#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c04 s ILE 8 N 0.00 4.57 0.10 0.52 1.09 0.99 -4.88 121.20 123.60 1c04 s ILE 8 Ca 0.00 -0.09 -0.31 0.00 -1.10 0.00 0.00 60.65 59.15 1c04 s ILE 8 Cb 0.00 -3.11 -0.07 0.00 -1.06 0.00 0.00 42.46 38.23 1c04 s ILE 8 CO 0.00 0.39 1.27 -0.70 -0.10 0.00 0.00 174.94 175.80 1c04 s GLU 9 N 1.07 4.40 -0.51 2.79 2.12 -1.26 -0.29 118.70 127.01 1c04 s GLU 9 Ca 0.04 1.91 -0.22 0.00 0.36 0.00 0.00 54.97 57.07 1c04 s GLU 9 Cb -0.14 -3.29 0.05 0.00 0.26 0.00 0.00 34.13 31.01 1c04 s GLU 9 CO 0.03 -0.30 0.77 0.42 -0.54 0.00 0.00 175.26 175.64 1c04 s ILE 10 N 0.88 4.66 1.17 -3.70 1.01 -0.91 -4.93 121.20 119.38 1c04 s ILE 10 Ca 0.60 -0.06 -0.17 0.00 0.00 0.00 0.00 60.65 61.02 1c04 s ILE 10 Cb -0.33 -4.39 0.27 0.00 0.01 0.00 0.00 42.46 38.02 1c04 s ILE 10 CO 0.31 -0.90 1.07 -2.16 0.00 0.00 0.00 174.94 173.26 1c04 s PRO 11 N 3.23 -0.96 0.48 2.79 0.04 -1.26 -4.93 135.00 134.39 1c04 s PRO 11 Ca 0.23 0.24 -0.22 0.00 0.04 0.00 0.00 61.00 61.29 1c04 s PRO 11 Cb -0.15 -1.60 -0.07 0.00 0.04 0.00 0.00 34.50 32.71 1c04 s PRO 11 CO 0.16 -3.60 1.14 0.00 0.04 0.00 0.00 177.00 174.75 1c04 s ALA 12 N -2.83 2.90 0.00 8.56 0.00 -1.26 -2.90 121.76 126.24 1c04 s ALA 12 Ca 0.69 0.88 0.00 0.00 0.00 0.00 0.00 51.96 53.52 1c04 s ALA 12 Cb -0.15 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.61 1c04 s ALA 12 CO 0.58 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1c04 n GLY 13 N 0.33 2.59 3.72 0.00 0.00 -1.26 -4.97 105.19 105.60 1c04 n GLY 13 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 1c04 n GLY 13 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c04 s VAL 14 N -2.55 5.31 -0.18 1.61 1.01 -1.14 -4.45 120.40 120.02 1c04 s VAL 14 Ca 0.00 0.51 -0.02 0.00 0.00 0.00 0.00 61.98 62.47 1c04 s VAL 14 Cb 0.00 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 1c04 s VAL 14 CO 0.00 0.38 -0.08 -0.89 0.00 0.00 0.00 175.10 174.52 1c04 s THR 15 N 0.53 3.33 -0.12 3.92 2.01 -0.69 -4.85 115.64 119.77 1c04 s THR 15 Ca 0.15 -0.54 -0.01 0.00 0.31 0.00 0.00 61.69 61.61 1c04 s THR 15 Cb -0.13 -2.46 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 1c04 s THR 15 CO 0.03 0.47 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.64 1c04 s VAL 16 N 0.87 3.31 -0.05 3.82 1.01 -1.26 -1.07 120.40 127.03 1c04 s VAL 16 Ca -0.02 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1c04 s VAL 16 Cb -0.15 -2.40 0.00 0.00 0.00 0.00 0.00 36.38 33.84 1c04 s VAL 16 CO 0.01 0.53 -0.14 -0.89 0.00 0.00 0.00 175.10 174.60 1c04 s THR 17 N 0.17 1.27 -0.05 3.92 2.01 0.10 -4.99 115.64 118.06 1c04 s THR 17 Ca -0.06 -0.59 0.05 0.00 0.31 0.00 0.00 61.69 61.41 1c04 s THR 17 Cb -0.15 -1.12 -0.01 0.00 0.01 0.00 0.00 72.50 71.24 1c04 s THR 17 CO 0.04 0.38 -0.22 -0.69 -0.69 0.00 0.00 174.62 173.44 1c04 s VAL 18 N 0.34 1.81 -0.36 3.82 1.01 -1.26 -0.44 120.40 125.32 1c04 s VAL 18 Ca -0.09 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 60.97 1c04 s VAL 18 Cb -0.13 -1.54 0.15 0.00 0.00 0.00 0.00 36.38 34.85 1c04 s VAL 18 CO 0.03 0.51 0.28 0.21 0.00 0.00 0.00 175.10 176.13 1c04 s ASN 19 N -0.05 2.16 1.36 3.32 2.47 -0.61 -5.03 114.94 118.56 1c04 s ASN 19 Ca -0.05 -1.87 0.00 0.00 0.42 0.00 0.00 52.86 51.36 1c04 s ASN 19 Cb -0.13 0.04 0.00 0.00 -1.45 0.00 0.00 41.25 39.71 1c04 s ASN 19 CO 0.03 -0.29 0.00 0.61 -3.72 0.00 0.00 177.10 173.73 1c04 n GLY 20 N 4.18 2.83 1.17 1.21 0.00 -1.26 -2.37 105.19 110.96 1c04 n GLY 20 Ca 0.11 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.96 1c04 n GLY 20 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1c04 n ASN 21 N 8.67 3.62 -4.59 1.61 6.94 -1.26 -4.79 115.26 125.47 1c04 n ASN 21 Ca 0.00 -1.98 -0.35 0.00 -0.02 0.00 0.00 54.58 52.23 1c04 n ASN 21 Cb 0.00 -0.37 -0.10 0.00 -2.36 0.00 0.00 39.78 36.94 1c04 n ASN 21 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1c04 s THR 22 N -1.14 4.58 -0.11 5.53 2.01 -1.00 -0.52 115.64 124.99 1c04 s THR 22 Ca 0.42 -0.11 0.03 0.00 0.31 0.00 0.00 61.69 62.34 1c04 s THR 22 Cb 0.22 -3.07 -0.00 0.00 0.01 0.00 0.00 72.50 69.66 1c04 s THR 22 CO 0.30 0.45 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.78 1c04 s VAL 23 N 0.54 2.36 -0.15 3.82 1.01 0.18 -1.58 120.40 126.58 1c04 s VAL 23 Ca 0.02 -0.91 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 1c04 s VAL 23 Cb -0.13 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.30 1c04 s VAL 23 CO 0.01 0.55 -0.11 -0.89 0.00 0.00 0.00 175.10 174.66 1c04 s THR 24 N 0.37 3.06 -0.10 3.92 2.01 0.41 -0.50 115.64 124.81 1c04 s THR 24 Ca -0.16 -0.64 0.03 0.00 0.31 0.00 0.00 61.69 61.23 1c04 s THR 24 Cb -0.17 -2.31 0.01 0.00 0.01 0.00 0.00 72.50 70.03 1c04 s THR 24 CO 0.07 0.50 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.61 1c04 s VAL 25 N 0.67 1.79 0.15 3.82 1.01 0.04 0.03 120.40 127.91 1c04 s VAL 25 Ca -0.06 -0.85 0.11 0.00 0.00 0.00 0.00 61.98 61.17 1c04 s VAL 25 Cb -0.15 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 1c04 s VAL 25 CO 0.02 0.50 -0.24 -0.54 0.00 0.00 0.00 175.10 174.84 1c04 s LYS 26 N 0.52 1.39 0.18 2.72 1.02 -0.23 -0.57 119.74 124.77 1c04 s LYS 26 Ca -0.16 -1.39 -0.16 0.00 0.02 0.00 0.00 55.97 54.27 1c04 s LYS 26 Cb -0.17 -1.76 0.06 0.00 -0.52 0.00 0.00 37.83 35.44 1c04 s LYS 26 CO 0.06 0.40 0.80 0.41 -0.92 0.00 0.00 175.35 176.09 1c04 n GLY 27 N 0.64 0.82 0.33 -3.33 0.00 -0.02 -1.70 105.19 101.93 1c04 n GLY 27 Ca -0.16 -1.13 0.04 0.00 0.00 0.00 0.00 46.02 44.78 1c04 n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c04 h PRO 28 N 0.00 0.65 -0.01 1.61 0.13 -1.69 -2.84 132.00 129.85 1c04 h PRO 28 Ca -0.23 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1c04 h PRO 28 Cb 0.97 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1c04 h PRO 28 CO 0.30 0.43 -0.11 1.63 -0.23 0.00 0.00 178.00 180.02 1c04 n LYS 29 N -4.46 1.05 -2.23 0.86 4.76 0.02 -4.94 118.16 113.21 1c04 n LYS 29 Ca 0.06 -0.50 0.00 0.00 -2.87 0.00 0.00 58.31 55.00 1c04 n LYS 29 Cb 0.11 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.81 1c04 n LYS 29 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1c04 n GLY 30 N 1.24 -0.64 2.91 0.72 0.00 -1.07 -3.66 105.19 104.69 1c04 n GLY 30 Ca 0.16 -1.56 -0.16 0.00 0.00 0.00 0.00 46.02 44.46 1c04 n GLY 30 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1c04 s GLU 31 N -1.84 0.43 -0.01 1.61 2.12 -1.26 -0.84 118.70 118.91 1c04 s GLU 31 Ca 0.00 -0.11 0.01 0.00 0.36 0.00 0.00 54.97 55.23 1c04 s GLU 31 Cb 0.00 -0.46 0.01 0.00 0.26 0.00 0.00 34.13 33.93 1c04 s GLU 31 CO 0.00 0.03 -0.02 -0.51 -0.54 0.00 0.00 175.26 174.22 1c04 s LEU 32 N 0.27 1.78 -0.09 2.70 1.43 0.26 -4.85 118.68 120.18 1c04 s LEU 32 Ca -0.03 -0.04 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1c04 s LEU 32 Cb -0.06 -0.15 -0.00 0.00 0.03 0.00 0.00 46.19 46.00 1c04 s LEU 32 CO -0.00 -0.00 -0.23 -0.89 0.23 0.00 0.00 176.35 175.45 1c04 s THR 33 N 0.23 2.13 -0.01 5.49 2.01 -1.26 -0.78 115.64 123.44 1c04 s THR 33 Ca -0.02 -1.01 -0.03 0.00 0.31 0.00 0.00 61.69 60.94 1c04 s THR 33 Cb -0.04 -1.80 0.00 0.00 0.01 0.00 0.00 72.50 70.66 1c04 s THR 33 CO -0.01 0.56 0.07 -0.60 -0.69 0.00 0.00 174.62 173.95 1c04 s ARG 34 N 0.24 0.22 -0.03 4.92 3.52 0.34 -4.97 118.95 123.19 1c04 s ARG 34 Ca -0.15 -0.14 -0.02 0.00 -0.13 0.00 0.00 55.73 55.29 1c04 s ARG 34 Cb -0.17 0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.27 1c04 s ARG 34 CO 0.08 -0.04 0.12 0.99 -0.81 0.00 0.00 175.30 175.64 1c04 s THR 35 N -0.55 5.05 0.35 4.11 2.01 -1.26 0.48 115.64 125.83 1c04 s THR 35 Ca -0.06 -0.22 0.07 0.00 0.31 0.00 0.00 61.69 61.79 1c04 s THR 35 Cb -0.04 -3.30 -0.07 0.00 0.01 0.00 0.00 72.50 69.10 1c04 s THR 35 CO 0.00 0.40 -0.04 -0.36 -0.69 0.00 0.00 174.62 173.94 1c04 s PHE 36 N -1.19 2.28 -0.02 4.92 0.40 0.32 -4.99 117.98 119.70 1c04 s PHE 36 Ca 0.22 -0.66 -0.35 0.00 -0.60 0.00 0.00 56.93 55.55 1c04 s PHE 36 Cb -0.12 -1.42 -0.13 0.00 0.51 0.00 0.00 43.02 41.86 1c04 s PHE 36 CO 0.13 0.40 1.76 1.58 0.70 0.00 0.00 175.22 179.79 1c04 n HIS 37 N -0.78 2.26 -0.33 0.36 -0.00 -1.26 -4.86 115.22 110.62 1c04 n HIS 37 Ca -0.05 0.14 0.25 0.00 -0.00 0.00 0.00 57.72 58.05 1c04 n HIS 37 Cb 0.65 -2.60 0.47 0.00 -0.00 0.00 0.00 29.99 28.51 1c04 n HIS 37 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1c04 h PRO 38 N 7.89 0.09 0.00 1.57 0.11 -1.98 0.65 132.00 140.33 1c04 h PRO 38 Ca -0.47 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1c04 h PRO 38 Cb 1.27 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1c04 h PRO 38 CO 0.92 0.06 0.00 -0.44 -0.21 0.00 0.00 178.00 178.33 1c04 h ASP 39 N 0.09 0.00 -3.25 -2.05 5.19 -1.99 -3.43 116.42 110.98 1c04 h ASP 39 Ca 0.74 0.00 -0.58 0.00 -0.62 0.00 0.00 57.03 56.57 1c04 h ASP 39 Cb 1.79 0.00 -0.05 0.00 0.18 0.00 0.00 39.33 41.25 1c04 h ASP 39 CO -0.76 0.00 -0.06 -0.04 -3.12 0.00 0.00 179.24 175.27 1c04 s MET 40 N -3.67 4.23 -0.19 3.56 -1.94 0.22 -3.91 119.30 117.59 1c04 s MET 40 Ca -0.01 0.67 -0.05 0.00 -1.71 0.00 0.00 55.69 54.59 1c04 s MET 40 Cb 0.09 -3.30 -0.03 0.00 2.01 0.00 0.00 34.83 33.60 1c04 s MET 40 CO 0.35 0.48 0.00 0.99 -0.01 0.00 0.00 175.02 176.83 1c04 s THR 41 N -0.52 4.03 -0.12 2.05 2.01 -0.36 -4.93 115.64 117.79 1c04 s THR 41 Ca 0.29 -0.29 0.01 0.00 0.31 0.00 0.00 61.69 62.01 1c04 s THR 41 Cb -0.18 -2.81 -0.01 0.00 0.01 0.00 0.00 72.50 69.51 1c04 s THR 41 CO 0.17 0.44 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.74 1c04 s ILE 42 N 0.84 2.70 0.00 1.82 1.01 -1.26 -0.19 121.20 126.12 1c04 s ILE 42 Ca 0.01 -0.78 -0.00 0.00 0.00 0.00 0.00 60.65 59.87 1c04 s ILE 42 Cb -0.14 -2.11 -0.00 0.00 0.01 0.00 0.00 42.46 40.22 1c04 s ILE 42 CO 0.02 0.53 0.00 0.42 0.00 0.00 0.00 174.94 175.91 1c04 s THR 43 N 0.41 0.02 -0.56 2.92 -4.23 -0.66 -4.98 115.64 108.57 1c04 s THR 43 Ca -0.13 -0.18 -0.21 0.00 -1.18 0.00 0.00 61.69 60.00 1c04 s THR 43 Cb -0.16 -0.07 0.06 0.00 1.34 0.00 0.00 72.50 73.67 1c04 s THR 43 CO 0.06 -0.10 0.78 -0.69 -0.54 0.00 0.00 174.62 174.14 1c04 s VAL 44 N -0.28 4.64 -1.19 2.29 1.01 -1.26 -0.21 120.40 125.39 1c04 s VAL 44 Ca -0.03 -0.33 -0.13 0.00 0.00 0.00 0.00 61.98 61.48 1c04 s VAL 44 Cb -0.02 -4.46 0.18 0.00 0.00 0.00 0.00 36.38 32.08 1c04 s VAL 44 CO -0.00 -1.05 1.40 -0.70 0.00 0.00 0.00 175.10 174.75 1c04 s GLU 45 N 3.25 4.09 2.89 2.72 2.56 0.17 -4.90 118.70 129.49 1c04 s GLU 45 Ca 0.20 -2.62 0.00 0.00 0.00 0.00 0.00 54.97 52.55 1c04 s GLU 45 Cb -0.18 -5.02 0.00 0.00 2.00 0.00 0.00 34.13 30.94 1c04 s GLU 45 CO 0.13 -1.72 0.00 0.41 -0.56 0.00 0.00 175.26 173.51 1c04 n GLY 46 N 4.01 0.72 0.76 -1.50 0.00 -1.26 -2.23 105.19 105.69 1c04 n GLY 46 Ca 0.35 0.50 0.10 0.00 0.00 0.00 0.00 46.02 46.97 1c04 n GLY 46 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1c04 n ASN 47 N 5.54 2.57 -4.11 1.61 0.23 -1.26 -4.99 115.26 114.85 1c04 n ASN 47 Ca 0.00 -1.78 -0.13 0.00 -0.53 0.00 0.00 54.58 52.14 1c04 n ASN 47 Cb 0.00 0.10 -0.11 0.00 -2.08 0.00 0.00 39.78 37.69 1c04 n ASN 47 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1c04 s VAL 48 N -1.86 0.65 -0.18 3.53 -7.23 -0.95 -2.13 120.40 112.23 1c04 s VAL 48 Ca 0.23 -1.39 -0.12 0.00 -1.81 0.00 0.00 61.98 58.89 1c04 s VAL 48 Cb 0.17 -1.01 -0.05 0.00 0.56 0.00 0.00 36.38 36.05 1c04 s VAL 48 CO 0.31 -0.53 0.22 -0.63 -0.31 0.00 0.00 175.10 174.16 1c04 s ILE 49 N -2.12 5.35 0.01 -0.62 1.01 0.60 0.46 121.20 125.90 1c04 s ILE 49 Ca -0.02 0.38 0.06 0.00 0.00 0.00 0.00 60.65 61.08 1c04 s ILE 49 Cb -0.05 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 1c04 s ILE 49 CO -0.01 0.41 -0.17 -0.89 0.00 0.00 0.00 174.94 174.28 1c04 s THR 50 N 0.45 2.84 -0.15 2.92 2.01 0.71 -0.01 115.64 124.41 1c04 s THR 50 Ca 0.13 -1.06 0.00 0.00 0.31 0.00 0.00 61.69 61.07 1c04 s THR 50 Cb -0.12 -2.16 -0.00 0.00 0.01 0.00 0.00 72.50 70.22 1c04 s THR 50 CO 0.01 0.41 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.51 1c04 s VAL 51 N -0.86 2.64 -0.17 3.82 1.01 -1.26 -1.65 120.40 123.92 1c04 s VAL 51 Ca 0.14 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1c04 s VAL 51 Cb -0.11 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.18 1c04 s VAL 51 CO 0.04 0.52 -0.19 -0.89 0.00 0.00 0.00 175.10 174.58 1c04 s THR 52 N 0.75 2.20 0.34 3.92 2.01 0.74 -4.96 115.64 120.63 1c04 s THR 52 Ca -0.06 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 60.93 1c04 s THR 52 Cb -0.15 -1.91 -0.07 0.00 0.01 0.00 0.00 72.50 70.38 1c04 s THR 52 CO 0.01 0.53 0.68 0.00 -0.69 0.00 0.00 174.62 175.15 1c04 s ARG 53 N 1.11 3.79 0.29 4.92 1.70 -1.26 -1.22 118.95 128.28 1c04 s ARG 53 Ca 0.00 0.37 0.09 0.00 -0.47 0.00 0.00 55.73 55.73 1c04 s ARG 53 Cb -0.14 -2.49 0.44 0.00 -0.57 0.00 0.00 34.95 32.19 1c04 s ARG 53 CO -0.08 0.11 1.67 -1.00 -1.08 0.00 0.00 175.30 174.92 1c04 h PRO 54 N 1.72 0.08 0.00 3.89 0.13 -1.95 -3.48 132.00 132.39 1c04 h PRO 54 Ca -0.47 -0.05 -0.21 0.00 -0.87 0.00 0.00 66.00 64.39 1c04 h PRO 54 Cb 1.18 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 1c04 h PRO 54 CO 0.65 0.58 -0.18 -1.13 -0.23 0.00 0.00 178.00 177.70 1c04 n SER 55 N -3.93 -0.55 -0.90 1.44 3.41 -1.26 -5.06 113.62 106.77 1c04 n SER 55 Ca -0.02 -2.13 0.08 0.00 -0.26 0.00 0.00 58.87 56.54 1c04 n SER 55 Cb 0.54 1.13 0.24 0.00 -0.26 0.00 0.00 64.21 65.86 1c04 n SER 55 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1c04 n ASP 56 N -2.09 3.68 -3.95 4.04 8.00 -1.26 -4.65 116.55 120.33 1c04 n ASP 56 Ca 0.03 -2.58 -0.30 0.00 0.71 0.00 0.00 54.79 52.64 1c04 n ASP 56 Cb 0.33 -0.44 0.24 0.00 -0.02 0.00 0.00 41.12 41.23 1c04 n ASP 56 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1c04 s GLU 57 N -2.06 -1.27 -0.00 -1.24 2.02 -1.26 -4.82 118.70 110.07 1c04 s GLU 57 Ca 0.36 0.13 -0.25 0.00 0.02 0.00 0.00 54.97 55.24 1c04 s GLU 57 Cb 0.26 -1.57 -0.18 0.00 0.10 0.00 0.00 34.13 32.74 1c04 s GLU 57 CO 0.13 -3.79 1.24 -0.22 0.02 0.00 0.00 175.26 172.64 1c04 h LYS 58 N -2.64 -0.21 -0.83 1.61 3.64 -1.99 -2.52 116.57 113.63 1c04 h LYS 58 Ca -0.48 0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.11 1c04 h LYS 58 Cb 1.31 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 33.13 1c04 h LYS 58 CO 0.38 0.16 0.56 1.12 -2.27 0.00 0.00 179.45 179.41 1c04 h HIS 59 N -0.62 0.42 -0.04 1.91 2.07 -1.99 0.47 115.15 117.37 1c04 h HIS 59 Ca -0.02 0.01 -0.18 0.00 -2.85 0.00 0.00 60.37 57.33 1c04 h HIS 59 Cb 0.46 -0.13 0.01 0.00 2.57 0.00 0.00 27.41 30.33 1c04 h HIS 59 CO 0.05 0.13 -0.69 0.45 -3.07 0.00 0.00 177.93 174.79 1c04 h HIS 60 N 0.33 0.78 -0.79 6.12 3.86 -1.88 -0.75 115.15 122.81 1c04 h HIS 60 Ca 0.42 -0.39 0.03 0.00 -1.16 0.00 0.00 60.37 59.26 1c04 h HIS 60 Cb 1.13 -0.10 -0.04 0.00 1.06 0.00 0.00 27.41 29.46 1c04 h HIS 60 CO -0.00 1.21 0.52 -0.09 0.86 0.00 0.00 177.93 180.43 1c04 h ARG 61 N 0.13 0.97 -0.16 2.45 2.43 -0.54 0.16 114.38 119.82 1c04 h ARG 61 Ca -0.08 -0.06 -0.22 0.00 -0.81 0.00 0.00 59.98 58.82 1c04 h ARG 61 Cb 1.37 -0.22 0.01 0.00 -0.42 0.00 0.00 29.97 30.71 1c04 h ARG 61 CO 0.14 0.64 -0.75 0.00 -1.51 0.00 0.00 179.97 178.49 1c04 h ALA 62 N 1.53 0.36 -0.67 2.80 0.00 -0.98 -2.81 119.26 119.49 1c04 h ALA 62 Ca 0.31 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1c04 h ALA 62 Cb -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1c04 h ALA 62 CO -0.08 0.69 0.27 -0.07 0.00 0.00 0.00 179.25 180.06 1c04 h LEU 63 N 0.52 0.93 -0.02 0.00 3.38 -0.41 -2.47 115.31 117.25 1c04 h LEU 63 Ca -0.04 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.77 1c04 h LEU 63 Cb 1.37 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.86 1c04 h LEU 63 CO 0.15 0.85 -0.08 -0.74 0.09 0.00 0.00 178.44 178.72 1c04 h HIS 64 N 0.96 -0.20 -0.28 1.13 2.76 -0.65 1.00 115.15 119.86 1c04 h HIS 64 Ca 0.22 0.01 -0.12 0.00 -2.20 0.00 0.00 60.37 58.28 1c04 h HIS 64 Cb 0.21 0.09 -0.01 0.00 1.55 0.00 0.00 27.41 29.25 1c04 h HIS 64 CO 0.01 -0.12 -0.32 0.78 -1.30 0.00 0.00 177.93 176.98 1c04 h GLY 65 N -0.13 0.65 0.96 5.26 0.00 -1.52 -1.83 103.07 106.46 1c04 h GLY 65 Ca 0.04 -0.60 -0.08 0.00 0.00 0.00 0.00 47.33 46.70 1c04 h GLY 65 CO -0.10 0.54 -0.05 -0.84 0.00 0.00 0.00 176.54 176.09 1c04 h THR 66 N 0.51 1.27 -0.42 4.70 2.02 -1.13 -1.55 112.91 118.31 1c04 h THR 66 Ca 0.06 -1.11 -0.03 0.00 0.77 0.00 0.00 66.41 66.11 1c04 h THR 66 Cb 0.80 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1c04 h THR 66 CO 0.07 0.37 0.16 0.74 0.37 0.00 0.00 175.52 177.23 1c04 h THR 67 N 0.54 1.20 -0.40 3.16 2.02 -0.75 -2.35 112.91 116.34 1c04 h THR 67 Ca 0.10 -0.64 0.01 0.00 0.77 0.00 0.00 66.41 66.65 1c04 h THR 67 Cb 0.55 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.77 1c04 h THR 67 CO 0.03 0.23 0.24 -0.09 0.37 0.00 0.00 175.52 176.31 1c04 h ARG 68 N 0.54 0.48 -0.01 6.66 2.43 -1.24 -2.12 114.38 121.12 1c04 h ARG 68 Ca 0.14 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 1c04 h ARG 68 Cb 0.21 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1c04 h ARG 68 CO -0.01 0.32 0.00 0.77 -1.51 0.00 0.00 179.97 179.54 1c04 h SER 69 N 0.49 0.01 -0.82 -3.80 0.02 -1.12 -0.91 113.55 107.42 1c04 h SER 69 Ca 0.15 -0.04 0.13 0.00 -0.84 0.00 0.00 61.79 61.19 1c04 h SER 69 Cb -0.01 -0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.44 1c04 h SER 69 CO -0.06 0.05 0.42 -0.07 -1.14 0.00 0.00 176.83 176.03 1c04 h LEU 70 N -0.03 0.53 -0.23 5.07 4.07 -1.26 -0.35 115.31 123.11 1c04 h LEU 70 Ca 0.00 0.08 -0.03 0.00 0.08 0.00 0.00 57.88 58.01 1c04 h LEU 70 Cb 0.04 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 41.77 1c04 h LEU 70 CO -0.00 0.25 0.01 -0.07 -1.08 0.00 0.00 178.44 177.55 1c04 h LEU 71 N 0.64 0.39 -0.28 1.67 3.38 -1.09 -1.42 115.31 118.59 1c04 h LEU 71 Ca 0.43 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 58.18 1c04 h LEU 71 Cb 0.57 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 1c04 h LEU 71 CO -0.33 0.59 -0.13 0.00 0.09 0.00 0.00 178.44 178.65 1c04 h ALA 72 N 0.82 0.09 0.00 1.53 0.00 -0.08 0.50 119.26 122.12 1c04 h ALA 72 Ca 0.07 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1c04 h ALA 72 Cb 0.38 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1c04 h ALA 72 CO 0.01 -0.53 -0.18 -0.91 0.00 0.00 0.00 179.25 177.64 1c04 h ASN 73 N -0.09 0.00 -0.19 0.00 2.35 -1.02 0.91 115.58 117.54 1c04 h ASN 73 Ca 0.15 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.72 1c04 h ASN 73 Cb 0.32 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 1c04 h ASN 73 CO -0.34 0.18 -0.56 0.24 -1.65 0.00 0.00 177.43 175.30 1c04 h MET 74 N 0.00 0.78 -0.31 0.81 2.86 -0.03 -1.21 114.93 117.82 1c04 h MET 74 Ca -0.00 -0.50 -0.14 0.00 -2.06 0.00 0.00 59.70 57.00 1c04 h MET 74 Cb 0.34 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 1c04 h MET 74 CO 0.02 1.13 -0.37 0.28 1.06 0.00 0.00 176.91 179.03 1c04 h VAL 75 N 0.60 1.29 -0.48 -2.22 2.07 0.04 -3.01 116.25 114.53 1c04 h VAL 75 Ca 0.01 -1.54 -0.12 0.00 0.82 0.00 0.00 66.70 65.87 1c04 h VAL 75 Cb 1.15 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 1c04 h VAL 75 CO 0.12 0.50 -0.17 -0.08 0.02 0.00 0.00 177.57 177.96 1c04 h GLU 76 N 0.60 0.97 -0.30 1.57 4.81 -0.74 -2.77 114.58 118.72 1c04 h GLU 76 Ca 0.05 -0.40 -0.00 0.00 -0.13 0.00 0.00 59.36 58.88 1c04 h GLU 76 Cb 0.91 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 1c04 h GLU 76 CO 0.08 1.07 0.18 0.78 -0.73 0.00 0.00 179.01 180.39 1c04 h GLY 77 N 0.83 0.44 1.92 1.92 0.00 -1.17 0.45 103.07 107.45 1c04 h GLY 77 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1c04 h GLY 77 CO 0.06 0.18 -0.05 3.33 0.00 0.00 0.00 176.54 180.06 1c04 n VAL 78 N -4.84 0.29 -0.12 4.60 0.24 -1.14 -3.80 118.33 113.55 1c04 n VAL 78 Ca -0.02 -0.14 -0.24 0.00 -2.04 0.00 0.00 64.34 61.90 1c04 n VAL 78 Cb 0.05 -0.49 -0.08 0.00 -1.47 0.00 0.00 33.84 31.85 1c04 n VAL 78 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1c04 n SER 79 N -1.88 1.84 -3.67 -1.34 3.41 -1.05 -0.80 113.62 110.13 1c04 n SER 79 Ca 0.06 0.32 -0.41 0.00 -0.26 0.00 0.00 58.87 58.58 1c04 n SER 79 Cb 0.39 -0.75 0.01 0.00 -0.26 0.00 0.00 64.21 63.59 1c04 n SER 79 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1c04 n LYS 80 N -4.21 4.91 0.00 4.33 5.02 0.15 -4.60 118.16 123.77 1c04 n LYS 80 Ca -0.44 -4.23 0.00 0.00 -2.02 0.00 0.00 58.31 51.63 1c04 n LYS 80 Cb 0.79 -2.56 0.00 0.00 -0.02 0.00 0.00 35.03 33.24 1c04 n LYS 80 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c04 n GLY 81 N 0.89 0.00 3.92 0.72 0.00 -1.25 -4.98 105.19 104.49 1c04 n GLY 81 Ca 0.47 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.26 1c04 n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c04 s TYR 82 N 0.00 3.37 0.06 1.61 2.02 0.22 -4.96 117.35 119.68 1c04 s TYR 82 Ca 0.00 0.01 -0.16 0.00 -0.37 0.00 0.00 57.07 56.55 1c04 s TYR 82 Cb 0.00 -1.57 0.03 0.00 -0.40 0.00 0.00 41.96 40.02 1c04 s TYR 82 CO 0.00 0.49 0.36 -1.83 -1.57 0.00 0.00 175.55 173.00 1c04 s GLU 83 N -3.63 0.91 -0.03 -0.62 -1.05 -1.26 -2.04 118.70 110.98 1c04 s GLU 83 Ca 0.34 -0.52 -0.01 0.00 -0.15 0.00 0.00 54.97 54.63 1c04 s GLU 83 Cb -0.10 0.40 0.03 0.00 -0.44 0.00 0.00 34.13 34.02 1c04 s GLU 83 CO 0.28 -0.31 0.04 0.21 0.95 0.00 0.00 175.26 176.42 1c04 s LYS 84 N -2.86 -0.04 0.04 -4.83 2.47 0.06 -4.97 119.74 109.61 1c04 s LYS 84 Ca -0.03 0.25 -0.00 0.00 -1.56 0.00 0.00 55.97 54.63 1c04 s LYS 84 Cb 0.00 -0.31 -0.04 0.00 -1.46 0.00 0.00 37.83 36.02 1c04 s LYS 84 CO -0.05 -0.21 0.17 0.00 0.16 0.00 0.00 175.35 175.42 1c04 s ALA 85 N 1.37 3.89 0.11 3.13 0.00 -1.26 -0.91 121.76 128.09 1c04 s ALA 85 Ca -0.05 -0.85 0.04 0.00 0.00 0.00 0.00 51.96 51.10 1c04 s ALA 85 Cb -0.13 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 1c04 s ALA 85 CO -0.03 0.78 -0.11 -0.51 0.00 0.00 0.00 175.76 175.89 1c04 s LEU 86 N -2.27 2.43 0.03 0.00 1.43 0.01 -1.44 118.68 118.87 1c04 s LEU 86 Ca 0.31 -0.85 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1c04 s LEU 86 Cb -0.13 -0.36 -0.02 0.00 0.03 0.00 0.00 46.19 45.72 1c04 s LEU 86 CO 0.23 -0.25 -0.10 -1.83 0.23 0.00 0.00 176.35 174.63 1c04 s GLU 87 N -2.93 0.71 -0.12 1.70 -1.05 0.30 -1.35 118.70 115.96 1c04 s GLU 87 Ca 0.08 -0.63 -0.12 0.00 -0.15 0.00 0.00 54.97 54.15 1c04 s GLU 87 Cb -0.02 -0.64 -0.05 0.00 -0.44 0.00 0.00 34.13 32.98 1c04 s GLU 87 CO 0.01 0.15 0.26 -0.51 0.95 0.00 0.00 175.26 176.12 1c04 s LEU 88 N -1.04 4.33 -0.13 1.83 1.43 -0.03 -1.78 118.68 123.28 1c04 s LEU 88 Ca -0.02 0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 53.65 1c04 s LEU 88 Cb -0.07 -2.32 0.03 0.00 0.03 0.00 0.00 46.19 43.86 1c04 s LEU 88 CO 0.01 0.23 -0.06 -0.69 0.23 0.00 0.00 176.35 176.06 1c04 s VAL 89 N -0.24 1.02 0.00 -1.59 1.01 -0.57 -4.89 120.40 115.14 1c04 s VAL 89 Ca 0.17 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 61.76 1c04 s VAL 89 Cb -0.13 -1.10 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1c04 s VAL 89 CO 0.05 0.28 0.00 0.61 0.00 0.00 0.00 175.10 176.04 1c04 n GLY 90 N 4.93 4.47 3.70 4.51 0.00 -1.26 -1.33 105.19 120.21 1c04 n GLY 90 Ca -0.12 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 1c04 n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1c04 s VAL 91 N -0.84 3.15 0.00 1.61 -7.23 -1.26 -1.76 120.40 114.07 1c04 s VAL 91 Ca 0.00 0.71 0.00 0.00 -1.81 0.00 0.00 61.98 60.88 1c04 s VAL 91 Cb 0.00 -3.46 0.00 0.00 0.56 0.00 0.00 36.38 33.48 1c04 s VAL 91 CO 0.00 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.42 1c04 n GLY 92 N 3.75 1.59 3.65 2.32 0.00 -1.26 -4.99 105.19 110.24 1c04 n GLY 92 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 1c04 n GLY 92 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c04 s TYR 93 N -2.38 2.98 0.05 1.61 1.51 -0.72 -4.77 117.35 115.64 1c04 s TYR 93 Ca 0.00 1.12 -0.17 0.00 -1.01 0.00 0.00 57.07 57.01 1c04 s TYR 93 Cb 0.00 -3.56 0.03 0.00 -0.11 0.00 0.00 41.96 38.32 1c04 s TYR 93 CO 0.00 -1.25 0.38 -0.98 -1.11 0.00 0.00 175.55 172.59 1c04 s ARG 94 N 3.60 0.91 0.11 -0.62 1.70 -0.43 -4.81 118.95 119.39 1c04 s ARG 94 Ca 0.51 -0.43 0.11 0.00 -0.47 0.00 0.00 55.73 55.44 1c04 s ARG 94 Cb -0.17 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.57 1c04 s ARG 94 CO 0.14 -0.31 -0.27 0.00 -1.08 0.00 0.00 175.30 173.79 1c04 s ALA 95 N -2.61 2.34 0.13 7.88 0.00 -0.43 -0.68 121.76 128.39 1c04 s ALA 95 Ca -0.04 -1.42 -0.11 0.00 0.00 0.00 0.00 51.96 50.39 1c04 s ALA 95 Cb -0.01 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.72 1c04 s ALA 95 CO -0.03 0.54 0.28 -1.54 0.00 0.00 0.00 175.76 175.01 1c04 s SER 96 N -1.87 0.00 -0.27 0.00 1.04 -0.66 -4.49 113.70 107.46 1c04 s SER 96 Ca 0.13 -0.65 -0.06 0.00 0.48 0.00 0.00 55.95 55.85 1c04 s SER 96 Cb -0.10 0.41 -0.00 0.00 0.10 0.00 0.00 66.02 66.43 1c04 s SER 96 CO 0.05 -0.83 0.05 -0.75 0.98 0.00 0.00 173.24 172.74 1c04 s LYS 97 N -3.89 3.24 -0.54 4.02 2.47 -1.26 -0.97 119.74 122.82 1c04 s LYS 97 Ca 0.09 -0.74 0.04 0.00 -1.56 0.00 0.00 55.97 53.79 1c04 s LYS 97 Cb 0.03 -3.28 0.13 0.00 -1.46 0.00 0.00 37.83 33.26 1c04 s LYS 97 CO -0.07 -0.35 0.28 -0.65 0.16 0.00 0.00 175.35 174.73 1c04 s GLN 98 N 1.51 2.04 3.54 4.03 -1.52 -0.33 -5.01 119.66 123.91 1c04 s GLN 98 Ca 0.04 -2.67 0.00 0.00 -1.95 0.00 0.00 55.36 50.77 1c04 s GLN 98 Cb -0.16 -3.34 0.00 0.00 -0.22 0.00 0.00 33.01 29.28 1c04 s GLN 98 CO 0.01 -1.12 0.00 0.41 -0.25 0.00 0.00 175.29 174.34 1c04 n GLY 99 N 3.04 0.22 0.01 3.09 0.00 -1.26 -2.88 105.19 107.41 1c04 n GLY 99 Ca 0.06 -1.02 0.14 0.00 0.00 0.00 0.00 46.02 45.19 1c04 n GLY 99 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1c04 n LYS 100 N 8.83 0.02 -2.87 1.61 3.00 -1.26 -4.86 118.16 122.63 1c04 n LYS 100 Ca 0.00 0.02 -0.39 0.00 -0.00 0.00 0.00 58.31 57.94 1c04 n LYS 100 Cb 0.00 -1.52 -0.06 0.00 0.00 0.00 0.00 35.03 33.45 1c04 n LYS 100 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 1c04 s LYS 101 N -3.01 4.67 -0.16 1.64 1.02 -1.14 -4.43 119.74 118.33 1c04 s LYS 101 Ca 0.14 1.30 -0.18 0.00 0.02 0.00 0.00 55.97 57.24 1c04 s LYS 101 Cb 0.18 -3.18 -0.04 0.00 -0.52 0.00 0.00 37.83 34.27 1c04 s LYS 101 CO 0.54 0.50 0.48 -1.17 -0.92 0.00 0.00 175.35 174.79 1c04 s LEU 102 N -1.33 4.21 -0.20 3.17 2.96 0.27 -1.19 118.68 126.57 1c04 s LEU 102 Ca 0.40 0.72 -0.02 0.00 -0.22 0.00 0.00 54.13 55.01 1c04 s LEU 102 Cb -0.23 -2.68 -0.00 0.00 0.50 0.00 0.00 46.19 43.78 1c04 s LEU 102 CO 0.28 -0.08 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.44 1c04 s VAL 103 N 1.13 3.02 -0.13 1.68 1.01 -0.14 -0.72 120.40 126.25 1c04 s VAL 103 Ca 0.24 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.59 1c04 s VAL 103 Cb -0.15 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 1c04 s VAL 103 CO 0.10 0.47 -0.07 -0.76 0.00 0.00 0.00 175.10 174.84 1c04 s LEU 104 N 1.25 3.11 -0.40 3.92 1.43 0.13 -1.65 118.68 126.47 1c04 s LEU 104 Ca 0.03 -0.14 0.01 0.00 -1.03 0.00 0.00 54.13 52.99 1c04 s LEU 104 Cb -0.14 -1.72 0.11 0.00 0.03 0.00 0.00 46.19 44.47 1c04 s LEU 104 CO -0.04 0.22 0.15 -0.44 0.23 0.00 0.00 176.35 176.47 1c04 s SER 105 N 0.04 4.95 -0.33 2.29 0.01 0.14 -0.87 113.70 119.94 1c04 s SER 105 Ca -0.01 -2.23 0.11 0.00 1.31 0.00 0.00 55.95 55.13 1c04 s SER 105 Cb -0.14 -1.72 0.46 0.00 0.21 0.00 0.00 66.02 64.83 1c04 s SER 105 CO 0.03 -0.43 1.12 1.33 0.41 0.00 0.00 173.24 175.70 1c04 n VAL 106 N 4.24 2.03 -1.21 3.43 0.24 -1.26 -1.32 118.33 124.48 1c04 n VAL 106 Ca 0.02 -4.02 -0.00 0.00 -2.04 0.00 0.00 64.34 58.30 1c04 n VAL 106 Cb 0.41 -0.46 -0.00 0.00 -1.47 0.00 0.00 33.84 32.31 1c04 n VAL 106 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1c04 n GLY 107 N -0.53 0.40 3.87 7.63 0.00 -1.26 -5.02 105.19 110.27 1c04 n GLY 107 Ca 0.31 -1.04 -0.23 0.00 0.00 0.00 0.00 46.02 45.06 1c04 n GLY 107 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c04 s TYR 108 N -2.02 2.35 0.29 1.61 2.02 -1.26 -5.02 117.35 115.31 1c04 s TYR 108 Ca 0.00 -0.61 -0.01 0.00 -0.37 0.00 0.00 57.07 56.08 1c04 s TYR 108 Cb 0.00 -2.07 0.43 0.00 -0.40 0.00 0.00 41.96 39.91 1c04 s TYR 108 CO 0.00 -0.22 1.85 0.66 -1.57 0.00 0.00 175.55 176.27 1c04 h SER 109 N 0.98 0.77 -3.14 2.29 4.64 -2.03 -3.44 113.55 113.62 1c04 h SER 109 Ca -0.40 -0.12 -0.46 0.00 -0.47 0.00 0.00 61.79 60.34 1c04 h SER 109 Cb 1.27 -0.20 -0.14 0.00 -0.31 0.00 0.00 62.40 63.02 1c04 h SER 109 CO 0.58 0.73 -0.70 -1.00 -0.87 0.00 0.00 176.83 175.58 1c04 s HIS 110 N -5.29 1.80 0.68 4.77 3.76 -1.26 -5.15 115.29 114.61 1c04 s HIS 110 Ca -0.10 -0.66 -0.13 0.00 -0.15 0.00 0.00 55.06 54.02 1c04 s HIS 110 Cb 0.16 -0.95 0.01 0.00 1.11 0.00 0.00 32.58 32.91 1c04 s HIS 110 CO 0.80 0.29 1.09 -1.25 -0.85 0.00 0.00 174.74 174.81 1c04 s PRO 111 N -3.70 2.79 -0.20 8.40 0.04 -1.26 -4.86 135.00 136.20 1c04 s PRO 111 Ca 0.26 1.23 -0.06 0.00 0.04 0.00 0.00 61.00 62.47 1c04 s PRO 111 Cb 0.02 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1c04 s PRO 111 CO 0.09 -1.23 0.04 0.08 0.04 0.00 0.00 177.00 176.02 1c04 s VAL 112 N -2.61 4.32 -0.16 -0.36 1.01 -0.05 -4.91 120.40 117.65 1c04 s VAL 112 Ca 0.63 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.40 1c04 s VAL 112 Cb -0.18 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.21 1c04 s VAL 112 CO 0.46 0.42 -0.06 -1.61 0.00 0.00 0.00 175.10 174.31 1c04 s GLU 113 N 0.93 3.57 -0.07 2.72 2.02 -1.26 0.17 118.70 126.77 1c04 s GLU 113 Ca 0.03 -0.57 0.04 0.00 0.02 0.00 0.00 54.97 54.48 1c04 s GLU 113 Cb -0.14 -2.86 0.00 0.00 0.10 0.00 0.00 34.13 31.23 1c04 s GLU 113 CO 0.02 0.18 -0.20 0.42 0.02 0.00 0.00 175.26 175.70 1c04 s ILE 114 N 0.50 1.71 -0.19 -1.63 1.01 0.10 -4.96 121.20 117.75 1c04 s ILE 114 Ca -0.05 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 59.75 1c04 s ILE 114 Cb -0.15 -1.49 -0.00 0.00 0.01 0.00 0.00 42.46 40.84 1c04 s ILE 114 CO 0.03 0.48 -0.11 -0.70 0.00 0.00 0.00 174.94 174.65 1c04 s GLU 115 N 0.29 3.26 0.64 2.79 2.12 -1.26 -0.57 118.70 125.98 1c04 s GLU 115 Ca -0.13 -0.70 -0.16 0.00 0.36 0.00 0.00 54.97 54.35 1c04 s GLU 115 Cb -0.16 -2.81 -0.01 0.00 0.26 0.00 0.00 34.13 31.42 1c04 s GLU 115 CO 0.06 -0.13 1.13 -1.25 -0.54 0.00 0.00 175.26 174.52 1c04 s PRO 116 N 1.22 2.83 1.04 4.30 0.04 -1.26 -5.03 135.00 138.14 1c04 s PRO 116 Ca 0.02 1.48 -0.18 0.00 0.04 0.00 0.00 61.00 62.37 1c04 s PRO 116 Cb -0.14 -1.95 0.24 0.00 0.04 0.00 0.00 34.50 32.69 1c04 s PRO 116 CO -0.04 -1.24 1.29 0.39 0.04 0.00 0.00 177.00 177.44 1c04 n GLU 117 N -2.23 -1.68 -2.01 4.56 4.71 -1.26 -4.92 120.64 117.80 1c04 n GLU 117 Ca 0.11 -2.01 -0.41 0.00 -0.01 0.00 0.00 57.16 54.84 1c04 n GLU 117 Cb 0.52 -1.43 -0.02 0.00 -1.01 0.00 0.00 31.44 29.49 1c04 n GLU 117 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1c04 s GLU 118 N -5.84 4.27 0.00 3.49 2.12 -1.26 -2.32 118.70 119.16 1c04 s GLU 118 Ca 0.75 2.31 0.00 0.00 0.36 0.00 0.00 54.97 58.39 1c04 s GLU 118 Cb -0.03 -3.09 0.00 0.00 0.26 0.00 0.00 34.13 31.27 1c04 s GLU 118 CO 0.54 -0.39 0.00 0.41 -0.54 0.00 0.00 175.26 175.28 1c04 n GLY 119 N 1.76 0.95 3.32 -1.50 0.00 -1.26 -5.05 105.19 103.40 1c04 n GLY 119 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1c04 n GLY 119 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1c04 s LEU 120 N 0.00 2.11 0.14 0.99 1.43 -0.98 -4.27 118.68 118.09 1c04 s LEU 120 Ca 0.00 -0.52 0.08 0.00 -1.03 0.00 0.00 54.13 52.66 1c04 s LEU 120 Cb 0.00 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.90 1c04 s LEU 120 CO 0.00 0.28 -0.18 -1.61 0.23 0.00 0.00 176.35 175.07 1c04 s GLU 121 N -0.90 1.19 -0.06 1.70 2.02 -0.13 -4.65 118.70 117.87 1c04 s GLU 121 Ca 0.10 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.79 1c04 s GLU 121 Cb -0.10 -1.29 0.02 0.00 0.10 0.00 0.00 34.13 32.87 1c04 s GLU 121 CO 0.00 0.27 -0.03 0.42 0.02 0.00 0.00 175.26 175.95 1c04 s ILE 122 N -1.77 0.52 0.08 -1.63 1.01 -1.26 -1.19 121.20 116.96 1c04 s ILE 122 Ca 0.12 -0.05 0.09 0.00 0.00 0.00 0.00 60.65 60.80 1c04 s ILE 122 Cb -0.07 -0.59 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1c04 s ILE 122 CO 0.05 0.25 -0.21 -1.61 0.00 0.00 0.00 174.94 173.42 1c04 s GLU 123 N 1.33 1.83 -0.53 2.79 2.02 0.12 -4.95 118.70 121.32 1c04 s GLU 123 Ca -0.05 -1.13 0.04 0.00 0.02 0.00 0.00 54.97 53.86 1c04 s GLU 123 Cb -0.13 -2.09 0.16 0.00 0.10 0.00 0.00 34.13 32.16 1c04 s GLU 123 CO -0.02 0.50 0.35 0.08 0.02 0.00 0.00 175.26 176.19 1c04 s VAL 124 N -1.01 1.70 0.30 2.63 1.01 -1.26 0.07 120.40 123.84 1c04 s VAL 124 Ca 0.15 -3.21 0.23 0.00 0.00 0.00 0.00 61.98 59.15 1c04 s VAL 124 Cb -0.10 -2.15 0.22 0.00 0.00 0.00 0.00 36.38 34.34 1c04 s VAL 124 CO 0.07 -1.01 1.91 1.55 0.00 0.00 0.00 175.10 177.62 1c04 h PRO 125 N 5.99 0.00 -3.73 2.72 0.13 -1.97 -3.45 132.00 131.68 1c04 h PRO 125 Ca 0.11 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.14 1c04 h PRO 125 Cb 0.86 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.83 1c04 h PRO 125 CO 0.55 0.23 -0.41 -1.54 -0.23 0.00 0.00 178.00 176.59 1c04 s SER 126 N -6.33 0.11 0.00 1.44 1.04 -1.26 -5.04 113.70 103.66 1c04 s SER 126 Ca -0.01 -0.55 0.01 0.00 0.48 0.00 0.00 55.95 55.88 1c04 s SER 126 Cb 0.12 0.30 0.05 0.00 0.10 0.00 0.00 66.02 66.59 1c04 s SER 126 CO 0.64 -0.63 0.94 0.00 0.98 0.00 0.00 173.24 175.17 1c04 n GLN 127 N 0.34 0.01 -0.04 4.02 10.64 -1.26 -1.85 117.38 129.23 1c04 n GLN 127 Ca -0.17 0.38 0.04 0.00 -1.83 0.00 0.00 57.00 55.42 1c04 n GLN 127 Cb 0.60 -1.50 0.05 0.00 -0.86 0.00 0.00 30.24 28.54 1c04 n GLN 127 CO 0.00 0.00 0.00 0.25 -1.83 0.00 0.00 177.06 175.48 1c04 n THR 128 N -1.40 1.26 -4.45 -0.39 -2.24 -1.26 -1.31 114.28 104.49 1c04 n THR 128 Ca 0.00 -1.40 -0.22 0.00 -2.27 0.00 0.00 64.05 60.17 1c04 n THR 128 Cb 0.01 0.25 -0.16 0.00 -2.10 0.00 0.00 70.33 68.33 1c04 n THR 128 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1c04 s LYS 129 N -1.62 1.27 -0.07 -0.78 2.20 -0.77 -0.85 119.74 119.12 1c04 s LYS 129 Ca 0.12 -0.32 0.04 0.00 -0.36 0.00 0.00 55.97 55.44 1c04 s LYS 129 Cb 0.10 -1.12 0.00 0.00 -1.51 0.00 0.00 37.83 35.30 1c04 s LYS 129 CO 0.01 0.05 -0.19 0.42 -0.36 0.00 0.00 175.35 175.28 1c04 s ILE 130 N 0.52 1.61 -0.13 5.43 1.01 -0.45 -3.84 121.20 125.34 1c04 s ILE 130 Ca -0.10 -0.78 0.03 0.00 0.00 0.00 0.00 60.65 59.79 1c04 s ILE 130 Cb -0.13 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 40.95 1c04 s ILE 130 CO 0.02 0.46 -0.21 -0.63 0.00 0.00 0.00 174.94 174.57 1c04 s ILE 131 N 0.27 1.99 -0.14 2.92 1.01 0.11 -0.81 121.20 126.55 1c04 s ILE 131 Ca -0.11 -0.94 -0.05 0.00 0.00 0.00 0.00 60.65 59.54 1c04 s ILE 131 Cb -0.15 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 1c04 s ILE 131 CO 0.05 0.54 0.05 -0.69 0.00 0.00 0.00 174.94 174.89 1c04 s VAL 132 N 0.80 4.71 0.03 2.92 1.01 -0.09 0.16 120.40 129.94 1c04 s VAL 132 Ca -0.08 -0.08 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 1c04 s VAL 132 Cb -0.16 -3.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.15 1c04 s VAL 132 CO -0.01 0.54 0.12 -1.59 0.00 0.00 0.00 175.10 174.15 1c04 s LYS 133 N -0.26 0.58 0.00 2.72 -2.85 -0.33 -0.76 119.74 118.84 1c04 s LYS 133 Ca 0.08 -0.67 0.00 0.00 -1.00 0.00 0.00 55.97 54.38 1c04 s LYS 133 Cb -0.12 0.23 0.00 0.00 -2.06 0.00 0.00 37.83 35.88 1c04 s LYS 133 CO 0.02 -0.15 0.00 0.41 0.10 0.00 0.00 175.35 175.73 1c04 n GLY 134 N 0.89 -1.42 0.12 0.59 0.00 -0.87 -0.96 105.19 103.54 1c04 n GLY 134 Ca -0.20 -1.05 0.01 0.00 0.00 0.00 0.00 46.02 44.79 1c04 n GLY 134 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c04 h ALA 135 N 0.00 0.65 -2.35 4.61 0.00 -1.74 0.66 119.26 121.10 1c04 h ALA 135 Ca 0.00 -0.61 -0.69 0.00 0.00 0.00 0.00 54.91 53.61 1c04 h ALA 135 Cb 0.00 0.07 -0.18 0.00 0.00 0.00 0.00 17.79 17.67 1c04 h ALA 135 CO 0.00 0.74 -0.17 0.34 0.00 0.00 0.00 179.25 180.16 1c04 s ASP 136 N -6.16 6.21 0.39 0.00 -1.08 -1.26 -3.22 116.67 111.54 1c04 s ASP 136 Ca 0.01 -0.67 0.10 0.00 -0.52 0.00 0.00 52.55 51.47 1c04 s ASP 136 Cb 0.08 -2.23 0.88 0.00 -1.46 0.00 0.00 42.92 40.19 1c04 s ASP 136 CO 0.78 -0.61 1.92 0.50 0.52 0.00 0.00 175.17 178.28 1c04 h LYS 137 N 8.75 0.59 -0.03 4.34 1.63 -1.84 -1.82 116.57 128.19 1c04 h LYS 137 Ca -0.26 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.49 1c04 h LYS 137 Cb 1.11 -0.13 -0.00 0.00 -0.60 0.00 0.00 32.23 32.61 1c04 h LYS 137 CO 0.81 0.39 -0.03 0.37 -3.45 0.00 0.00 179.45 177.53 1c04 h GLN 138 N 0.60 0.08 -0.00 1.90 5.75 -1.94 -1.67 115.11 119.83 1c04 h GLN 138 Ca 0.37 -0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.78 1c04 h GLN 138 Cb 0.59 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.14 1c04 h GLN 138 CO -0.14 0.55 -0.20 0.00 -2.65 0.00 0.00 178.83 176.40 1c04 h ARG 139 N -0.38 0.00 -0.17 1.69 3.08 -1.89 -0.34 114.38 116.37 1c04 h ARG 139 Ca 0.01 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 1c04 h ARG 139 Cb 0.54 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.58 1c04 h ARG 139 CO 0.01 0.20 -0.19 0.28 -1.07 0.00 0.00 179.97 179.20 1c04 h VAL 140 N 0.00 1.34 -0.52 2.04 2.07 -1.32 -1.90 116.25 117.96 1c04 h VAL 140 Ca -0.00 -1.36 -0.00 0.00 0.82 0.00 0.00 66.70 66.16 1c04 h VAL 140 Cb 0.35 1.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 1c04 h VAL 140 CO 0.03 0.41 0.31 1.23 0.02 0.00 0.00 177.57 179.57 1c04 h GLY 141 N 0.08 0.76 0.98 2.17 0.00 -0.74 -2.40 103.07 103.92 1c04 h GLY 141 Ca 0.03 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 46.99 1c04 h GLY 141 CO 0.05 0.31 0.12 -2.09 0.00 0.00 0.00 176.54 174.93 1c04 h GLU 142 N 0.70 0.80 -0.47 4.80 4.81 -1.04 -2.24 114.58 121.96 1c04 h GLU 142 Ca 0.19 -0.19 -0.14 0.00 -0.13 0.00 0.00 59.36 59.09 1c04 h GLU 142 Cb -0.01 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1c04 h GLU 142 CO -0.03 0.77 -0.24 1.25 -0.73 0.00 0.00 179.01 180.03 1c04 h LEU 143 N 0.69 1.01 -1.37 1.64 5.85 -1.27 -2.16 115.31 119.70 1c04 h LEU 143 Ca 0.16 -0.39 -0.04 0.00 0.84 0.00 0.00 57.88 58.44 1c04 h LEU 143 Cb 0.33 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1c04 h LEU 143 CO 0.00 1.19 -0.05 0.00 -0.34 0.00 0.00 178.44 179.24 1c04 h ALA 144 N 0.88 1.48 -0.09 1.25 0.00 -1.40 -0.49 119.26 120.90 1c04 h ALA 144 Ca 0.10 -0.18 -0.15 0.00 0.00 0.00 0.00 54.91 54.68 1c04 h ALA 144 Cb 0.82 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1c04 h ALA 144 CO 0.07 0.37 -0.60 0.00 0.00 0.00 0.00 179.25 179.09 1c04 h ALA 145 N 1.61 0.82 -0.11 0.00 0.00 -1.25 -2.10 119.26 118.24 1c04 h ALA 145 Ca 0.08 -0.54 -0.16 0.00 0.00 0.00 0.00 54.91 54.28 1c04 h ALA 145 Cb 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1c04 h ALA 145 CO 0.01 0.72 -0.63 -0.91 0.00 0.00 0.00 179.25 178.44 1c04 h ASN 146 N 0.22 0.45 0.01 0.00 -0.26 -0.78 -1.91 115.58 113.30 1c04 h ASN 146 Ca -0.01 -0.27 -0.00 0.00 -0.56 0.00 0.00 56.30 55.47 1c04 h ASN 146 Cb 1.11 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 38.24 1c04 h ASN 146 CO 0.10 0.97 -0.00 0.40 -1.06 0.00 0.00 177.43 177.83 1c04 h ILE 147 N 0.29 1.33 -0.93 2.81 2.04 -0.99 -3.14 117.51 118.93 1c04 h ILE 147 Ca -0.01 -1.02 0.12 0.00 1.00 0.00 0.00 64.86 64.96 1c04 h ILE 147 Cb 1.17 2.02 -0.07 0.00 -0.74 0.00 0.00 36.82 39.19 1c04 h ILE 147 CO 0.11 0.26 0.59 -0.09 0.00 0.00 0.00 178.15 179.02 1c04 h ARG 148 N -0.45 0.81 0.00 2.37 2.43 -1.39 -0.67 114.38 117.49 1c04 h ARG 148 Ca -0.00 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1c04 h ARG 148 Cb 0.44 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1c04 h ARG 148 CO 0.00 0.54 0.00 0.00 -1.51 0.00 0.00 179.97 179.00 1c04 n ALA 149 N -2.40 1.32 -0.27 2.80 0.00 -0.72 -1.75 120.51 119.48 1c04 n ALA 149 Ca 0.17 0.15 -0.06 0.00 0.00 0.00 0.00 53.44 53.70 1c04 n ALA 149 Cb 0.39 -1.35 0.06 0.00 0.00 0.00 0.00 19.45 18.55 1c04 n ALA 149 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1c04 h VAL 150 N 0.00 1.25 -0.99 0.00 2.07 -1.08 -3.39 116.25 114.10 1c04 h VAL 150 Ca 0.00 -0.74 -0.11 0.00 0.82 0.00 0.00 66.70 66.67 1c04 h VAL 150 Cb 0.16 0.35 -0.17 0.00 -1.52 0.00 0.00 31.29 30.11 1c04 h VAL 150 CO 0.00 0.31 -0.47 -0.60 0.02 0.00 0.00 177.57 176.83 1c04 s ARG 151 N -5.62 0.96 0.93 1.57 3.52 -1.01 -5.10 118.95 114.20 1c04 s ARG 151 Ca -0.13 -0.72 -0.11 0.00 -0.13 0.00 0.00 55.73 54.65 1c04 s ARG 151 Cb 0.15 0.01 0.15 0.00 -1.56 0.00 0.00 34.95 33.70 1c04 s ARG 151 CO 0.82 -1.26 1.10 -2.14 -0.81 0.00 0.00 175.30 173.02 1c04 s PRO 152 N 1.29 0.95 0.19 5.12 0.02 -0.72 -0.02 135.00 141.83 1c04 s PRO 152 Ca 0.24 1.21 -0.32 0.00 0.02 0.00 0.00 61.00 62.14 1c04 s PRO 152 Cb -0.02 -1.74 -0.12 0.00 0.02 0.00 0.00 34.50 32.64 1c04 s PRO 152 CO -0.06 -2.56 1.71 -2.30 -0.33 0.00 0.00 177.00 173.46 1c04 n PRO 153 N -4.15 2.67 -3.33 5.54 -0.02 -1.21 -4.43 135.00 130.07 1c04 n PRO 153 Ca 0.09 0.96 -0.38 0.00 -2.02 0.00 0.00 63.50 62.15 1c04 n PRO 153 Cb 0.53 -2.80 -0.06 0.00 -0.02 0.00 0.00 33.50 31.15 1c04 n PRO 153 CO 0.00 0.00 0.00 -1.83 1.98 0.00 0.00 175.50 175.65 1c04 s GLU 154 N 1.31 4.13 0.53 -0.52 4.04 0.12 -4.88 118.70 123.43 1c04 s GLU 154 Ca 0.77 0.66 0.26 0.00 0.04 0.00 0.00 54.97 56.69 1c04 s GLU 154 Cb -0.53 -3.24 1.40 0.00 0.02 0.00 0.00 34.13 31.78 1c04 s GLU 154 CO 0.34 0.64 1.98 -1.00 -1.84 0.00 0.00 175.26 175.38 1c04 h PRO 155 N 4.61 0.01 0.09 -4.83 0.13 -1.94 0.51 132.00 130.58 1c04 h PRO 155 Ca -0.50 -0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.37 1c04 h PRO 155 Cb 1.21 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1c04 h PRO 155 CO 0.63 0.01 -1.25 1.88 -0.23 0.00 0.00 178.00 179.04 1c04 h TYR 156 N 0.01 0.33 0.00 1.56 0.05 -1.94 -3.41 116.97 113.58 1c04 h TYR 156 Ca 0.28 -0.24 0.00 0.00 0.05 0.00 0.00 58.73 58.81 1c04 h TYR 156 Cb 1.10 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.83 1c04 h TYR 156 CO -0.00 1.21 0.00 1.17 -1.05 0.00 0.00 178.16 179.49 1c04 n LYS 157 N -3.45 0.61 -1.14 4.88 3.00 -1.20 -4.85 118.16 116.02 1c04 n LYS 157 Ca -0.08 -0.10 -0.05 0.00 -0.00 0.00 0.00 58.31 58.08 1c04 n LYS 157 Cb 1.01 -0.48 -0.02 0.00 0.00 0.00 0.00 35.03 35.54 1c04 n LYS 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1c04 n GLY 158 N 0.12 0.75 3.80 3.14 0.00 0.18 -4.97 105.19 108.21 1c04 n GLY 158 Ca 0.00 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 44.97 1c04 n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c04 s LYS 159 N -2.23 3.89 0.00 1.61 1.02 -1.24 -4.54 119.74 118.25 1c04 s LYS 159 Ca 0.00 1.31 0.00 0.00 0.02 0.00 0.00 55.97 57.30 1c04 s LYS 159 Cb 0.00 -2.11 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 1c04 s LYS 159 CO 0.00 -0.34 0.00 0.41 -0.92 0.00 0.00 175.35 174.50 1c04 n GLY 160 N -0.33 0.70 3.54 -3.33 0.00 -0.44 0.15 105.19 105.48 1c04 n GLY 160 Ca 0.09 -2.04 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 1c04 n GLY 160 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1c04 s ILE 161 N -1.54 3.79 0.09 -0.61 1.01 0.97 -1.52 121.20 123.38 1c04 s ILE 161 Ca 0.00 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.25 1c04 s ILE 161 Cb 0.00 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 1c04 s ILE 161 CO 0.00 0.55 -0.06 0.00 0.00 0.00 0.00 174.94 175.42 1c04 s ARG 162 N -0.20 0.80 0.76 2.79 1.70 -0.73 -3.31 118.95 120.76 1c04 s ARG 162 Ca 0.03 -1.29 -0.12 0.00 -0.47 0.00 0.00 55.73 53.87 1c04 s ARG 162 Cb -0.13 -0.19 0.06 0.00 -0.57 0.00 0.00 34.95 34.12 1c04 s ARG 162 CO 0.03 -0.02 1.13 0.71 -1.08 0.00 0.00 175.30 176.07 1c04 s TYR 163 N -3.49 2.30 0.18 5.89 2.02 -1.26 -0.54 117.35 122.44 1c04 s TYR 163 Ca 0.10 1.61 -0.21 0.00 -0.37 0.00 0.00 57.07 58.21 1c04 s TYR 163 Cb 0.04 -3.21 0.11 0.00 -0.40 0.00 0.00 41.96 38.50 1c04 s TYR 163 CO -0.05 -2.12 1.60 1.49 -1.57 0.00 0.00 175.55 174.91 1c04 h GLU 164 N -0.83 -0.17 -1.00 -0.62 4.81 -1.53 -1.75 114.58 113.48 1c04 h GLU 164 Ca -0.45 0.01 -0.49 0.00 -0.13 0.00 0.00 59.36 58.30 1c04 h GLU 164 Cb 1.25 0.04 -0.29 0.00 0.63 0.00 0.00 28.75 30.39 1c04 h GLU 164 CO 0.50 -0.12 0.62 0.41 -0.73 0.00 0.00 179.01 179.69 1c04 n GLY 165 N -1.42 4.38 3.64 1.92 0.00 -1.26 -4.92 105.19 107.53 1c04 n GLY 165 Ca 0.03 -1.06 -0.43 0.00 0.00 0.00 0.00 46.02 44.56 1c04 n GLY 165 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1c04 s GLU 166 N -3.09 3.99 -0.78 1.61 2.12 -0.66 -4.95 118.70 116.94 1c04 s GLU 166 Ca 0.53 1.59 -0.26 0.00 0.36 0.00 0.00 54.97 57.19 1c04 s GLU 166 Cb 0.45 -3.91 0.02 0.00 0.26 0.00 0.00 34.13 30.95 1c04 s GLU 166 CO 0.10 -1.03 1.42 -1.17 -0.54 0.00 0.00 175.26 174.04 1c04 s LEU 167 N 4.36 3.24 -0.50 2.70 0.20 -1.26 -4.90 118.68 122.52 1c04 s LEU 167 Ca 0.62 -0.52 0.03 0.00 0.69 0.00 0.00 54.13 54.95 1c04 s LEU 167 Cb -0.22 -2.56 0.15 0.00 -0.43 0.00 0.00 46.19 43.13 1c04 s LEU 167 CO 0.23 -1.90 0.31 0.54 -0.29 0.00 0.00 176.35 175.25 1c04 s VAL 168 N 6.26 1.62 0.13 1.68 0.11 -1.26 -5.09 120.40 123.84 1c04 s VAL 168 Ca 0.43 -2.98 -0.30 0.00 -2.93 0.00 0.00 61.98 56.19 1c04 s VAL 168 Cb -0.07 -2.11 -0.07 0.00 -1.53 0.00 0.00 36.38 32.60 1c04 s VAL 168 CO 0.11 -0.97 1.24 -0.13 -3.33 0.00 0.00 175.10 172.02 1c04 s ARG 169 N -0.12 4.43 0.00 1.54 0.52 -1.26 -4.86 118.95 119.20 1c04 s ARG 169 Ca 0.22 1.88 0.21 0.00 -0.52 0.00 0.00 55.73 57.51 1c04 s ARG 169 Cb -0.16 -3.28 1.25 0.00 0.52 0.00 0.00 34.95 33.28 1c04 s ARG 169 CO -0.07 -0.22 1.63 1.28 0.02 0.00 0.00 175.30 177.94