#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhs s SER 2 N 0.00 5.43 -0.04 1.61 0.15 -1.26 -5.13 113.70 114.46 1uhs s SER 2 Ca 0.00 -0.47 0.06 0.00 0.70 0.00 0.00 55.95 56.24 1uhs s SER 2 Cb 0.00 -0.92 -0.01 0.00 -1.71 0.00 0.00 66.02 63.38 1uhs s SER 2 CO 0.00 -0.47 -0.22 -1.61 1.20 0.00 0.00 173.24 172.14 1uhs s GLU 3 N -4.10 2.10 0.00 5.44 0.41 -1.26 -4.85 118.70 116.44 1uhs s GLU 3 Ca 0.45 -0.79 0.00 0.00 -0.41 0.00 0.00 54.97 54.22 1uhs s GLU 3 Cb -0.07 -1.86 0.00 0.00 -1.78 0.00 0.00 34.13 30.42 1uhs s GLU 3 CO 0.28 0.38 0.00 0.41 -0.49 0.00 0.00 175.26 175.84 1uhs n GLY 4 N 2.87 2.01 2.46 -1.39 0.00 -1.26 -4.90 105.19 104.97 1uhs n GLY 4 Ca -0.17 -0.38 -0.03 0.00 0.00 0.00 0.00 46.02 45.44 1uhs n GLY 4 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uhs n ALA 5 N 0.00 -2.96 -1.52 4.61 0.00 -1.26 -5.02 120.51 114.35 1uhs n ALA 5 Ca 0.00 1.56 -0.14 0.00 0.00 0.00 0.00 53.44 54.86 1uhs n ALA 5 Cb 0.00 -3.28 0.15 0.00 0.00 0.00 0.00 19.45 16.32 1uhs n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uhs n ALA 6 N 1.74 -1.28 -3.43 0.00 0.00 -1.26 -5.01 120.51 111.26 1uhs n ALA 6 Ca -0.23 -1.17 -0.44 0.00 0.00 0.00 0.00 53.44 51.60 1uhs n ALA 6 Cb 0.36 -0.06 -0.06 0.00 0.00 0.00 0.00 19.45 19.69 1uhs n ALA 6 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1uhs s THR 7 N -2.88 4.83 0.83 0.00 -1.32 -1.26 -5.07 115.64 110.77 1uhs s THR 7 Ca 0.51 -1.86 -0.10 0.00 -1.21 0.00 0.00 61.69 59.02 1uhs s THR 7 Cb -0.02 -4.10 0.09 0.00 -1.51 0.00 0.00 72.50 66.96 1uhs s THR 7 CO 0.36 -0.86 1.12 -0.04 -2.21 0.00 0.00 174.62 172.98 1uhs s MET 8 N 1.16 1.75 0.66 7.08 -1.94 -1.26 -5.04 119.30 121.71 1uhs s MET 8 Ca 0.07 1.33 -0.03 0.00 -1.71 0.00 0.00 55.69 55.36 1uhs s MET 8 Cb -0.25 -1.83 0.07 0.00 2.01 0.00 0.00 34.83 34.84 1uhs s MET 8 CO -0.01 -2.05 0.93 0.95 -0.01 0.00 0.00 175.02 174.83 1uhs s THR 9 N -2.79 2.37 0.20 2.05 -4.23 -1.26 -4.89 115.64 107.10 1uhs s THR 9 Ca 0.64 -0.49 -0.12 0.00 -1.18 0.00 0.00 61.69 60.54 1uhs s THR 9 Cb -0.20 -2.88 0.12 0.00 1.34 0.00 0.00 72.50 70.88 1uhs s THR 9 CO 0.57 0.00 1.86 -0.33 -0.54 0.00 0.00 174.62 176.18 1uhs h GLU 10 N -0.38 0.87 -0.10 3.99 5.08 -1.98 -0.43 114.58 121.62 1uhs h GLU 10 Ca -0.41 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 57.89 1uhs h GLU 10 Cb 1.29 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1uhs h GLU 10 CO 0.51 0.57 0.05 -0.44 -1.00 0.00 0.00 179.01 178.70 1uhs h ASP 11 N 0.89 0.12 0.12 1.42 5.19 -1.97 0.55 116.42 122.74 1uhs h ASP 11 Ca 0.25 -0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.42 1uhs h ASP 11 Cb -0.09 -0.03 0.02 0.00 0.18 0.00 0.00 39.33 39.42 1uhs h ASP 11 CO -0.06 0.10 -0.99 1.56 -3.12 0.00 0.00 179.24 176.73 1uhs h GLN 12 N 0.14 0.47 -0.21 3.56 4.20 -1.62 -3.06 115.11 118.59 1uhs h GLN 12 Ca 0.04 -0.66 -0.20 0.00 0.06 0.00 0.00 58.65 57.89 1uhs h GLN 12 Cb 0.02 0.22 0.01 0.00 0.30 0.00 0.00 27.48 28.03 1uhs h GLN 12 CO -0.01 1.29 -0.65 0.28 -0.67 0.00 0.00 178.83 179.07 1uhs h VAL 13 N -0.03 1.28 -0.40 -0.54 2.07 -0.64 -0.08 116.25 117.91 1uhs h VAL 13 Ca -0.16 -1.84 0.03 0.00 0.82 0.00 0.00 66.70 65.55 1uhs h VAL 13 Cb 1.73 1.85 -0.03 0.00 -1.52 0.00 0.00 31.29 33.32 1uhs h VAL 13 CO 0.19 0.59 0.20 -0.33 0.02 0.00 0.00 177.57 178.24 1uhs h GLU 14 N 0.55 0.39 0.00 1.57 5.08 -0.03 0.24 114.58 122.38 1uhs h GLU 14 Ca -0.02 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.14 1uhs h GLU 14 Cb 1.27 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 1uhs h GLU 14 CO 0.14 0.26 -0.84 0.82 -1.00 0.00 0.00 179.01 178.39 1uhs h ILE 15 N 0.40 1.53 -0.04 3.13 2.04 -1.57 -1.19 117.51 121.82 1uhs h ILE 15 Ca 0.17 -2.95 -0.14 0.00 1.00 0.00 0.00 64.86 62.94 1uhs h ILE 15 Cb 0.08 2.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.77 1uhs h ILE 15 CO -0.12 0.82 -0.61 -0.07 0.00 0.00 0.00 178.15 178.17 1uhs h LEU 16 N 0.00 0.15 0.03 1.44 3.38 -0.53 -2.70 115.31 117.07 1uhs h LEU 16 Ca -0.01 -0.08 -0.30 0.00 0.09 0.00 0.00 57.88 57.57 1uhs h LEU 16 Cb 1.56 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 42.22 1uhs h LEU 16 CO 0.11 0.72 -1.73 -0.33 0.09 0.00 0.00 178.44 177.30 1uhs h GLU 17 N 0.09 0.06 -0.10 1.13 5.08 -0.56 -3.34 114.58 116.94 1uhs h GLU 17 Ca -0.01 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.19 1uhs h GLU 17 Cb 1.10 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 1uhs h GLU 17 CO 0.09 0.66 -0.24 -0.92 -1.00 0.00 0.00 179.01 177.60 1uhs h TYR 18 N 0.02 0.18 -0.63 4.33 5.03 -1.22 -2.24 116.97 122.44 1uhs h TYR 18 Ca -0.30 -0.03 -0.20 0.00 2.58 0.00 0.00 58.73 60.78 1uhs h TYR 18 Cb 2.01 -0.05 -0.12 0.00 1.55 0.00 0.00 36.73 40.13 1uhs h TYR 18 CO 0.02 0.41 0.25 0.09 -1.32 0.00 0.00 178.16 177.60 1uhs n ASN 19 N -4.19 4.30 0.00 -2.11 3.02 -1.02 -2.98 115.26 112.27 1uhs n ASN 19 Ca -0.01 -3.02 0.00 0.00 -0.03 0.00 0.00 54.58 51.52 1uhs n ASN 19 Cb 0.34 -0.71 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 1uhs n ASN 19 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1uhs n PHE 20 N -0.12 0.00 -0.02 3.10 7.35 -0.85 -3.86 117.46 123.07 1uhs n PHE 20 Ca 0.35 0.00 0.01 0.00 -0.76 0.00 0.00 57.45 57.04 1uhs n PHE 20 Cb 1.23 0.00 -0.06 0.00 0.35 0.00 0.00 39.48 41.00 1uhs n PHE 20 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1uhs n ASN 21 N -1.80 3.29 -0.08 -2.13 3.02 -1.17 -4.02 115.26 112.37 1uhs n ASN 21 Ca 0.00 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.37 1uhs n ASN 21 Cb 0.38 1.04 -0.13 0.00 -0.61 0.00 0.00 39.78 40.46 1uhs n ASN 21 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1uhs n LYS 22 N -1.98 0.69 -0.00 3.52 4.01 -1.16 -4.77 118.16 118.47 1uhs n LYS 22 Ca -0.06 0.18 -0.00 0.00 -0.51 0.00 0.00 58.31 57.92 1uhs n LYS 22 Cb 0.43 -1.59 -0.00 0.00 -0.51 0.00 0.00 35.03 33.36 1uhs n LYS 22 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1uhs h VAL 23 N 0.02 0.00 -2.23 -0.18 2.07 -1.78 -3.50 116.25 110.65 1uhs h VAL 23 Ca -0.52 -0.02 0.10 0.00 0.82 0.00 0.00 66.70 67.08 1uhs h VAL 23 Cb 1.97 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 1uhs h VAL 23 CO -0.02 0.00 0.37 -0.46 0.02 0.00 0.00 177.57 177.48 1uhs n ASN 24 N -2.23 -1.13 -0.03 0.57 0.23 -1.25 -5.00 115.26 106.41 1uhs n ASN 24 Ca -0.00 -1.61 -0.04 0.00 -0.53 0.00 0.00 54.58 52.40 1uhs n ASN 24 Cb 0.00 1.84 -0.03 0.00 -2.08 0.00 0.00 39.78 39.52 1uhs n ASN 24 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1uhs n LYS 25 N -0.46 0.83 -3.23 -3.83 4.01 -1.26 -3.74 118.16 110.48 1uhs n LYS 25 Ca -0.02 0.03 -0.28 0.00 -0.51 0.00 0.00 58.31 57.53 1uhs n LYS 25 Cb 0.37 -1.13 -0.06 0.00 -0.51 0.00 0.00 35.03 33.70 1uhs n LYS 25 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 1uhs n HIS 26 N -2.58 3.66 -2.20 2.13 8.25 -1.26 -4.93 115.22 118.30 1uhs n HIS 26 Ca -0.11 -3.96 -0.34 0.00 -0.26 0.00 0.00 57.72 53.06 1uhs n HIS 26 Cb 0.63 -0.60 0.00 0.00 1.12 0.00 0.00 29.99 31.14 1uhs n HIS 26 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1uhs s PRO 27 N -2.86 3.40 0.72 -0.41 0.04 -1.26 -5.06 135.00 129.57 1uhs s PRO 27 Ca 0.42 1.36 -0.08 0.00 0.04 0.00 0.00 61.00 62.74 1uhs s PRO 27 Cb 0.18 -2.04 0.06 0.00 0.04 0.00 0.00 34.50 32.75 1uhs s PRO 27 CO -0.04 -0.76 1.04 -0.51 0.04 0.00 0.00 177.00 176.77 1uhs s ASP 28 N -2.32 4.80 0.59 6.66 1.11 -1.26 -4.81 116.67 121.44 1uhs s ASP 28 Ca 0.67 0.53 0.29 0.00 0.18 0.00 0.00 52.55 54.22 1uhs s ASP 28 Cb -0.18 -1.17 1.61 0.00 1.07 0.00 0.00 42.92 44.25 1uhs s ASP 28 CO 0.30 -1.63 2.04 -0.65 1.18 0.00 0.00 175.17 176.42 1uhs h PRO 29 N -0.67 0.00 0.13 8.23 0.11 -1.97 -0.27 132.00 137.56 1uhs h PRO 29 Ca -0.45 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 1uhs h PRO 29 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 1uhs h PRO 29 CO 0.61 0.00 -0.06 1.15 -0.21 0.00 0.00 178.00 179.49 1uhs h THR 30 N 0.00 1.02 -0.08 -1.15 2.02 -2.01 -2.61 112.91 110.10 1uhs h THR 30 Ca 0.12 -0.67 -0.17 0.00 0.77 0.00 0.00 66.41 66.46 1uhs h THR 30 Cb 0.67 1.44 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 1uhs h THR 30 CO -0.00 0.16 -0.68 0.74 0.37 0.00 0.00 175.52 176.11 1uhs h THR 31 N -0.50 1.38 -0.20 3.16 2.02 -1.75 -3.06 112.91 113.97 1uhs h THR 31 Ca -0.02 -2.09 0.03 0.00 0.77 0.00 0.00 66.41 65.10 1uhs h THR 31 Cb 0.39 2.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.86 1uhs h THR 31 CO 0.03 0.62 0.14 0.25 0.37 0.00 0.00 175.52 176.93 1uhs h LEU 32 N 0.24 0.12 -1.15 2.58 5.85 -1.07 -0.67 115.31 121.21 1uhs h LEU 32 Ca -0.02 -0.00 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 1uhs h LEU 32 Cb 1.23 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 1uhs h LEU 32 CO 0.11 0.08 -0.35 0.00 -0.34 0.00 0.00 178.44 177.95 1uhs h LEU 34 N 0.12 0.87 -0.72 0.00 3.38 -1.22 -1.89 115.31 115.85 1uhs h LEU 34 Ca 0.01 -0.50 -0.14 0.00 0.09 0.00 0.00 57.88 57.35 1uhs h LEU 34 Cb 0.67 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1uhs h LEU 34 CO 0.05 1.28 -0.60 0.40 0.09 0.00 0.00 178.44 179.66 1uhs h ILE 35 N 0.57 1.40 0.04 1.22 2.04 -1.30 -2.53 117.51 118.95 1uhs h ILE 35 Ca -0.01 -2.00 -0.00 0.00 1.00 0.00 0.00 64.86 63.85 1uhs h ILE 35 Cb 1.22 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 39.34 1uhs h ILE 35 CO 0.13 0.58 -0.02 0.00 0.00 0.00 0.00 178.15 178.84 1uhs h ALA 36 N 1.28 -0.06 -0.14 1.87 0.00 -1.29 -2.87 119.26 118.06 1uhs h ALA 36 Ca -0.01 -0.30 0.01 0.00 0.00 0.00 0.00 54.91 54.62 1uhs h ALA 36 Cb 1.08 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1uhs h ALA 36 CO 0.09 -0.21 0.09 0.00 0.00 0.00 0.00 179.25 179.22 1uhs h ALA 37 N 0.18 1.95 0.16 0.00 0.00 -1.37 0.95 119.26 121.13 1uhs h ALA 37 Ca -0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1uhs h ALA 37 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1uhs h ALA 37 CO 0.01 0.03 -0.08 1.49 0.00 0.00 0.00 179.25 180.70 1uhs h GLU 38 N 0.14 -0.21 -0.24 0.00 4.81 -1.46 -3.27 114.58 114.36 1uhs h GLU 38 Ca 0.05 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1uhs h GLU 38 Cb 0.05 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 1uhs h GLU 38 CO -0.01 -0.14 0.08 0.00 -0.73 0.00 0.00 179.01 178.21 1uhs h ALA 39 N -1.83 1.70 0.00 2.92 0.00 -1.46 -3.46 119.26 117.13 1uhs h ALA 39 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1uhs h ALA 39 Cb 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1uhs h ALA 39 CO 0.04 0.24 0.00 0.41 0.00 0.00 0.00 179.25 179.94 1uhs n GLY 40 N -1.28 1.94 1.26 0.00 0.00 0.12 -4.78 105.19 102.45 1uhs n GLY 40 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1uhs n GLY 40 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uhs n LEU 41 N 0.00 0.00 -4.72 0.99 4.77 0.29 -4.97 117.00 113.37 1uhs n LEU 41 Ca 0.00 -1.12 -0.23 0.00 -0.03 0.00 0.00 56.01 54.63 1uhs n LEU 41 Cb 0.00 0.19 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1uhs n LEU 41 CO 0.00 -0.16 -0.25 0.42 -1.33 0.00 0.00 177.39 176.07 1uhs s THR 42 N -1.76 3.51 0.38 -5.08 -4.23 -1.26 -3.48 115.64 103.71 1uhs s THR 42 Ca 0.02 -1.72 0.05 0.00 -1.18 0.00 0.00 61.69 58.85 1uhs s THR 42 Cb 0.00 -3.01 0.26 0.00 1.34 0.00 0.00 72.50 71.09 1uhs s THR 42 CO 0.01 -0.30 2.02 -0.33 -0.54 0.00 0.00 174.62 175.49 1uhs h GLU 43 N 1.68 0.68 -0.03 3.99 3.07 -1.92 0.25 114.58 122.29 1uhs h GLU 43 Ca -0.45 -0.05 -0.05 0.00 -0.50 0.00 0.00 59.36 58.31 1uhs h GLU 43 Cb 1.25 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 29.00 1uhs h GLU 43 CO 0.61 0.47 -0.23 1.49 -1.40 0.00 0.00 179.01 179.95 1uhs h GLU 44 N 0.69 0.05 0.04 2.33 4.81 -1.95 0.58 114.58 121.14 1uhs h GLU 44 Ca 0.19 -0.01 -0.28 0.00 -0.13 0.00 0.00 59.36 59.12 1uhs h GLU 44 Cb -0.05 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.29 1uhs h GLU 44 CO -0.04 0.28 -1.53 1.96 -0.73 0.00 0.00 179.01 178.95 1uhs h GLN 45 N 0.05 0.08 -0.00 1.92 4.20 -1.65 -3.33 115.11 116.38 1uhs h GLN 45 Ca 0.01 -0.15 -0.16 0.00 0.06 0.00 0.00 58.65 58.41 1uhs h GLN 45 Cb 0.43 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 1uhs h GLN 45 CO 0.03 0.82 -0.77 1.15 -0.67 0.00 0.00 178.83 179.39 1uhs h THR 46 N 0.02 1.53 -0.68 -0.54 2.02 -0.71 -3.19 112.91 111.36 1uhs h THR 46 Ca -0.22 -2.58 -0.05 0.00 0.77 0.00 0.00 66.41 64.33 1uhs h THR 46 Cb 1.96 2.40 -0.03 0.00 -1.74 0.00 0.00 68.15 70.74 1uhs h THR 46 CO 0.11 0.74 0.24 -0.61 0.37 0.00 0.00 175.52 176.37 1uhs h GLN 47 N 0.03 1.03 -0.52 6.66 4.15 -1.01 -1.46 115.11 123.99 1uhs h GLN 47 Ca -0.01 -0.20 -0.08 0.00 0.77 0.00 0.00 58.65 59.13 1uhs h GLN 47 Cb 1.36 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 28.86 1uhs h GLN 47 CO 0.10 0.87 -0.00 0.87 -1.93 0.00 0.00 178.83 178.74 1uhs h LYS 48 N 1.00 0.88 -0.01 1.69 1.79 -1.66 -1.18 116.57 119.08 1uhs h LYS 48 Ca 0.23 -0.25 -0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1uhs h LYS 48 Cb 0.25 -0.09 -0.00 0.00 -1.58 0.00 0.00 32.23 30.80 1uhs h LYS 48 CO -0.01 0.88 -0.01 2.35 -1.08 0.00 0.00 179.45 181.58 1uhs h TRP 49 N 0.81 0.02 -0.59 -1.35 7.01 -1.48 -0.11 115.95 120.27 1uhs h TRP 49 Ca 0.15 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.16 1uhs h TRP 49 Cb 0.49 -0.01 -0.03 0.00 -2.10 0.00 0.00 29.16 27.51 1uhs h TRP 49 CO 0.03 0.45 0.38 0.74 -2.79 0.00 0.00 178.44 177.25 1uhs h PHE 50 N -0.40 0.72 -0.14 2.65 0.04 -1.23 0.21 116.94 118.79 1uhs h PHE 50 Ca 0.00 0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.76 1uhs h PHE 50 Cb 0.44 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 38.34 1uhs h PHE 50 CO 0.07 0.44 -0.01 -0.22 -0.60 0.00 0.00 178.31 177.99 1uhs h LYS 51 N 0.77 0.26 -0.71 1.51 3.11 -1.23 -0.51 116.57 119.77 1uhs h LYS 51 Ca 0.22 -0.09 -0.02 0.00 -2.81 0.00 0.00 60.65 57.95 1uhs h LYS 51 Cb -0.06 -0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 31.11 1uhs h LYS 51 CO -0.06 0.51 0.36 1.96 -2.81 0.00 0.00 179.45 179.41 1uhs h GLN 52 N -0.03 1.01 -0.00 1.90 4.20 -0.81 -2.39 115.11 118.98 1uhs h GLN 52 Ca 0.04 -0.14 -0.10 0.00 0.06 0.00 0.00 58.65 58.51 1uhs h GLN 52 Cb 0.41 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1uhs h GLN 52 CO 0.01 0.78 -0.48 -0.09 -0.67 0.00 0.00 178.83 178.38 1uhs h ARG 53 N 0.99 0.01 -0.11 1.46 9.65 -0.55 -2.87 114.38 122.95 1uhs h ARG 53 Ca 0.25 -0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 59.10 1uhs h ARG 53 Cb 0.09 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.67 1uhs h ARG 53 CO -0.03 0.49 -0.04 -0.07 2.80 0.00 0.00 179.97 183.11 1uhs h LEU 54 N 0.01 0.15 -2.02 3.80 3.38 -0.56 -1.87 115.31 118.19 1uhs h LEU 54 Ca -0.00 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1uhs h LEU 54 Cb 0.86 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1uhs h LEU 54 CO 0.06 0.23 0.03 0.00 0.09 0.00 0.00 178.44 178.84 1uhs h ALA 55 N 1.80 2.01 0.00 1.53 0.00 -1.37 -1.29 119.26 121.94 1uhs h ALA 55 Ca 0.04 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1uhs h ALA 55 Cb 0.19 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1uhs h ALA 55 CO 0.01 -0.04 -1.21 0.93 0.00 0.00 0.00 179.25 178.93 1uhs h GLU 56 N 0.00 0.00 -0.18 0.00 4.39 -1.49 -3.34 114.58 113.95 1uhs h GLU 56 Ca 0.02 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.50 1uhs h GLU 56 Cb 0.07 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.72 1uhs h GLU 56 CO -0.00 0.33 -0.73 2.35 -1.16 0.00 0.00 179.01 179.80 1uhs h TRP 57 N 0.00 1.05 -0.39 4.33 7.01 -0.98 -2.52 115.95 124.44 1uhs h TRP 57 Ca -0.12 -0.44 0.02 0.00 2.11 0.00 0.00 58.89 60.46 1uhs h TRP 57 Cb 1.53 -0.17 -0.03 0.00 -2.10 0.00 0.00 29.16 28.39 1uhs h TRP 57 CO 0.00 1.27 0.22 0.00 -2.79 0.00 0.00 178.44 177.14 1uhs h ARG 58 N 0.56 0.43 -0.50 2.65 3.08 -1.42 0.53 114.38 119.70 1uhs h ARG 58 Ca -0.04 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.89 1uhs h ARG 58 Cb 1.35 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 1uhs h ARG 58 CO 0.15 0.28 -0.06 0.00 -1.07 0.00 0.00 179.97 179.27 1uhs h ARG 59 N 0.44 0.92 0.72 0.04 2.47 -1.68 0.35 114.38 117.64 1uhs h ARG 59 Ca 0.16 -0.32 -0.04 0.00 -1.26 0.00 0.00 59.98 58.52 1uhs h ARG 59 Cb 0.04 -0.07 0.01 0.00 -1.65 0.00 0.00 29.97 28.30 1uhs h ARG 59 CO -0.09 0.98 -0.35 0.66 0.56 0.00 0.00 179.97 181.73 1uhs h SER 60 N 0.78 -0.82 0.42 7.04 4.64 -1.10 -3.35 113.55 121.16 1uhs h SER 60 Ca 0.13 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 1uhs h SER 60 Cb 0.60 0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1uhs h SER 60 CO 0.04 -0.54 -0.20 -0.33 -0.87 0.00 0.00 176.83 174.93 1uhs h GLU 61 N -1.07 -0.55 -0.58 4.77 4.39 -0.97 -3.50 114.58 117.07 1uhs h GLU 61 Ca -0.10 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1uhs h GLU 61 Cb 0.74 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.52 1uhs h GLU 61 CO 0.16 -0.37 0.00 0.41 -1.16 0.00 0.00 179.01 178.06 1uhs n GLY 62 N -0.25 -0.29 3.46 -3.84 0.00 0.12 -5.08 105.19 99.32 1uhs n GLY 62 Ca -0.07 -0.81 -0.27 0.00 0.00 0.00 0.00 46.02 44.87 1uhs n GLY 62 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uhs s LEU 63 N 0.00 2.56 1.10 0.99 1.02 -1.26 -5.08 118.68 118.01 1uhs s LEU 63 Ca 0.00 -0.77 -0.15 0.00 0.02 0.00 0.00 54.13 53.23 1uhs s LEU 63 Cb 0.00 -1.31 0.24 0.00 0.02 0.00 0.00 46.19 45.14 1uhs s LEU 63 CO 0.00 0.13 1.10 -2.16 0.02 0.00 0.00 176.35 175.43 1uhs s PRO 64 N -2.61 -0.39 -0.16 1.29 0.04 -1.26 -5.06 135.00 126.85 1uhs s PRO 64 Ca 0.21 0.25 0.01 0.00 0.04 0.00 0.00 61.00 61.51 1uhs s PRO 64 Cb -0.08 -1.66 0.02 0.00 0.04 0.00 0.00 34.50 32.81 1uhs s PRO 64 CO 0.11 -3.22 -0.17 0.45 0.04 0.00 0.00 177.00 174.20 1uhs s SER 65 N -3.62 2.90 0.10 6.66 0.15 -1.26 -5.12 113.70 113.52 1uhs s SER 65 Ca 0.68 -0.57 0.05 0.00 0.70 0.00 0.00 55.95 56.81 1uhs s SER 65 Cb -0.15 -1.33 -0.04 0.00 -1.71 0.00 0.00 66.02 62.80 1uhs s SER 65 CO 0.57 -0.03 -0.12 -0.70 1.20 0.00 0.00 173.24 174.16 1uhs s GLU 66 N 1.37 0.91 -0.27 5.44 2.56 -1.26 -5.06 118.70 122.39 1uhs s GLU 66 Ca 0.05 -1.16 -0.03 0.00 0.00 0.00 0.00 54.97 53.82 1uhs s GLU 66 Cb -0.13 -0.72 -0.15 0.00 2.00 0.00 0.00 34.13 35.13 1uhs s GLU 66 CO -0.11 0.13 -0.27 0.00 -0.56 0.00 0.00 175.26 174.44 1uhs s ARG 68 N -2.51 3.83 0.63 0.00 3.00 -1.26 -5.05 118.95 117.59 1uhs s ARG 68 Ca -0.36 0.33 -0.11 0.00 -1.00 0.00 0.00 55.73 54.60 1uhs s ARG 68 Cb 0.11 -3.77 0.16 0.00 0.00 0.00 0.00 34.95 31.45 1uhs s ARG 68 CO 0.56 -0.72 0.46 -1.13 0.00 0.00 0.00 175.30 174.47 1uhs n SER 69 N 6.16 -2.26 -4.77 -2.12 3.41 -1.26 -5.06 113.62 107.72 1uhs n SER 69 Ca 0.01 -0.61 -0.23 0.00 -0.26 0.00 0.00 58.87 57.78 1uhs n SER 69 Cb 0.48 -0.47 -0.06 0.00 -0.26 0.00 0.00 64.21 63.91 1uhs n SER 69 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1uhs s VAL 70 N -1.73 2.89 -0.05 -3.33 -7.23 -1.26 -5.14 120.40 104.56 1uhs s VAL 70 Ca 0.32 -1.60 0.04 0.00 -1.81 0.00 0.00 61.98 58.93 1uhs s VAL 70 Cb -0.04 -3.01 0.00 0.00 0.56 0.00 0.00 36.38 33.89 1uhs s VAL 70 CO 0.26 -0.12 -0.16 0.42 -0.31 0.00 0.00 175.10 175.18 1uhs s THR 71 N -2.45 1.40 0.00 5.32 -4.23 -1.26 -5.31 115.64 109.11 1uhs s THR 71 Ca 0.40 -0.68 0.00 0.00 -1.18 0.00 0.00 61.69 60.23 1uhs s THR 71 Cb -0.02 -1.22 0.00 0.00 1.34 0.00 0.00 72.50 72.60 1uhs s THR 71 CO 0.24 0.41 0.00 -0.67 -0.54 0.00 0.00 174.62 174.06