#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d3f s ASN 2 N 0.00 0.13 0.26 6.12 2.20 -1.26 -5.03 114.94 117.35 1d3f s ASN 2 Ca 0.00 -1.17 -0.01 0.00 -0.94 0.00 0.00 52.86 50.74 1d3f s ASN 2 Cb 0.00 0.82 0.54 0.00 -2.00 0.00 0.00 41.25 40.61 1d3f s ASN 2 CO 0.00 -1.61 1.74 -0.29 -2.94 0.00 0.00 177.10 174.00 1d3f h ILE 3 N 2.02 0.67 -0.15 0.54 6.09 -1.98 0.24 117.51 124.94 1d3f h ILE 3 Ca -0.31 -0.18 -0.02 0.00 -1.37 0.00 0.00 64.86 62.98 1d3f h ILE 3 Cb 1.25 0.08 -0.01 0.00 0.47 0.00 0.00 36.82 38.62 1d3f h ILE 3 CO 0.39 0.10 0.03 -0.26 -3.07 0.00 0.00 178.15 175.35 1d3f h PHE 4 N 0.54 0.26 -0.20 2.19 -1.00 -1.98 0.25 116.94 117.00 1d3f h PHE 4 Ca 0.46 -0.03 -0.09 0.00 2.81 0.00 0.00 57.97 61.13 1d3f h PHE 4 Cb 0.71 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 40.18 1d3f h PHE 4 CO -0.12 0.40 -0.25 0.93 -1.61 0.00 0.00 178.31 177.65 1d3f h GLU 5 N 0.05 0.37 0.21 1.51 5.08 -1.78 0.37 114.58 120.39 1d3f h GLU 5 Ca 0.05 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1d3f h GLU 5 Cb 0.27 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1d3f h GLU 5 CO 0.00 0.60 -0.10 1.98 -1.00 0.00 0.00 179.01 180.49 1d3f h MET 6 N 0.33 -0.28 -0.09 2.33 4.05 -0.20 -2.18 114.93 118.89 1d3f h MET 6 Ca 0.05 0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.45 1d3f h MET 6 Cb 0.63 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.48 1d3f h MET 6 CO 0.04 0.08 -0.14 -0.07 0.23 0.00 0.00 176.91 177.05 1d3f h LEU 7 N -0.69 0.14 -1.32 3.39 3.38 -0.44 -1.73 115.31 118.03 1d3f h LEU 7 Ca -0.03 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1d3f h LEU 7 Cb 0.48 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1d3f h LEU 7 CO 0.05 0.30 -0.14 -0.09 0.09 0.00 0.00 178.44 178.65 1d3f h ARG 8 N 0.14 0.29 -0.04 1.13 9.65 -0.77 -0.66 114.38 124.12 1d3f h ARG 8 Ca 0.03 -0.07 -0.01 0.00 -1.10 0.00 0.00 59.98 58.83 1d3f h ARG 8 Cb 0.35 -0.04 -0.00 0.00 -1.39 0.00 0.00 29.97 28.89 1d3f h ARG 8 CO 0.02 0.43 -0.02 0.82 2.80 0.00 0.00 179.97 184.02 1d3f h ILE 9 N 0.27 1.32 0.00 1.20 2.04 -0.68 -1.82 117.51 119.84 1d3f h ILE 9 Ca 0.05 -0.99 -0.08 0.00 1.00 0.00 0.00 64.86 64.84 1d3f h ILE 9 Cb 0.41 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.38 1d3f h ILE 9 CO 0.02 0.27 -0.38 0.44 0.00 0.00 0.00 178.15 178.50 1d3f h ASP 10 N -0.29 0.00 0.00 1.72 3.32 -0.98 -3.32 116.42 116.88 1d3f h ASP 10 Ca 0.01 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 1d3f h ASP 10 Cb 0.44 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.97 1d3f h ASP 10 CO 0.01 0.38 -1.93 -0.62 -1.72 0.00 0.00 179.24 175.36 1d3f n GLU 11 N -3.83 0.92 -0.01 3.56 -0.58 -0.29 -5.09 120.64 115.31 1d3f n GLU 11 Ca -0.01 -0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.64 1d3f n GLU 11 Cb 0.45 -1.41 -0.00 0.00 -0.57 0.00 0.00 31.44 29.91 1d3f n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d3f n GLY 12 N 1.75 -1.82 2.79 0.62 0.00 -0.68 -4.35 105.19 103.48 1d3f n GLY 12 Ca -0.14 -1.32 -0.18 0.00 0.00 0.00 0.00 46.02 44.38 1d3f n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1d3f s LEU 13 N 0.00 -0.01 -0.06 0.99 2.96 -1.26 -4.40 118.68 116.90 1d3f s LEU 13 Ca 0.00 0.26 0.02 0.00 -0.22 0.00 0.00 54.13 54.19 1d3f s LEU 13 Cb 0.00 0.16 0.02 0.00 0.50 0.00 0.00 46.19 46.87 1d3f s LEU 13 CO 0.00 -0.25 -0.09 -0.13 -1.32 0.00 0.00 176.35 174.57 1d3f s ARG 14 N 2.25 1.30 0.00 1.98 0.52 -0.48 -4.99 118.95 119.53 1d3f s ARG 14 Ca 0.04 -0.27 0.27 0.00 -0.52 0.00 0.00 55.73 55.25 1d3f s ARG 14 Cb -0.12 -1.16 0.87 0.00 0.52 0.00 0.00 34.95 35.07 1d3f s ARG 14 CO -0.05 -0.03 1.64 1.28 0.02 0.00 0.00 175.30 178.16 1d3f n LEU 15 N 3.96 1.69 -4.31 2.53 4.77 -1.26 0.89 117.00 125.28 1d3f n LEU 15 Ca -0.23 -0.56 -0.26 0.00 -0.03 0.00 0.00 56.01 54.93 1d3f n LEU 15 Cb 0.51 -0.01 -0.13 0.00 -2.33 0.00 0.00 43.42 41.46 1d3f n LEU 15 CO 0.24 0.28 -0.54 -0.75 -1.33 0.00 0.00 177.39 175.30 1d3f s LYS 16 N -2.05 1.29 0.40 3.23 2.47 -1.26 -2.08 119.74 121.73 1d3f s LYS 16 Ca 0.35 -1.17 -0.24 0.00 -1.56 0.00 0.00 55.97 53.35 1d3f s LYS 16 Cb 0.21 -1.58 -0.11 0.00 -1.46 0.00 0.00 37.83 34.88 1d3f s LYS 16 CO 0.35 0.38 0.92 -0.89 0.16 0.00 0.00 175.35 176.27 1d3f n ILE 17 N 1.23 2.28 -4.13 5.43 5.41 -0.95 -4.71 119.36 123.92 1d3f n ILE 17 Ca -0.19 -0.50 -0.16 0.00 1.00 0.00 0.00 62.75 62.90 1d3f n ILE 17 Cb 0.53 -1.01 -0.05 0.00 -0.71 0.00 0.00 39.64 38.41 1d3f n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1d3f s TYR 18 N -1.28 1.24 -0.14 1.39 -0.85 0.13 -4.95 117.35 112.89 1d3f s TYR 18 Ca 0.63 -1.40 -0.05 0.00 -0.52 0.00 0.00 57.07 55.73 1d3f s TYR 18 Cb -0.59 -0.20 -0.03 0.00 0.38 0.00 0.00 41.96 41.51 1d3f s TYR 18 CO 0.57 -1.12 0.01 0.15 -1.52 0.00 0.00 175.55 173.65 1d3f s LYS 19 N -3.02 3.58 0.38 -3.49 1.02 -1.26 0.40 119.74 117.36 1d3f s LYS 19 Ca 0.33 -0.41 -0.06 0.00 0.02 0.00 0.00 55.97 55.84 1d3f s LYS 19 Cb -0.00 -2.99 0.09 0.00 -0.52 0.00 0.00 37.83 34.40 1d3f s LYS 19 CO 0.23 0.40 0.47 -0.40 -0.92 0.00 0.00 175.35 175.12 1d3f n ASP 20 N 3.09 -0.32 0.28 2.83 5.68 0.22 -4.77 116.55 123.56 1d3f n ASP 20 Ca -0.17 -1.07 0.16 0.00 -0.50 0.00 0.00 54.79 53.21 1d3f n ASP 20 Cb 0.53 -0.37 0.92 0.00 -1.14 0.00 0.00 41.12 41.06 1d3f n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1d3f h THR 21 N -1.45 0.45 -0.22 2.12 1.35 -1.99 1.00 112.91 114.17 1d3f h THR 21 Ca -0.16 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1d3f h THR 21 Cb 0.44 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1d3f h THR 21 CO 0.11 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.76 1d3f n GLU 22 N -3.74 2.08 -0.88 4.72 -0.58 -1.26 -4.94 120.64 116.04 1d3f n GLU 22 Ca -0.02 -1.61 0.00 0.00 -0.42 0.00 0.00 57.16 55.11 1d3f n GLU 22 Cb 0.15 -1.45 0.00 0.00 -0.57 0.00 0.00 31.44 29.57 1d3f n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d3f n GLY 23 N 1.30 0.46 3.92 0.62 0.00 0.35 -5.06 105.19 106.76 1d3f n GLY 23 Ca 0.17 -0.95 -0.29 0.00 0.00 0.00 0.00 46.02 44.95 1d3f n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d3f s TYR 24 N -2.00 3.49 0.10 1.61 4.12 -1.26 -4.63 117.35 118.78 1d3f s TYR 24 Ca 0.00 0.38 -0.31 0.00 0.02 0.00 0.00 57.07 57.16 1d3f s TYR 24 Cb 0.00 -1.87 -0.08 0.00 -1.52 0.00 0.00 41.96 38.49 1d3f s TYR 24 CO 0.00 0.43 1.48 0.71 0.02 0.00 0.00 175.55 178.19 1d3f s TYR 25 N -1.75 2.99 0.20 2.71 4.12 -1.18 0.68 117.35 125.13 1d3f s TYR 25 Ca 0.38 0.74 -0.02 0.00 0.02 0.00 0.00 57.07 58.19 1d3f s TYR 25 Cb -0.12 -3.79 -0.04 0.00 -1.52 0.00 0.00 41.96 36.50 1d3f s TYR 25 CO 0.28 -2.90 0.17 0.99 0.02 0.00 0.00 175.55 174.11 1d3f s THR 26 N 1.60 0.01 0.23 -0.71 2.01 0.16 0.36 115.64 119.30 1d3f s THR 26 Ca 0.67 -1.92 -0.20 0.00 0.31 0.00 0.00 61.69 60.55 1d3f s THR 26 Cb -0.38 -2.42 0.03 0.00 0.01 0.00 0.00 72.50 69.74 1d3f s THR 26 CO 0.30 -0.04 0.63 -0.51 -0.69 0.00 0.00 174.62 174.32 1d3f s ILE 27 N -4.13 0.01 0.00 1.82 2.07 -0.58 0.22 121.20 120.60 1d3f s ILE 27 Ca 0.36 -0.70 0.00 0.00 -1.41 0.00 0.00 60.65 58.90 1d3f s ILE 27 Cb 0.06 -1.64 0.00 0.00 0.13 0.00 0.00 42.46 41.01 1d3f s ILE 27 CO 0.11 -0.03 0.00 0.61 -1.91 0.00 0.00 174.94 173.72 1d3f n GLY 28 N -0.41 1.51 3.15 1.50 0.00 0.26 -1.62 105.19 109.58 1d3f n GLY 28 Ca -0.09 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 1d3f n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1d3f n ILE 29 N 0.00 3.90 -1.54 -0.61 5.41 -1.26 -1.38 119.36 123.87 1d3f n ILE 29 Ca 0.00 -5.34 -0.14 0.00 1.00 0.00 0.00 62.75 58.27 1d3f n ILE 29 Cb 0.00 -2.41 -0.05 0.00 -0.71 0.00 0.00 39.64 36.47 1d3f n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1d3f n GLY 30 N 2.24 1.22 3.56 7.39 0.00 -1.24 -4.91 105.19 113.44 1d3f n GLY 30 Ca 0.24 -0.35 -0.43 0.00 0.00 0.00 0.00 46.02 45.48 1d3f n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1d3f s HIS 31 N -2.55 2.84 0.17 1.61 5.04 -0.64 -4.90 115.29 116.85 1d3f s HIS 31 Ca 0.00 0.29 -0.31 0.00 -1.54 0.00 0.00 55.06 53.50 1d3f s HIS 31 Cb 0.00 -4.10 -0.10 0.00 0.04 0.00 0.00 32.58 28.42 1d3f s HIS 31 CO 0.00 -1.25 1.52 -1.17 -2.34 0.00 0.00 174.74 171.50 1d3f s LEU 32 N 4.00 4.37 -0.26 8.88 2.96 -1.26 -1.53 118.68 135.85 1d3f s LEU 32 Ca 0.36 2.57 -0.09 0.00 -0.22 0.00 0.00 54.13 56.76 1d3f s LEU 32 Cb -0.10 -3.60 -0.15 0.00 0.50 0.00 0.00 46.19 42.84 1d3f s LEU 32 CO 0.25 -0.77 -0.22 0.18 -1.32 0.00 0.00 176.35 174.46 1d3f n LEU 33 N 3.73 2.34 -3.51 -0.68 4.77 0.16 -4.94 117.00 118.85 1d3f n LEU 33 Ca 0.12 0.18 -0.14 0.00 -0.03 0.00 0.00 56.01 56.14 1d3f n LEU 33 Cb 0.39 -0.88 -0.05 0.00 -2.33 0.00 0.00 43.42 40.56 1d3f n LEU 33 CO 0.61 0.69 0.54 0.28 -1.33 0.00 0.00 177.39 178.17 1d3f s THR 34 N -2.50 0.00 -0.95 -5.08 -1.32 -1.16 -4.93 115.64 99.70 1d3f s THR 34 Ca -0.36 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 60.36 1d3f s THR 34 Cb 0.12 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 70.02 1d3f s THR 34 CO 0.55 0.00 1.19 0.29 -2.21 0.00 0.00 174.62 174.44 1d3f n LYS 35 N 0.48 0.04 -1.60 7.08 5.02 -1.26 -3.09 118.16 124.84 1d3f n LYS 35 Ca -0.15 -0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.81 1d3f n LYS 35 Cb 0.59 -1.51 0.06 0.00 -0.02 0.00 0.00 35.03 34.15 1d3f n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1d3f s SER 36 N -3.11 4.93 0.09 4.39 0.15 -1.26 -4.89 113.70 113.98 1d3f s SER 36 Ca 0.09 1.93 0.28 0.00 0.70 0.00 0.00 55.95 58.95 1d3f s SER 36 Cb 0.17 -2.54 1.04 0.00 -1.71 0.00 0.00 66.02 62.97 1d3f s SER 36 CO 0.77 -1.75 1.85 -2.65 1.20 0.00 0.00 173.24 172.66 1d3f n PRO 37 N -2.78 0.11 -2.84 5.44 -0.02 -1.26 -4.70 135.00 128.95 1d3f n PRO 37 Ca 0.10 0.09 -0.42 0.00 -2.02 0.00 0.00 63.50 61.25 1d3f n PRO 37 Cb 0.52 -1.62 -0.04 0.00 -0.02 0.00 0.00 33.50 32.34 1d3f n PRO 37 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1d3f s SER 38 N -3.63 7.05 0.50 2.55 0.15 -1.26 -4.91 113.70 114.14 1d3f s SER 38 Ca 0.12 1.28 0.25 0.00 0.70 0.00 0.00 55.95 58.31 1d3f s SER 38 Cb 0.16 -2.48 1.30 0.00 -1.71 0.00 0.00 66.02 63.29 1d3f s SER 38 CO 0.56 -0.39 2.02 0.25 1.20 0.00 0.00 173.24 176.89 1d3f h LEU 39 N 8.08 0.00 0.13 3.45 5.85 -1.99 -1.81 115.31 129.02 1d3f h LEU 39 Ca -0.31 0.00 -0.25 0.00 0.84 0.00 0.00 57.88 58.17 1d3f h LEU 39 Cb 1.14 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.20 1d3f h LEU 39 CO 0.83 0.15 -1.04 0.78 -0.34 0.00 0.00 178.44 178.83 1d3f h ASN 40 N 0.00 0.70 -0.92 1.25 2.35 -1.98 0.15 115.58 117.13 1d3f h ASN 40 Ca -0.00 -0.87 0.15 0.00 -0.55 0.00 0.00 56.30 55.03 1d3f h ASN 40 Cb 0.39 -0.22 -0.08 0.00 0.05 0.00 0.00 38.32 38.47 1d3f h ASN 40 CO 0.02 1.50 0.59 0.00 -1.65 0.00 0.00 177.43 177.88 1d3f h ALA 41 N 0.21 1.81 -0.31 -0.83 0.00 -1.81 0.39 119.26 118.73 1d3f h ALA 41 Ca -0.17 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1d3f h ALA 41 Cb 1.77 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1d3f h ALA 41 CO 0.20 -0.07 -0.01 0.00 0.00 0.00 0.00 179.25 179.36 1d3f h ALA 42 N 1.60 0.42 -0.66 0.00 0.00 -1.05 -1.43 119.26 118.13 1d3f h ALA 42 Ca 0.47 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1d3f h ALA 42 Cb 0.75 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1d3f h ALA 42 CO -0.23 0.18 0.24 0.87 0.00 0.00 0.00 179.25 180.31 1d3f h LYS 43 N 0.34 0.99 -0.47 0.00 1.57 0.12 0.09 116.57 119.22 1d3f h LYS 43 Ca 0.09 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.66 1d3f h LYS 43 Cb 0.46 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 1d3f h LYS 43 CO 0.02 0.83 0.20 1.03 -0.57 0.00 0.00 179.45 180.95 1d3f h SER 44 N 0.97 0.64 -0.38 0.86 0.87 -0.11 -1.09 113.55 115.30 1d3f h SER 44 Ca 0.22 -0.16 -0.08 0.00 -1.23 0.00 0.00 61.79 60.54 1d3f h SER 44 Cb 0.22 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.00 1d3f h SER 44 CO -0.02 0.62 -0.05 -0.33 -0.53 0.00 0.00 176.83 176.52 1d3f h GLU 45 N 0.61 0.80 0.06 2.24 4.39 -0.87 -2.21 114.58 119.61 1d3f h GLU 45 Ca 0.16 -0.24 0.01 0.00 0.34 0.00 0.00 59.36 59.63 1d3f h GLU 45 Cb 0.17 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 1d3f h GLU 45 CO -0.01 0.84 -0.14 1.25 -1.16 0.00 0.00 179.01 179.78 1d3f h LEU 46 N 0.73 -0.39 -0.82 1.33 5.85 -0.40 -0.91 115.31 120.71 1d3f h LEU 46 Ca 0.13 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.94 1d3f h LEU 46 Cb 0.52 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 1d3f h LEU 46 CO 0.03 -0.20 0.52 0.44 -0.34 0.00 0.00 178.44 178.88 1d3f h ASP 47 N -0.27 0.86 -0.46 1.25 3.32 -1.06 -0.98 116.42 119.07 1d3f h ASP 47 Ca 0.03 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1d3f h ASP 47 Cb 0.29 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1d3f h ASP 47 CO -0.09 0.58 0.11 0.50 -1.72 0.00 0.00 179.24 178.62 1d3f h LYS 48 N 1.00 0.81 -0.14 3.56 3.64 -1.26 0.71 116.57 124.90 1d3f h LYS 48 Ca 0.33 -0.17 -0.16 0.00 -1.27 0.00 0.00 60.65 59.38 1d3f h LYS 48 Cb 0.03 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1d3f h LYS 48 CO -0.12 0.75 -0.57 0.00 -2.27 0.00 0.00 179.45 177.23 1d3f h ALA 49 N 1.34 0.75 0.00 5.00 0.00 0.11 -3.26 119.26 123.20 1d3f h ALA 49 Ca 0.17 -0.52 -0.22 0.00 0.00 0.00 0.00 54.91 54.33 1d3f h ALA 49 Cb 0.32 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1d3f h ALA 49 CO 0.00 0.70 -1.74 -0.89 0.00 0.00 0.00 179.25 177.32 1d3f n ILE 50 N -3.93 1.22 -1.25 0.00 2.08 -0.66 -5.00 119.36 111.82 1d3f n ILE 50 Ca -0.03 -0.73 0.00 0.00 0.56 0.00 0.00 62.75 62.55 1d3f n ILE 50 Cb 0.61 -0.68 0.00 0.00 -0.75 0.00 0.00 39.64 38.82 1d3f n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1d3f n GLY 51 N 1.50 0.79 3.65 7.39 0.00 0.24 -5.04 105.19 113.72 1d3f n GLY 51 Ca -0.16 -0.66 -0.06 0.00 0.00 0.00 0.00 46.02 45.15 1d3f n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1d3f s ARG 52 N -2.74 1.08 -0.61 1.61 1.70 -0.81 -5.04 118.95 114.14 1d3f s ARG 52 Ca 0.00 -0.53 -0.27 0.00 -0.47 0.00 0.00 55.73 54.46 1d3f s ARG 52 Cb 0.00 0.41 0.04 0.00 -0.57 0.00 0.00 34.95 34.83 1d3f s ARG 52 CO 0.00 -0.49 1.14 1.21 -1.08 0.00 0.00 175.30 176.08 1d3f s ASN 53 N -2.76 6.34 -0.12 -2.89 2.47 -1.26 -4.29 114.94 112.43 1d3f s ASN 53 Ca 0.09 -0.19 0.19 0.00 0.42 0.00 0.00 52.86 53.36 1d3f s ASN 53 Cb -0.01 -2.52 -0.26 0.00 -1.45 0.00 0.00 41.25 37.01 1d3f s ASN 53 CO -0.03 -1.50 0.29 0.35 -3.72 0.00 0.00 177.10 172.49 1d3f n THR 54 N 6.45 1.04 -3.40 -5.21 -2.24 -1.26 -5.01 114.28 104.65 1d3f n THR 54 Ca 0.05 -0.75 -0.19 0.00 -2.27 0.00 0.00 64.05 60.89 1d3f n THR 54 Cb 0.48 -0.41 0.08 0.00 -2.10 0.00 0.00 70.33 68.38 1d3f n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1d3f n ASN 55 N -2.66 -4.24 0.00 3.42 5.15 -1.26 -3.35 115.26 112.32 1d3f n ASN 55 Ca -0.22 -0.52 0.00 0.00 -0.60 0.00 0.00 54.58 53.24 1d3f n ASN 55 Cb 0.97 -4.61 0.00 0.00 -0.53 0.00 0.00 39.78 35.61 1d3f n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1d3f n GLY 56 N -1.54 0.12 3.25 8.20 0.00 -1.26 -4.99 105.19 108.97 1d3f n GLY 56 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.70 1d3f n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d3f s VAL 57 N -1.25 1.47 0.21 1.61 1.01 -1.21 -2.25 120.40 119.99 1d3f s VAL 57 Ca 0.00 -1.58 -0.04 0.00 0.00 0.00 0.00 61.98 60.36 1d3f s VAL 57 Cb 0.00 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 1d3f s VAL 57 CO 0.00 -0.23 0.23 0.00 0.00 0.00 0.00 175.10 175.10 1d3f s MET 58 N -2.18 1.29 0.39 2.72 0.23 -0.89 -4.81 119.30 116.05 1d3f s MET 58 Ca 0.06 -1.51 0.07 0.00 -1.03 0.00 0.00 55.69 53.28 1d3f s MET 58 Cb -0.08 0.33 0.00 0.00 -1.53 0.00 0.00 34.83 33.55 1d3f s MET 58 CO 0.04 -0.46 0.54 0.95 -2.03 0.00 0.00 175.02 174.06 1d3f s THR 59 N -4.11 3.51 0.16 3.16 -4.23 -1.26 -4.82 115.64 108.04 1d3f s THR 59 Ca 0.33 -0.96 -0.16 0.00 -1.18 0.00 0.00 61.69 59.73 1d3f s THR 59 Cb 0.05 -3.21 0.04 0.00 1.34 0.00 0.00 72.50 70.72 1d3f s THR 59 CO 0.11 -0.09 1.75 0.50 -0.54 0.00 0.00 174.62 176.35 1d3f h LYS 60 N 0.71 0.27 -0.49 3.99 3.64 -1.98 0.21 116.57 122.92 1d3f h LYS 60 Ca -0.43 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 58.99 1d3f h LYS 60 Cb 1.27 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.98 1d3f h LYS 60 CO 0.49 0.18 0.22 -0.44 -2.27 0.00 0.00 179.45 177.63 1d3f h ASP 61 N 0.28 0.29 -0.40 4.20 5.19 -1.98 0.12 116.42 124.11 1d3f h ASP 61 Ca 0.18 0.04 -0.03 0.00 -0.62 0.00 0.00 57.03 56.60 1d3f h ASP 61 Cb 0.16 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.65 1d3f h ASP 61 CO -0.19 0.20 0.14 -0.33 -3.12 0.00 0.00 179.24 175.94 1d3f h GLU 62 N 0.43 0.61 -0.54 3.56 5.08 -1.64 -0.48 114.58 121.60 1d3f h GLU 62 Ca 0.22 -0.12 0.04 0.00 -1.00 0.00 0.00 59.36 58.51 1d3f h GLU 62 Cb 0.17 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 1d3f h GLU 62 CO -0.19 0.59 0.28 0.00 -1.00 0.00 0.00 179.01 178.70 1d3f h ALA 63 N 0.99 0.70 -0.44 3.43 0.00 0.02 -0.40 119.26 123.55 1d3f h ALA 63 Ca 0.13 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1d3f h ALA 63 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1d3f h ALA 63 CO -0.01 -0.05 0.07 0.93 0.00 0.00 0.00 179.25 180.19 1d3f h GLU 64 N 0.55 0.68 -0.04 0.00 5.08 -0.58 0.38 114.58 120.65 1d3f h GLU 64 Ca 0.24 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1d3f h GLU 64 Cb 0.13 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1d3f h GLU 64 CO -0.15 0.65 0.00 -0.22 -1.00 0.00 0.00 179.01 178.29 1d3f h LYS 65 N 0.66 0.08 -0.53 2.33 3.64 0.17 0.63 116.57 123.54 1d3f h LYS 65 Ca 0.14 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1d3f h LYS 65 Cb 0.31 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.10 1d3f h LYS 65 CO 0.00 0.36 0.34 -0.07 -2.27 0.00 0.00 179.45 177.81 1d3f h LEU 66 N -0.22 0.62 -0.37 5.20 3.38 -0.81 -2.04 115.31 121.07 1d3f h LEU 66 Ca 0.01 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1d3f h LEU 66 Cb 0.33 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1d3f h LEU 66 CO 0.00 0.47 0.13 0.15 0.09 0.00 0.00 178.44 179.28 1d3f h PHE 67 N 0.73 0.57 -0.81 1.13 3.57 -0.42 0.90 116.94 122.61 1d3f h PHE 67 Ca 0.19 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.68 1d3f h PHE 67 Cb -0.06 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.47 1d3f h PHE 67 CO 0.00 0.53 0.54 -0.91 -2.23 0.00 0.00 178.31 176.24 1d3f h ASN 68 N 0.45 0.86 -0.49 0.41 2.35 -0.46 -1.29 115.58 117.41 1d3f h ASN 68 Ca 0.12 -0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.74 1d3f h ASN 68 Cb 0.21 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1d3f h ASN 68 CO -0.01 0.59 -0.16 1.56 -1.65 0.00 0.00 177.43 177.76 1d3f h GLN 69 N 0.99 0.98 -0.70 0.81 4.20 -0.81 -1.55 115.11 119.03 1d3f h GLN 69 Ca 0.33 -0.40 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1d3f h GLN 69 Cb 0.06 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.76 1d3f h GLN 69 CO -0.10 1.07 0.23 -0.44 -0.67 0.00 0.00 178.83 178.92 1d3f h ASP 70 N 0.83 1.02 -0.00 1.46 3.32 -0.19 0.13 116.42 122.99 1d3f h ASP 70 Ca 0.12 -0.20 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 1d3f h ASP 70 Cb 0.73 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.02 1d3f h ASP 70 CO 0.06 0.95 0.00 0.58 -1.72 0.00 0.00 179.24 179.11 1d3f h VAL 71 N 1.03 1.14 -0.50 -1.35 2.07 -1.15 -1.18 116.25 116.30 1d3f h VAL 71 Ca 0.23 -0.40 0.08 0.00 0.82 0.00 0.00 66.70 67.43 1d3f h VAL 71 Cb 0.29 1.40 -0.07 0.00 -1.52 0.00 0.00 31.29 31.40 1d3f h VAL 71 CO -0.01 0.10 0.13 -0.78 0.02 0.00 0.00 177.57 177.03 1d3f h ASP 72 N -0.16 0.07 -0.90 0.57 3.58 -1.12 -1.17 116.42 117.28 1d3f h ASP 72 Ca 0.00 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.53 1d3f h ASP 72 Cb 0.17 0.09 -0.04 0.00 1.72 0.00 0.00 39.33 41.27 1d3f h ASP 72 CO -0.00 0.06 0.54 0.00 -2.88 0.00 0.00 179.24 176.97 1d3f h ALA 73 N 1.37 1.26 -0.58 -0.78 0.00 -0.49 -0.70 119.26 119.35 1d3f h ALA 73 Ca 0.25 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1d3f h ALA 73 Cb 0.31 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1d3f h ALA 73 CO -0.30 0.63 0.30 0.00 0.00 0.00 0.00 179.25 179.89 1d3f h ALA 74 N 1.36 0.74 -0.75 0.00 0.00 -0.08 0.55 119.26 121.07 1d3f h ALA 74 Ca 0.32 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1d3f h ALA 74 Cb -0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1d3f h ALA 74 CO -0.06 0.28 0.36 0.28 0.00 0.00 0.00 179.25 180.11 1d3f h VAL 75 N 0.78 1.24 -0.01 0.00 2.07 -0.81 0.22 116.25 119.74 1d3f h VAL 75 Ca 0.20 -0.69 -0.12 0.00 0.82 0.00 0.00 66.70 66.91 1d3f h VAL 75 Cb 0.08 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1d3f h VAL 75 CO -0.03 0.29 -0.56 0.03 0.02 0.00 0.00 177.57 177.32 1d3f h ARG 76 N 1.06 0.04 -0.51 1.57 3.08 -0.59 0.09 114.38 119.12 1d3f h ARG 76 Ca 0.26 -0.03 -0.12 0.00 0.07 0.00 0.00 59.98 60.16 1d3f h ARG 76 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1d3f h ARG 76 CO -0.03 0.60 -0.16 0.78 -1.07 0.00 0.00 179.97 180.08 1d3f h GLY 77 N 1.65 1.10 0.87 0.04 0.00 0.74 -1.72 103.07 105.74 1d3f h GLY 77 Ca -0.00 -0.93 0.02 0.00 0.00 0.00 0.00 47.33 46.41 1d3f h GLY 77 CO 0.08 0.85 0.17 -2.22 0.00 0.00 0.00 176.54 175.42 1d3f h ILE 78 N 0.88 1.00 0.00 2.60 2.04 0.07 -2.64 117.51 121.46 1d3f h ILE 78 Ca 0.12 -0.12 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 1d3f h ILE 78 Cb 0.74 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1d3f h ILE 78 CO 0.06 0.06 -0.26 -0.07 0.00 0.00 0.00 178.15 177.95 1d3f h LEU 79 N 0.35 0.00 -0.30 1.44 3.38 -0.73 -0.90 115.31 118.55 1d3f h LEU 79 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1d3f h LEU 79 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1d3f h LEU 79 CO -0.09 0.26 -0.18 0.54 0.09 0.00 0.00 178.44 179.06 1d3f n ARG 80 N -3.81 0.67 -3.36 1.13 1.74 -0.67 -4.77 116.66 107.60 1d3f n ARG 80 Ca -0.01 -0.30 -0.39 0.00 -0.77 0.00 0.00 57.85 56.38 1d3f n ARG 80 Cb 0.35 -1.49 -0.08 0.00 -1.02 0.00 0.00 32.46 30.22 1d3f n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1d3f s ASN 81 N -2.53 6.43 0.48 0.55 3.84 -0.35 -4.95 114.94 118.41 1d3f s ASN 81 Ca 0.26 0.51 0.32 0.00 0.21 0.00 0.00 52.86 54.16 1d3f s ASN 81 Cb 0.20 -2.24 1.47 0.00 -0.55 0.00 0.00 41.25 40.12 1d3f s ASN 81 CO 0.51 -0.12 1.96 0.00 -2.79 0.00 0.00 177.10 176.66 1d3f h ALA 82 N 7.52 1.00 0.00 1.71 0.00 -1.89 0.26 119.26 127.87 1d3f h ALA 82 Ca -0.35 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.22 1d3f h ALA 82 Cb 1.16 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 1d3f h ALA 82 CO 0.71 0.00 -2.15 1.63 0.00 0.00 0.00 179.25 179.44 1d3f n LYS 83 N -2.78 0.67 0.07 0.00 4.01 -1.26 -4.53 118.16 114.35 1d3f n LYS 83 Ca 0.00 0.10 -0.23 0.00 -0.51 0.00 0.00 58.31 57.67 1d3f n LYS 83 Cb 0.21 -1.62 -0.15 0.00 -0.51 0.00 0.00 35.03 32.96 1d3f n LYS 83 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1d3f h LEU 84 N 0.00 0.60 -0.72 -0.35 3.38 -1.70 -3.36 115.31 113.16 1d3f h LEU 84 Ca -0.46 -0.92 0.16 0.00 0.09 0.00 0.00 57.88 56.75 1d3f h LEU 84 Cb 2.17 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 42.60 1d3f h LEU 84 CO 0.05 1.72 0.07 0.50 0.09 0.00 0.00 178.44 180.86 1d3f h LYS 85 N -0.01 0.16 -0.12 1.13 3.64 -0.38 0.26 116.57 121.25 1d3f h LYS 85 Ca -0.31 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 58.97 1d3f h LYS 85 Cb 2.01 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.78 1d3f h LYS 85 CO 0.17 0.10 -0.32 -1.35 -2.27 0.00 0.00 179.45 175.78 1d3f h PRO 86 N 0.16 0.23 0.15 1.90 0.11 -1.80 0.23 132.00 132.98 1d3f h PRO 86 Ca 0.40 -0.09 -0.01 0.00 0.11 0.00 0.00 66.00 66.41 1d3f h PRO 86 Cb 0.69 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1d3f h PRO 86 CO -0.58 0.53 -0.07 0.28 -0.21 0.00 0.00 178.00 177.94 1d3f h VAL 87 N 0.20 0.97 -1.00 3.15 2.07 -1.16 -2.51 116.25 117.98 1d3f h VAL 87 Ca 0.03 -0.58 0.10 0.00 0.82 0.00 0.00 66.70 67.08 1d3f h VAL 87 Cb 0.67 1.32 -0.08 0.00 -1.52 0.00 0.00 31.29 31.68 1d3f h VAL 87 CO 0.05 0.13 0.63 0.22 0.02 0.00 0.00 177.57 178.63 1d3f h TYR 88 N -0.49 1.15 -0.02 1.57 3.20 -0.90 -0.97 116.97 120.52 1d3f h TYR 88 Ca -0.02 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1d3f h TYR 88 Cb 0.38 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 1d3f h TYR 88 CO 0.02 0.50 -0.34 -0.44 -1.64 0.00 0.00 178.16 176.26 1d3f h ASP 89 N 1.04 0.04 0.64 -2.11 3.32 -0.36 -2.20 116.42 116.78 1d3f h ASP 89 Ca 0.47 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1d3f h ASP 89 Cb 0.40 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.94 1d3f h ASP 89 CO -0.23 0.37 -0.06 -1.54 -1.72 0.00 0.00 179.24 176.05 1d3f n SER 90 N -4.13 0.14 -4.93 6.45 3.41 -0.39 -4.88 113.62 109.30 1d3f n SER 90 Ca -0.02 -0.07 -0.26 0.00 -0.26 0.00 0.00 58.87 58.27 1d3f n SER 90 Cb 0.38 -0.26 -0.01 0.00 -0.26 0.00 0.00 64.21 64.07 1d3f n SER 90 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1d3f s LEU 91 N -2.70 3.91 0.79 1.04 1.43 -0.83 -5.07 118.68 117.24 1d3f s LEU 91 Ca 0.23 0.63 -0.12 0.00 -1.03 0.00 0.00 54.13 53.84 1d3f s LEU 91 Cb 0.20 -3.51 0.07 0.00 0.03 0.00 0.00 46.19 42.97 1d3f s LEU 91 CO 0.50 -0.36 1.15 1.51 0.23 0.00 0.00 176.35 179.38 1d3f s ASP 92 N -3.92 4.67 0.26 2.29 1.47 -1.26 -4.80 116.67 115.38 1d3f s ASP 92 Ca 0.43 0.93 -0.02 0.00 1.18 0.00 0.00 52.55 55.07 1d3f s ASP 92 Cb -0.10 -1.53 0.47 0.00 -0.34 0.00 0.00 42.92 41.42 1d3f s ASP 92 CO 0.38 -1.82 1.83 0.00 0.68 0.00 0.00 175.17 176.24 1d3f h ALA 93 N -0.99 1.34 0.05 2.11 0.00 -1.98 -0.26 119.26 119.54 1d3f h ALA 93 Ca -0.46 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.47 1d3f h ALA 93 Cb 1.30 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1d3f h ALA 93 CO 0.65 0.18 -0.02 0.28 0.00 0.00 0.00 179.25 180.34 1d3f h VAL 94 N 0.91 1.19 -0.14 0.00 2.07 -1.94 -2.67 116.25 115.68 1d3f h VAL 94 Ca 0.45 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 1d3f h VAL 94 Cb 0.40 1.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1d3f h VAL 94 CO -0.25 0.20 0.03 0.03 0.02 0.00 0.00 177.57 177.60 1d3f h ARG 95 N -0.42 0.20 -0.88 1.57 3.08 -1.77 -1.31 114.38 114.85 1d3f h ARG 95 Ca -0.01 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1d3f h ARG 95 Cb 0.38 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.35 1d3f h ARG 95 CO 0.01 0.20 0.54 0.00 -1.07 0.00 0.00 179.97 179.65 1d3f h ARG 96 N 0.20 1.19 -0.83 0.04 3.08 -0.80 -1.30 114.38 115.96 1d3f h ARG 96 Ca 0.05 -0.10 0.03 0.00 0.07 0.00 0.00 59.98 60.04 1d3f h ARG 96 Cb 0.10 -0.25 -0.05 0.00 0.08 0.00 0.00 29.97 29.85 1d3f h ARG 96 CO -0.00 0.82 0.55 0.00 -1.07 0.00 0.00 179.97 180.27 1d3f h ALA 97 N 1.39 1.49 -0.81 0.04 0.00 -0.91 0.16 119.26 120.61 1d3f h ALA 97 Ca 0.32 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.15 1d3f h ALA 97 Cb -0.07 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.39 1d3f h ALA 97 CO -0.06 0.43 0.35 0.00 0.00 0.00 0.00 179.25 179.97 1d3f h ALA 98 N 1.51 1.06 -0.24 0.00 0.00 -0.91 -1.74 119.26 118.95 1d3f h ALA 98 Ca 0.33 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 1d3f h ALA 98 Cb 0.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1d3f h ALA 98 CO -0.10 0.66 -0.39 1.25 0.00 0.00 0.00 179.25 180.68 1d3f h LEU 99 N 1.18 0.58 -0.54 0.00 5.85 -0.37 -2.46 115.31 119.55 1d3f h LEU 99 Ca 0.27 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1d3f h LEU 99 Cb 0.19 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1d3f h LEU 99 CO -0.03 0.91 0.28 0.40 -0.34 0.00 0.00 178.44 179.66 1d3f h ILE 100 N 0.45 1.19 -0.34 4.05 2.04 -0.29 -1.60 117.51 123.01 1d3f h ILE 100 Ca 0.04 -0.49 0.06 0.00 1.00 0.00 0.00 64.86 65.47 1d3f h ILE 100 Cb 0.88 0.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.44 1d3f h ILE 100 CO 0.08 0.20 -0.01 -1.13 0.00 0.00 0.00 178.15 177.29 1d3f h ASN 101 N 0.72 -0.15 -0.67 1.72 -0.73 -1.21 0.53 115.58 115.79 1d3f h ASN 101 Ca 0.19 0.08 -0.00 0.00 1.87 0.00 0.00 56.30 58.43 1d3f h ASN 101 Cb 0.07 0.15 -0.03 0.00 0.27 0.00 0.00 38.32 38.77 1d3f h ASN 101 CO -0.03 -0.04 0.40 0.24 -0.37 0.00 0.00 177.43 177.63 1d3f h MET 102 N 0.09 0.91 -0.86 6.67 2.86 -1.08 -1.80 114.93 121.72 1d3f h MET 102 Ca 0.17 -0.08 -0.02 0.00 -2.06 0.00 0.00 59.70 57.71 1d3f h MET 102 Cb 0.23 -0.19 -0.04 0.00 0.06 0.00 0.00 31.60 31.66 1d3f h MET 102 CO -0.29 0.65 0.47 0.28 1.06 0.00 0.00 176.91 179.08 1d3f h VAL 103 N 0.91 1.25 -0.85 -2.22 2.07 -0.21 0.11 116.25 117.30 1d3f h VAL 103 Ca 0.24 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 1d3f h VAL 103 Cb -0.02 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 29.81 1d3f h VAL 103 CO -0.04 0.28 0.44 0.15 0.02 0.00 0.00 177.57 178.41 1d3f h PHE 104 N 1.20 1.20 0.09 1.57 3.57 0.41 0.32 116.94 125.29 1d3f h PHE 104 Ca 0.30 -0.04 -0.25 0.00 3.53 0.00 0.00 57.97 61.50 1d3f h PHE 104 Cb 0.03 -0.38 -0.00 0.00 2.79 0.00 0.00 35.95 38.39 1d3f h PHE 104 CO 0.01 0.85 -1.14 0.37 -2.23 0.00 0.00 178.31 176.17 1d3f h GLN 105 N 1.21 0.26 0.00 1.11 4.15 -0.83 -3.39 115.11 117.61 1d3f h GLN 105 Ca 0.30 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 59.32 1d3f h GLN 105 Cb 0.08 0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.91 1d3f h GLN 105 CO -0.04 1.16 0.00 0.00 -1.93 0.00 0.00 178.83 178.01 1d3f n MET 106 N -3.56 1.44 0.00 1.69 0.00 0.32 -5.11 117.12 111.89 1d3f n MET 106 Ca -0.07 -0.32 0.00 0.00 0.00 0.00 0.00 57.70 57.31 1d3f n MET 106 Cb 0.97 -0.81 0.00 0.00 0.00 0.00 0.00 33.22 33.38 1d3f n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1d3f n GLY 107 N 0.30 -2.79 0.30 3.17 0.00 0.11 -3.55 105.19 102.73 1d3f n GLY 107 Ca 0.00 -1.29 0.01 0.00 0.00 0.00 0.00 46.02 44.74 1d3f n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1d3f h GLU 108 N 0.00 0.82 -0.45 1.61 4.81 -1.92 -1.35 114.58 118.09 1d3f h GLU 108 Ca 0.00 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 1d3f h GLU 108 Cb 0.00 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.18 1d3f h GLU 108 CO 0.00 0.54 0.14 1.15 -0.73 0.00 0.00 179.01 180.12 1d3f h THR 109 N 0.85 1.22 -0.12 0.32 2.02 -1.96 0.20 112.91 115.44 1d3f h THR 109 Ca 0.36 -0.74 0.02 0.00 0.77 0.00 0.00 66.41 66.83 1d3f h THR 109 Cb 0.24 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.47 1d3f h THR 109 CO -0.20 0.27 -0.02 1.23 0.37 0.00 0.00 175.52 177.17 1d3f h GLY 110 N 0.60 0.09 1.06 2.16 0.00 -1.34 -2.83 103.07 102.82 1d3f h GLY 110 Ca 0.15 0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.40 1d3f h GLY 110 CO -0.00 -0.04 -0.14 -2.08 0.00 0.00 0.00 176.54 174.28 1d3f h VAL 111 N 0.01 1.27 0.00 4.60 2.07 -1.07 -2.40 116.25 120.73 1d3f h VAL 111 Ca 0.05 -1.28 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1d3f h VAL 111 Cb 0.08 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1d3f h VAL 111 CO -0.11 0.44 0.14 0.00 0.02 0.00 0.00 177.57 178.06 1d3f h ALA 112 N 0.88 1.14 0.00 1.67 0.00 -0.42 -1.70 119.26 120.83 1d3f h ALA 112 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1d3f h ALA 112 Cb 0.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1d3f h ALA 112 CO 0.05 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.57 1d3f n GLY 113 N -1.14 -1.20 2.54 0.00 0.00 -0.90 -4.10 105.19 100.39 1d3f n GLY 113 Ca -0.03 -0.08 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1d3f n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1d3f n PHE 114 N -1.48 2.22 -0.21 1.61 3.01 -0.64 -4.75 117.46 117.22 1d3f n PHE 114 Ca 0.06 -2.37 -0.02 0.00 1.01 0.00 0.00 57.45 56.12 1d3f n PHE 114 Cb 0.24 -1.52 0.04 0.00 -0.01 0.00 0.00 39.48 38.24 1d3f n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1d3f h THR 115 N 2.25 0.28 -0.76 4.37 2.02 -1.83 0.64 112.91 119.87 1d3f h THR 115 Ca 0.54 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.68 1d3f h THR 115 Cb 0.46 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 1d3f h THR 115 CO 1.19 0.00 0.32 0.78 0.37 0.00 0.00 175.52 178.18 1d3f h ASN 116 N -0.07 1.02 -0.42 4.18 2.35 -1.95 -1.56 115.58 119.12 1d3f h ASN 116 Ca 0.28 -0.14 -0.12 0.00 -0.55 0.00 0.00 56.30 55.76 1d3f h ASN 116 Cb 0.51 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1d3f h ASN 116 CO -0.67 0.89 -0.22 0.28 -1.65 0.00 0.00 177.43 176.06 1d3f h SER 117 N 1.09 0.91 -0.53 5.81 0.02 -1.47 -2.03 113.55 117.36 1d3f h SER 117 Ca 0.26 -0.41 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1d3f h SER 117 Cb 0.17 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.42 1d3f h SER 117 CO -0.03 1.12 0.29 -0.07 -1.14 0.00 0.00 176.83 177.01 1d3f h LEU 118 N 0.71 0.43 -0.99 5.07 3.38 -0.82 0.44 115.31 123.53 1d3f h LEU 118 Ca 0.09 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1d3f h LEU 118 Cb 0.79 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 1d3f h LEU 118 CO 0.06 0.30 0.25 -0.09 0.09 0.00 0.00 178.44 179.05 1d3f h ARG 119 N 0.56 0.97 -0.42 1.13 2.43 -1.03 0.56 114.38 118.58 1d3f h ARG 119 Ca 0.23 -0.17 -0.12 0.00 -0.81 0.00 0.00 59.98 59.11 1d3f h ARG 119 Cb 0.10 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.47 1d3f h ARG 119 CO -0.14 0.80 -0.22 0.52 -1.51 0.00 0.00 179.97 179.42 1d3f h MET 120 N 0.95 0.84 -0.37 0.20 2.86 -0.60 -0.56 114.93 118.26 1d3f h MET 120 Ca 0.22 -0.35 -0.12 0.00 -2.06 0.00 0.00 59.70 57.39 1d3f h MET 120 Cb 0.21 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.82 1d3f h MET 120 CO -0.02 0.98 -0.27 -0.07 1.06 0.00 0.00 176.91 178.59 1d3f h LEU 121 N 0.73 0.78 -1.81 1.22 3.38 0.84 -1.94 115.31 118.51 1d3f h LEU 121 Ca 0.10 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.77 1d3f h LEU 121 Cb 0.76 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1d3f h LEU 121 CO 0.06 1.01 0.14 -0.61 0.09 0.00 0.00 178.44 179.13 1d3f h GLN 122 N 0.65 0.25 -0.01 1.13 4.15 -0.30 -0.40 115.11 120.58 1d3f h GLN 122 Ca 0.08 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1d3f h GLN 122 Cb 0.79 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.43 1d3f h GLN 122 CO 0.07 0.16 -0.07 1.04 -1.93 0.00 0.00 178.83 178.10 1d3f n GLN 123 N -4.51 1.19 -2.77 1.69 6.02 -0.28 -4.91 117.38 113.82 1d3f n GLN 123 Ca 0.00 -0.55 -0.16 0.00 -0.01 0.00 0.00 57.00 56.29 1d3f n GLN 123 Cb 0.09 -1.49 0.02 0.00 1.02 0.00 0.00 30.24 29.89 1d3f n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1d3f n LYS 124 N -0.42 -3.34 -3.02 -1.09 5.02 -0.16 -4.95 118.16 110.20 1d3f n LYS 124 Ca 0.18 0.64 -0.44 0.00 -2.02 0.00 0.00 58.31 56.67 1d3f n LYS 124 Cb 0.29 -4.93 0.00 0.00 -0.02 0.00 0.00 35.03 30.38 1d3f n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1d3f n ARG 125 N -3.01 3.84 0.20 1.97 1.74 -0.81 -4.89 116.66 115.71 1d3f n ARG 125 Ca -0.08 -4.26 -0.15 0.00 -0.77 0.00 0.00 57.85 52.58 1d3f n ARG 125 Cb 0.59 -2.67 -0.08 0.00 -1.02 0.00 0.00 32.46 29.28 1d3f n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1d3f h TRP 126 N 6.19 -1.00 -0.78 -1.55 -0.00 -1.90 -0.10 115.95 116.82 1d3f h TRP 126 Ca 0.24 0.01 -0.02 0.00 -0.00 0.00 0.00 58.89 59.12 1d3f h TRP 126 Cb 0.75 0.40 -0.04 0.00 -0.00 0.00 0.00 29.16 30.27 1d3f h TRP 126 CO 0.97 -0.50 0.41 -0.44 -0.00 0.00 0.00 178.44 178.87 1d3f h ASP 127 N -0.72 0.98 -0.61 -3.49 5.19 -1.90 -1.87 116.42 114.01 1d3f h ASP 127 Ca -0.01 -0.11 -0.09 0.00 -0.62 0.00 0.00 57.03 56.19 1d3f h ASP 127 Cb 0.67 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.90 1d3f h ASP 127 CO -0.10 0.81 0.01 -0.33 -3.12 0.00 0.00 179.24 176.52 1d3f h GLU 128 N 1.08 1.08 -0.58 3.56 5.08 -1.93 -2.47 114.58 120.40 1d3f h GLU 128 Ca 0.27 -0.33 -0.08 0.00 -1.00 0.00 0.00 59.36 58.22 1d3f h GLU 128 Cb 0.06 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.18 1d3f h GLU 128 CO -0.04 1.04 0.05 0.00 -1.00 0.00 0.00 179.01 179.06 1d3f h ALA 129 N 1.01 0.99 -0.62 3.43 0.00 -0.86 -1.76 119.26 121.46 1d3f h ALA 129 Ca 0.18 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1d3f h ALA 129 Cb 0.54 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1d3f h ALA 129 CO 0.03 0.63 0.33 0.00 0.00 0.00 0.00 179.25 180.23 1d3f h ALA 130 N 1.15 1.42 0.07 0.00 0.00 -1.01 0.67 119.26 121.56 1d3f h ALA 130 Ca 0.17 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1d3f h ALA 130 Cb 0.46 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1d3f h ALA 130 CO 0.02 0.47 -0.04 0.28 0.00 0.00 0.00 179.25 179.98 1d3f h VAL 131 N 0.86 1.13 -0.85 0.00 2.07 -1.22 -2.57 116.25 115.68 1d3f h VAL 131 Ca 0.22 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1d3f h VAL 131 Cb 0.03 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 1d3f h VAL 131 CO -0.03 0.19 0.56 -1.13 0.02 0.00 0.00 177.57 177.17 1d3f h ASN 132 N -0.44 0.97 -0.70 0.57 -0.73 -0.77 -2.41 115.58 112.07 1d3f h ASN 132 Ca -0.01 -0.02 0.03 0.00 1.87 0.00 0.00 56.30 58.17 1d3f h ASN 132 Cb 0.38 -0.24 -0.04 0.00 0.27 0.00 0.00 38.32 38.69 1d3f h ASN 132 CO 0.02 0.70 0.46 -0.07 -0.37 0.00 0.00 177.43 178.17 1d3f h LEU 133 N 1.14 0.73 -1.89 0.34 3.38 0.48 -2.43 115.31 117.07 1d3f h LEU 133 Ca 0.31 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.27 1d3f h LEU 133 Cb -0.12 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.46 1d3f h LEU 133 CO -0.07 0.51 0.00 0.00 0.09 0.00 0.00 178.44 178.97 1d3f h ALA 134 N 1.59 1.00 -1.41 1.53 0.00 -1.02 -3.33 119.26 117.62 1d3f h ALA 134 Ca 0.28 0.00 -0.76 0.00 0.00 0.00 0.00 54.91 54.43 1d3f h ALA 134 Cb 0.05 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.66 1d3f h ALA 134 CO -0.08 0.00 1.56 1.63 0.00 0.00 0.00 179.25 182.36 1d3f n LYS 135 N -2.87 3.58 -3.52 0.00 5.02 -0.92 -4.64 118.16 114.81 1d3f n LYS 135 Ca -0.01 -3.80 -0.16 0.00 -2.02 0.00 0.00 58.31 52.33 1d3f n LYS 135 Cb 0.18 -2.92 -0.05 0.00 -0.02 0.00 0.00 35.03 32.22 1d3f n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1d3f s SER 136 N 1.49 -0.57 0.22 4.39 1.04 -1.25 -5.02 113.70 114.00 1d3f s SER 136 Ca 0.40 0.43 -0.08 0.00 0.48 0.00 0.00 55.95 57.17 1d3f s SER 136 Cb 0.03 0.53 0.25 0.00 0.10 0.00 0.00 66.02 66.93 1d3f s SER 136 CO 0.01 -0.70 1.83 -0.09 0.98 0.00 0.00 173.24 175.27 1d3f h ARG 137 N 2.79 0.78 -0.66 4.02 2.43 -1.92 -1.04 114.38 120.77 1d3f h ARG 137 Ca -0.29 -0.05 0.13 0.00 -0.81 0.00 0.00 59.98 58.96 1d3f h ARG 137 Cb 1.19 -0.18 -0.13 0.00 -0.42 0.00 0.00 29.97 30.44 1d3f h ARG 137 CO 0.39 0.52 -0.25 2.35 -1.51 0.00 0.00 179.97 181.48 1d3f h TRP 138 N 0.81 -0.62 -0.38 2.20 7.01 -1.95 0.72 115.95 123.74 1d3f h TRP 138 Ca 0.31 0.07 -0.06 0.00 2.11 0.00 0.00 58.89 61.32 1d3f h TRP 138 Cb 0.14 0.37 -0.01 0.00 -2.10 0.00 0.00 29.16 27.56 1d3f h TRP 138 CO -0.06 -0.34 -0.01 -0.92 -2.79 0.00 0.00 178.44 174.32 1d3f h TYR 139 N -0.07 0.74 -0.41 2.65 3.20 -1.70 -1.25 116.97 120.14 1d3f h TYR 139 Ca 0.29 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 62.00 1d3f h TYR 139 Cb 0.53 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 1d3f h TYR 139 CO -0.60 0.78 0.12 -0.91 -1.64 0.00 0.00 178.16 175.90 1d3f h ASN 140 N 0.50 0.55 0.47 -2.11 4.21 -0.06 -1.38 115.58 117.75 1d3f h ASN 140 Ca 0.11 -0.07 -0.30 0.00 1.21 0.00 0.00 56.30 57.24 1d3f h ASN 140 Cb 0.49 -0.14 -0.00 0.00 -1.12 0.00 0.00 38.32 37.54 1d3f h ASN 140 CO 0.02 0.54 -1.49 1.56 -1.29 0.00 0.00 177.43 176.76 1d3f h GLN 141 N 0.59 0.26 -2.23 0.81 1.08 0.60 -3.39 115.11 112.82 1d3f h GLN 141 Ca 0.14 -0.44 -0.58 0.00 -1.45 0.00 0.00 58.65 56.31 1d3f h GLN 141 Cb 0.20 0.17 -0.40 0.00 -0.05 0.00 0.00 27.48 27.39 1d3f h GLN 141 CO -0.01 1.14 -0.86 0.25 -0.95 0.00 0.00 178.83 178.40 1d3f n THR 142 N -3.47 0.49 -0.21 -0.54 -2.24 -0.49 -4.97 114.28 102.85 1d3f n THR 142 Ca -0.15 -4.42 -0.03 0.00 -2.27 0.00 0.00 64.05 57.17 1d3f n THR 142 Cb 1.04 -1.99 0.15 0.00 -2.10 0.00 0.00 70.33 67.44 1d3f n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1d3f h PRO 143 N 4.44 1.00 -0.46 -0.78 0.13 -1.44 -1.30 132.00 133.60 1d3f h PRO 143 Ca 0.15 -0.17 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 1d3f h PRO 143 Cb 0.80 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 1d3f h PRO 143 CO 0.60 0.82 -0.11 -0.91 -0.23 0.00 0.00 178.00 178.17 1d3f h ASN 144 N 0.98 0.89 -0.21 1.44 2.35 -1.93 0.05 115.58 119.15 1d3f h ASN 144 Ca 0.23 -0.36 -0.11 0.00 -0.55 0.00 0.00 56.30 55.51 1d3f h ASN 144 Cb 0.20 -0.24 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1d3f h ASN 144 CO -0.02 1.04 -0.30 -0.09 -1.65 0.00 0.00 177.43 176.42 1d3f h ARG 145 N 0.72 0.57 -0.60 0.81 2.43 -1.94 -1.57 114.38 114.80 1d3f h ARG 145 Ca 0.12 -0.33 0.05 0.00 -0.81 0.00 0.00 59.98 59.00 1d3f h ARG 145 Cb 0.65 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.18 1d3f h ARG 145 CO 0.04 0.94 0.33 0.00 -1.51 0.00 0.00 179.97 179.77 1d3f h ALA 146 N 0.62 0.78 -0.79 2.80 0.00 -1.15 0.10 119.26 121.63 1d3f h ALA 146 Ca 0.02 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1d3f h ALA 146 Cb 0.88 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.50 1d3f h ALA 146 CO 0.07 0.00 0.48 0.87 0.00 0.00 0.00 179.25 180.67 1d3f h LYS 147 N 0.62 0.86 -0.47 0.00 1.57 -0.88 0.31 116.57 118.57 1d3f h LYS 147 Ca 0.26 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.97 1d3f h LYS 147 Cb 0.14 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 1d3f h LYS 147 CO -0.16 0.57 0.23 0.00 -0.57 0.00 0.00 179.45 179.51 1d3f h ARG 148 N 0.88 0.67 -0.42 3.15 3.08 0.18 -1.45 114.38 120.47 1d3f h ARG 148 Ca 0.34 -0.10 -0.05 0.00 0.07 0.00 0.00 59.98 60.25 1d3f h ARG 148 Cb 0.16 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 1d3f h ARG 148 CO -0.17 0.56 0.07 0.28 -1.07 0.00 0.00 179.97 179.64 1d3f h VAL 149 N 0.61 1.24 -0.91 2.04 2.07 -0.36 -2.26 116.25 118.68 1d3f h VAL 149 Ca 0.16 -0.89 0.00 0.00 0.82 0.00 0.00 66.70 66.80 1d3f h VAL 149 Cb 0.11 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1d3f h VAL 149 CO -0.02 0.31 0.58 0.40 0.02 0.00 0.00 177.57 178.86 1d3f h ILE 150 N 0.56 1.24 -0.37 4.57 2.04 -0.32 -1.74 117.51 123.49 1d3f h ILE 150 Ca 0.13 -0.47 -0.06 0.00 1.00 0.00 0.00 64.86 65.45 1d3f h ILE 150 Cb 0.38 -0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.36 1d3f h ILE 150 CO 0.01 0.24 -0.04 0.74 0.00 0.00 0.00 178.15 179.10 1d3f h THR 151 N 1.24 1.22 -0.63 -0.27 2.02 -1.15 0.20 112.91 115.55 1d3f h THR 151 Ca 0.33 -0.94 -0.05 0.00 0.77 0.00 0.00 66.41 66.53 1d3f h THR 151 Cb -0.11 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 1d3f h THR 151 CO -0.07 0.32 0.22 0.74 0.37 0.00 0.00 175.52 177.10 1d3f h THR 152 N 0.57 1.24 -0.28 3.16 2.02 -0.80 0.23 112.91 119.05 1d3f h THR 152 Ca 0.11 -0.81 -0.17 0.00 0.77 0.00 0.00 66.41 66.32 1d3f h THR 152 Cb 0.43 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.41 1d3f h THR 152 CO 0.02 0.31 -0.51 -0.26 0.37 0.00 0.00 175.52 175.45 1d3f h PHE 153 N 0.90 0.98 -0.14 3.16 0.05 -0.72 0.22 116.94 121.39 1d3f h PHE 153 Ca 0.21 -0.34 -0.01 0.00 3.82 0.00 0.00 57.97 61.65 1d3f h PHE 153 Cb 0.26 -0.19 -0.01 0.00 2.00 0.00 0.00 35.95 38.02 1d3f h PHE 153 CO 0.02 1.14 0.05 -0.09 -0.18 0.00 0.00 178.31 179.25 1d3f h ARG 154 N 0.62 0.21 0.00 1.51 2.43 -0.34 -3.33 114.38 115.47 1d3f h ARG 154 Ca 0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1d3f h ARG 154 Cb 1.10 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1d3f h ARG 154 CO 0.11 0.31 -1.18 0.25 -1.51 0.00 0.00 179.97 177.95 1d3f n THR 155 N -4.88 0.18 -1.39 0.20 -2.24 0.78 -4.80 114.28 102.13 1d3f n THR 155 Ca -0.05 -0.30 -0.13 0.00 -2.27 0.00 0.00 64.05 61.30 1d3f n THR 155 Cb 0.12 0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 68.47 1d3f n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d3f n GLY 156 N 1.34 1.30 3.62 3.38 0.00 0.78 -4.97 105.19 110.64 1d3f n GLY 156 Ca 0.01 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 1d3f n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1d3f s THR 157 N -2.22 0.91 -1.68 2.61 -4.23 -1.26 -4.80 115.64 104.97 1d3f s THR 157 Ca 0.00 -2.00 0.21 0.00 -1.18 0.00 0.00 61.69 58.72 1d3f s THR 157 Cb 0.00 -2.31 0.68 0.00 1.34 0.00 0.00 72.50 72.21 1d3f s THR 157 CO 0.00 0.00 1.57 0.79 -0.54 0.00 0.00 174.62 176.44 1d3f n TRP 158 N -1.06 1.18 0.03 3.99 7.02 -1.26 -4.61 117.44 122.74 1d3f n TRP 158 Ca -0.11 -0.53 0.22 0.00 -1.02 0.00 0.00 57.50 56.05 1d3f n TRP 158 Cb 0.66 -0.09 0.73 0.00 -2.42 0.00 0.00 31.31 30.19 1d3f n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1d3f h ASP 159 N 4.22 0.00 0.87 -0.99 3.32 -1.96 0.53 116.42 122.42 1d3f h ASP 159 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1d3f h ASP 159 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1d3f h ASP 159 CO 0.09 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.61 1d3f n ALA 160 N -2.45 1.93 0.14 3.45 0.00 -1.26 -1.61 120.51 120.70 1d3f n ALA 160 Ca 0.09 -0.01 0.06 0.00 0.00 0.00 0.00 53.44 53.58 1d3f n ALA 160 Cb 0.67 -1.38 0.10 0.00 0.00 0.00 0.00 19.45 18.84 1d3f n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1d3f n TYR 161 N -1.88 0.24 1.28 0.00 4.02 0.18 -4.97 117.16 116.03 1d3f n TYR 161 Ca 0.04 -0.26 0.13 0.00 -0.01 0.00 0.00 57.90 57.81 1d3f n TYR 161 Cb 0.28 -0.01 0.34 0.00 -0.02 0.00 0.00 39.34 39.92 1d3f n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48