#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d04 h LYS 2 N 0.00 0.00 -5.38 0.00 2.10 -1.84 -3.45 116.57 107.99 1d04 h LYS 2 Ca 0.00 0.00 -0.64 0.00 -2.00 0.00 0.00 60.65 58.01 1d04 h LYS 2 Cb 0.00 0.00 -0.22 0.00 -0.90 0.00 0.00 32.23 31.11 1d04 h LYS 2 CO 0.00 0.00 -0.68 0.42 -2.00 0.00 0.00 179.45 177.19 1d04 s ILE 3 N -3.17 3.76 -0.18 0.07 1.01 -1.23 -3.90 121.20 117.56 1d04 s ILE 3 Ca 0.07 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.30 1d04 s ILE 3 Cb 0.12 -2.63 -0.00 0.00 0.01 0.00 0.00 42.46 39.95 1d04 s ILE 3 CO 0.68 0.51 -0.10 -0.83 0.00 0.00 0.00 174.94 175.19 1d04 s GLY 4 N 0.24 1.54 -0.24 6.18 0.00 -0.77 -1.13 107.32 113.14 1d04 s GLY 4 Ca -0.04 -1.10 -0.06 0.00 0.00 0.00 0.00 44.72 43.52 1d04 s GLY 4 CO 0.03 0.22 0.02 -2.27 0.00 0.00 0.00 173.10 171.10 1d04 s LEU 5 N 1.11 3.23 -0.16 0.66 0.20 0.61 -1.38 118.68 122.95 1d04 s LEU 5 Ca 0.01 -0.27 0.01 0.00 0.69 0.00 0.00 54.13 54.56 1d04 s LEU 5 Cb -0.14 -1.85 0.00 0.00 -0.43 0.00 0.00 46.19 43.77 1d04 s LEU 5 CO -0.03 -0.02 -0.17 -0.36 -0.29 0.00 0.00 176.35 175.48 1d04 s PHE 6 N 1.53 2.77 0.25 5.38 0.40 -0.35 -0.64 117.98 127.32 1d04 s PHE 6 Ca 0.06 -1.22 0.05 0.00 -0.60 0.00 0.00 56.93 55.22 1d04 s PHE 6 Cb -0.15 -1.89 -0.05 0.00 0.51 0.00 0.00 43.02 41.43 1d04 s PHE 6 CO 0.01 -0.58 -0.04 1.52 0.70 0.00 0.00 175.22 176.83 1d04 s TYR 7 N 0.96 1.72 0.04 0.36 -0.85 -0.59 -1.25 117.35 117.75 1d04 s TYR 7 Ca -0.03 -0.79 0.03 0.00 -0.52 0.00 0.00 57.07 55.76 1d04 s TYR 7 Cb -0.15 -0.98 -0.02 0.00 0.38 0.00 0.00 41.96 41.20 1d04 s TYR 7 CO -0.03 0.13 -0.10 0.20 -1.52 0.00 0.00 175.55 174.23 1d04 s GLY 8 N -3.36 0.61 -0.08 5.49 0.00 -0.81 -0.11 107.32 109.05 1d04 s GLY 8 Ca 0.28 -0.73 -0.19 0.00 0.00 0.00 0.00 44.72 44.08 1d04 s GLY 8 CO 0.09 -0.74 0.46 -1.08 0.00 0.00 0.00 173.10 171.83 1d04 s THR 9 N -0.99 0.02 -0.22 0.90 -1.32 -1.26 -4.30 115.64 108.47 1d04 s THR 9 Ca -0.03 -0.19 -0.12 0.00 -1.21 0.00 0.00 61.69 60.14 1d04 s THR 9 Cb -0.08 -0.72 -0.09 0.00 -1.51 0.00 0.00 72.50 70.09 1d04 s THR 9 CO 0.01 -0.10 -0.29 0.00 -2.21 0.00 0.00 174.62 172.02 1d04 n GLN 10 N 1.77 0.48 -0.10 7.08 1.13 -1.26 -4.73 117.38 121.75 1d04 n GLN 10 Ca -0.18 0.21 0.07 0.00 -1.94 0.00 0.00 57.00 55.16 1d04 n GLN 10 Cb 0.56 -1.30 0.12 0.00 0.11 0.00 0.00 30.24 29.74 1d04 n GLN 10 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1d04 n THR 11 N -4.03 0.44 -0.01 5.09 -2.24 -1.26 -5.00 114.28 107.27 1d04 n THR 11 Ca -0.43 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 60.64 1d04 n THR 11 Cb 0.79 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 1d04 n THR 11 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d04 n GLY 12 N 0.82 0.29 0.08 3.38 0.00 -1.26 -4.98 105.19 103.53 1d04 n GLY 12 Ca 0.11 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1d04 n GLY 12 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1d04 h VAL 13 N 0.00 1.23 0.00 1.61 2.07 -1.96 -2.17 116.25 117.03 1d04 h VAL 13 Ca 0.00 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 1d04 h VAL 13 Cb 0.00 1.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1d04 h VAL 13 CO 0.00 0.20 -0.10 0.74 0.02 0.00 0.00 177.57 178.43 1d04 h THR 14 N -0.11 0.87 -0.22 2.57 2.02 -1.94 -1.33 112.91 114.78 1d04 h THR 14 Ca 0.03 -0.37 -0.08 0.00 0.77 0.00 0.00 66.41 66.76 1d04 h THR 14 Cb 0.31 1.21 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1d04 h THR 14 CO 0.00 0.10 -0.18 -0.61 0.37 0.00 0.00 175.52 175.20 1d04 h GLN 15 N 0.00 0.52 -0.80 6.66 4.15 -1.78 -0.65 115.11 123.20 1d04 h GLN 15 Ca -0.00 -0.26 -0.01 0.00 0.77 0.00 0.00 58.65 59.15 1d04 h GLN 15 Cb 0.20 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.85 1d04 h GLN 15 CO 0.01 0.83 0.47 1.15 -1.93 0.00 0.00 178.83 179.37 1d04 h THR 16 N 0.21 1.23 -0.23 2.39 2.02 -0.74 0.02 112.91 117.81 1d04 h THR 16 Ca 0.04 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.69 1d04 h THR 16 Cb 0.72 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1d04 h THR 16 CO 0.05 0.24 0.10 0.40 0.37 0.00 0.00 175.52 176.68 1d04 h ILE 17 N 1.10 1.16 -0.65 3.11 2.04 -1.18 -1.72 117.51 121.36 1d04 h ILE 17 Ca 0.29 -0.46 0.07 0.00 1.00 0.00 0.00 64.86 65.75 1d04 h ILE 17 Cb -0.02 1.04 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1d04 h ILE 17 CO -0.05 0.15 0.35 0.00 0.00 0.00 0.00 178.15 178.60 1d04 h ALA 18 N 0.95 0.87 -0.59 1.87 0.00 -0.49 -0.44 119.26 121.43 1d04 h ALA 18 Ca 0.08 0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 1d04 h ALA 18 Cb 0.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1d04 h ALA 18 CO -0.01 0.00 0.14 0.93 0.00 0.00 0.00 179.25 180.32 1d04 h GLU 19 N 0.63 0.92 -0.49 0.00 5.08 -0.77 -1.60 114.58 118.35 1d04 h GLU 19 Ca 0.30 -0.20 -0.10 0.00 -1.00 0.00 0.00 59.36 58.36 1d04 h GLU 19 Cb 0.22 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1d04 h GLU 19 CO -0.20 0.83 -0.09 0.77 -1.00 0.00 0.00 179.01 179.32 1d04 h SER 20 N 0.89 0.93 -0.35 1.42 0.02 -0.42 -1.77 113.55 114.27 1d04 h SER 20 Ca 0.19 -0.35 -0.00 0.00 -0.84 0.00 0.00 61.79 60.79 1d04 h SER 20 Cb 0.32 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 1d04 h SER 20 CO -0.00 1.06 0.22 0.40 -1.14 0.00 0.00 176.83 177.36 1d04 h ILE 21 N 0.78 1.12 -0.53 3.27 2.04 -0.79 0.50 117.51 123.90 1d04 h ILE 21 Ca 0.13 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.76 1d04 h ILE 21 Cb 0.63 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 1d04 h ILE 21 CO 0.04 0.12 0.31 -0.61 0.00 0.00 0.00 178.15 178.00 1d04 h GLN 22 N 0.46 0.59 -0.69 2.37 4.15 -1.20 -1.05 115.11 119.73 1d04 h GLN 22 Ca 0.13 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.50 1d04 h GLN 22 Cb -0.00 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.52 1d04 h GLN 22 CO -0.02 0.39 0.40 0.37 -1.93 0.00 0.00 178.83 178.04 1d04 h GLN 23 N 0.61 0.96 -0.31 1.69 4.15 -0.88 -1.16 115.11 120.16 1d04 h GLN 23 Ca 0.22 -0.10 -0.07 0.00 0.77 0.00 0.00 58.65 59.47 1d04 h GLN 23 Cb 0.05 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 1d04 h GLN 23 CO -0.11 0.70 -0.12 0.93 -1.93 0.00 0.00 178.83 178.30 1d04 h GLU 24 N 0.95 0.53 0.00 1.69 4.39 -0.25 -2.34 114.58 119.55 1d04 h GLU 24 Ca 0.25 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.79 1d04 h GLU 24 Cb 0.00 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 28.60 1d04 h GLU 24 CO -0.04 0.65 -0.02 0.74 -1.16 0.00 0.00 179.01 179.17 1d04 h PHE 25 N 0.49 0.00 0.00 4.33 0.04 -0.87 -3.46 116.94 117.47 1d04 h PHE 25 Ca 0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.86 1d04 h PHE 25 Cb 0.50 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.65 1d04 h PHE 25 CO 0.02 0.02 0.00 0.41 -0.60 0.00 0.00 178.31 178.16 1d04 n GLY 26 N 0.08 0.48 0.00 -1.45 0.00 -0.88 -4.91 105.19 98.51 1d04 n GLY 26 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1d04 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1d04 n GLY 27 N 0.00 -1.98 0.17 -0.02 0.00 -0.47 -4.67 105.19 98.23 1d04 n GLY 27 Ca 0.00 -2.18 0.13 0.00 0.00 0.00 0.00 46.02 43.96 1d04 n GLY 27 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1d04 h GLU 28 N 3.37 0.00 0.00 1.61 4.11 -1.84 -1.13 114.58 120.70 1d04 h GLU 28 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1d04 h GLU 28 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1d04 h GLU 28 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 179.01 179.74 1d04 h SER 29 N 0.00 0.00 0.00 3.06 4.64 -1.97 -3.32 113.55 115.96 1d04 h SER 29 Ca 0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1d04 h SER 29 Cb 0.22 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.24 1d04 h SER 29 CO 0.00 0.00 -2.39 -0.38 -0.87 0.00 0.00 176.83 173.19 1d04 n ILE 30 N -2.81 1.40 -4.33 0.95 2.08 -0.50 -4.23 119.36 111.92 1d04 n ILE 30 Ca 0.04 -0.56 -0.24 0.00 0.56 0.00 0.00 62.75 62.55 1d04 n ILE 30 Cb 0.44 -1.30 -0.17 0.00 -0.75 0.00 0.00 39.64 37.86 1d04 n ILE 30 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1d04 s VAL 31 N -2.49 0.96 -0.11 1.39 1.01 -0.76 -3.57 120.40 116.83 1d04 s VAL 31 Ca -0.31 -0.35 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1d04 s VAL 31 Cb 0.08 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 1d04 s VAL 31 CO 0.58 0.33 0.71 -1.81 0.00 0.00 0.00 175.10 174.91 1d04 s ASP 32 N 0.97 6.92 -0.23 3.32 1.01 -0.28 -4.27 116.67 124.12 1d04 s ASP 32 Ca -0.09 1.12 -0.09 0.00 0.71 0.00 0.00 52.55 54.20 1d04 s ASP 32 Cb -0.15 -2.41 -0.04 0.00 1.01 0.00 0.00 42.92 41.33 1d04 s ASP 32 CO 0.00 -0.20 0.11 -0.22 0.21 0.00 0.00 175.17 175.07 1d04 s LEU 33 N 1.27 3.85 -0.02 1.23 2.96 -1.26 -0.28 118.68 126.42 1d04 s LEU 33 Ca 0.36 0.02 0.00 0.00 -0.22 0.00 0.00 54.13 54.29 1d04 s LEU 33 Cb -0.17 -2.02 0.02 0.00 0.50 0.00 0.00 46.19 44.52 1d04 s LEU 33 CO 0.15 0.07 0.01 0.20 -1.32 0.00 0.00 176.35 175.46 1d04 s ASN 34 N 1.02 0.19 -0.11 3.68 -0.87 0.19 -4.99 114.94 114.05 1d04 s ASN 34 Ca 0.06 -0.00 -0.28 0.00 -1.57 0.00 0.00 52.86 51.06 1d04 s ASN 34 Cb -0.14 -0.09 -0.02 0.00 -0.02 0.00 0.00 41.25 40.98 1d04 s ASN 34 CO 0.04 -0.07 0.94 -0.62 -2.57 0.00 0.00 177.10 174.82 1d04 s ASP 35 N 0.67 7.16 0.55 -1.22 -1.08 -1.26 -1.54 116.67 119.95 1d04 s ASP 35 Ca -0.06 1.43 0.37 0.00 -0.52 0.00 0.00 52.55 53.76 1d04 s ASP 35 Cb -0.09 -2.52 1.96 0.00 -1.46 0.00 0.00 42.92 40.81 1d04 s ASP 35 CO -0.02 -0.40 2.12 -0.29 0.52 0.00 0.00 175.17 177.10 1d04 h ILE 36 N 5.08 0.00 0.00 4.11 6.09 -0.85 -1.07 117.51 130.87 1d04 h ILE 36 Ca -0.32 -0.04 -0.05 0.00 -1.37 0.00 0.00 64.86 63.08 1d04 h ILE 36 Cb 1.15 0.87 -0.01 0.00 0.47 0.00 0.00 36.82 39.30 1d04 h ILE 36 CO 0.84 0.00 -0.26 0.00 -3.07 0.00 0.00 178.15 175.66 1d04 h ALA 37 N 2.01 1.31 -0.66 0.18 0.00 -1.90 -2.61 119.26 117.58 1d04 h ALA 37 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1d04 h ALA 37 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1d04 h ALA 37 CO 0.00 0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.67 1d04 n ASN 38 N -3.85 4.37 -4.58 0.00 3.02 -0.41 -4.99 115.26 108.81 1d04 n ASN 38 Ca -0.02 -2.27 -0.26 0.00 -0.03 0.00 0.00 54.58 52.00 1d04 n ASN 38 Cb 0.35 -0.53 -0.10 0.00 -0.61 0.00 0.00 39.78 38.89 1d04 n ASN 38 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1d04 s ALA 39 N -1.50 3.07 0.06 5.41 0.00 -0.99 -5.00 121.76 122.81 1d04 s ALA 39 Ca 0.49 -2.15 0.04 0.00 0.00 0.00 0.00 51.96 50.35 1d04 s ALA 39 Cb 0.29 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 1d04 s ALA 39 CO 0.27 0.01 -0.03 -0.51 0.00 0.00 0.00 175.76 175.50 1d04 s ASP 40 N -3.66 4.86 0.39 0.00 1.01 -1.26 -5.01 116.67 113.00 1d04 s ASP 40 Ca 0.34 -0.18 0.12 0.00 0.71 0.00 0.00 52.55 53.54 1d04 s ASP 40 Cb 0.05 -1.13 0.93 0.00 1.01 0.00 0.00 42.92 43.78 1d04 s ASP 40 CO 0.17 0.21 1.90 0.00 0.21 0.00 0.00 175.17 177.66 1d04 h ALA 41 N 3.79 1.97 0.00 5.23 0.00 -1.93 0.11 119.26 128.43 1d04 h ALA 41 Ca -0.48 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1d04 h ALA 41 Cb 1.17 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1d04 h ALA 41 CO 0.57 -0.18 -0.03 0.66 0.00 0.00 0.00 179.25 180.27 1d04 h SER 42 N 0.55 0.00 0.13 0.00 4.64 -1.94 -1.83 113.55 115.11 1d04 h SER 42 Ca 0.40 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.71 1d04 h SER 42 Cb 0.76 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1d04 h SER 42 CO -0.15 0.03 -0.03 0.44 -0.87 0.00 0.00 176.83 176.25 1d04 h ASP 43 N 0.00 0.00 1.31 4.97 3.32 -1.17 -0.76 116.42 124.09 1d04 h ASP 43 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d04 h ASP 43 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1d04 h ASP 43 CO 0.00 0.03 0.00 -0.07 -1.72 0.00 0.00 179.24 177.48 1d04 h LEU 44 N 0.00 0.00 -2.05 1.55 4.07 -1.48 -3.20 115.31 114.20 1d04 h LEU 44 Ca -0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 1d04 h LEU 44 Cb 0.10 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.84 1d04 h LEU 44 CO 0.00 0.00 -0.08 0.78 -1.08 0.00 0.00 178.44 178.06 1d04 h ASN 45 N 0.00 0.00 0.65 -0.43 2.35 -1.30 -3.13 115.58 113.72 1d04 h ASN 45 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1d04 h ASN 45 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 1d04 h ASN 45 CO 0.00 0.08 0.00 0.00 -1.65 0.00 0.00 177.43 175.86 1d04 n ALA 46 N -2.37 1.78 -2.45 -0.83 0.00 -1.21 -4.85 120.51 110.57 1d04 n ALA 46 Ca -0.02 -0.03 -0.30 0.00 0.00 0.00 0.00 53.44 53.09 1d04 n ALA 46 Cb 0.17 -1.30 -0.12 0.00 0.00 0.00 0.00 19.45 18.19 1d04 n ALA 46 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1d04 s TYR 47 N -3.06 2.49 -0.08 0.00 2.02 -1.18 -5.00 117.35 112.54 1d04 s TYR 47 Ca 0.08 -0.29 0.14 0.00 -0.37 0.00 0.00 57.07 56.63 1d04 s TYR 47 Cb 0.11 -1.38 -0.15 0.00 -0.40 0.00 0.00 41.96 40.14 1d04 s TYR 47 CO 0.34 0.31 0.90 -0.44 -1.57 0.00 0.00 175.55 175.08 1d04 h ASP 48 N 4.14 0.00 -3.39 2.29 3.32 -1.89 -3.46 116.42 117.44 1d04 h ASP 48 Ca -0.49 0.00 -0.59 0.00 0.02 0.00 0.00 57.03 55.98 1d04 h ASP 48 Cb 1.16 0.00 -0.33 0.00 0.22 0.00 0.00 39.33 40.38 1d04 h ASP 48 CO 0.45 0.73 -0.84 -0.31 -1.72 0.00 0.00 179.24 177.55 1d04 s TYR 49 N -2.82 1.93 0.04 4.55 2.02 -1.25 -1.79 117.35 120.04 1d04 s TYR 49 Ca -0.02 -0.76 0.04 0.00 -0.37 0.00 0.00 57.07 55.96 1d04 s TYR 49 Cb 0.08 -1.35 -0.02 0.00 -0.40 0.00 0.00 41.96 40.28 1d04 s TYR 49 CO 0.81 -0.34 -0.11 -0.51 -1.57 0.00 0.00 175.55 173.83 1d04 s LEU 50 N 0.52 2.20 -0.14 -1.29 1.43 -0.73 -1.85 118.68 118.82 1d04 s LEU 50 Ca -0.16 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 1d04 s LEU 50 Cb -0.17 -0.41 0.02 0.00 0.03 0.00 0.00 46.19 45.66 1d04 s LEU 50 CO 0.06 -0.06 -0.13 -0.63 0.23 0.00 0.00 176.35 175.82 1d04 s ILE 51 N -1.01 1.50 -0.24 -0.59 1.01 -0.48 -0.67 121.20 120.72 1d04 s ILE 51 Ca -0.03 -0.59 -0.06 0.00 0.00 0.00 0.00 60.65 59.97 1d04 s ILE 51 Cb -0.08 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 1d04 s ILE 51 CO 0.01 0.45 0.03 -0.63 0.00 0.00 0.00 174.94 174.80 1d04 s ILE 52 N 1.51 4.01 -0.13 2.92 -1.09 0.48 -1.21 121.20 127.70 1d04 s ILE 52 Ca 0.05 -0.28 0.01 0.00 -2.23 0.00 0.00 60.65 58.20 1d04 s ILE 52 Cb -0.13 -2.86 -0.01 0.00 -1.58 0.00 0.00 42.46 37.88 1d04 s ILE 52 CO -0.10 0.36 -0.15 -0.83 -1.23 0.00 0.00 174.94 172.99 1d04 s GLY 53 N 1.57 1.51 -0.26 6.18 0.00 -0.38 -1.13 107.32 114.81 1d04 s GLY 53 Ca 0.06 -0.90 -0.10 0.00 0.00 0.00 0.00 44.72 43.77 1d04 s GLY 53 CO 0.01 -0.21 0.59 0.00 0.00 0.00 0.00 173.10 173.49 1d04 s PRO 55 N 2.45 3.60 -0.12 0.00 0.04 -1.26 -4.11 135.00 135.60 1d04 s PRO 55 Ca -0.06 0.53 -0.07 0.00 0.04 0.00 0.00 61.00 61.44 1d04 s PRO 55 Cb -0.10 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.19 1d04 s PRO 55 CO -0.17 -0.39 0.14 0.99 0.04 0.00 0.00 177.00 177.60 1d04 s THR 56 N -2.95 5.50 0.17 1.26 2.01 -1.16 -3.32 115.64 117.14 1d04 s THR 56 Ca 0.52 0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.75 1d04 s THR 56 Cb -0.11 -3.39 -0.05 0.00 0.01 0.00 0.00 72.50 68.96 1d04 s THR 56 CO 0.49 0.62 -0.02 0.26 -0.69 0.00 0.00 174.62 175.27 1d04 s TRP 57 N -1.02 1.25 -1.56 4.92 0.52 -0.33 -4.90 118.94 117.81 1d04 s TRP 57 Ca 0.15 -0.95 -0.04 0.00 0.02 0.00 0.00 56.10 55.29 1d04 s TRP 57 Cb -0.12 -0.70 0.04 0.00 -1.15 0.00 0.00 33.47 31.54 1d04 s TRP 57 CO 0.04 -0.12 0.22 0.09 0.02 0.00 0.00 176.95 177.19 1d04 n ASN 58 N -0.24 0.08 -2.53 2.95 3.02 -1.26 -0.64 115.26 116.64 1d04 n ASN 58 Ca -0.07 -1.19 -0.04 0.00 -0.03 0.00 0.00 54.58 53.24 1d04 n ASN 58 Cb 0.63 -2.03 0.00 0.00 -0.61 0.00 0.00 39.78 37.77 1d04 n ASN 58 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1d04 n VAL 59 N -4.47 -8.32 -2.03 2.41 0.31 -1.26 -4.38 118.33 100.59 1d04 n VAL 59 Ca -0.25 0.39 -0.10 0.00 -0.01 0.00 0.00 64.34 64.36 1d04 n VAL 59 Cb 0.66 -6.28 -0.01 0.00 -0.91 0.00 0.00 33.84 27.30 1d04 n VAL 59 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1d04 n GLY 60 N -0.74 0.17 3.74 2.92 0.00 -1.20 -5.03 105.19 105.05 1d04 n GLY 60 Ca 0.06 -0.47 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 1d04 n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d04 s GLU 61 N -4.21 2.68 0.50 1.61 0.41 0.19 -4.71 118.70 115.17 1d04 s GLU 61 Ca 0.00 -1.05 -0.20 0.00 -0.41 0.00 0.00 54.97 53.31 1d04 s GLU 61 Cb 0.00 -2.48 -0.08 0.00 -1.78 0.00 0.00 34.13 29.79 1d04 s GLU 61 CO 0.00 0.44 1.07 -0.51 -0.49 0.00 0.00 175.26 175.77 1d04 s LEU 62 N -3.27 3.83 0.49 1.80 1.43 -1.26 -1.19 118.68 120.51 1d04 s LEU 62 Ca 0.30 2.02 -0.24 0.00 -1.03 0.00 0.00 54.13 55.18 1d04 s LEU 62 Cb -0.09 -4.55 -0.07 0.00 0.03 0.00 0.00 46.19 41.51 1d04 s LEU 62 CO 0.22 -0.91 1.42 1.67 0.23 0.00 0.00 176.35 178.97 1d04 n GLN 63 N -1.03 2.06 -0.28 1.70 0.00 -1.21 -4.67 117.38 113.94 1d04 n GLN 63 Ca 0.10 0.74 0.10 0.00 -0.00 0.00 0.00 57.00 57.95 1d04 n GLN 63 Cb 0.52 -2.63 0.25 0.00 0.00 0.00 0.00 30.24 28.39 1d04 n GLN 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1d04 h SER 64 N 1.98 0.04 -0.39 1.69 4.64 -1.94 -1.41 113.55 118.17 1d04 h SER 64 Ca -0.51 0.17 -0.08 0.00 -0.47 0.00 0.00 61.79 60.91 1d04 h SER 64 Cb 1.28 0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 63.58 1d04 h SER 64 CO 0.60 -0.09 -0.02 0.44 -0.87 0.00 0.00 176.83 176.88 1d04 h ASP 65 N 0.25 0.76 0.07 4.97 3.32 -1.93 -1.05 116.42 122.81 1d04 h ASP 65 Ca 0.51 -0.19 -0.16 0.00 0.02 0.00 0.00 57.03 57.20 1d04 h ASP 65 Cb 0.96 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 1d04 h ASP 65 CO -0.59 0.84 -0.57 -0.50 -1.72 0.00 0.00 179.24 176.69 1d04 h TRP 66 N 0.73 0.65 -0.78 4.55 4.06 -1.67 -2.82 115.95 120.67 1d04 h TRP 66 Ca 0.14 -0.24 0.01 0.00 2.06 0.00 0.00 58.89 60.87 1d04 h TRP 66 Cb 0.48 -0.12 -0.04 0.00 -1.00 0.00 0.00 29.16 28.47 1d04 h TRP 66 CO 0.02 0.96 0.51 1.49 -3.56 0.00 0.00 178.44 177.87 1d04 h GLU 67 N 0.39 1.01 -0.82 0.49 4.57 -0.84 -0.14 114.58 119.24 1d04 h GLU 67 Ca 0.00 -0.06 -0.03 0.00 -1.18 0.00 0.00 59.36 58.10 1d04 h GLU 67 Cb 1.11 -0.23 -0.04 0.00 -0.16 0.00 0.00 28.75 29.44 1d04 h GLU 67 CO 0.10 0.67 0.41 0.78 -1.18 0.00 0.00 179.01 179.79 1d04 h GLY 68 N 1.04 1.25 1.07 1.92 0.00 -1.00 -2.96 103.07 104.38 1d04 h GLY 68 Ca 0.29 -0.60 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1d04 h GLY 68 CO -0.08 0.57 -0.48 4.51 0.00 0.00 0.00 176.54 181.07 1d04 n ILE 69 N -4.36 0.02 -0.22 2.60 3.06 -1.04 -4.51 119.36 114.91 1d04 n ILE 69 Ca 0.08 -0.02 -0.01 0.00 -2.50 0.00 0.00 62.75 60.30 1d04 n ILE 69 Cb 0.12 0.18 0.06 0.00 0.54 0.00 0.00 39.64 40.54 1d04 n ILE 69 CO 0.00 0.00 0.00 0.22 -2.50 0.00 0.00 176.55 174.27 1d04 h TYR 70 N 0.00 -0.48 0.00 9.51 3.20 -0.85 0.45 116.97 128.80 1d04 h TYR 70 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1d04 h TYR 70 Cb 0.51 0.31 0.00 0.00 1.54 0.00 0.00 36.73 39.10 1d04 h TYR 70 CO 0.00 -0.31 0.00 -0.44 -1.64 0.00 0.00 178.16 175.77 1d04 h ASP 71 N -0.04 0.00 0.85 -2.11 3.32 -1.79 -2.70 116.42 113.95 1d04 h ASP 71 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1d04 h ASP 71 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1d04 h ASP 71 CO -0.68 0.00 -0.19 0.47 -1.72 0.00 0.00 179.24 177.12 1d04 n ASP 72 N -2.83 0.23 0.25 6.45 8.00 0.14 -3.88 116.55 124.91 1d04 n ASP 72 Ca 0.00 0.24 0.07 0.00 0.71 0.00 0.00 54.79 55.82 1d04 n ASP 72 Cb 0.24 -0.24 0.60 0.00 -0.02 0.00 0.00 41.12 41.71 1d04 n ASP 72 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 1d04 h LEU 73 N 0.00 0.00 -2.75 0.64 3.38 -1.36 -2.28 115.31 112.93 1d04 h LEU 73 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1d04 h LEU 73 Cb 0.52 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 1d04 h LEU 73 CO 0.00 0.08 -0.01 0.44 0.09 0.00 0.00 178.44 179.04 1d04 h ASP 74 N 0.00 0.00 0.55 -0.43 3.32 -1.79 -0.94 116.42 117.13 1d04 h ASP 74 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d04 h ASP 74 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1d04 h ASP 74 CO 0.01 0.01 -0.21 -1.54 -1.72 0.00 0.00 179.24 175.78 1d04 n SER 75 N -3.22 0.40 -4.81 6.45 3.41 -0.86 -4.82 113.62 110.18 1d04 n SER 75 Ca -0.03 -0.23 -0.38 0.00 -0.26 0.00 0.00 58.87 57.97 1d04 n SER 75 Cb 0.10 -0.07 -0.06 0.00 -0.26 0.00 0.00 64.21 63.92 1d04 n SER 75 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1d04 s VAL 76 N -2.77 4.88 -0.58 -3.33 1.01 -0.36 -4.98 120.40 114.27 1d04 s VAL 76 Ca 0.19 1.08 -0.21 0.00 0.00 0.00 0.00 61.98 63.04 1d04 s VAL 76 Cb 0.19 -3.83 0.07 0.00 0.00 0.00 0.00 36.38 32.81 1d04 s VAL 76 CO 0.56 0.54 0.78 0.21 0.00 0.00 0.00 175.10 177.19 1d04 s ASN 77 N -0.90 6.21 0.00 3.32 2.47 -1.26 -4.87 114.94 119.91 1d04 s ASN 77 Ca 0.27 -1.04 0.27 0.00 0.42 0.00 0.00 52.86 52.78 1d04 s ASN 77 Cb -0.18 -2.35 0.89 0.00 -1.45 0.00 0.00 41.25 38.16 1d04 s ASN 77 CO 0.16 -1.16 1.66 0.49 -3.72 0.00 0.00 177.10 174.53 1d04 n PHE 78 N 6.81 0.00 -1.66 0.43 3.72 -1.25 -4.90 117.46 120.60 1d04 n PHE 78 Ca -0.06 0.00 -0.51 0.00 -0.05 0.00 0.00 57.45 56.83 1d04 n PHE 78 Cb 0.45 -0.24 -0.05 0.00 -0.94 0.00 0.00 39.48 38.69 1d04 n PHE 78 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1d04 n GLN 79 N -1.15 1.69 -0.69 -1.08 1.13 -1.24 -1.30 117.38 114.75 1d04 n GLN 79 Ca 0.10 0.62 0.00 0.00 -1.94 0.00 0.00 57.00 55.77 1d04 n GLN 79 Cb 0.32 -2.36 0.00 0.00 0.11 0.00 0.00 30.24 28.31 1d04 n GLN 79 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1d04 n GLY 80 N 3.67 0.94 3.88 1.08 0.00 -1.22 -4.96 105.19 108.57 1d04 n GLY 80 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1d04 n GLY 80 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d04 s LYS 81 N -0.27 3.74 -0.19 1.61 1.02 -0.42 -4.96 119.74 120.27 1d04 s LYS 81 Ca 0.00 0.15 -0.05 0.00 0.02 0.00 0.00 55.97 56.09 1d04 s LYS 81 Cb 0.00 -2.73 -0.03 0.00 -0.52 0.00 0.00 37.83 34.56 1d04 s LYS 81 CO 0.00 0.38 -0.01 0.15 -0.92 0.00 0.00 175.35 174.95 1d04 s LYS 82 N -2.73 3.64 -0.07 1.68 1.02 -0.74 -0.67 119.74 121.87 1d04 s LYS 82 Ca 0.45 -0.52 0.03 0.00 0.02 0.00 0.00 55.97 55.95 1d04 s LYS 82 Cb -0.12 -3.04 0.00 0.00 -0.52 0.00 0.00 37.83 34.15 1d04 s LYS 82 CO 0.22 0.07 -0.17 0.08 -0.92 0.00 0.00 175.35 174.63 1d04 s VAL 83 N 0.83 1.52 0.18 3.17 1.01 -0.29 -1.77 120.40 125.06 1d04 s VAL 83 Ca 0.00 -0.72 0.08 0.00 0.00 0.00 0.00 61.98 61.34 1d04 s VAL 83 Cb -0.14 -1.34 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1d04 s VAL 83 CO 0.02 0.44 -0.05 0.00 0.00 0.00 0.00 175.10 175.51 1d04 s ALA 84 N 0.40 3.08 0.10 5.51 0.00 0.16 -1.89 121.76 129.12 1d04 s ALA 84 Ca -0.13 -1.44 0.05 0.00 0.00 0.00 0.00 51.96 50.44 1d04 s ALA 84 Cb -0.16 -0.86 -0.04 0.00 0.00 0.00 0.00 23.12 22.07 1d04 s ALA 84 CO 0.05 0.46 -0.12 0.71 0.00 0.00 0.00 175.76 176.86 1d04 s TYR 85 N -1.76 1.22 0.08 0.00 1.51 -1.26 -0.39 117.35 116.75 1d04 s TYR 85 Ca 0.26 -0.59 -0.13 0.00 -1.01 0.00 0.00 57.07 55.61 1d04 s TYR 85 Cb -0.09 -0.65 0.02 0.00 -0.11 0.00 0.00 41.96 41.13 1d04 s TYR 85 CO 0.17 0.07 0.30 -0.59 -1.11 0.00 0.00 175.55 174.39 1d04 s PHE 86 N -2.16 -0.06 -0.01 2.71 -0.71 -0.28 -1.28 117.98 116.18 1d04 s PHE 86 Ca 0.06 -0.22 -0.29 0.00 -1.04 0.00 0.00 56.93 55.45 1d04 s PHE 86 Cb -0.05 0.10 0.08 0.00 -1.21 0.00 0.00 43.02 41.95 1d04 s PHE 86 CO 0.02 -0.58 0.74 0.20 -1.34 0.00 0.00 175.22 174.26 1d04 s GLY 87 N -2.53 -0.52 0.05 1.99 0.00 -0.66 -1.83 107.32 103.82 1d04 s GLY 87 Ca 0.00 1.19 -0.00 0.00 0.00 0.00 0.00 44.72 45.91 1d04 s GLY 87 CO -0.08 0.69 0.18 0.00 0.00 0.00 0.00 173.10 173.89 1d04 s ALA 88 N -2.08 3.92 0.22 3.20 0.00 -1.26 -0.87 121.76 124.90 1d04 s ALA 88 Ca -0.04 -0.85 -0.15 0.00 0.00 0.00 0.00 51.96 50.92 1d04 s ALA 88 Cb -0.00 -1.78 0.05 0.00 0.00 0.00 0.00 23.12 21.39 1d04 s ALA 88 CO 0.00 0.80 0.74 0.41 0.00 0.00 0.00 175.76 177.71 1d04 n GLY 89 N 0.48 0.93 2.66 0.00 0.00 -0.72 -2.97 105.19 105.57 1d04 n GLY 89 Ca -0.07 -1.15 -0.29 0.00 0.00 0.00 0.00 46.02 44.51 1d04 n GLY 89 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1d04 s ASP 90 N -2.81 3.78 0.48 1.61 2.15 -1.26 -4.31 116.67 116.31 1d04 s ASP 90 Ca 0.16 -1.46 0.27 0.00 0.43 0.00 0.00 52.55 51.94 1d04 s ASP 90 Cb -0.03 -0.65 1.13 0.00 -0.30 0.00 0.00 42.92 43.08 1d04 s ASP 90 CO 0.07 -0.42 1.91 0.06 -0.17 0.00 0.00 175.17 176.62 1d04 h GLN 91 N 8.22 0.00 0.00 4.34 3.07 -1.88 -1.86 115.11 127.00 1d04 h GLN 91 Ca -0.16 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 58.55 1d04 h GLN 91 Cb 1.02 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.57 1d04 h GLN 91 CO 0.45 0.16 -0.23 0.28 0.09 0.00 0.00 178.83 179.58 1d04 h VAL 92 N 0.00 0.52 -0.03 1.86 2.07 -1.95 -2.99 116.25 115.72 1d04 h VAL 92 Ca -0.00 -1.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.02 1d04 h VAL 92 Cb 0.61 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1d04 h VAL 92 CO 0.02 0.18 -0.26 1.23 0.02 0.00 0.00 177.57 178.76 1d04 h GLY 93 N -1.00 0.06 -5.52 2.17 0.00 -2.00 -3.31 103.07 93.48 1d04 h GLY 93 Ca -0.04 -0.04 -0.51 0.00 0.00 0.00 0.00 47.33 46.74 1d04 h GLY 93 CO -0.02 0.04 -0.98 -1.72 0.00 0.00 0.00 176.54 173.86 1d04 n TYR 94 N -4.21 1.84 0.30 5.60 4.01 -0.70 -4.92 117.16 119.08 1d04 n TYR 94 Ca -0.02 -3.69 0.18 0.00 -0.16 0.00 0.00 57.90 54.21 1d04 n TYR 94 Cb 0.32 -0.41 0.89 0.00 -0.31 0.00 0.00 39.34 39.83 1d04 n TYR 94 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1d04 h SER 95 N 2.96 0.00 0.08 7.72 4.64 -1.62 -1.57 113.55 125.75 1d04 h SER 95 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1d04 h SER 95 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1d04 h SER 95 CO 0.63 0.00 -0.22 0.47 -0.87 0.00 0.00 176.83 176.85 1d04 n ASP 96 N -2.86 1.68 -1.37 4.97 8.00 -1.26 -0.54 116.55 125.15 1d04 n ASP 96 Ca -0.01 -1.35 0.03 0.00 0.71 0.00 0.00 54.79 54.17 1d04 n ASP 96 Cb 0.15 0.17 0.01 0.00 -0.02 0.00 0.00 41.12 41.43 1d04 n ASP 96 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1d04 n ASN 97 N -0.01 0.74 -4.67 -2.24 4.13 -0.69 -4.45 115.26 108.07 1d04 n ASN 97 Ca 0.13 -1.99 -0.42 0.00 1.68 0.00 0.00 54.58 53.98 1d04 n ASN 97 Cb 0.42 -0.24 -0.03 0.00 -1.54 0.00 0.00 39.78 38.39 1d04 n ASN 97 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1d04 s PHE 98 N 0.00 1.81 -1.88 3.10 5.36 -0.68 -2.27 117.98 123.43 1d04 s PHE 98 Ca 0.28 -0.07 0.00 0.00 -0.96 0.00 0.00 56.93 56.18 1d04 s PHE 98 Cb 0.32 -4.09 0.00 0.00 -0.34 0.00 0.00 43.02 38.91 1d04 s PHE 98 CO -0.14 -4.68 0.00 1.04 -1.46 0.00 0.00 175.22 169.98 1d04 n GLN 99 N 6.79 -1.44 -0.27 10.12 1.13 -1.26 -4.40 117.38 128.05 1d04 n GLN 99 Ca 0.18 1.07 0.08 0.00 -1.94 0.00 0.00 57.00 56.39 1d04 n GLN 99 Cb 0.41 -5.51 0.32 0.00 0.11 0.00 0.00 30.24 25.57 1d04 n GLN 99 CO 0.00 0.00 0.00 -0.44 -1.44 0.00 0.00 177.06 175.18 1d04 h ASP 100 N 0.00 0.76 -0.45 1.08 5.19 -1.82 -2.53 116.42 118.65 1d04 h ASP 100 Ca -0.43 0.02 0.01 0.00 -0.62 0.00 0.00 57.03 56.02 1d04 h ASP 100 Cb 1.30 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 40.65 1d04 h ASP 100 CO 0.56 0.44 0.28 0.00 -3.12 0.00 0.00 179.24 177.41 1d04 h ALA 101 N 1.57 0.57 -0.88 3.45 0.00 -1.84 0.04 119.26 122.17 1d04 h ALA 101 Ca 0.40 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.36 1d04 h ALA 101 Cb 0.43 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1d04 h ALA 101 CO -0.17 -0.02 0.55 1.98 0.00 0.00 0.00 179.25 181.59 1d04 h MET 102 N 0.56 0.97 -0.35 0.00 1.85 -1.65 -1.26 114.93 115.05 1d04 h MET 102 Ca 0.18 -0.06 -0.13 0.00 -0.61 0.00 0.00 59.70 59.08 1d04 h MET 102 Cb -0.02 -0.22 -0.01 0.00 0.43 0.00 0.00 31.60 31.78 1d04 h MET 102 CO -0.07 0.64 -0.30 0.78 -0.40 0.00 0.00 176.91 177.57 1d04 h GLY 103 N 1.00 0.82 0.88 1.39 0.00 -1.17 -1.29 103.07 104.70 1d04 h GLY 103 Ca 0.38 -0.76 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1d04 h GLY 103 CO -0.17 0.69 0.06 -2.22 0.00 0.00 0.00 176.54 174.89 1d04 h ILE 104 N 0.64 1.22 -0.44 2.60 2.04 -0.30 -1.54 117.51 121.73 1d04 h ILE 104 Ca 0.07 -0.73 -0.05 0.00 1.00 0.00 0.00 64.86 65.15 1d04 h ILE 104 Cb 0.83 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1d04 h ILE 104 CO 0.07 0.24 0.08 -0.07 0.00 0.00 0.00 178.15 178.46 1d04 h LEU 105 N 0.25 0.70 -0.57 1.44 3.38 -1.18 -2.46 115.31 116.88 1d04 h LEU 105 Ca 0.08 -0.26 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 1d04 h LEU 105 Cb 0.30 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1d04 h LEU 105 CO 0.00 0.78 0.36 -0.08 0.09 0.00 0.00 178.44 179.59 1d04 h GLU 106 N 0.59 0.77 -0.54 1.13 4.22 -1.18 0.23 114.58 119.80 1d04 h GLU 106 Ca 0.14 -0.06 0.01 0.00 0.08 0.00 0.00 59.36 59.52 1d04 h GLU 106 Cb 0.37 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1d04 h GLU 106 CO 0.01 0.54 0.36 1.49 -2.18 0.00 0.00 179.01 179.22 1d04 h GLU 107 N 0.77 0.71 0.62 1.92 4.81 -1.14 0.31 114.58 122.58 1d04 h GLU 107 Ca 0.21 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1d04 h GLU 107 Cb -0.04 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.18 1d04 h GLU 107 CO -0.04 0.47 -0.30 -0.22 -0.73 0.00 0.00 179.01 178.19 1d04 h LYS 108 N 0.73 -0.81 -0.67 1.92 1.63 -1.10 -2.37 116.57 115.91 1d04 h LYS 108 Ca 0.20 0.06 -0.00 0.00 -0.85 0.00 0.00 60.65 60.05 1d04 h LYS 108 Cb -0.08 0.18 -0.03 0.00 -0.60 0.00 0.00 32.23 31.70 1d04 h LYS 108 CO -0.05 -0.49 0.41 0.82 -3.45 0.00 0.00 179.45 176.68 1d04 h ILE 109 N -1.08 1.19 -0.11 2.00 2.04 -0.92 -2.38 117.51 118.25 1d04 h ILE 109 Ca -0.09 -0.40 -0.16 0.00 1.00 0.00 0.00 64.86 65.21 1d04 h ILE 109 Cb 0.69 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1d04 h ILE 109 CO 0.14 0.19 -0.63 0.77 0.00 0.00 0.00 178.15 178.62 1d04 h SER 110 N 0.91 0.45 0.61 1.72 4.64 -0.98 -2.58 113.55 118.33 1d04 h SER 110 Ca 0.24 -0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1d04 h SER 110 Cb -0.05 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 1d04 h SER 110 CO -0.05 0.97 0.00 0.77 -0.87 0.00 0.00 176.83 177.65 1d04 h SER 111 N 0.29 0.00 -0.33 4.97 4.64 -0.91 -1.59 113.55 120.62 1d04 h SER 111 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1d04 h SER 111 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1d04 h SER 111 CO 0.11 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.25 1d04 n LEU 112 N -2.44 1.87 0.00 5.97 4.77 -0.97 -4.91 117.00 121.29 1d04 n LEU 112 Ca 0.01 -0.92 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 1d04 n LEU 112 Cb 0.20 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1d04 n LEU 112 CO 0.19 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.32 1d04 n GLY 113 N 1.08 0.62 3.92 -0.72 0.00 -0.60 -3.59 105.19 105.89 1d04 n GLY 113 Ca 0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.88 1d04 n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1d04 s SER 114 N -2.07 5.08 -0.17 1.61 1.04 -1.20 -3.45 113.70 114.53 1d04 s SER 114 Ca 0.00 0.63 -0.02 0.00 0.48 0.00 0.00 55.95 57.04 1d04 s SER 114 Cb 0.00 -1.38 -0.01 0.00 0.10 0.00 0.00 66.02 64.73 1d04 s SER 114 CO 0.00 -1.44 -0.10 -1.58 0.98 0.00 0.00 173.24 171.10 1d04 s GLN 115 N -5.21 3.36 0.14 4.02 0.74 0.15 -4.69 119.66 118.17 1d04 s GLN 115 Ca 0.58 -0.67 -0.29 0.00 0.05 0.00 0.00 55.36 55.04 1d04 s GLN 115 Cb -0.11 -2.79 -0.07 0.00 1.10 0.00 0.00 33.01 31.14 1d04 s GLN 115 CO 0.46 0.01 0.92 0.99 -0.55 0.00 0.00 175.29 177.12 1d04 s THR 116 N 0.90 4.40 0.11 -0.34 2.01 -1.26 -1.14 115.64 120.32 1d04 s THR 116 Ca -0.02 2.00 0.02 0.00 0.31 0.00 0.00 61.69 64.00 1d04 s THR 116 Cb -0.15 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.03 1d04 s THR 116 CO 0.00 0.39 -0.05 0.68 -0.69 0.00 0.00 174.62 174.95 1d04 s VAL 117 N -0.40 0.65 0.00 3.82 -7.23 -0.79 -4.90 120.40 111.54 1d04 s VAL 117 Ca 0.44 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.67 1d04 s VAL 117 Cb -0.24 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 34.93 1d04 s VAL 117 CO 0.29 -0.79 0.00 0.61 -0.31 0.00 0.00 175.10 174.90 1d04 n GLY 118 N -0.08 1.35 3.70 2.32 0.00 -1.26 -4.14 105.19 107.08 1d04 n GLY 118 Ca -0.11 -0.35 -0.38 0.00 0.00 0.00 0.00 46.02 45.17 1d04 n GLY 118 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1d04 n TYR 119 N -2.19 1.85 -4.76 1.61 4.01 -1.26 -4.11 117.16 112.30 1d04 n TYR 119 Ca 0.00 0.44 -0.25 0.00 -0.16 0.00 0.00 57.90 57.93 1d04 n TYR 119 Cb 0.20 -2.29 -0.16 0.00 -0.31 0.00 0.00 39.34 36.77 1d04 n TYR 119 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 1d04 s TRP 120 N -1.35 1.61 0.59 -0.72 -0.11 -0.31 -4.89 118.94 113.76 1d04 s TRP 120 Ca 0.73 -0.47 -0.18 0.00 1.22 0.00 0.00 56.10 57.40 1d04 s TRP 120 Cb -0.42 -1.09 -0.04 0.00 -1.50 0.00 0.00 33.47 30.42 1d04 s TRP 120 CO 0.48 -0.17 1.13 -1.25 -4.62 0.00 0.00 176.95 172.52 1d04 s PRO 121 N 0.12 3.12 0.00 5.86 0.04 -1.26 0.40 135.00 143.28 1d04 s PRO 121 Ca -0.05 1.55 0.30 0.00 0.04 0.00 0.00 61.00 62.84 1d04 s PRO 121 Cb -0.12 -1.98 1.39 0.00 0.04 0.00 0.00 34.50 33.83 1d04 s PRO 121 CO 0.02 -1.02 1.94 0.44 0.04 0.00 0.00 177.00 178.42 1d04 n ILE 122 N -1.72 0.00 -1.74 0.56 -5.35 -1.26 -4.73 119.36 105.11 1d04 n ILE 122 Ca 0.11 -0.11 -0.42 0.00 -0.27 0.00 0.00 62.75 62.06 1d04 n ILE 122 Cb 0.51 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.39 1d04 n ILE 122 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 1d04 s GLU 123 N -2.12 4.12 0.00 6.28 8.01 -1.26 -2.70 118.70 131.03 1d04 s GLU 123 Ca 0.39 2.60 0.00 0.00 0.01 0.00 0.00 54.97 57.97 1d04 s GLU 123 Cb 0.21 -3.05 0.00 0.00 -4.31 0.00 0.00 34.13 26.98 1d04 s GLU 123 CO 0.38 -0.70 0.00 0.41 0.01 0.00 0.00 175.26 175.36 1d04 n GLY 124 N 3.12 0.51 3.89 -1.39 0.00 -1.26 -5.07 105.19 105.00 1d04 n GLY 124 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 1d04 n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d04 s TYR 125 N -2.15 3.15 -0.23 1.61 1.51 -1.10 -5.10 117.35 115.04 1d04 s TYR 125 Ca 0.00 -0.15 -0.04 0.00 -1.01 0.00 0.00 57.07 55.87 1d04 s TYR 125 Cb 0.00 -1.63 0.08 0.00 -0.11 0.00 0.00 41.96 40.29 1d04 s TYR 125 CO 0.00 0.33 0.10 0.34 -1.11 0.00 0.00 175.55 175.21 1d04 s ASP 126 N -3.97 2.99 0.16 2.29 2.15 -1.26 -5.12 116.67 113.91 1d04 s ASP 126 Ca 0.37 -0.96 -0.15 0.00 0.43 0.00 0.00 52.55 52.24 1d04 s ASP 126 Cb -0.08 -0.38 0.02 0.00 -0.30 0.00 0.00 42.92 42.18 1d04 s ASP 126 CO 0.27 -0.38 0.41 0.72 -0.17 0.00 0.00 175.17 176.03 1d04 s PHE 127 N 2.04 -0.03 -0.23 -5.34 -0.71 -1.26 -4.63 117.98 107.82 1d04 s PHE 127 Ca 0.05 -0.31 -0.15 0.00 -1.04 0.00 0.00 56.93 55.47 1d04 s PHE 127 Cb -0.16 0.23 -0.17 0.00 -1.21 0.00 0.00 43.02 41.71 1d04 s PHE 127 CO -0.20 -0.78 -0.02 0.09 -1.34 0.00 0.00 175.22 172.97 1d04 n ASN 128 N -0.26 1.93 -4.04 1.98 3.02 0.29 -5.03 115.26 113.16 1d04 n ASN 128 Ca -0.12 0.33 -0.08 0.00 -0.03 0.00 0.00 54.58 54.68 1d04 n ASN 128 Cb 0.63 -0.86 -0.10 0.00 -0.61 0.00 0.00 39.78 38.84 1d04 n ASN 128 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1d04 s GLU 129 N -2.45 0.49 -0.28 3.52 0.41 -0.47 -4.99 118.70 114.93 1d04 s GLU 129 Ca -0.33 -0.95 -0.22 0.00 -0.41 0.00 0.00 54.97 53.06 1d04 s GLU 129 Cb 0.10 0.17 0.09 0.00 -1.78 0.00 0.00 34.13 32.71 1d04 s GLU 129 CO 0.57 -0.09 0.82 0.45 -0.49 0.00 0.00 175.26 176.53 1d04 s SER 130 N -2.29 -0.69 0.00 -0.19 0.15 -1.26 -2.94 113.70 106.48 1d04 s SER 130 Ca -0.03 1.25 0.29 0.00 0.70 0.00 0.00 55.95 58.16 1d04 s SER 130 Cb 0.00 1.27 1.31 0.00 -1.71 0.00 0.00 66.02 66.89 1d04 s SER 130 CO -0.06 -0.21 1.93 0.29 1.20 0.00 0.00 173.24 176.39 1d04 n LYS 131 N 3.06 0.37 -0.45 5.44 5.02 -1.26 -3.66 118.16 126.67 1d04 n LYS 131 Ca -0.15 -0.06 0.07 0.00 -2.02 0.00 0.00 58.31 56.15 1d04 n LYS 131 Cb 0.56 -1.50 0.27 0.00 -0.02 0.00 0.00 35.03 34.35 1d04 n LYS 131 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1d04 n ALA 132 N -1.26 2.89 -2.87 7.82 0.00 -1.26 -4.48 120.51 121.35 1d04 n ALA 132 Ca 0.12 -1.18 -0.34 0.00 0.00 0.00 0.00 53.44 52.04 1d04 n ALA 132 Cb 0.28 -1.01 -0.11 0.00 0.00 0.00 0.00 19.45 18.60 1d04 n ALA 132 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1d04 s VAL 133 N -1.70 4.09 -0.04 0.00 1.01 -1.24 -0.70 120.40 121.82 1d04 s VAL 133 Ca 0.39 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1d04 s VAL 133 Cb 0.25 -2.78 0.03 0.00 0.00 0.00 0.00 36.38 33.88 1d04 s VAL 133 CO 0.20 0.51 0.07 -0.60 0.00 0.00 0.00 175.10 175.28 1d04 s ARG 134 N 0.10 -0.00 -1.49 2.72 3.52 0.65 -4.87 118.95 119.58 1d04 s ARG 134 Ca 0.01 0.29 -0.11 0.00 -0.13 0.00 0.00 55.73 55.79 1d04 s ARG 134 Cb -0.13 -0.26 0.07 0.00 -1.56 0.00 0.00 34.95 33.06 1d04 s ARG 134 CO 0.02 -0.20 0.90 -1.71 -0.81 0.00 0.00 175.30 173.51 1d04 n ASN 135 N 4.41 -3.89 -2.26 -2.12 5.15 -1.26 -1.17 115.26 114.12 1d04 n ASN 135 Ca -0.23 -0.80 -0.20 0.00 -0.60 0.00 0.00 54.58 52.75 1d04 n ASN 135 Cb 0.50 -3.86 -0.01 0.00 -0.53 0.00 0.00 39.78 35.89 1d04 n ASN 135 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1d04 n ASN 136 N -2.88 -5.69 -4.03 1.20 4.05 -1.26 -4.99 115.26 101.67 1d04 n ASN 136 Ca -0.04 -0.01 -0.10 0.00 0.45 0.00 0.00 54.58 54.88 1d04 n ASN 136 Cb 0.56 -4.71 -0.11 0.00 1.23 0.00 0.00 39.78 36.75 1d04 n ASN 136 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1d04 s GLN 137 N -4.98 0.44 0.38 1.20 -0.21 -0.31 -4.08 119.66 112.10 1d04 s GLN 137 Ca 0.00 -0.79 -0.24 0.00 0.02 0.00 0.00 55.36 54.35 1d04 s GLN 137 Cb 0.00 0.02 -0.10 0.00 1.00 0.00 0.00 33.01 33.93 1d04 s GLN 137 CO 0.00 -0.04 0.98 -0.06 -2.12 0.00 0.00 175.29 174.05 1d04 s PHE 138 N -1.99 3.42 -1.86 0.91 0.08 0.16 -0.25 117.98 118.45 1d04 s PHE 138 Ca -0.09 1.68 0.21 0.00 0.12 0.00 0.00 56.93 58.85 1d04 s PHE 138 Cb -0.06 -2.97 1.20 0.00 -0.57 0.00 0.00 43.02 40.62 1d04 s PHE 138 CO -0.02 -0.17 1.64 1.33 -0.10 0.00 0.00 175.22 177.89 1d04 n VAL 139 N -0.05 0.09 -3.77 -0.44 0.24 0.12 -1.16 118.33 113.38 1d04 n VAL 139 Ca 0.05 0.02 -0.00 0.00 -2.04 0.00 0.00 64.34 62.36 1d04 n VAL 139 Cb 0.51 -0.69 0.01 0.00 -1.47 0.00 0.00 33.84 32.20 1d04 n VAL 139 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1d04 n GLY 140 N 0.34 0.75 3.64 7.63 0.00 -1.26 -4.40 105.19 111.89 1d04 n GLY 140 Ca 0.14 -1.01 -0.43 0.00 0.00 0.00 0.00 46.02 44.73 1d04 n GLY 140 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1d04 s LEU 141 N 0.00 3.99 -0.41 0.99 2.96 -0.40 -4.27 118.68 121.54 1d04 s LEU 141 Ca 0.13 1.53 -0.17 0.00 -0.22 0.00 0.00 54.13 55.40 1d04 s LEU 141 Cb -0.01 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.16 1d04 s LEU 141 CO 0.02 -1.05 0.42 0.00 -1.32 0.00 0.00 176.35 174.42 1d04 s ALA 142 N 4.40 3.44 0.03 5.97 0.00 -1.26 -1.65 121.76 132.70 1d04 s ALA 142 Ca 0.62 -1.46 0.01 0.00 0.00 0.00 0.00 51.96 51.13 1d04 s ALA 142 Cb -0.22 -3.01 -0.04 0.00 0.00 0.00 0.00 23.12 19.85 1d04 s ALA 142 CO 0.23 -1.49 0.11 0.42 0.00 0.00 0.00 175.76 175.03 1d04 s ILE 143 N 2.11 4.83 -0.33 0.00 -1.09 -0.04 -5.00 121.20 121.68 1d04 s ILE 143 Ca 0.12 -0.51 -0.01 0.00 -2.23 0.00 0.00 60.65 58.03 1d04 s ILE 143 Cb -0.17 -3.28 0.13 0.00 -1.58 0.00 0.00 42.46 37.56 1d04 s ILE 143 CO 0.13 0.24 0.22 -0.62 -1.23 0.00 0.00 174.94 173.68 1d04 s ASP 144 N -2.10 2.72 0.34 3.58 -1.08 -1.26 -1.76 116.67 117.10 1d04 s ASP 144 Ca 0.27 -1.71 0.18 0.00 -0.52 0.00 0.00 52.55 50.78 1d04 s ASP 144 Cb -0.12 -0.15 0.29 0.00 -1.46 0.00 0.00 42.92 41.48 1d04 s ASP 144 CO 0.19 -0.35 1.55 -0.33 0.52 0.00 0.00 175.17 176.76 1d04 h GLU 145 N 7.53 0.00 -0.31 4.34 4.39 -1.83 0.12 114.58 128.81 1d04 h GLU 145 Ca -0.03 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.51 1d04 h GLU 145 Cb 1.00 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.65 1d04 h GLU 145 CO 0.31 0.38 -0.42 -0.44 -1.16 0.00 0.00 179.01 177.67 1d04 h ASP 146 N 0.00 0.84 0.00 1.42 3.32 -1.94 -3.34 116.42 116.72 1d04 h ASP 146 Ca -0.00 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 56.63 1d04 h ASP 146 Cb 1.19 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.50 1d04 h ASP 146 CO 0.05 1.15 -1.10 0.59 -1.72 0.00 0.00 179.24 178.21 1d04 n ASN 147 N -4.03 4.60 -2.77 6.45 3.02 -1.24 -4.84 115.26 116.44 1d04 n ASN 147 Ca -0.02 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.33 1d04 n ASN 147 Cb 0.55 0.74 -0.01 0.00 -0.61 0.00 0.00 39.78 40.46 1d04 n ASN 147 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1d04 n GLN 148 N -1.88 2.24 0.26 3.52 6.02 0.39 -4.91 117.38 123.03 1d04 n GLN 148 Ca -0.02 -3.99 0.10 0.00 -0.01 0.00 0.00 57.00 53.08 1d04 n GLN 148 Cb 0.37 -1.85 0.70 0.00 1.02 0.00 0.00 30.24 30.47 1d04 n GLN 148 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 1d04 h PRO 149 N 2.87 0.00 0.00 -1.09 0.13 -1.66 -2.46 132.00 129.78 1d04 h PRO 149 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1d04 h PRO 149 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1d04 h PRO 149 CO 0.67 0.05 0.00 -0.44 -0.23 0.00 0.00 178.00 178.06 1d04 h ASP 150 N 0.00 0.00 0.72 1.44 3.32 -1.90 -3.12 116.42 116.88 1d04 h ASP 150 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d04 h ASP 150 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1d04 h ASP 150 CO 0.01 0.00 -1.02 0.18 -1.72 0.00 0.00 179.24 176.69 1d04 n LEU 151 N -2.53 0.68 -0.01 1.55 4.77 -0.93 -4.55 117.00 115.97 1d04 n LEU 151 Ca 0.03 0.18 -0.09 0.00 -0.03 0.00 0.00 56.01 56.10 1d04 n LEU 151 Cb 0.33 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 1d04 n LEU 151 CO 0.26 -0.08 0.72 0.74 -1.33 0.00 0.00 177.39 177.70 1d04 h THR 152 N 0.00 0.47 -0.21 -5.08 2.02 -1.60 -1.51 112.91 107.01 1d04 h THR 152 Ca 0.00 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.24 1d04 h THR 152 Cb 0.87 0.47 -0.07 0.00 -1.74 0.00 0.00 68.15 67.68 1d04 h THR 152 CO 0.00 0.00 -0.25 0.50 0.37 0.00 0.00 175.52 176.14 1d04 h LYS 153 N -0.25 -0.26 -0.31 6.66 3.64 -1.80 -1.32 116.57 122.93 1d04 h LYS 153 Ca 0.11 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.41 1d04 h LYS 153 Cb 0.42 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 1d04 h LYS 153 CO -0.31 -0.18 -0.21 -0.97 -2.27 0.00 0.00 179.45 175.52 1d04 h ASN 154 N -0.27 0.57 -0.63 4.20 -1.24 -1.82 -2.27 115.58 114.12 1d04 h ASN 154 Ca 0.12 -0.19 -0.01 0.00 0.71 0.00 0.00 56.30 56.94 1d04 h ASN 154 Cb 0.46 -0.16 -0.03 0.00 0.73 0.00 0.00 38.32 39.33 1d04 h ASN 154 CO -0.37 0.78 0.34 0.03 -1.29 0.00 0.00 177.43 176.93 1d04 h ARG 155 N 0.51 0.88 -0.10 6.67 3.08 -0.69 -1.56 114.38 123.18 1d04 h ARG 155 Ca 0.08 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1d04 h ARG 155 Cb 0.64 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 1d04 h ARG 155 CO 0.05 0.67 0.02 0.82 -1.07 0.00 0.00 179.97 180.46 1d04 h ILE 156 N 0.86 1.19 -0.17 2.04 2.04 -1.00 -1.60 117.51 120.87 1d04 h ILE 156 Ca 0.22 -0.60 0.04 0.00 1.00 0.00 0.00 64.86 65.52 1d04 h ILE 156 Cb 0.05 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 1d04 h ILE 156 CO -0.04 0.17 -0.05 0.11 0.00 0.00 0.00 178.15 178.35 1d04 h LYS 157 N -0.04 -0.01 -0.41 2.37 1.57 -1.27 -0.21 116.57 118.57 1d04 h LYS 157 Ca 0.03 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.77 1d04 h LYS 157 Cb 0.25 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1d04 h LYS 157 CO 0.00 -0.01 0.11 1.15 -0.57 0.00 0.00 179.45 180.13 1d04 h THR 158 N -0.01 1.23 -0.28 -0.16 2.02 -1.29 -1.75 112.91 112.66 1d04 h THR 158 Ca 0.09 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 1d04 h THR 158 Cb 0.14 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1d04 h THR 158 CO -0.19 0.27 0.12 -0.25 0.37 0.00 0.00 175.52 175.85 1d04 h TRP 159 N 0.52 0.41 -0.75 3.16 7.01 -1.06 -2.12 115.95 123.13 1d04 h TRP 159 Ca 0.13 -0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.08 1d04 h TRP 159 Cb 0.30 -0.13 -0.03 0.00 -2.10 0.00 0.00 29.16 27.20 1d04 h TRP 159 CO 0.02 0.40 0.37 0.28 -2.79 0.00 0.00 178.44 176.71 1d04 h VAL 160 N 0.31 1.24 -0.40 2.65 2.07 -0.98 -0.51 116.25 120.63 1d04 h VAL 160 Ca 0.09 -0.65 0.04 0.00 0.82 0.00 0.00 66.70 67.01 1d04 h VAL 160 Cb 0.15 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.17 1d04 h VAL 160 CO -0.01 0.28 0.16 -1.28 0.02 0.00 0.00 177.57 176.73 1d04 h SER 161 N 1.04 0.19 -0.17 0.57 0.87 -1.09 -0.98 113.55 113.98 1d04 h SER 161 Ca 0.26 0.04 -0.08 0.00 -1.23 0.00 0.00 61.79 60.77 1d04 h SER 161 Cb 0.10 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.05 1d04 h SER 161 CO -0.03 0.15 -0.15 1.56 -0.53 0.00 0.00 176.83 177.82 1d04 h GLN 162 N 0.33 0.56 -0.45 2.24 4.20 -1.02 -3.09 115.11 117.88 1d04 h GLN 162 Ca 0.18 -0.18 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 1d04 h GLN 162 Cb 0.14 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.85 1d04 h GLN 162 CO -0.17 0.70 0.10 -0.07 -0.67 0.00 0.00 178.83 178.72 1d04 h LEU 163 N 0.51 0.69 -0.92 1.46 3.38 -0.26 -3.21 115.31 116.97 1d04 h LEU 163 Ca 0.09 -0.24 0.25 0.00 0.09 0.00 0.00 57.88 58.07 1d04 h LEU 163 Cb 0.56 -0.18 -0.16 0.00 0.09 0.00 0.00 40.66 40.96 1d04 h LEU 163 CO 0.04 0.75 0.11 0.11 0.09 0.00 0.00 178.44 179.54 1d04 h LYS 164 N 0.60 0.08 0.10 1.13 1.57 -1.12 0.17 116.57 119.09 1d04 h LYS 164 Ca 0.14 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1d04 h LYS 164 Cb 0.34 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 1d04 h LYS 164 CO 0.00 0.05 -0.16 0.77 -0.57 0.00 0.00 179.45 179.55 1d04 h SER 165 N 0.08 -0.43 0.12 0.86 0.02 -1.69 0.07 113.55 112.57 1d04 h SER 165 Ca 0.57 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.56 1d04 h SER 165 Cb 1.17 0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.87 1d04 h SER 165 CO -0.80 -0.23 -0.04 -0.33 -1.14 0.00 0.00 176.83 174.29 1d04 h GLU 166 N -0.31 0.00 -0.69 3.45 4.39 -0.82 -2.12 114.58 118.48 1d04 h GLU 166 Ca 0.02 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.49 1d04 h GLU 166 Cb 0.33 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 28.84 1d04 h GLU 166 CO -0.08 0.04 0.26 1.19 -1.16 0.00 0.00 179.01 179.26 1d04 n PHE 167 N -3.71 2.27 -2.84 4.33 3.72 -0.62 -4.94 117.46 115.68 1d04 n PHE 167 Ca -0.03 -1.30 -0.22 0.00 -0.05 0.00 0.00 57.45 55.86 1d04 n PHE 167 Cb 0.13 -0.67 0.02 0.00 -0.94 0.00 0.00 39.48 38.02 1d04 n PHE 167 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1d04 n GLY 168 N -0.41 -0.52 0.12 1.37 0.00 -0.80 -5.02 105.19 99.93 1d04 n GLY 168 Ca 0.41 0.09 0.01 0.00 0.00 0.00 0.00 46.02 46.53 1d04 n GLY 168 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36