#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d3j s ASN 2 N 0.00 0.25 0.30 6.12 2.20 -1.26 -5.02 114.94 117.54 1d3j s ASN 2 Ca 0.00 -1.15 0.06 0.00 -0.94 0.00 0.00 52.86 50.82 1d3j s ASN 2 Cb 0.00 0.73 0.74 0.00 -2.00 0.00 0.00 41.25 40.71 1d3j s ASN 2 CO 0.00 -1.42 1.78 -0.29 -2.94 0.00 0.00 177.10 174.23 1d3j h ILE 3 N 2.08 0.72 -0.30 0.54 6.09 -1.97 0.39 117.51 125.05 1d3j h ILE 3 Ca -0.28 -0.27 -0.06 0.00 -1.37 0.00 0.00 64.86 62.89 1d3j h ILE 3 Cb 1.25 -0.12 -0.01 0.00 0.47 0.00 0.00 36.82 38.40 1d3j h ILE 3 CO 0.37 0.14 -0.03 -0.26 -3.07 0.00 0.00 178.15 175.30 1d3j h PHE 4 N 0.77 0.61 -0.51 2.19 -1.00 -1.99 0.16 116.94 117.18 1d3j h PHE 4 Ca 0.57 -0.12 -0.08 0.00 2.81 0.00 0.00 57.97 61.16 1d3j h PHE 4 Cb 0.88 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 40.27 1d3j h PHE 4 CO -0.00 0.71 -0.00 0.93 -1.61 0.00 0.00 178.31 178.34 1d3j h GLU 5 N 0.34 0.91 0.32 1.51 5.08 -1.64 0.13 114.58 121.23 1d3j h GLU 5 Ca 0.08 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.14 1d3j h GLU 5 Cb 0.48 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1d3j h GLU 5 CO 0.02 0.93 -0.16 1.98 -1.00 0.00 0.00 179.01 180.79 1d3j h MET 6 N 0.77 -0.42 0.00 2.33 4.05 -0.02 -1.48 114.93 120.17 1d3j h MET 6 Ca 0.15 0.03 -0.04 0.00 -0.28 0.00 0.00 59.70 59.55 1d3j h MET 6 Cb 0.52 0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.41 1d3j h MET 6 CO 0.03 -0.28 -0.21 -0.07 0.23 0.00 0.00 176.91 176.60 1d3j h LEU 7 N -0.43 0.00 -1.32 3.39 3.38 -0.88 -0.90 115.31 118.54 1d3j h LEU 7 Ca -0.04 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1d3j h LEU 7 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1d3j h LEU 7 CO 0.07 0.21 -0.17 -0.09 0.09 0.00 0.00 178.44 178.55 1d3j h ARG 8 N 0.00 0.24 -0.10 1.13 9.65 0.02 0.01 114.38 125.33 1d3j h ARG 8 Ca -0.00 -0.06 -0.10 0.00 -1.10 0.00 0.00 59.98 58.72 1d3j h ARG 8 Cb 0.40 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 1d3j h ARG 8 CO 0.03 0.42 -0.31 0.82 2.80 0.00 0.00 179.97 183.72 1d3j h ILE 9 N 0.22 1.40 0.00 1.20 2.04 -0.26 -1.61 117.51 120.50 1d3j h ILE 9 Ca 0.04 -1.66 -0.09 0.00 1.00 0.00 0.00 64.86 64.16 1d3j h ILE 9 Cb 0.44 2.20 -0.01 0.00 -0.74 0.00 0.00 36.82 38.71 1d3j h ILE 9 CO 0.03 0.48 -0.42 0.44 0.00 0.00 0.00 178.15 178.68 1d3j h ASP 10 N -0.07 0.00 0.00 1.72 3.32 -0.86 -3.31 116.42 117.22 1d3j h ASP 10 Ca -0.01 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 1d3j h ASP 10 Cb 0.94 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.47 1d3j h ASP 10 CO 0.07 0.42 -1.88 -0.62 -1.72 0.00 0.00 179.24 175.51 1d3j n GLU 11 N -3.76 0.79 -0.03 3.56 -0.58 -0.04 -5.09 120.64 115.49 1d3j n GLU 11 Ca -0.01 -0.11 0.00 0.00 -0.42 0.00 0.00 57.16 56.62 1d3j n GLU 11 Cb 0.49 -1.41 -0.00 0.00 -0.57 0.00 0.00 31.44 29.95 1d3j n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d3j n GLY 12 N 1.68 -1.95 2.97 0.62 0.00 -0.60 -4.49 105.19 103.42 1d3j n GLY 12 Ca -0.10 -1.37 -0.14 0.00 0.00 0.00 0.00 46.02 44.41 1d3j n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1d3j s LEU 13 N 0.00 -0.27 -0.05 0.99 2.96 -1.26 -4.41 118.68 116.65 1d3j s LEU 13 Ca 0.00 0.53 0.02 0.00 -0.22 0.00 0.00 54.13 54.47 1d3j s LEU 13 Cb 0.00 0.64 0.01 0.00 0.50 0.00 0.00 46.19 47.34 1d3j s LEU 13 CO 0.00 -0.24 -0.10 -0.13 -1.32 0.00 0.00 176.35 174.56 1d3j s ARG 14 N 2.40 1.32 0.00 1.98 0.52 -0.37 -4.98 118.95 119.82 1d3j s ARG 14 Ca 0.02 -0.33 0.23 0.00 -0.52 0.00 0.00 55.73 55.12 1d3j s ARG 14 Cb -0.12 -1.16 0.66 0.00 0.52 0.00 0.00 34.95 34.85 1d3j s ARG 14 CO -0.08 0.05 1.51 1.28 0.02 0.00 0.00 175.30 178.07 1d3j n LEU 15 N 3.66 2.22 -4.26 2.53 4.77 -1.26 0.77 117.00 125.43 1d3j n LEU 15 Ca -0.22 -0.89 -0.26 0.00 -0.03 0.00 0.00 56.01 54.61 1d3j n LEU 15 Cb 0.52 -0.11 -0.14 0.00 -2.33 0.00 0.00 43.42 41.36 1d3j n LEU 15 CO 0.25 0.45 -0.53 -0.75 -1.33 0.00 0.00 177.39 175.48 1d3j s LYS 16 N -1.77 1.44 0.48 3.23 2.47 -1.26 -1.66 119.74 122.66 1d3j s LYS 16 Ca 0.34 -0.95 -0.22 0.00 -1.56 0.00 0.00 55.97 53.59 1d3j s LYS 16 Cb 0.19 -1.55 -0.10 0.00 -1.46 0.00 0.00 37.83 34.91 1d3j s LYS 16 CO 0.29 0.40 0.76 -0.89 0.16 0.00 0.00 175.35 176.07 1d3j n ILE 17 N 1.86 2.39 -4.00 5.43 5.41 -1.06 -4.72 119.36 124.68 1d3j n ILE 17 Ca -0.17 -0.50 -0.11 0.00 1.00 0.00 0.00 62.75 62.97 1d3j n ILE 17 Cb 0.53 -0.87 -0.04 0.00 -0.71 0.00 0.00 39.64 38.55 1d3j n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1d3j s TYR 18 N -1.46 0.54 -0.13 1.39 -0.85 0.23 -4.96 117.35 112.12 1d3j s TYR 18 Ca 0.66 -0.91 -0.06 0.00 -0.52 0.00 0.00 57.07 56.24 1d3j s TYR 18 Cb -0.53 0.21 -0.04 0.00 0.38 0.00 0.00 41.96 41.99 1d3j s TYR 18 CO 0.55 -1.13 0.10 0.15 -1.52 0.00 0.00 175.55 173.70 1d3j s LYS 19 N -3.45 3.47 0.00 -3.49 1.02 -1.26 -0.04 119.74 115.99 1d3j s LYS 19 Ca 0.24 -0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.00 1d3j s LYS 19 Cb -0.01 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.17 1d3j s LYS 19 CO 0.13 0.66 0.00 -0.40 -0.92 0.00 0.00 175.35 174.82 1d3j n ASP 20 N 2.34 -0.02 0.25 2.83 5.75 0.18 -4.80 116.55 123.08 1d3j n ASP 20 Ca -0.19 -0.55 0.13 0.00 -0.01 0.00 0.00 54.79 54.16 1d3j n ASP 20 Cb 0.54 0.00 0.64 0.00 -1.03 0.00 0.00 41.12 41.27 1d3j n ASP 20 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1d3j h THR 21 N -0.58 0.47 -0.01 2.12 1.35 -1.99 -1.16 112.91 113.12 1d3j h THR 21 Ca 0.00 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.11 1d3j h THR 21 Cb 0.00 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 1d3j h THR 21 CO 0.00 0.14 -0.16 -0.62 -0.25 0.00 0.00 175.52 174.63 1d3j n GLU 22 N -3.45 1.00 -0.45 4.72 -0.58 -1.26 -4.94 120.64 115.67 1d3j n GLU 22 Ca -0.01 -0.53 0.00 0.00 -0.42 0.00 0.00 57.16 56.20 1d3j n GLU 22 Cb 0.31 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 1d3j n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1d3j n GLY 23 N 1.28 0.76 3.88 0.62 0.00 -0.44 -5.07 105.19 106.22 1d3j n GLY 23 Ca 0.14 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1d3j n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1d3j s TYR 24 N -2.00 3.44 0.00 1.61 4.12 -1.26 -4.60 117.35 118.66 1d3j s TYR 24 Ca 0.00 0.81 -0.30 0.00 0.02 0.00 0.00 57.07 57.60 1d3j s TYR 24 Cb 0.00 -2.21 -0.06 0.00 -1.52 0.00 0.00 41.96 38.17 1d3j s TYR 24 CO 0.00 0.31 1.54 0.71 0.02 0.00 0.00 175.55 178.12 1d3j s TYR 25 N -1.77 2.51 0.14 2.71 4.12 -1.22 0.49 117.35 124.32 1d3j s TYR 25 Ca 0.46 0.52 -0.01 0.00 0.02 0.00 0.00 57.07 58.06 1d3j s TYR 25 Cb -0.11 -3.81 -0.04 0.00 -1.52 0.00 0.00 41.96 36.47 1d3j s TYR 25 CO 0.22 -3.20 0.05 0.99 0.02 0.00 0.00 175.55 173.63 1d3j s THR 26 N 2.91 0.16 0.18 -0.71 2.01 0.94 1.00 115.64 122.14 1d3j s THR 26 Ca 0.69 -1.92 -0.15 0.00 0.31 0.00 0.00 61.69 60.61 1d3j s THR 26 Cb -0.34 -2.08 0.02 0.00 0.01 0.00 0.00 72.50 70.11 1d3j s THR 26 CO 0.29 -0.44 0.46 -0.51 -0.69 0.00 0.00 174.62 173.73 1d3j s ILE 27 N -4.01 0.04 0.00 1.82 2.07 -0.63 0.78 121.20 121.28 1d3j s ILE 27 Ca 0.25 -0.91 0.00 0.00 -1.41 0.00 0.00 60.65 58.58 1d3j s ILE 27 Cb 0.07 -1.61 0.00 0.00 0.13 0.00 0.00 42.46 41.05 1d3j s ILE 27 CO 0.03 -0.17 0.00 0.61 -1.91 0.00 0.00 174.94 173.49 1d3j n GLY 28 N -0.30 1.41 2.79 1.50 0.00 0.23 -1.48 105.19 109.33 1d3j n GLY 28 Ca -0.10 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.07 1d3j n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1d3j n ILE 29 N 0.00 3.57 -1.45 -0.61 5.41 -1.26 -1.24 119.36 123.78 1d3j n ILE 29 Ca 0.00 -5.45 -0.08 0.00 1.00 0.00 0.00 62.75 58.21 1d3j n ILE 29 Cb 0.00 -2.15 -0.03 0.00 -0.71 0.00 0.00 39.64 36.75 1d3j n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1d3j n GLY 30 N 1.34 0.79 3.55 7.39 0.00 -1.24 -4.91 105.19 112.10 1d3j n GLY 30 Ca 0.27 -0.64 -0.43 0.00 0.00 0.00 0.00 46.02 45.22 1d3j n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1d3j s HIS 31 N -2.33 2.82 0.19 1.61 5.04 -0.55 -4.92 115.29 117.15 1d3j s HIS 31 Ca 0.00 0.21 -0.31 0.00 -1.54 0.00 0.00 55.06 53.42 1d3j s HIS 31 Cb 0.00 -4.09 -0.10 0.00 0.04 0.00 0.00 32.58 28.43 1d3j s HIS 31 CO 0.00 -1.28 1.55 -1.17 -2.34 0.00 0.00 174.74 171.50 1d3j s LEU 32 N 4.00 4.37 -0.23 8.88 2.96 -1.26 -1.60 118.68 135.79 1d3j s LEU 32 Ca 0.35 2.64 -0.07 0.00 -0.22 0.00 0.00 54.13 56.84 1d3j s LEU 32 Cb -0.11 -3.60 -0.18 0.00 0.50 0.00 0.00 46.19 42.81 1d3j s LEU 32 CO 0.23 -0.81 -0.11 0.18 -1.32 0.00 0.00 176.35 174.52 1d3j n LEU 33 N 3.59 2.52 -3.55 -0.68 4.77 0.28 -4.94 117.00 118.99 1d3j n LEU 33 Ca 0.12 0.12 -0.11 0.00 -0.03 0.00 0.00 56.01 56.11 1d3j n LEU 33 Cb 0.39 -0.93 -0.04 0.00 -2.33 0.00 0.00 43.42 40.50 1d3j n LEU 33 CO 0.61 0.75 0.70 0.28 -1.33 0.00 0.00 177.39 178.41 1d3j s THR 34 N -2.51 0.00 -1.18 -5.08 -1.32 -1.15 -4.93 115.64 99.48 1d3j s THR 34 Ca -0.33 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.41 1d3j s THR 34 Cb 0.10 -1.00 0.11 0.00 -1.51 0.00 0.00 72.50 70.20 1d3j s THR 34 CO 0.60 0.00 1.53 0.29 -2.21 0.00 0.00 174.62 174.83 1d3j n LYS 35 N 0.51 0.20 -2.34 7.08 5.02 -1.26 -3.38 118.16 123.99 1d3j n LYS 35 Ca -0.11 -0.11 -0.36 0.00 -2.02 0.00 0.00 58.31 55.71 1d3j n LYS 35 Cb 0.59 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.09 1d3j n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1d3j s SER 36 N -2.87 6.14 0.58 4.39 0.15 -1.26 -4.90 113.70 115.93 1d3j s SER 36 Ca 0.15 2.17 0.37 0.00 0.70 0.00 0.00 55.95 59.34 1d3j s SER 36 Cb 0.18 -2.59 1.66 0.00 -1.71 0.00 0.00 66.02 63.57 1d3j s SER 36 CO 0.63 -0.93 2.09 -0.65 1.20 0.00 0.00 173.24 175.59 1d3j h PRO 37 N 1.77 0.00 -6.02 5.44 0.10 -1.96 -3.44 132.00 127.90 1d3j h PRO 37 Ca -0.49 0.00 -0.58 0.00 0.10 0.00 0.00 66.00 65.02 1d3j h PRO 37 Cb 1.24 0.00 -0.06 0.00 0.10 0.00 0.00 31.00 32.28 1d3j h PRO 37 CO 0.59 0.00 0.67 0.45 0.10 0.00 0.00 178.00 179.81 1d3j s SER 38 N -5.54 7.04 0.41 -2.05 0.15 -1.26 -4.92 113.70 107.53 1d3j s SER 38 Ca -0.01 1.30 0.11 0.00 0.70 0.00 0.00 55.95 58.06 1d3j s SER 38 Cb 0.10 -2.51 0.87 0.00 -1.71 0.00 0.00 66.02 62.77 1d3j s SER 38 CO 0.51 -0.59 1.95 0.25 1.20 0.00 0.00 173.24 176.55 1d3j h LEU 39 N 9.16 0.14 -0.27 3.45 5.85 -1.99 -0.12 115.31 131.54 1d3j h LEU 39 Ca -0.22 -0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.34 1d3j h LEU 39 Cb 1.08 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.07 1d3j h LEU 39 CO 0.93 0.31 -0.36 0.78 -0.34 0.00 0.00 178.44 179.76 1d3j h ASN 40 N 0.14 0.78 -0.90 1.25 2.35 -1.98 0.28 115.58 117.51 1d3j h ASN 40 Ca 0.03 -0.50 0.08 0.00 -0.55 0.00 0.00 56.30 55.35 1d3j h ASN 40 Cb 0.35 -0.22 -0.06 0.00 0.05 0.00 0.00 38.32 38.44 1d3j h ASN 40 CO 0.02 1.13 0.58 0.00 -1.65 0.00 0.00 177.43 177.51 1d3j h ALA 41 N 0.67 1.55 -0.55 -0.83 0.00 -1.67 0.42 119.26 118.86 1d3j h ALA 41 Ca 0.03 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.83 1d3j h ALA 41 Cb 0.94 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1d3j h ALA 41 CO 0.08 0.29 -0.05 0.00 0.00 0.00 0.00 179.25 179.58 1d3j h ALA 42 N 1.53 0.74 -0.12 0.00 0.00 -0.19 -1.00 119.26 120.22 1d3j h ALA 42 Ca 0.40 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1d3j h ALA 42 Cb 0.27 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1d3j h ALA 42 CO -0.16 0.60 -0.34 0.87 0.00 0.00 0.00 179.25 180.23 1d3j h LYS 43 N 0.87 0.23 0.05 0.00 1.57 0.80 0.14 116.57 120.23 1d3j h LYS 43 Ca 0.15 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1d3j h LYS 43 Cb 0.60 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1d3j h LYS 43 CO 0.04 0.55 -0.02 1.03 -0.57 0.00 0.00 179.45 180.48 1d3j h SER 44 N 0.20 -0.05 -0.73 0.86 0.87 0.23 -1.65 113.55 113.28 1d3j h SER 44 Ca 0.02 -0.33 -0.01 0.00 -1.23 0.00 0.00 61.79 60.25 1d3j h SER 44 Cb 0.71 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.64 1d3j h SER 44 CO 0.05 0.31 0.43 -0.33 -0.53 0.00 0.00 176.83 176.76 1d3j h GLU 45 N -0.42 1.01 -0.40 2.24 4.39 -0.96 -2.05 114.58 118.38 1d3j h GLU 45 Ca -0.01 -0.09 0.01 0.00 0.34 0.00 0.00 59.36 59.61 1d3j h GLU 45 Cb 0.38 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1d3j h GLU 45 CO 0.01 0.72 0.25 1.25 -1.16 0.00 0.00 179.01 180.08 1d3j h LEU 46 N 1.02 0.42 -1.01 1.33 5.85 -0.37 -0.25 115.31 122.31 1d3j h LEU 46 Ca 0.27 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.94 1d3j h LEU 46 Cb -0.02 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 1d3j h LEU 46 CO -0.05 0.30 0.27 0.44 -0.34 0.00 0.00 178.44 179.06 1d3j h ASP 47 N 0.51 0.89 -0.05 1.25 3.32 -0.93 -0.47 116.42 120.95 1d3j h ASP 47 Ca 0.15 -0.12 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 1d3j h ASP 47 Cb -0.03 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 1d3j h ASP 47 CO -0.05 0.80 -0.19 0.50 -1.72 0.00 0.00 179.24 178.57 1d3j h LYS 48 N 0.96 0.43 -0.13 3.56 3.64 -1.18 0.72 116.57 124.57 1d3j h LYS 48 Ca 0.23 -0.14 -0.19 0.00 -1.27 0.00 0.00 60.65 59.28 1d3j h LYS 48 Cb 0.18 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1d3j h LYS 48 CO -0.02 0.61 -0.69 0.00 -2.27 0.00 0.00 179.45 177.08 1d3j h ALA 49 N 1.41 0.56 0.05 5.00 0.00 0.17 -3.30 119.26 123.15 1d3j h ALA 49 Ca 0.07 -0.58 -0.29 0.00 0.00 0.00 0.00 54.91 54.10 1d3j h ALA 49 Cb 0.56 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 1d3j h ALA 49 CO 0.04 0.72 -1.60 0.82 0.00 0.00 0.00 179.25 179.23 1d3j h ILE 50 N 0.39 1.02 -0.03 0.00 1.08 -0.97 -3.49 117.51 115.50 1d3j h ILE 50 Ca -0.02 -2.78 0.00 0.00 -0.39 0.00 0.00 64.86 61.67 1d3j h ILE 50 Cb 1.27 2.58 0.00 0.00 -3.07 0.00 0.00 36.82 37.60 1d3j h ILE 50 CO 0.13 0.70 0.00 0.61 -0.69 0.00 0.00 178.15 178.90 1d3j n GLY 51 N 1.62 1.03 3.80 5.37 0.00 0.25 -5.06 105.19 112.19 1d3j n GLY 51 Ca -0.17 -0.52 -0.05 0.00 0.00 0.00 0.00 46.02 45.29 1d3j n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1d3j s ARG 52 N -2.79 1.42 -0.56 1.61 1.70 -1.08 -5.06 118.95 114.19 1d3j s ARG 52 Ca 0.00 -0.79 -0.26 0.00 -0.47 0.00 0.00 55.73 54.21 1d3j s ARG 52 Cb 0.00 0.48 0.04 0.00 -0.57 0.00 0.00 34.95 34.89 1d3j s ARG 52 CO 0.00 -0.65 1.06 1.21 -1.08 0.00 0.00 175.30 175.84 1d3j s ASN 53 N -2.95 6.39 0.15 -2.89 2.47 -1.26 -4.45 114.94 112.40 1d3j s ASN 53 Ca 0.12 -0.14 0.22 0.00 0.42 0.00 0.00 52.86 53.48 1d3j s ASN 53 Cb -0.03 -2.49 -0.08 0.00 -1.45 0.00 0.00 41.25 37.20 1d3j s ASN 53 CO 0.04 -1.34 0.91 0.35 -3.72 0.00 0.00 177.10 173.34 1d3j n THR 54 N 6.41 0.49 -3.14 -5.21 -2.24 -1.26 -4.96 114.28 104.37 1d3j n THR 54 Ca 0.05 -0.54 -0.23 0.00 -2.27 0.00 0.00 64.05 61.06 1d3j n THR 54 Cb 0.48 -0.27 0.02 0.00 -2.10 0.00 0.00 70.33 68.47 1d3j n THR 54 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1d3j n ASN 55 N -2.59 -5.36 0.00 3.42 5.15 -1.26 -2.10 115.26 112.52 1d3j n ASN 55 Ca -0.01 -0.32 0.00 0.00 -0.60 0.00 0.00 54.58 53.64 1d3j n ASN 55 Cb 0.56 -4.35 0.00 0.00 -0.53 0.00 0.00 39.78 35.46 1d3j n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1d3j n GLY 56 N -1.42 0.37 3.10 8.20 0.00 -1.26 -5.01 105.19 109.16 1d3j n GLY 56 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 1d3j n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1d3j s VAL 57 N -1.86 1.05 0.33 1.61 1.01 -0.89 -2.55 120.40 119.10 1d3j s VAL 57 Ca 0.00 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.44 1d3j s VAL 57 Cb 0.00 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 1d3j s VAL 57 CO 0.00 0.29 0.08 0.27 0.00 0.00 0.00 175.10 175.75 1d3j s ILE 58 N -0.32 0.92 0.41 2.22 -4.36 -0.66 -4.79 121.20 114.62 1d3j s ILE 58 Ca 0.05 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.49 1d3j s ILE 58 Cb -0.05 -2.65 0.00 0.00 1.25 0.00 0.00 42.46 41.01 1d3j s ILE 58 CO -0.00 0.00 0.58 0.42 0.24 0.00 0.00 174.94 176.17 1d3j s THR 59 N -3.36 3.54 0.20 8.37 -4.23 -1.26 -4.80 115.64 114.10 1d3j s THR 59 Ca 0.33 -0.87 -0.11 0.00 -1.18 0.00 0.00 61.69 59.87 1d3j s THR 59 Cb 0.07 -3.24 0.12 0.00 1.34 0.00 0.00 72.50 70.79 1d3j s THR 59 CO 0.15 -0.12 1.77 0.50 -0.54 0.00 0.00 174.62 176.39 1d3j h LYS 60 N 0.62 0.48 -0.84 3.99 3.64 -1.99 0.49 116.57 122.97 1d3j h LYS 60 Ca -0.44 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 58.94 1d3j h LYS 60 Cb 1.27 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.93 1d3j h LYS 60 CO 0.51 0.32 0.55 -0.44 -2.27 0.00 0.00 179.45 178.12 1d3j h ASP 61 N 0.50 0.93 -0.41 4.20 5.19 -1.99 -0.36 116.42 124.48 1d3j h ASP 61 Ca 0.27 -0.02 -0.03 0.00 -0.62 0.00 0.00 57.03 56.64 1d3j h ASP 61 Cb 0.25 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 1d3j h ASP 61 CO -0.22 0.66 0.13 -0.33 -3.12 0.00 0.00 179.24 176.36 1d3j h GLU 62 N 1.10 0.63 -0.39 3.56 5.08 -1.56 -0.02 114.58 122.98 1d3j h GLU 62 Ca 0.32 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.58 1d3j h GLU 62 Cb -0.07 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.06 1d3j h GLU 62 CO -0.09 0.62 0.17 0.00 -1.00 0.00 0.00 179.01 178.71 1d3j h ALA 63 N 0.98 0.47 -0.35 3.43 0.00 -0.57 -1.10 119.26 122.12 1d3j h ALA 63 Ca 0.13 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 1d3j h ALA 63 Cb 0.25 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1d3j h ALA 63 CO -0.01 -0.20 0.03 0.93 0.00 0.00 0.00 179.25 180.01 1d3j h GLU 64 N 0.36 0.53 -0.37 0.00 5.08 -0.81 0.70 114.58 120.06 1d3j h GLU 64 Ca 0.17 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1d3j h GLU 64 Cb 0.10 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1d3j h GLU 64 CO -0.14 0.53 -0.03 -0.22 -1.00 0.00 0.00 179.01 178.15 1d3j h LYS 65 N 0.51 0.67 -0.69 2.33 3.64 -0.22 0.17 116.57 122.97 1d3j h LYS 65 Ca 0.11 -0.23 -0.02 0.00 -1.27 0.00 0.00 60.65 59.24 1d3j h LYS 65 Cb 0.28 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1d3j h LYS 65 CO 0.00 0.79 0.33 0.52 -2.27 0.00 0.00 179.45 178.83 1d3j h MET 66 N 0.48 0.99 -0.36 1.90 2.86 -0.69 -1.93 114.93 118.17 1d3j h MET 66 Ca 0.10 -0.13 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1d3j h MET 66 Cb 0.51 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 1d3j h MET 66 CO 0.02 0.76 0.22 0.35 1.06 0.00 0.00 176.91 179.32 1d3j h PHE 67 N 0.98 0.41 -0.91 -0.22 3.57 -0.40 0.26 116.94 120.62 1d3j h PHE 67 Ca 0.24 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.80 1d3j h PHE 67 Cb 0.10 -0.13 -0.06 0.00 2.79 0.00 0.00 35.95 38.65 1d3j h PHE 67 CO 0.01 0.24 0.58 -0.91 -2.23 0.00 0.00 178.31 176.00 1d3j h ASN 68 N 0.44 0.96 -0.49 0.41 2.35 -0.67 0.12 115.58 118.70 1d3j h ASN 68 Ca 0.14 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.77 1d3j h ASN 68 Cb -0.00 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.14 1d3j h ASN 68 CO -0.06 0.65 -0.18 1.56 -1.65 0.00 0.00 177.43 177.74 1d3j h GLN 69 N 1.11 0.99 -0.51 0.81 4.20 -0.54 -1.89 115.11 119.27 1d3j h GLN 69 Ca 0.37 -0.41 -0.04 0.00 0.06 0.00 0.00 58.65 58.63 1d3j h GLN 69 Cb 0.05 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 1d3j h GLN 69 CO -0.13 1.08 0.14 -0.44 -0.67 0.00 0.00 178.83 178.81 1d3j h ASP 70 N 0.84 0.71 -0.17 1.46 3.32 0.21 -0.27 116.42 122.52 1d3j h ASP 70 Ca 0.12 -0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1d3j h ASP 70 Cb 0.76 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 1d3j h ASP 70 CO 0.06 0.69 0.04 0.58 -1.72 0.00 0.00 179.24 178.90 1d3j h VAL 71 N 0.75 1.20 -0.65 -1.35 2.07 -0.58 -1.83 116.25 115.86 1d3j h VAL 71 Ca 0.17 -0.63 0.08 0.00 0.82 0.00 0.00 66.70 67.14 1d3j h VAL 71 Cb 0.25 1.29 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 1d3j h VAL 71 CO -0.01 0.19 0.31 -0.78 0.02 0.00 0.00 177.57 177.31 1d3j h ASP 72 N 0.09 0.40 -0.64 0.57 3.58 -1.17 -1.29 116.42 117.97 1d3j h ASP 72 Ca 0.05 0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 1d3j h ASP 72 Cb 0.26 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.27 1d3j h ASP 72 CO 0.00 0.24 0.38 0.00 -2.88 0.00 0.00 179.24 176.98 1d3j h ALA 73 N 1.39 0.82 -0.21 -0.78 0.00 -0.88 0.45 119.26 120.04 1d3j h ALA 73 Ca 0.31 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1d3j h ALA 73 Cb 0.31 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1d3j h ALA 73 CO -0.25 0.30 0.04 0.00 0.00 0.00 0.00 179.25 179.35 1d3j h ALA 74 N 1.19 0.22 -0.24 0.00 0.00 -0.40 0.48 119.26 120.51 1d3j h ALA 74 Ca 0.23 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.20 1d3j h ALA 74 Cb -0.01 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1d3j h ALA 74 CO -0.04 -0.38 0.07 0.28 0.00 0.00 0.00 179.25 179.18 1d3j h VAL 75 N 0.13 0.93 -0.84 0.00 2.07 -0.90 0.45 116.25 118.09 1d3j h VAL 75 Ca 0.10 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 1d3j h VAL 75 Cb 0.09 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1d3j h VAL 75 CO -0.13 0.03 0.51 0.03 0.02 0.00 0.00 177.57 178.04 1d3j h ARG 76 N 0.18 1.13 -0.69 1.57 3.08 -0.61 0.20 114.38 119.23 1d3j h ARG 76 Ca 0.11 -0.09 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1d3j h ARG 76 Cb 0.08 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 29.86 1d3j h ARG 76 CO -0.12 0.78 0.30 0.78 -1.07 0.00 0.00 179.97 180.65 1d3j h GLY 77 N 1.17 1.10 0.97 0.04 0.00 0.12 -1.75 103.07 104.71 1d3j h GLY 77 Ca 0.30 -0.58 0.01 0.00 0.00 0.00 0.00 47.33 47.06 1d3j h GLY 77 CO -0.06 0.54 0.17 -2.22 0.00 0.00 0.00 176.54 174.97 1d3j h ILE 78 N 0.98 1.05 0.00 2.60 2.04 0.62 -2.43 117.51 122.37 1d3j h ILE 78 Ca 0.23 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 1d3j h ILE 78 Cb 0.17 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1d3j h ILE 78 CO -0.02 0.06 -0.04 -0.07 0.00 0.00 0.00 178.15 178.08 1d3j h LEU 79 N 0.34 0.00 0.00 1.44 3.38 -0.09 -1.56 115.31 118.82 1d3j h LEU 79 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1d3j h LEU 79 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1d3j h LEU 79 CO -0.04 0.04 -0.64 0.54 0.09 0.00 0.00 178.44 178.43 1d3j n ARG 80 N -3.20 0.03 -3.30 1.13 1.74 -0.71 -4.81 116.66 107.54 1d3j n ARG 80 Ca -0.01 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 1d3j n ARG 80 Cb 0.25 -1.51 -0.07 0.00 -1.02 0.00 0.00 32.46 30.11 1d3j n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1d3j s ASN 81 N -3.09 6.48 0.56 0.55 3.84 -0.60 -4.94 114.94 117.74 1d3j s ASN 81 Ca 0.10 0.57 0.25 0.00 0.21 0.00 0.00 52.86 53.98 1d3j s ASN 81 Cb 0.17 -2.27 1.57 0.00 -0.55 0.00 0.00 41.25 40.17 1d3j s ASN 81 CO 0.74 -0.17 2.16 0.00 -2.79 0.00 0.00 177.10 177.05 1d3j h ALA 82 N 7.59 1.83 0.00 1.71 0.00 -1.90 0.51 119.26 129.01 1d3j h ALA 82 Ca -0.33 -0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.31 1d3j h ALA 82 Cb 1.15 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.91 1d3j h ALA 82 CO 0.72 -0.13 -1.64 1.63 0.00 0.00 0.00 179.25 179.84 1d3j n LYS 83 N -4.11 0.63 0.06 0.00 4.01 -1.26 -4.45 118.16 113.03 1d3j n LYS 83 Ca -0.01 0.28 -0.21 0.00 -0.51 0.00 0.00 58.31 57.86 1d3j n LYS 83 Cb 0.19 -1.80 -0.15 0.00 -0.51 0.00 0.00 35.03 32.76 1d3j n LYS 83 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 1d3j h LEU 84 N 0.00 0.51 -0.76 -0.35 3.38 -1.55 -3.37 115.31 113.17 1d3j h LEU 84 Ca -0.26 -0.93 0.14 0.00 0.09 0.00 0.00 57.88 56.92 1d3j h LEU 84 Cb 1.90 -0.17 -0.14 0.00 0.09 0.00 0.00 40.66 42.35 1d3j h LEU 84 CO 0.07 1.48 -0.27 0.50 0.09 0.00 0.00 178.44 180.31 1d3j h LYS 85 N -0.29 -0.05 -0.24 1.13 3.64 -0.82 0.18 116.57 120.13 1d3j h LYS 85 Ca -0.19 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.15 1d3j h LYS 85 Cb 1.74 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.56 1d3j h LYS 85 CO 0.15 -0.03 -0.07 -1.35 -2.27 0.00 0.00 179.45 175.88 1d3j h PRO 86 N -0.05 0.37 -0.09 1.90 0.11 -1.80 0.37 132.00 132.80 1d3j h PRO 86 Ca 0.33 -0.08 -0.03 0.00 0.11 0.00 0.00 66.00 66.33 1d3j h PRO 86 Cb 0.57 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.63 1d3j h PRO 86 CO -0.80 0.46 -0.06 0.28 -0.21 0.00 0.00 178.00 177.67 1d3j h VAL 87 N 0.35 1.34 -0.73 3.15 2.07 -0.89 -2.29 116.25 119.26 1d3j h VAL 87 Ca 0.07 -1.14 0.09 0.00 0.82 0.00 0.00 66.70 66.54 1d3j h VAL 87 Cb 0.35 1.90 -0.07 0.00 -1.52 0.00 0.00 31.29 31.95 1d3j h VAL 87 CO 0.02 0.32 0.39 0.22 0.02 0.00 0.00 177.57 178.53 1d3j h TYR 88 N -0.18 0.70 0.00 1.57 3.20 -0.64 -0.59 116.97 121.03 1d3j h TYR 88 Ca 0.02 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 1d3j h TYR 88 Cb 0.54 -0.20 -0.00 0.00 1.54 0.00 0.00 36.73 38.60 1d3j h TYR 88 CO 0.08 0.28 -0.16 -0.44 -1.64 0.00 0.00 178.16 176.28 1d3j h ASP 89 N 0.66 0.00 1.53 -2.11 3.32 -0.14 -2.15 116.42 117.53 1d3j h ASP 89 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1d3j h ASP 89 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1d3j h ASP 89 CO -0.25 0.16 -0.02 0.77 -1.72 0.00 0.00 179.24 178.18 1d3j h SER 90 N 0.00 0.00 -3.58 6.45 4.64 -0.52 -3.46 113.55 117.07 1d3j h SER 90 Ca -0.00 -0.01 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 1d3j h SER 90 Cb 0.34 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1d3j h SER 90 CO 0.02 0.00 0.09 -0.76 -0.87 0.00 0.00 176.83 175.31 1d3j s LEU 91 N -4.74 3.76 0.83 5.97 1.43 -0.81 -5.08 118.68 120.04 1d3j s LEU 91 Ca 0.10 0.99 -0.12 0.00 -1.03 0.00 0.00 54.13 54.07 1d3j s LEU 91 Cb 0.11 -3.90 0.09 0.00 0.03 0.00 0.00 46.19 42.52 1d3j s LEU 91 CO 0.61 -0.46 1.14 1.51 0.23 0.00 0.00 176.35 179.38 1d3j s ASP 92 N -3.60 4.27 0.25 2.29 1.47 -1.26 -4.80 116.67 115.30 1d3j s ASP 92 Ca 0.49 0.98 -0.03 0.00 1.18 0.00 0.00 52.55 55.16 1d3j s ASP 92 Cb -0.10 -1.58 0.43 0.00 -0.34 0.00 0.00 42.92 41.33 1d3j s ASP 92 CO 0.37 -2.07 1.82 0.00 0.68 0.00 0.00 175.17 175.97 1d3j h ALA 93 N -1.17 1.26 -0.10 2.11 0.00 -1.98 -1.14 119.26 118.25 1d3j h ALA 93 Ca -0.48 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1d3j h ALA 93 Cb 1.31 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 1d3j h ALA 93 CO 0.63 0.15 -0.03 0.28 0.00 0.00 0.00 179.25 180.28 1d3j h VAL 94 N 0.86 1.29 0.00 0.00 2.07 -1.94 -2.90 116.25 115.63 1d3j h VAL 94 Ca 0.42 -0.96 -0.07 0.00 0.82 0.00 0.00 66.70 66.92 1d3j h VAL 94 Cb 0.38 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1d3j h VAL 94 CO -0.25 0.27 -0.32 0.03 0.02 0.00 0.00 177.57 177.33 1d3j h ARG 95 N -0.14 0.00 -0.88 1.57 3.08 -1.76 -1.74 114.38 114.51 1d3j h ARG 95 Ca 0.02 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.12 1d3j h ARG 95 Cb 0.44 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.43 1d3j h ARG 95 CO 0.01 0.32 0.56 0.00 -1.07 0.00 0.00 179.97 179.78 1d3j h ARG 96 N 0.00 1.02 -0.56 0.04 3.08 -1.10 -0.01 114.38 116.85 1d3j h ARG 96 Ca -0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1d3j h ARG 96 Cb 0.57 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 1d3j h ARG 96 CO 0.04 0.67 0.36 0.00 -1.07 0.00 0.00 179.97 179.97 1d3j h ALA 97 N 1.39 1.57 -0.54 0.04 0.00 -1.13 0.25 119.26 120.84 1d3j h ALA 97 Ca 0.37 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.15 1d3j h ALA 97 Cb 0.10 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1d3j h ALA 97 CO -0.15 0.39 0.05 0.00 0.00 0.00 0.00 179.25 179.54 1d3j h ALA 98 N 1.62 1.07 -0.28 0.00 0.00 -0.58 -1.00 119.26 120.09 1d3j h ALA 98 Ca 0.20 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1d3j h ALA 98 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1d3j h ALA 98 CO -0.04 0.59 -0.42 1.25 0.00 0.00 0.00 179.25 180.64 1d3j h LEU 99 N 0.83 0.74 -0.72 0.00 5.85 -0.35 -2.32 115.31 119.34 1d3j h LEU 99 Ca 0.17 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.56 1d3j h LEU 99 Cb 0.42 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1d3j h LEU 99 CO 0.01 1.06 0.46 0.40 -0.34 0.00 0.00 178.44 180.04 1d3j h ILE 100 N 0.56 1.14 -0.40 4.05 2.04 -0.00 -1.54 117.51 123.36 1d3j h ILE 100 Ca 0.04 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.64 1d3j h ILE 100 Cb 0.95 0.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 1d3j h ILE 100 CO 0.09 0.17 0.10 -1.13 0.00 0.00 0.00 178.15 177.37 1d3j h ASN 101 N 0.93 0.04 -0.75 1.72 -0.73 -1.00 0.55 115.58 116.34 1d3j h ASN 101 Ca 0.28 0.06 -0.03 0.00 1.87 0.00 0.00 56.30 58.48 1d3j h ASN 101 Cb -0.05 0.08 -0.04 0.00 0.27 0.00 0.00 38.32 38.59 1d3j h ASN 101 CO -0.08 0.06 0.35 0.24 -0.37 0.00 0.00 177.43 177.62 1d3j h MET 102 N 0.23 1.10 -0.34 6.67 2.86 -1.01 -1.39 114.93 123.05 1d3j h MET 102 Ca 0.19 -0.17 -0.10 0.00 -2.06 0.00 0.00 59.70 57.56 1d3j h MET 102 Cb 0.22 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 1d3j h MET 102 CO -0.24 0.86 -0.22 0.28 1.06 0.00 0.00 176.91 178.65 1d3j h VAL 103 N 1.09 1.27 -0.21 -2.22 2.07 -0.08 0.12 116.25 118.28 1d3j h VAL 103 Ca 0.26 -1.29 -0.07 0.00 0.82 0.00 0.00 66.70 66.42 1d3j h VAL 103 Cb 0.14 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 1d3j h VAL 103 CO -0.03 0.42 -0.18 0.15 0.02 0.00 0.00 177.57 177.96 1d3j h PHE 104 N 0.59 0.40 0.07 1.57 3.57 0.54 0.41 116.94 124.08 1d3j h PHE 104 Ca 0.09 -0.06 -0.26 0.00 3.53 0.00 0.00 57.97 61.26 1d3j h PHE 104 Cb 0.69 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1d3j h PHE 104 CO 0.03 0.53 -1.29 0.37 -2.23 0.00 0.00 178.31 175.72 1d3j h GLN 105 N 0.34 0.15 0.00 1.11 4.15 -0.66 -3.39 115.11 116.81 1d3j h GLN 105 Ca 0.06 -0.25 0.00 0.00 0.77 0.00 0.00 58.65 59.23 1d3j h GLN 105 Cb 0.51 0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.30 1d3j h GLN 105 CO 0.03 1.04 0.00 0.00 -1.93 0.00 0.00 178.83 177.98 1d3j n MET 106 N -3.40 0.05 0.00 1.69 0.00 0.37 -5.11 117.12 110.72 1d3j n MET 106 Ca -0.09 -0.35 0.00 0.00 0.00 0.00 0.00 57.70 57.26 1d3j n MET 106 Cb 1.00 -0.84 0.00 0.00 0.00 0.00 0.00 33.22 33.39 1d3j n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1d3j n GLY 107 N 0.11 -1.33 0.32 3.17 0.00 0.14 -3.82 105.19 103.78 1d3j n GLY 107 Ca 0.00 -1.44 -0.03 0.00 0.00 0.00 0.00 46.02 44.55 1d3j n GLY 107 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1d3j h GLU 108 N 0.00 0.97 -0.18 1.61 4.81 -1.92 -1.55 114.58 118.32 1d3j h GLU 108 Ca 0.00 -0.17 -0.02 0.00 -0.13 0.00 0.00 59.36 59.03 1d3j h GLU 108 Cb 0.00 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.22 1d3j h GLU 108 CO 0.00 0.81 0.02 1.15 -0.73 0.00 0.00 179.01 180.26 1d3j h THR 109 N 0.94 1.23 -0.35 0.32 2.02 -1.96 0.80 112.91 115.92 1d3j h THR 109 Ca 0.22 -0.76 0.05 0.00 0.77 0.00 0.00 66.41 66.69 1d3j h THR 109 Cb 0.23 1.38 -0.05 0.00 -1.74 0.00 0.00 68.15 67.98 1d3j h THR 109 CO -0.01 0.23 0.06 1.23 0.37 0.00 0.00 175.52 177.40 1d3j h GLY 110 N 0.09 0.40 0.91 2.16 0.00 -1.52 -2.09 103.07 103.01 1d3j h GLY 110 Ca 0.05 -0.02 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 1d3j h GLY 110 CO 0.00 -0.03 0.05 -2.08 0.00 0.00 0.00 176.54 174.48 1d3j h VAL 111 N 0.18 1.24 -0.01 4.60 2.07 -1.12 -1.77 116.25 121.44 1d3j h VAL 111 Ca 0.17 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.84 1d3j h VAL 111 Cb 0.19 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 1d3j h VAL 111 CO -0.22 0.28 0.08 0.00 0.02 0.00 0.00 177.57 177.73 1d3j h ALA 112 N 0.89 1.15 0.00 1.67 0.00 -0.52 0.45 119.26 122.91 1d3j h ALA 112 Ca 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1d3j h ALA 112 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1d3j h ALA 112 CO 0.01 -0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.58 1d3j n GLY 113 N -1.14 -0.96 2.58 0.00 0.00 -0.66 -3.96 105.19 101.03 1d3j n GLY 113 Ca -0.03 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 1d3j n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1d3j n PHE 114 N -1.43 2.55 -0.13 1.61 3.01 0.15 -4.76 117.46 118.47 1d3j n PHE 114 Ca 0.05 -2.56 -0.06 0.00 1.01 0.00 0.00 57.45 55.89 1d3j n PHE 114 Cb 0.16 -1.50 0.01 0.00 -0.01 0.00 0.00 39.48 38.14 1d3j n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1d3j h THR 115 N 2.33 0.34 -0.75 4.37 2.02 -1.82 -0.24 112.91 119.15 1d3j h THR 115 Ca 0.59 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.74 1d3j h THR 115 Cb 0.34 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.06 1d3j h THR 115 CO 1.29 0.00 0.33 0.78 0.37 0.00 0.00 175.52 178.29 1d3j h ASN 116 N -0.16 0.99 -0.34 4.18 2.35 -1.95 -2.14 115.58 118.52 1d3j h ASN 116 Ca 0.20 -0.13 -0.12 0.00 -0.55 0.00 0.00 56.30 55.70 1d3j h ASN 116 Cb 0.47 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1d3j h ASN 116 CO -0.52 0.86 -0.22 0.28 -1.65 0.00 0.00 177.43 176.18 1d3j h SER 117 N 1.07 0.85 -0.57 5.81 0.02 -1.61 -2.61 113.55 116.51 1d3j h SER 117 Ca 0.26 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1d3j h SER 117 Cb 0.15 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.43 1d3j h SER 117 CO -0.03 1.04 0.37 -0.07 -1.14 0.00 0.00 176.83 177.00 1d3j h LEU 118 N 0.72 0.66 -0.91 5.07 3.38 -0.96 0.23 115.31 123.50 1d3j h LEU 118 Ca 0.10 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.05 1d3j h LEU 118 Cb 0.76 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.29 1d3j h LEU 118 CO 0.06 0.49 0.60 -0.09 0.09 0.00 0.00 178.44 179.60 1d3j h ARG 119 N 0.77 1.19 -0.60 1.13 2.43 -1.24 0.50 114.38 118.56 1d3j h ARG 119 Ca 0.21 -0.07 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 1d3j h ARG 119 Cb -0.07 -0.27 -0.02 0.00 -0.42 0.00 0.00 29.97 29.19 1d3j h ARG 119 CO -0.04 0.79 0.01 0.52 -1.51 0.00 0.00 179.97 179.73 1d3j h MET 120 N 1.23 1.05 -0.42 0.20 2.86 -1.02 0.16 114.93 118.98 1d3j h MET 120 Ca 0.34 -0.33 -0.12 0.00 -2.06 0.00 0.00 59.70 57.52 1d3j h MET 120 Cb -0.13 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.42 1d3j h MET 120 CO -0.08 1.02 -0.24 -0.07 1.06 0.00 0.00 176.91 178.61 1d3j h LEU 121 N 0.95 0.87 -1.25 1.22 3.38 0.12 -2.37 115.31 118.23 1d3j h LEU 121 Ca 0.17 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.82 1d3j h LEU 121 Cb 0.54 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1d3j h LEU 121 CO 0.03 1.07 0.51 -0.61 0.09 0.00 0.00 178.44 179.53 1d3j h GLN 122 N 0.74 0.99 -0.00 1.13 4.15 -0.28 -0.74 115.11 121.10 1d3j h GLN 122 Ca 0.10 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1d3j h GLN 122 Cb 0.78 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.24 1d3j h GLN 122 CO 0.06 0.66 0.00 1.04 -1.93 0.00 0.00 178.83 178.66 1d3j n GLN 123 N -4.42 1.09 -2.41 1.69 6.02 0.50 -4.91 117.38 114.94 1d3j n GLN 123 Ca 0.09 -0.13 -0.17 0.00 -0.01 0.00 0.00 57.00 56.77 1d3j n GLN 123 Cb 0.05 -1.48 -0.00 0.00 1.02 0.00 0.00 30.24 29.83 1d3j n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1d3j n LYS 124 N -0.82 -1.76 -2.71 -1.09 5.02 -0.28 -4.96 118.16 111.56 1d3j n LYS 124 Ca 0.22 0.79 -0.43 0.00 -2.02 0.00 0.00 58.31 56.87 1d3j n LYS 124 Cb 0.14 -5.22 0.00 0.00 -0.02 0.00 0.00 35.03 29.94 1d3j n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1d3j n ARG 125 N -2.72 3.67 0.08 1.97 1.74 -0.93 -4.88 116.66 115.59 1d3j n ARG 125 Ca -0.18 -3.86 -0.12 0.00 -0.77 0.00 0.00 57.85 52.92 1d3j n ARG 125 Cb 0.64 -2.87 -0.05 0.00 -1.02 0.00 0.00 32.46 29.17 1d3j n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 1d3j h TRP 126 N 6.20 -0.60 -0.47 -1.55 -0.00 -1.90 -0.59 115.95 117.05 1d3j h TRP 126 Ca 0.32 0.02 -0.01 0.00 -0.00 0.00 0.00 58.89 59.22 1d3j h TRP 126 Cb 0.72 0.26 -0.02 0.00 -0.00 0.00 0.00 29.16 30.12 1d3j h TRP 126 CO 1.13 -0.32 0.25 -0.44 -0.00 0.00 0.00 178.44 179.06 1d3j h ASP 127 N -0.38 0.59 -0.84 -3.49 5.19 -1.90 -1.63 116.42 113.96 1d3j h ASP 127 Ca 0.05 -0.10 0.01 0.00 -0.62 0.00 0.00 57.03 56.38 1d3j h ASP 127 Cb 0.44 -0.15 -0.04 0.00 0.18 0.00 0.00 39.33 39.75 1d3j h ASP 127 CO -0.17 0.51 0.55 -0.33 -3.12 0.00 0.00 179.24 176.68 1d3j h GLU 128 N 0.62 1.09 -0.66 3.56 5.08 -1.91 -1.68 114.58 120.67 1d3j h GLU 128 Ca 0.16 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.39 1d3j h GLU 128 Cb 0.06 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1d3j h GLU 128 CO -0.03 0.72 0.14 0.00 -1.00 0.00 0.00 179.01 178.84 1d3j h ALA 129 N 1.32 0.87 -0.74 3.43 0.00 -0.91 -1.07 119.26 122.16 1d3j h ALA 129 Ca 0.31 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1d3j h ALA 129 Cb -0.11 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 1d3j h ALA 129 CO -0.08 0.61 0.36 0.00 0.00 0.00 0.00 179.25 180.14 1d3j h ALA 130 N 1.05 1.24 -0.09 0.00 0.00 -0.86 0.78 119.26 121.37 1d3j h ALA 130 Ca 0.20 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1d3j h ALA 130 Cb 0.40 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1d3j h ALA 130 CO 0.01 0.59 -0.08 0.28 0.00 0.00 0.00 179.25 180.04 1d3j h VAL 131 N 1.05 1.36 -0.94 0.00 2.07 -1.01 -2.75 116.25 116.03 1d3j h VAL 131 Ca 0.26 -1.22 0.02 0.00 0.82 0.00 0.00 66.70 66.58 1d3j h VAL 131 Cb 0.10 1.97 -0.05 0.00 -1.52 0.00 0.00 31.29 31.79 1d3j h VAL 131 CO -0.03 0.34 0.62 -1.13 0.02 0.00 0.00 177.57 177.39 1d3j h ASN 132 N -0.19 1.06 0.17 0.57 -0.73 -0.77 -2.03 115.58 113.65 1d3j h ASN 132 Ca 0.02 -0.02 -0.02 0.00 1.87 0.00 0.00 56.30 58.15 1d3j h ASN 132 Cb 0.59 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 38.92 1d3j h ASN 132 CO 0.02 0.75 -0.08 -0.07 -0.37 0.00 0.00 177.43 177.69 1d3j h LEU 133 N 1.25 0.00 -0.62 0.34 3.38 0.69 -2.21 115.31 118.14 1d3j h LEU 133 Ca 0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1d3j h LEU 133 Cb -0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1d3j h LEU 133 CO -0.09 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.52 1d3j h ALA 134 N 1.92 1.00 -1.43 1.53 0.00 -1.07 -3.36 119.26 117.86 1d3j h ALA 134 Ca -0.00 0.00 -0.74 0.00 0.00 0.00 0.00 54.91 54.17 1d3j h ALA 134 Cb 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 17.81 1d3j h ALA 134 CO 0.01 0.00 1.59 1.63 0.00 0.00 0.00 179.25 182.48 1d3j n LYS 135 N -2.77 3.43 -3.54 0.00 5.02 -0.83 -4.65 118.16 114.82 1d3j n LYS 135 Ca 0.03 -3.73 -0.16 0.00 -2.02 0.00 0.00 58.31 52.42 1d3j n LYS 135 Cb 0.38 -3.03 -0.05 0.00 -0.02 0.00 0.00 35.03 32.31 1d3j n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1d3j s SER 136 N 2.32 -0.57 0.23 4.39 1.04 -1.26 -5.01 113.70 114.84 1d3j s SER 136 Ca 0.42 0.46 -0.07 0.00 0.48 0.00 0.00 55.95 57.25 1d3j s SER 136 Cb 0.01 0.52 0.26 0.00 0.10 0.00 0.00 66.02 66.91 1d3j s SER 136 CO 0.01 -0.67 1.87 -0.09 0.98 0.00 0.00 173.24 175.34 1d3j h ARG 137 N 2.88 1.02 -0.63 4.02 2.43 -1.93 0.04 114.38 122.21 1d3j h ARG 137 Ca -0.29 -0.06 0.13 0.00 -0.81 0.00 0.00 59.98 58.95 1d3j h ARG 137 Cb 1.18 -0.23 -0.12 0.00 -0.42 0.00 0.00 29.97 30.38 1d3j h ARG 137 CO 0.39 0.67 -0.12 2.35 -1.51 0.00 0.00 179.97 181.76 1d3j h TRP 138 N 1.05 -0.26 -0.46 2.20 7.01 -1.94 0.38 115.95 123.93 1d3j h TRP 138 Ca 0.34 0.05 -0.11 0.00 2.11 0.00 0.00 58.89 61.28 1d3j h TRP 138 Cb 0.02 0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.29 1d3j h TRP 138 CO -0.02 -0.25 -0.15 -0.92 -2.79 0.00 0.00 178.44 174.31 1d3j h TYR 139 N 0.03 1.03 -0.38 2.65 3.20 -1.63 -0.55 116.97 121.32 1d3j h TYR 139 Ca 0.31 -0.24 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 1d3j h TYR 139 Cb 0.49 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.49 1d3j h TYR 139 CO -0.48 1.02 0.10 -0.91 -1.64 0.00 0.00 178.16 176.25 1d3j h ASN 140 N 0.75 0.51 0.43 -2.11 4.21 0.55 -2.66 115.58 117.26 1d3j h ASN 140 Ca 0.11 -0.07 -0.31 0.00 1.21 0.00 0.00 56.30 57.24 1d3j h ASN 140 Cb 0.71 -0.13 -0.01 0.00 -1.12 0.00 0.00 38.32 37.77 1d3j h ASN 140 CO 0.05 0.51 -1.57 1.56 -1.29 0.00 0.00 177.43 176.70 1d3j h GLN 141 N 0.55 0.25 -2.32 0.81 1.08 -0.05 -3.40 115.11 112.02 1d3j h GLN 141 Ca 0.13 -0.42 -0.59 0.00 -1.45 0.00 0.00 58.65 56.32 1d3j h GLN 141 Cb 0.20 0.16 -0.39 0.00 -0.05 0.00 0.00 27.48 27.40 1d3j h GLN 141 CO -0.00 1.10 -0.92 0.25 -0.95 0.00 0.00 178.83 178.31 1d3j n THR 142 N -3.44 -0.21 -0.18 -0.54 -2.24 -0.24 -4.96 114.28 102.48 1d3j n THR 142 Ca -0.17 -4.04 -0.08 0.00 -2.27 0.00 0.00 64.05 57.49 1d3j n THR 142 Cb 1.04 -1.88 0.02 0.00 -2.10 0.00 0.00 70.33 67.41 1d3j n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1d3j h PRO 143 N 4.88 0.74 -0.60 -0.78 0.13 -1.66 -0.43 132.00 134.27 1d3j h PRO 143 Ca 0.18 -0.11 -0.04 0.00 -0.87 0.00 0.00 66.00 65.15 1d3j h PRO 143 Cb 0.85 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 31.82 1d3j h PRO 143 CO 0.51 0.62 0.21 -0.91 -0.23 0.00 0.00 178.00 178.19 1d3j h ASN 144 N 0.69 0.86 -0.17 1.44 2.35 -1.93 -0.66 115.58 118.16 1d3j h ASN 144 Ca 0.18 -0.19 -0.07 0.00 -0.55 0.00 0.00 56.30 55.66 1d3j h ASN 144 Cb 0.12 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1d3j h ASN 144 CO -0.02 0.82 -0.17 -0.09 -1.65 0.00 0.00 177.43 176.32 1d3j h ARG 145 N 0.85 0.42 -0.97 0.81 2.43 -1.96 -2.14 114.38 113.82 1d3j h ARG 145 Ca 0.20 -0.22 0.11 0.00 -0.81 0.00 0.00 59.98 59.26 1d3j h ARG 145 Cb 0.26 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.74 1d3j h ARG 145 CO -0.01 0.79 0.62 0.00 -1.51 0.00 0.00 179.97 179.86 1d3j h ALA 146 N 0.63 1.56 -0.70 2.80 0.00 -0.96 0.35 119.26 122.93 1d3j h ALA 146 Ca 0.03 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1d3j h ALA 146 Cb 0.71 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.25 1d3j h ALA 146 CO 0.04 0.22 0.46 0.87 0.00 0.00 0.00 179.25 180.84 1d3j h LYS 147 N 0.97 0.89 -0.74 0.00 1.57 -0.89 0.71 116.57 119.09 1d3j h LYS 147 Ca 0.47 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 59.14 1d3j h LYS 147 Cb 0.46 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.53 1d3j h LYS 147 CO -0.23 0.59 0.24 0.00 -0.57 0.00 0.00 179.45 179.48 1d3j h ARG 148 N 0.92 1.14 -0.31 3.15 3.08 -0.32 -0.96 114.38 121.07 1d3j h ARG 148 Ca 0.27 -0.24 -0.10 0.00 0.07 0.00 0.00 59.98 59.98 1d3j h ARG 148 Cb -0.07 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.81 1d3j h ARG 148 CO -0.07 0.97 -0.18 0.28 -1.07 0.00 0.00 179.97 179.89 1d3j h VAL 149 N 1.09 1.29 -0.90 2.04 2.07 -0.54 -2.27 116.25 119.03 1d3j h VAL 149 Ca 0.24 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 1d3j h VAL 149 Cb 0.30 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 1d3j h VAL 149 CO -0.01 0.42 0.50 0.40 0.02 0.00 0.00 177.57 178.90 1d3j h ILE 150 N 0.42 1.26 -0.37 4.57 2.04 -0.79 -1.09 117.51 123.55 1d3j h ILE 150 Ca 0.06 -0.63 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 1d3j h ILE 150 Cb 0.72 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1d3j h ILE 150 CO 0.05 0.29 -0.04 0.74 0.00 0.00 0.00 178.15 179.19 1d3j h THR 151 N 1.26 1.22 -0.55 -0.27 2.02 -1.08 0.32 112.91 115.83 1d3j h THR 151 Ca 0.32 -0.93 -0.05 0.00 0.77 0.00 0.00 66.41 66.52 1d3j h THR 151 Cb 0.01 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1d3j h THR 151 CO -0.05 0.32 0.14 0.74 0.37 0.00 0.00 175.52 177.04 1d3j h THR 152 N 0.56 1.24 -0.23 3.16 2.02 -0.84 0.54 112.91 119.36 1d3j h THR 152 Ca 0.11 -0.86 -0.12 0.00 0.77 0.00 0.00 66.41 66.32 1d3j h THR 152 Cb 0.42 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1d3j h THR 152 CO 0.02 0.32 -0.35 -0.26 0.37 0.00 0.00 175.52 175.62 1d3j h PHE 153 N 0.78 0.58 -0.36 3.16 0.05 -0.51 0.21 116.94 120.85 1d3j h PHE 153 Ca 0.17 -0.15 -0.09 0.00 3.82 0.00 0.00 57.97 61.73 1d3j h PHE 153 Cb 0.33 -0.13 -0.01 0.00 2.00 0.00 0.00 35.95 38.14 1d3j h PHE 153 CO 0.02 0.79 -0.11 -0.09 -0.18 0.00 0.00 178.31 178.74 1d3j h ARG 154 N 0.43 0.71 0.00 1.51 2.43 0.25 -3.35 114.38 116.36 1d3j h ARG 154 Ca 0.05 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1d3j h ARG 154 Cb 0.81 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.33 1d3j h ARG 154 CO 0.07 0.88 -1.55 0.25 -1.51 0.00 0.00 179.97 178.11 1d3j n THR 155 N -4.37 0.00 -1.14 0.20 -2.24 0.18 -4.79 114.28 102.12 1d3j n THR 155 Ca -0.02 -0.27 -0.05 0.00 -2.27 0.00 0.00 64.05 61.44 1d3j n THR 155 Cb 0.36 0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 69.02 1d3j n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1d3j n GLY 156 N 1.37 0.65 3.57 3.38 0.00 0.71 -4.99 105.19 109.88 1d3j n GLY 156 Ca -0.00 -0.16 -0.27 0.00 0.00 0.00 0.00 46.02 45.59 1d3j n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1d3j s THR 157 N -1.81 1.03 -1.64 2.61 -4.23 -1.26 -4.80 115.64 105.55 1d3j s THR 157 Ca 0.00 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.67 1d3j s THR 157 Cb 0.00 -2.49 0.54 0.00 1.34 0.00 0.00 72.50 71.89 1d3j s THR 157 CO 0.00 0.00 1.44 0.79 -0.54 0.00 0.00 174.62 176.31 1d3j n TRP 158 N -0.94 0.97 -0.34 3.99 7.02 -1.26 -4.62 117.44 122.26 1d3j n TRP 158 Ca -0.08 -0.43 0.20 0.00 -1.02 0.00 0.00 57.50 56.17 1d3j n TRP 158 Cb 0.66 -0.10 0.44 0.00 -2.42 0.00 0.00 31.31 29.89 1d3j n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1d3j h ASP 159 N 3.32 0.58 0.55 -0.99 3.32 -1.96 0.48 116.42 121.73 1d3j h ASP 159 Ca 0.00 0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1d3j h ASP 159 Cb 0.98 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.55 1d3j h ASP 159 CO 0.09 0.09 0.00 0.00 -1.72 0.00 0.00 179.24 177.70 1d3j h ALA 160 N 1.69 1.00 -0.17 3.45 0.00 -1.89 -0.25 119.26 123.10 1d3j h ALA 160 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.54 1d3j h ALA 160 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1d3j h ALA 160 CO -0.41 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.50 1d3j n TYR 161 N -2.38 0.22 1.47 0.00 4.02 0.17 -4.97 117.16 115.68 1d3j n TYR 161 Ca 0.01 -0.22 0.14 0.00 -0.01 0.00 0.00 57.90 57.81 1d3j n TYR 161 Cb 0.18 -0.01 0.50 0.00 -0.02 0.00 0.00 39.34 39.99 1d3j n TYR 161 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48