00 1.08 0.00 0.00 64.86 64.62 1sl8 h ILE 107 Cb -0.06 1.74 -0.01 0.00 -1.09 0.00 0.00 36.82 37.40 1sl8 h ILE 107 CO -0.10 0.47 -0.11 -0.09 -1.08 0.00 0.00 178.15 177.24 1sl8 h ARG 108 N 0.17 0.88 -0.43 2.19 9.65 -1.86 0.14 114.38 125.13 1sl8 h ARG 108 Ca 0.01 -0.34 -0.02 0.00 -1.10 0.00 0.00 59.98 58.53 1sl8 h ARG 108 Cb 0.85 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.36 1sl8 h ARG 108 CO 0.07 0.98 0.18 -0.07 2.80 0.00 0.00 179.97 183.93 1sl8 h LEU 109 N 0.72 0.59 -0.24 3.80 3.38 -1.06 0.76 115.31 123.27 1sl8 h LEU 109 Ca 0.12 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1sl8 h LEU 109 Cb 0.66 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1sl8 h LEU 109 CO 0.05 0.58 0.04 -0.25 0.09 0.00 0.00 178.44 178.95 1sl8 h TRP 110 N 0.55 0.07 -0.24 1.13 7.01 -1.09 -2.63 115.95 120.75 1sl8 h TRP 110 Ca 0.14 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.13 1sl8 h TRP 110 Cb 0.18 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.22 1sl8 h TRP 110 CO -0.00 0.02 0.02 0.78 -2.79 0.00 0.00 178.44 176.46 1sl8 h GLY 111 N 0.13 0.38 0.89 2.65 0.00 -0.42 -0.53 103.07 106.17 1sl8 h GLY 111 Ca 0.11 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.21 1sl8 h GLY 111 CO -0.15 0.18 0.06 -0.55 0.00 0.00 0.00 176.54 176.08 1sl8 h ASP 112 N 0.35 0.46 -0.43 0.19 3.32 -0.68 0.15 116.42 119.77 1sl8 h ASP 112 Ca 0.08 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 56.81 1sl8 h ASP 112 Cb 0.21 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 1sl8 h ASP 112 CO 0.00 0.59 -0.01 0.00 -1.72 0.00 0.00 179.24 178.10 1sl8 h ALA 113 N 0.88 0.58 -0.52 3.45 0.00 -1.03 -2.73 119.26 119.90 1sl8 h ALA 113 Ca 0.09 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1sl8 h ALA 113 Cb 0.32 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1sl8 h ALA 113 CO 0.00 0.38 0.33 1.25 0.00 0.00 0.00 179.25 181.22 1sl8 h LEU 114 N 0.61 0.57 -0.34 0.00 5.85 -1.07 -3.16 115.31 117.78 1sl8 h LEU 114 Ca 0.12 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.90 1sl8 h LEU 114 Cb 0.51 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.34 1sl8 h LEU 114 CO 0.02 0.41 -0.04 0.15 -0.34 0.00 0.00 178.44 178.64 1sl8 h PHE 115 N 0.68 -0.10 -0.89 1.25 3.57 -0.50 -0.76 116.94 120.19 1sl8 h PHE 115 Ca 0.20 0.03 0.17 0.00 3.53 0.00 0.00 57.97 61.89 1sl8 h PHE 115 Cb -0.05 0.10 -0.07 0.00 2.79 0.00 0.00 35.95 38.71 1sl8 h PHE 115 CO -0.05 -0.11 0.58 0.22 -2.23 0.00 0.00 178.31 176.73 1sl8 h ASP 116 N 0.05 0.57 -0.04 0.41 3.58 -1.46 0.14 116.42 119.67 1sl8 h ASP 116 Ca 0.16 0.05 -0.12 0.00 0.42 0.00 0.00 57.03 57.54 1sl8 h ASP 116 Cb 0.24 -0.06 0.01 0.00 1.72 0.00 0.00 39.33 41.23 1sl8 h ASP 116 CO -0.31 0.26 -0.46 0.40 -2.88 0.00 0.00 179.24 176.25 1sl8 h ILE 117 N 0.59 1.43 0.00 2.25 2.04 -1.26 -3.27 117.51 119.29 1sl8 h ILE 117 Ca 0.46 -1.91 -0.04 0.00 1.00 0.00 0.00 64.86 64.37 1sl8 h ILE 117 Cb 0.89 2.47 -0.01 0.00 -0.74 0.00 0.00 36.82 39.43 1sl8 h ILE 117 CO -0.21 0.55 -0.18 0.16 0.00 0.00 0.00 178.15 178.48 1sl8 h ILE 118 N -0.13 0.38 -0.25 -0.67 3.07 -0.64 -3.33 117.51 115.94 1sl8 h ILE 118 Ca -0.05 -1.17 -0.63 0.00 1.55 0.00 0.00 64.86 64.57 1sl8 h ILE 118 Cb 1.14 1.88 -0.02 0.00 -0.27 0.00 0.00 36.82 39.55 1sl8 h ILE 118 CO 0.09 0.18 2.38 -0.67 -1.05 0.00 0.00 178.15 179.08 1sl8 n ASP 119 N -3.24 3.58 -0.37 2.16 2.03 -0.01 -4.77 116.55 115.93 1sl8 n ASP 119 Ca 0.01 -2.79 0.03 0.00 0.52 0.00 0.00 54.79 52.56 1sl8 n ASP 119 Cb 0.48 -1.53 0.17 0.00 -0.72 0.00 0.00 41.12 39.52 1sl8 n ASP 119 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1sl8 h LYS 120 N 7.45 1.12 -0.31 -0.67 1.79 -1.80 -2.02 116.57 122.13 1sl8 h LYS 120 Ca 0.45 -0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.85 1sl8 h LYS 120 Cb 0.74 -0.25 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 1sl8 h LYS 120 CO 1.72 0.74 0.00 -0.40 -1.08 0.00 0.00 179.45 180.43 1sl8 n ASP 121 N -4.52 1.55 -2.96 0.86 5.68 -1.26 -4.92 116.55 110.99 1sl8 n ASP 121 Ca 0.15 -2.02 -0.14 0.00 -0.50 0.00 0.00 54.79 52.29 1sl8 n ASP 121 Cb 0.19 -0.21 -0.01 0.00 -1.14 0.00 0.00 41.12 39.95 1sl8 n ASP 121 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1sl8 n GLN 122 N 0.31 -2.64 -0.03 0.11 1.13 -0.76 -4.83 117.38 110.68 1sl8 n GLN 122 Ca 0.09 0.27 0.13 0.00 -1.94 0.00 0.00 57.00 55.55 1sl8 n GLN 122 Cb 0.25 -4.86 0.46 0.00 0.11 0.00 0.00 30.24 26.21 1sl8 n GLN 122 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1sl8 n ASN 123 N -1.89 1.63 -0.35 1.08 6.94 -1.26 -4.95 115.26 116.46 1sl8 n ASN 123 Ca -0.02 -1.59 -0.04 0.00 -0.02 0.00 0.00 54.58 52.91 1sl8 n ASN 123 Cb 0.53 -0.04 -0.01 0.00 -2.36 0.00 0.00 39.78 37.90 1sl8 n ASN 123 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1sl8 n GLY 124 N 1.17 0.55 3.31 4.83 0.00 -1.26 -5.02 105.19 108.76 1sl8 n GLY 124 Ca 0.18 -0.84 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 1sl8 n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sl8 s ALA 125 N -2.16 -1.01 -0.30 4.61 0.00 -1.26 -4.62 121.76 117.01 1sl8 s ALA 125 Ca 0.00 0.48 -0.12 0.00 0.00 0.00 0.00 51.96 52.33 1sl8 s ALA 125 Cb 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1sl8 s ALA 125 CO 0.00 -0.33 0.21 0.42 0.00 0.00 0.00 175.76 176.05 1sl8 s ILE 126 N -1.63 5.26 0.90 0.00 -1.09 0.11 -4.82 121.20 119.93 1sl8 s ILE 126 Ca -0.11 -0.01 -0.12 0.00 -2.23 0.00 0.00 60.65 58.18 1sl8 s ILE 126 Cb -0.03 -3.59 0.13 0.00 -1.58 0.00 0.00 42.46 37.39 1sl8 s ILE 126 CO 0.03 0.14 1.14 -0.94 -1.23 0.00 0.00 174.94 174.09 1sl8 s SER 127 N 1.74 3.59 0.19 3.58 1.04 -1.26 -0.40 113.70 122.18 1sl8 s SER 127 Ca 0.07 0.96 -0.12 0.00 0.48 0.00 0.00 55.95 57.34 1sl8 s SER 127 Cb -0.17 -1.53 0.21 0.00 0.10 0.00 0.00 66.02 64.63 1sl8 s SER 127 CO 0.11 -2.50 1.74 0.25 0.98 0.00 0.00 173.24 173.82 1sl8 h LEU 128 N -1.46 0.15 -1.11 2.42 5.85 -1.98 -0.37 115.31 118.81 1sl8 h LEU 128 Ca -0.50 0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.31 1sl8 h LEU 128 Cb 1.33 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.38 1sl8 h LEU 128 CO 0.62 0.11 0.60 0.44 -0.34 0.00 0.00 178.44 179.87 1sl8 h ASP 129 N 0.34 1.03 -0.43 1.25 3.32 -1.98 0.87 116.42 120.82 1sl8 h ASP 129 Ca 0.26 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.20 1sl8 h ASP 129 Cb 0.31 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1sl8 h ASP 129 CO -0.28 0.73 -0.04 -0.33 -1.72 0.00 0.00 179.24 177.60 1sl8 h GLU 130 N 1.21 0.86 -0.46 3.56 5.08 -1.66 -2.16 114.58 121.01 1sl8 h GLU 130 Ca 0.34 -0.26 -0.13 0.00 -1.00 0.00 0.00 59.36 58.31 1sl8 h GLU 130 Cb -0.09 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1sl8 h GLU 130 CO -0.08 0.89 -0.21 2.35 -1.00 0.00 0.00 179.01 180.95 1sl8 h TRP 131 N 0.79 1.10 -0.68 4.33 2.91 -0.56 -1.66 115.95 122.18 1sl8 h TRP 131 Ca 0.14 -0.27 0.03 0.00 1.13 0.00 0.00 58.89 59.93 1sl8 h TRP 131 Cb 0.53 -0.26 -0.04 0.00 -0.51 0.00 0.00 29.16 28.88 1sl8 h TRP 131 CO 0.03 1.08 0.42 0.87 -1.03 0.00 0.00 178.44 179.81 1sl8 h LYS 132 N 0.80 0.79 -0.59 2.65 1.57 -0.61 0.13 116.57 121.31 1sl8 h LYS 132 Ca 0.10 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 1sl8 h LYS 132 Cb 0.79 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1sl8 h LYS 132 CO 0.07 0.52 0.00 0.00 -0.57 0.00 0.00 179.45 179.47 1sl8 h ALA 133 N 1.30 0.89 -0.32 3.86 0.00 -1.22 -1.92 119.26 121.86 1sl8 h ALA 133 Ca 0.28 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 1sl8 h ALA 133 Cb 0.05 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1sl8 h ALA 133 CO -0.12 0.66 -0.00 -0.92 0.00 0.00 0.00 179.25 178.87 1sl8 h TYR 134 N 0.94 0.61 -0.64 0.00 3.20 -0.59 -1.89 116.97 118.61 1sl8 h TYR 134 Ca 0.17 -0.11 -0.03 0.00 3.14 0.00 0.00 58.73 61.91 1sl8 h TYR 134 Cb 0.54 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1sl8 h TYR 134 CO 0.04 0.68 0.29 1.79 -1.64 0.00 0.00 178.16 179.32 1sl8 h THR 135 N 0.36 1.21 -0.47 1.81 1.35 -0.63 -1.42 112.91 115.13 1sl8 h THR 135 Ca 0.09 -0.63 -0.07 0.00 -0.55 0.00 0.00 66.41 65.25 1sl8 h THR 135 Cb 0.44 0.41 -0.02 0.00 -1.73 0.00 0.00 68.15 67.26 1sl8 h THR 135 CO 0.02 0.26 0.00 0.11 -0.25 0.00 0.00 175.52 175.66 1sl8 h LYS 136 N 0.91 0.78 0.00 4.72 1.57 -1.20 -2.57 116.57 120.79 1sl8 h LYS 136 Ca 0.22 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1sl8 h LYS 136 Cb 0.13 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 1sl8 h LYS 136 CO -0.03 0.79 -0.06 0.66 -0.57 0.00 0.00 179.45 180.24 1sl8 h SER 137 N 0.73 0.00 -0.11 0.86 4.64 -0.43 -0.86 113.55 118.38 1sl8 h SER 137 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 1sl8 h SER 137 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1sl8 h SER 137 CO 0.02 0.06 0.00 0.00 -0.87 0.00 0.00 176.83 176.04 1sl8 n ALA 138 N -2.48 2.55 -0.30 5.18 0.00 -0.98 -4.87 120.51 119.60 1sl8 n ALA 138 Ca -0.03 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1sl8 n ALA 138 Cb 0.14 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.44 1sl8 n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sl8 n GLY 139 N 1.06 0.71 3.70 0.00 0.00 -0.33 -5.03 105.19 105.31 1sl8 n GLY 139 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1sl8 n GLY 139 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sl8 s ILE 140 N -2.41 4.35 -0.20 -0.61 1.01 -1.12 -5.04 121.20 117.18 1sl8 s ILE 140 Ca 0.00 1.68 -0.04 0.00 0.00 0.00 0.00 60.65 62.28 1sl8 s ILE 140 Cb 0.00 -4.08 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 1sl8 s ILE 140 CO 0.00 0.09 -0.02 -0.63 0.00 0.00 0.00 174.94 174.38 1sl8 s ILE 141 N 1.41 3.76 0.08 2.92 -1.09 -1.26 -4.30 121.20 122.72 1sl8 s ILE 141 Ca 0.56 -0.38 -0.26 0.00 -2.23 0.00 0.00 60.65 58.34 1sl8 s ILE 141 Cb -0.25 -2.69 0.08 0.00 -1.58 0.00 0.00 42.46 38.02 1sl8 s ILE 141 CO 0.26 0.44 0.77 0.00 -1.23 0.00 0.00 174.94 175.18 1sl8 s GLN 142 N 1.01 1.05 0.85 2.79 -2.07 -1.26 -5.14 119.66 116.89 1sl8 s GLN 142 Ca 0.01 -0.41 -0.11 0.00 -1.82 0.00 0.00 55.36 53.04 1sl8 s GLN 142 Cb -0.14 0.47 0.11 0.00 -1.09 0.00 0.00 33.01 32.36 1sl8 s GLN 142 CO 0.01 -0.46 1.14 -1.54 -1.32 0.00 0.00 175.29 173.12 1sl8 s SER 143 N -2.62 3.53 0.25 12.60 1.04 -1.26 -4.85 113.70 122.39 1sl8 s SER 143 Ca 0.04 2.12 -0.07 0.00 0.48 0.00 0.00 55.95 58.53 1sl8 s SER 143 Cb -0.01 -2.56 0.45 0.00 0.10 0.00 0.00 66.02 64.00 1sl8 s SER 143 CO -0.10 -2.70 1.63 0.28 0.98 0.00 0.00 173.24 173.33 1sl8 h SER 144 N -1.43 -0.37 -0.92 7.02 0.02 -2.01 -1.82 113.55 114.04 1sl8 h SER 144 Ca -0.44 0.20 0.02 0.00 -0.84 0.00 0.00 61.79 60.73 1sl8 h SER 144 Cb 1.26 0.36 -0.05 0.00 0.14 0.00 0.00 62.40 64.11 1sl8 h SER 144 CO 0.45 -0.19 0.61 -0.33 -1.14 0.00 0.00 176.83 176.23 1sl8 h GLU 145 N 0.09 1.19 -0.30 3.45 3.07 -1.99 -0.53 114.58 119.56 1sl8 h GLU 145 Ca 0.42 -0.07 -0.16 0.00 -0.50 0.00 0.00 59.36 59.05 1sl8 h GLU 145 Cb 0.75 -0.27 -0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1sl8 h GLU 145 CO -0.69 0.78 -0.47 -0.44 -1.40 0.00 0.00 179.01 176.80 1sl8 h ASP 146 N 1.22 0.86 -0.73 1.42 5.19 -1.82 -1.28 116.42 121.28 1sl8 h ASP 146 Ca 0.35 -0.43 -0.01 0.00 -0.62 0.00 0.00 57.03 56.32 1sl8 h ASP 146 Cb -0.09 -0.25 -0.03 0.00 0.18 0.00 0.00 39.33 39.14 1sl8 h ASP 146 CO -0.09 1.19 0.40 0.00 -3.12 0.00 0.00 179.24 177.62 1sl8 h GLU 148 N 1.01 0.59 -0.39 0.00 5.08 -0.90 -1.17 114.58 118.80 1sl8 h GLU 148 Ca 0.26 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.34 1sl8 h GLU 148 Cb 0.03 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1sl8 h GLU 148 CO -0.04 0.77 0.02 1.49 -1.00 0.00 0.00 179.01 180.25 1sl8 h GLU 149 N 0.52 0.67 -0.01 2.33 4.81 -0.95 -0.14 114.58 121.81 1sl8 h GLU 149 Ca 0.08 -0.20 -0.12 0.00 -0.13 0.00 0.00 59.36 58.98 1sl8 h GLU 149 Cb 0.67 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 1sl8 h GLU 149 CO 0.05 0.75 -0.58 1.79 -0.73 0.00 0.00 179.01 180.29 1sl8 h THR 150 N 0.50 1.42 -0.17 0.32 1.35 -1.20 -0.66 112.91 114.47 1sl8 h THR 150 Ca 0.11 -1.99 0.01 0.00 -0.55 0.00 0.00 66.41 63.99 1sl8 h THR 150 Cb 0.43 2.07 -0.02 0.00 -1.73 0.00 0.00 68.15 68.91 1sl8 h THR 150 CO 0.02 0.57 0.07 0.15 -0.25 0.00 0.00 175.52 176.07 1sl8 h PHE 151 N 0.01 0.12 -0.80 4.73 3.57 -1.03 -1.25 116.94 122.30 1sl8 h PHE 151 Ca -0.01 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1sl8 h PHE 151 Cb 1.03 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.71 1sl8 h PHE 151 CO 0.00 0.07 0.39 0.00 -2.23 0.00 0.00 178.31 176.54 1sl8 h ARG 152 N 0.16 1.14 -0.97 1.11 3.08 -0.44 0.46 114.38 118.92 1sl8 h ARG 152 Ca 0.07 -0.16 0.05 0.00 0.07 0.00 0.00 59.98 60.01 1sl8 h ARG 152 Cb 0.03 -0.21 -0.06 0.00 0.08 0.00 0.00 29.97 29.81 1sl8 h ARG 152 CO -0.06 0.87 0.63 0.28 -1.07 0.00 0.00 179.97 180.61 1sl8 h VAL 153 N 1.13 1.12 -0.15 2.04 2.07 -1.05 -2.82 116.25 118.61 1sl8 h VAL 153 Ca 0.28 -0.40 -0.12 0.00 0.82 0.00 0.00 66.70 67.27 1sl8 h VAL 153 Cb 0.10 -0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 29.70 1sl8 h VAL 153 CO -0.04 0.22 -0.45 0.00 0.02 0.00 0.00 177.57 177.32 1sl8 n ASP 155 N -4.00 4.77 -0.33 0.00 2.03 0.06 -4.82 116.55 114.27 1sl8 n ASP 155 Ca -0.02 -3.00 0.05 0.00 0.52 0.00 0.00 54.79 52.33 1sl8 n ASP 155 Cb 0.52 -1.56 0.20 0.00 -0.72 0.00 0.00 41.12 39.55 1sl8 n ASP 155 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 1sl8 h ILE 156 N 4.09 0.92 -0.21 5.18 1.08 -1.78 0.17 117.51 126.96 1sl8 h ILE 156 Ca 0.44 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 64.60 1sl8 h ILE 156 Cb 0.69 -0.05 0.00 0.00 -3.07 0.00 0.00 36.82 34.38 1sl8 h ILE 156 CO 1.63 0.16 0.00 -0.90 -0.69 0.00 0.00 178.15 178.35 1sl8 n ASP 157 N -4.68 1.79 -3.42 1.72 5.75 -1.26 -4.91 116.55 111.54 1sl8 n ASP 157 Ca 0.16 -1.77 -0.25 0.00 -0.01 0.00 0.00 54.79 52.92 1sl8 n ASP 157 Cb 0.30 -0.14 0.01 0.00 -1.03 0.00 0.00 41.12 40.27 1sl8 n ASP 157 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1sl8 n GLU 158 N 0.41 -4.07 0.22 0.11 1.02 0.05 -4.85 120.64 113.53 1sl8 n GLU 158 Ca 0.16 0.58 0.15 0.00 -0.02 0.00 0.00 57.16 58.03 1sl8 n GLU 158 Cb 0.34 -5.35 0.59 0.00 -0.02 0.00 0.00 31.44 26.99 1sl8 n GLU 158 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1sl8 h SER 159 N -1.27 0.00 0.00 1.62 4.64 -1.91 -3.47 113.55 113.16 1sl8 h SER 159 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1sl8 h SER 159 Cb 1.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1sl8 h SER 159 CO 0.57 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.14 1sl8 n GLY 160 N 0.12 0.84 3.07 -0.77 0.00 -1.26 -5.05 105.19 102.13 1sl8 n GLY 160 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.96 1sl8 n GLY 160 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sl8 s GLN 161 N -0.71 0.56 -0.25 1.61 -0.21 -1.26 -4.49 119.66 114.90 1sl8 s GLN 161 Ca 0.00 -1.10 -0.10 0.00 0.02 0.00 0.00 55.36 54.18 1sl8 s GLN 161 Cb 0.00 0.17 -0.04 0.00 1.00 0.00 0.00 33.01 34.14 1sl8 s GLN 161 CO 0.00 -0.09 0.14 -0.51 -2.12 0.00 0.00 175.29 172.71 1sl8 s LEU 162 N -2.63 3.88 0.81 2.90 1.43 0.47 -4.80 118.68 120.73 1sl8 s LEU 162 Ca 0.03 -0.02 -0.10 0.00 -1.03 0.00 0.00 54.13 53.00 1sl8 s LEU 162 Cb 0.04 -2.05 0.12 0.00 0.03 0.00 0.00 46.19 44.33 1sl8 s LEU 162 CO -0.08 0.00 1.14 1.51 0.23 0.00 0.00 176.35 179.16 1sl8 s ASP 163 N 1.44 4.16 0.23 2.29 1.47 -1.26 0.08 116.67 125.08 1sl8 s ASP 163 Ca 0.07 0.37 -0.07 0.00 1.18 0.00 0.00 52.55 54.10 1sl8 s ASP 163 Cb -0.15 -0.76 0.32 0.00 -0.34 0.00 0.00 42.92 41.99 1sl8 s ASP 163 CO 0.07 -2.05 1.80 0.58 0.68 0.00 0.00 175.17 176.25 1sl8 h VAL 164 N -1.02 0.92 -0.38 2.11 2.07 -1.99 0.04 116.25 118.01 1sl8 h VAL 164 Ca -0.44 -0.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 1sl8 h VAL 164 Cb 1.29 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1sl8 h VAL 164 CO 0.52 0.13 0.07 -0.78 0.02 0.00 0.00 177.57 177.53 1sl8 h ASP 165 N 0.72 0.59 -0.65 0.57 3.58 -1.99 0.79 116.42 120.03 1sl8 h ASP 165 Ca 0.35 -0.25 0.03 0.00 0.42 0.00 0.00 57.03 57.58 1sl8 h ASP 165 Cb 0.29 -0.16 -0.04 0.00 1.72 0.00 0.00 39.33 41.14 1sl8 h ASP 165 CO -0.22 0.70 0.40 -0.33 -2.88 0.00 0.00 179.24 176.90 1sl8 h GLU 166 N 0.47 0.75 -0.16 0.28 5.08 -1.81 -0.77 114.58 118.43 1sl8 h GLU 166 Ca 0.12 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 1sl8 h GLU 166 Cb 0.35 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 1sl8 h GLU 166 CO 0.01 0.49 -0.44 0.52 -1.00 0.00 0.00 179.01 178.59 1sl8 h MET 167 N 0.77 0.37 -0.46 2.33 2.86 -0.73 -1.55 114.93 118.52 1sl8 h MET 167 Ca 0.27 -0.19 -0.00 0.00 -2.06 0.00 0.00 59.70 57.71 1sl8 h MET 167 Cb 0.05 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.69 1sl8 h MET 167 CO -0.12 0.74 0.27 1.15 1.06 0.00 0.00 176.91 180.02 1sl8 h THR 168 N 0.31 1.15 -0.51 2.22 2.02 -0.29 -1.32 112.91 116.49 1sl8 h THR 168 Ca 0.02 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 1sl8 h THR 168 Cb 0.90 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.83 1sl8 h THR 168 CO 0.07 0.15 0.19 0.03 0.37 0.00 0.00 175.52 176.33 1sl8 h ARG 169 N 0.61 0.73 0.08 6.66 3.08 -0.96 0.16 114.38 124.74 1sl8 h ARG 169 Ca 0.16 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1sl8 h ARG 169 Cb 0.01 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1sl8 h ARG 169 CO -0.03 0.62 -0.08 0.37 -1.07 0.00 0.00 179.97 179.78 1sl8 h GLN 170 N 0.72 -0.17 -0.67 0.04 5.75 -0.72 -0.41 115.11 119.66 1sl8 h GLN 170 Ca 0.17 0.01 -0.05 0.00 -0.15 0.00 0.00 58.65 58.63 1sl8 h GLN 170 Cb 0.17 0.04 -0.03 0.00 1.07 0.00 0.00 27.48 28.73 1sl8 h GLN 170 CO -0.01 -0.11 0.21 0.45 -2.65 0.00 0.00 178.83 176.72 1sl8 h HIS 171 N -0.17 1.07 -0.58 3.99 3.86 -0.73 -2.36 115.15 120.23 1sl8 h HIS 171 Ca 0.00 -0.11 -0.01 0.00 -1.16 0.00 0.00 60.37 59.10 1sl8 h HIS 171 Cb 0.17 -0.31 -0.03 0.00 1.06 0.00 0.00 27.41 28.30 1sl8 h HIS 171 CO -0.11 0.86 0.32 -0.07 0.86 0.00 0.00 177.93 179.80 1sl8 h LEU 172 N 0.97 0.72 -1.01 2.43 3.38 -0.69 -0.91 115.31 120.19 1sl8 h LEU 172 Ca 0.22 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1sl8 h LEU 172 Cb 0.29 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1sl8 h LEU 172 CO -0.01 0.61 0.50 1.23 0.09 0.00 0.00 178.44 180.86 1sl8 h GLY 173 N 0.79 1.27 0.26 0.83 0.00 -0.87 -0.73 103.07 104.61 1sl8 h GLY 173 Ca 0.20 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1sl8 h GLY 173 CO -0.03 0.53 -0.02 -2.75 0.00 0.00 0.00 176.54 174.27 1sl8 h PHE 174 N 1.20 -0.04 0.08 5.60 3.57 -1.03 -3.30 116.94 123.02 1sl8 h PHE 174 Ca 0.31 -0.00 -0.29 0.00 3.53 0.00 0.00 57.97 61.52 1sl8 h PHE 174 Cb -0.02 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 1sl8 h PHE 174 CO 0.01 0.63 -1.45 -1.49 -2.23 0.00 0.00 178.31 173.78 1sl8 h TRP 175 N -0.79 0.32 0.00 0.41 4.06 -1.19 -3.42 115.95 115.34 1sl8 h TRP 175 Ca -0.00 -0.23 -0.06 0.00 2.06 0.00 0.00 58.89 60.65 1sl8 h TRP 175 Cb 0.69 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.82 1sl8 h TRP 175 CO 0.16 1.27 -1.21 0.66 -3.56 0.00 0.00 178.44 175.76 1sl8 n TYR 176 N -3.39 0.00 -2.49 0.49 4.01 -0.34 -4.95 117.16 110.50 1sl8 n TYR 176 Ca -0.13 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.18 1sl8 n TYR 176 Cb 1.03 -0.15 -0.03 0.00 -0.31 0.00 0.00 39.34 39.88 1sl8 n TYR 176 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1sl8 s THR 177 N -2.08 4.32 0.72 -0.72 2.01 -0.84 -4.91 115.64 114.14 1sl8 s THR 177 Ca -0.02 1.64 -0.11 0.00 0.31 0.00 0.00 61.69 63.51 1sl8 s THR 177 Cb 0.01 -4.05 0.02 0.00 0.01 0.00 0.00 72.50 68.49 1sl8 s THR 177 CO 0.13 0.00 1.08 -0.04 -0.69 0.00 0.00 174.62 175.10 1sl8 s MET 178 N 2.14 2.76 0.42 4.92 -1.94 -1.26 -4.79 119.30 121.55 1sl8 s MET 178 Ca 0.55 0.70 -0.25 0.00 -1.71 0.00 0.00 55.69 54.97 1sl8 s MET 178 Cb -0.24 -1.99 -0.10 0.00 2.01 0.00 0.00 34.83 34.51 1sl8 s MET 178 CO 0.22 -1.16 1.25 -0.25 -0.01 0.00 0.00 175.02 175.06 1sl8 n ASP 179 N -3.13 2.44 -4.61 3.03 9.92 -1.26 -4.91 116.55 118.03 1sl8 n ASP 179 Ca 0.07 1.11 -0.41 0.00 -0.53 0.00 0.00 54.79 55.03 1sl8 n ASP 179 Cb 0.55 -1.48 0.02 0.00 -0.64 0.00 0.00 41.12 39.57 1sl8 n ASP 179 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 1sl8 n PRO 180 N 0.08 1.28 -0.14 -0.24 -0.02 -1.26 -4.89 135.00 129.80 1sl8 n PRO 180 Ca 0.07 0.46 -0.04 0.00 -2.02 0.00 0.00 63.50 61.96 1sl8 n PRO 180 Cb 0.39 -2.05 0.15 0.00 -0.02 0.00 0.00 33.50 31.97 1sl8 n PRO 180 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1sl8 h ALA 181 N 1.38 1.10 -3.12 3.55 0.00 -2.06 -3.45 119.26 116.67 1sl8 h ALA 181 Ca -0.45 -0.25 -0.56 0.00 0.00 0.00 0.00 54.91 53.65 1sl8 h ALA 181 Cb 1.34 -0.21 -0.19 0.00 0.00 0.00 0.00 17.79 18.73 1sl8 h ALA 181 CO 0.56 0.58 -0.80 0.00 0.00 0.00 0.00 179.25 179.59 1sl8 s GLU 183 N -2.61 3.27 0.17 0.00 2.02 -1.26 -5.09 118.70 115.19 1sl8 s GLU 183 Ca 0.15 0.15 0.05 0.00 0.02 0.00 0.00 54.97 55.34 1sl8 s GLU 183 Cb -0.07 -2.31 -0.04 0.00 0.10 0.00 0.00 34.13 31.81 1sl8 s GLU 183 CO 0.07 -0.45 0.13 0.15 0.02 0.00 0.00 175.26 175.18 1sl8 s LYS 184 N -4.88 2.87 0.24 1.61 3.01 -1.26 -5.04 119.74 116.30 1sl8 s LYS 184 Ca 0.51 -0.89 -0.31 0.00 -1.01 0.00 0.00 55.97 54.27 1sl8 s LYS 184 Cb -0.10 -2.62 -0.14 0.00 -1.01 0.00 0.00 37.83 33.96 1sl8 s LYS 184 CO 0.46 0.48 1.32 -0.11 0.51 0.00 0.00 175.35 178.01 1sl8 n LEU 185 N -0.36 2.79 -1.23 3.17 7.94 -1.26 -2.22 117.00 125.82 1sl8 n LEU 185 Ca -0.08 1.15 -0.13 0.00 -1.11 0.00 0.00 56.01 55.84 1sl8 n LEU 185 Cb 0.55 -1.39 -0.03 0.00 0.53 0.00 0.00 43.42 43.08 1sl8 n LEU 185 CO 0.43 -0.70 -0.14 -1.22 -1.11 0.00 0.00 177.39 174.65 1sl8 n TYR 186 N 1.51 -0.30 -1.98 1.96 4.01 -1.26 -1.76 117.16 119.33 1sl8 n TYR 186 Ca 0.11 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.69 1sl8 n TYR 186 Cb 0.31 -2.60 -0.04 0.00 -0.31 0.00 0.00 39.34 36.71 1sl8 n TYR 186 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sl8 n GLY 187 N -1.20 0.43 1.41 2.72 0.00 -0.94 -1.40 105.19 106.20 1sl8 n GLY 187 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1sl8 n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sl8 n GLY 188 N -0.61 0.74 3.90 -0.02 0.00 -0.72 -4.87 105.19 103.60 1sl8 n GLY 188 Ca -0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 1sl8 n GLY 188 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sl8 s ALA 189 N -2.47 3.33 -0.16 4.61 0.00 -0.49 -5.08 121.76 121.50 1sl8 s ALA 189 Ca 0.00 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 51.55 1sl8 s ALA 189 Cb 0.00 -2.71 -0.01 0.00 0.00 0.00 0.00 23.12 20.41 1sl8 s ALA 189 CO 0.00 -0.44 -0.14 0.08 0.00 0.00 0.00 175.76 175.27 1sl8 s VAL 190 N -2.85 2.82 -2.00 0.00 1.01 -1.26 -4.75 120.40 113.37 1sl8 s VAL 190 Ca 0.49 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.81 1sl8 s VAL 190 Cb -0.10 -2.20 0.14 0.00 0.00 0.00 0.00 36.38 34.22 1sl8 s VAL 190 CO 0.47 0.51 0.77 -2.65 0.00 0.00 0.00 175.10 174.20