#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uhs n SER 2 N 0.00 -6.11 -0.11 1.61 7.64 -1.26 -4.90 113.62 110.49 1uhs n SER 2 Ca 0.00 -0.29 -0.22 0.00 1.01 0.00 0.00 58.87 59.37 1uhs n SER 2 Cb 0.00 -4.92 -0.09 0.00 -1.01 0.00 0.00 64.21 58.19 1uhs n SER 2 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1uhs n GLU 3 N -4.00 0.51 0.00 1.43 2.13 -1.26 -5.11 120.64 114.33 1uhs n GLU 3 Ca -0.11 0.19 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1uhs n GLU 3 Cb 0.62 -1.36 0.00 0.00 0.27 0.00 0.00 31.44 30.97 1uhs n GLU 3 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1uhs n GLY 4 N 1.81 2.83 3.48 8.31 0.00 -1.26 -5.02 105.19 115.35 1uhs n GLY 4 Ca -0.44 0.04 -0.22 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.00 -1.35 -2.98 4.61 0.00 -1.26 -4.98 120.51 111.54 1uhs n ALA 5 Ca 0.00 0.33 -0.37 0.00 0.00 0.00 0.00 53.44 53.40 1uhs n ALA 5 Cb 0.00 -4.90 -0.12 0.00 0.00 0.00 0.00 19.45 14.43 1uhs n ALA 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uhs s ALA 6 N -3.31 3.22 -0.35 0.00 0.00 -1.26 -5.06 121.76 115.00 1uhs s ALA 6 Ca 0.48 -1.16 0.02 0.00 0.00 0.00 0.00 51.96 51.31 1uhs s ALA 6 Cb -0.21 -2.17 0.11 0.00 0.00 0.00 0.00 23.12 20.85 1uhs s ALA 6 CO 0.70 -0.55 0.10 0.95 0.00 0.00 0.00 175.76 176.95 1uhs s THR 7 N 1.63 1.81 0.34 0.00 -4.23 -1.26 -5.10 115.64 108.83 1uhs s THR 7 Ca 0.06 -2.16 0.03 0.00 -1.18 0.00 0.00 61.69 58.44 1uhs s THR 7 Cb -0.15 -2.33 -0.04 0.00 1.34 0.00 0.00 72.50 71.31 1uhs s THR 7 CO 0.05 -0.66 0.12 -0.04 -0.54 0.00 0.00 174.62 173.55 1uhs s MET 8 N 0.97 1.70 0.46 3.99 -1.94 -1.26 -5.17 119.30 118.05 1uhs s MET 8 Ca 0.12 -1.99 0.07 0.00 -1.71 0.00 0.00 55.69 52.17 1uhs s MET 8 Cb -0.19 -0.43 -0.01 0.00 2.01 0.00 0.00 34.83 36.20 1uhs s MET 8 CO -0.12 -0.40 0.30 0.95 -0.01 0.00 0.00 175.02 175.75 1uhs s THR 9 N -3.42 2.15 0.18 2.05 -4.23 -1.26 -5.03 115.64 106.08 1uhs s THR 9 Ca 0.32 -1.54 -0.06 0.00 -1.18 0.00 0.00 61.69 59.23 1uhs s THR 9 Cb 0.05 -2.69 -0.04 0.00 1.34 0.00 0.00 72.50 71.16 1uhs s THR 9 CO 0.16 0.00 1.51 -0.33 -0.54 0.00 0.00 174.62 175.42 1uhs h GLU 10 N 1.09 0.72 -0.11 3.99 4.39 -2.02 -1.89 114.58 120.74 1uhs h GLU 10 Ca -0.40 -0.40 -0.02 0.00 0.34 0.00 0.00 59.36 58.87 1uhs h GLU 10 Cb 1.28 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.94 1uhs h GLU 10 CO 0.62 1.02 -0.04 -0.44 -1.16 0.00 0.00 179.01 179.02 1uhs h ASP 11 N 0.57 0.15 0.22 1.42 3.32 -1.99 0.63 116.42 120.74 1uhs h ASP 11 Ca 0.04 -0.02 -0.31 0.00 0.02 0.00 0.00 57.03 56.76 1uhs h ASP 11 Cb 1.01 -0.04 0.03 0.00 0.22 0.00 0.00 39.33 40.55 1uhs h ASP 11 CO 0.10 0.22 -1.40 1.56 -1.72 0.00 0.00 179.24 177.99 1uhs h GLN 12 N 0.16 0.46 -0.54 3.56 4.20 -1.88 -3.27 115.11 117.81 1uhs h GLN 12 Ca 0.04 -0.79 -0.10 0.00 0.06 0.00 0.00 58.65 57.86 1uhs h GLN 12 Cb 0.18 0.30 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1uhs h GLN 12 CO 0.01 1.38 -0.05 0.28 -0.67 0.00 0.00 178.83 179.77 1uhs h VAL 13 N 0.02 1.26 -0.11 -0.54 2.07 -1.03 0.12 116.25 118.04 1uhs h VAL 13 Ca -0.25 -1.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.09 1uhs h VAL 13 Cb 2.05 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.71 1uhs h VAL 13 CO 0.23 0.42 0.07 -0.33 0.02 0.00 0.00 177.57 177.98 1uhs h GLU 14 N 0.88 0.15 0.01 1.57 5.08 -0.99 0.23 114.58 121.51 1uhs h GLU 14 Ca 0.15 -0.01 -0.30 0.00 -1.00 0.00 0.00 59.36 58.20 1uhs h GLU 14 Cb 0.59 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.76 1uhs h GLU 14 CO 0.04 0.10 -1.77 -0.89 -1.00 0.00 0.00 179.01 175.49 1uhs n ILE 15 N -4.51 1.62 0.07 3.13 5.41 -1.02 -2.78 119.36 121.27 1uhs n ILE 15 Ca -0.01 -0.78 -0.08 0.00 1.00 0.00 0.00 62.75 62.87 1uhs n ILE 15 Cb 0.09 -1.08 0.05 0.00 -0.71 0.00 0.00 39.64 37.99 1uhs n ILE 15 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1uhs h LEU 16 N 0.01 0.37 0.07 1.39 3.38 -0.23 -2.73 115.31 117.57 1uhs h LEU 16 Ca -0.31 -0.24 -0.27 0.00 0.09 0.00 0.00 57.88 57.15 1uhs h LEU 16 Cb 2.03 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.65 1uhs h LEU 16 CO 0.08 0.96 -1.31 -0.33 0.09 0.00 0.00 178.44 177.93 1uhs h GLU 17 N 0.21 0.14 0.00 1.13 5.08 -0.71 -3.29 114.58 117.15 1uhs h GLU 17 Ca -0.02 -0.24 -0.07 0.00 -1.00 0.00 0.00 59.36 58.02 1uhs h GLU 17 Cb 1.27 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.60 1uhs h GLU 17 CO 0.12 1.03 -0.32 -0.92 -1.00 0.00 0.00 179.01 177.91 1uhs h TYR 18 N 0.04 0.00 -0.46 4.33 5.03 -1.53 -2.32 116.97 122.06 1uhs h TYR 18 Ca -0.15 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.12 1uhs h TYR 18 Cb 1.93 0.00 -0.03 0.00 1.55 0.00 0.00 36.73 40.18 1uhs h TYR 18 CO 0.04 0.32 0.06 0.09 -1.32 0.00 0.00 178.16 177.34 1uhs n ASN 19 N -3.91 4.38 -0.00 -2.11 3.02 -1.03 -2.39 115.26 113.22 1uhs n ASN 19 Ca -0.02 -2.74 -0.00 0.00 -0.03 0.00 0.00 54.58 51.79 1uhs n ASN 19 Cb 0.39 -0.65 -0.01 0.00 -0.61 0.00 0.00 39.78 38.90 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 0.32 0.00 -0.03 3.10 7.35 -0.88 -3.71 117.46 123.61 1uhs n PHE 20 Ca 0.23 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 56.90 1uhs n PHE 20 Cb 1.00 -0.04 -0.05 0.00 0.35 0.00 0.00 39.48 40.74 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 -2.11 3.56 -1.76 -2.13 3.02 -1.18 -3.90 115.26 110.77 1uhs n ASN 21 Ca -0.01 0.00 -0.03 0.00 -0.03 0.00 0.00 54.58 54.50 1uhs n ASN 21 Cb 0.52 0.69 0.29 0.00 -0.61 0.00 0.00 39.78 40.67 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 -2.18 3.46 0.00 3.52 4.01 -1.00 -4.75 118.16 121.22 1uhs n LYS 22 Ca -0.09 -3.07 0.00 0.00 -0.51 0.00 0.00 58.31 54.64 1uhs n LYS 22 Cb 0.65 -2.13 0.00 0.00 -0.51 0.00 0.00 35.03 33.05 1uhs n LYS 22 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1uhs n VAL 23 N -0.29 0.00 -3.58 -0.18 0.31 -1.25 -4.88 118.33 108.45 1uhs n VAL 23 Ca 0.37 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.65 1uhs n VAL 23 Cb 1.28 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 34.19 1uhs n VAL 23 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1uhs s ASN 24 N -1.41 -0.19 -0.20 4.52 2.20 -1.24 -5.00 114.94 113.61 1uhs s ASN 24 Ca 0.00 -0.04 0.11 0.00 -0.94 0.00 0.00 52.86 51.99 1uhs s ASN 24 Cb 0.00 0.23 -0.20 0.00 -2.00 0.00 0.00 41.25 39.28 1uhs s ASN 24 CO 0.00 -0.38 -0.04 0.29 -2.94 0.00 0.00 177.10 174.03 1uhs n LYS 25 N -0.20 0.88 -3.15 3.55 4.01 -1.25 -3.74 118.16 118.25 1uhs n LYS 25 Ca -0.03 0.04 -0.28 0.00 -0.51 0.00 0.00 58.31 57.53 1uhs n LYS 25 Cb 0.60 -1.46 -0.06 0.00 -0.51 0.00 0.00 35.03 33.60 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 -2.86 3.80 -1.42 2.13 8.25 -1.26 -4.94 115.22 118.93 1uhs n HIS 26 Ca -0.34 -3.99 -0.30 0.00 -0.26 0.00 0.00 57.72 52.83 1uhs n HIS 26 Cb 1.03 -0.56 0.11 0.00 1.12 0.00 0.00 29.99 31.69 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 -3.03 1.63 0.44 -0.41 0.04 -1.26 -5.08 135.00 127.33 1uhs s PRO 27 Ca 0.44 0.65 0.06 0.00 0.04 0.00 0.00 61.00 62.20 1uhs s PRO 27 Cb 0.21 -1.87 0.01 0.00 0.04 0.00 0.00 34.50 32.90 1uhs s PRO 27 CO -0.07 -1.94 0.61 -0.51 0.04 0.00 0.00 177.00 175.13 1uhs s ASP 28 N -3.74 5.60 0.57 6.66 1.11 -1.26 -4.90 116.67 120.71 1uhs s ASP 28 Ca 0.62 -0.31 0.27 0.00 0.18 0.00 0.00 52.55 53.31 1uhs s ASP 28 Cb -0.16 -0.75 1.55 0.00 1.07 0.00 0.00 42.92 44.63 1uhs s ASP 28 CO 0.55 -0.82 2.07 -0.65 1.18 0.00 0.00 175.17 177.50 1uhs h PRO 29 N 0.53 0.00 -0.24 8.23 0.11 -1.98 0.30 132.00 138.95 1uhs h PRO 29 Ca -0.41 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.53 1uhs h PRO 29 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 1uhs h PRO 29 CO 0.47 0.00 -0.53 1.15 -0.21 0.00 0.00 178.00 178.88 1uhs h THR 30 N 0.00 1.30 0.20 -1.15 2.02 -2.01 -2.79 112.91 110.47 1uhs h THR 30 Ca 0.12 -1.75 -0.31 0.00 0.77 0.00 0.00 66.41 65.25 1uhs h THR 30 Cb 0.61 1.68 0.02 0.00 -1.74 0.00 0.00 68.15 68.72 1uhs h THR 30 CO -0.00 0.56 -1.39 0.74 0.37 0.00 0.00 175.52 175.79 1uhs h THR 31 N 0.55 1.36 -0.16 3.16 2.02 -1.52 -3.28 112.91 115.05 1uhs h THR 31 Ca 0.02 -2.86 0.01 0.00 0.77 0.00 0.00 66.41 64.35 1uhs h THR 31 Cb 1.11 2.99 -0.01 0.00 -1.74 0.00 0.00 68.15 70.50 1uhs h THR 31 CO 0.11 0.85 0.10 0.25 0.37 0.00 0.00 175.52 177.20 1uhs h LEU 32 N 0.11 0.15 -1.10 2.58 5.85 -1.03 -1.78 115.31 120.09 1uhs h LEU 32 Ca -0.21 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1uhs h LEU 32 Cb 2.08 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 43.03 1uhs h LEU 32 CO 0.24 0.11 0.55 0.00 -0.34 0.00 0.00 178.44 179.00 1uhs h LEU 34 N 1.19 0.45 -0.07 0.00 3.38 -1.46 -2.23 115.31 116.57 1uhs h LEU 34 Ca 0.31 -0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.99 1uhs h LEU 34 Cb -0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 1uhs h LEU 34 CO -0.06 0.51 -1.00 0.40 0.09 0.00 0.00 178.44 178.38 1uhs h ILE 35 N 0.46 1.63 -0.04 1.22 2.04 -1.32 -2.34 117.51 119.17 1uhs h ILE 35 Ca 0.10 -3.17 -0.09 0.00 1.00 0.00 0.00 64.86 62.70 1uhs h ILE 35 Cb 0.30 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 1uhs h ILE 35 CO 0.01 0.91 -0.41 0.00 0.00 0.00 0.00 178.15 178.66 1uhs h ALA 36 N 0.95 1.25 0.12 1.87 0.00 -0.65 -2.62 119.26 120.19 1uhs h ALA 36 Ca -0.04 -0.39 -0.32 0.00 0.00 0.00 0.00 54.91 54.17 1uhs h ALA 36 Cb 1.72 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.43 1uhs h ALA 36 CO 0.14 0.54 -1.65 0.00 0.00 0.00 0.00 179.25 178.28 1uhs h ALA 37 N 1.52 0.32 -0.77 0.00 0.00 -1.44 0.97 119.26 119.86 1uhs h ALA 37 Ca 0.00 -1.19 0.01 0.00 0.00 0.00 0.00 54.91 53.74 1uhs h ALA 37 Cb 0.75 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1uhs h ALA 37 CO 0.06 1.18 0.51 1.49 0.00 0.00 0.00 179.25 182.49 1uhs h GLU 38 N 0.07 1.01 0.10 0.00 4.81 -1.35 -3.21 114.58 116.00 1uhs h GLU 38 Ca -0.29 -0.06 -0.33 0.00 -0.13 0.00 0.00 59.36 58.55 1uhs h GLU 38 Cb 2.03 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 31.17 1uhs h GLU 38 CO 0.15 0.67 -1.82 0.00 -0.73 0.00 0.00 179.01 177.27 1uhs n ALA 39 N -2.31 0.86 0.00 2.92 0.00 -0.99 -5.01 120.51 115.97 1uhs n ALA 39 Ca 0.08 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.95 1uhs n ALA 39 Cb 0.02 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 18.82 1uhs n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uhs n GLY 40 N 1.85 0.88 1.57 0.00 0.00 -0.26 -4.92 105.19 104.31 1uhs n GLY 40 Ca -0.32 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.60 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 -4.71 0.99 4.77 0.17 -4.91 117.00 113.31 1uhs n LEU 41 Ca 0.00 -0.77 -0.23 0.00 -0.03 0.00 0.00 56.01 54.98 1uhs n LEU 41 Cb 0.00 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 40.72 1uhs n LEU 41 CO 0.00 -0.75 -0.25 0.42 -1.33 0.00 0.00 177.39 175.47 1uhs s THR 42 N -1.42 3.49 0.50 -5.08 -4.23 -1.26 -4.20 115.64 103.43 1uhs s THR 42 Ca 0.28 -1.75 0.15 0.00 -1.18 0.00 0.00 61.69 59.19 1uhs s THR 42 Cb -0.01 -2.99 0.27 0.00 1.34 0.00 0.00 72.50 71.11 1uhs s THR 42 CO 0.19 -0.31 2.13 -0.33 -0.54 0.00 0.00 174.62 175.76 1uhs h GLU 43 N 1.70 0.10 -0.05 3.99 3.07 -1.92 0.12 114.58 121.58 1uhs h GLU 43 Ca -0.45 -0.01 -0.07 0.00 -0.50 0.00 0.00 59.36 58.33 1uhs h GLU 43 Cb 1.25 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 29.13 1uhs h GLU 43 CO 0.61 0.06 -0.30 1.49 -1.40 0.00 0.00 179.01 179.47 1uhs h GLU 44 N 0.10 0.10 0.01 2.33 4.57 -1.98 -0.97 114.58 118.74 1uhs h GLU 44 Ca 0.04 -0.03 -0.31 0.00 -1.18 0.00 0.00 59.36 57.88 1uhs h GLU 44 Cb 0.02 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 28.56 1uhs h GLU 44 CO -0.01 0.39 -1.80 1.04 -1.18 0.00 0.00 179.01 177.46 1uhs n GLN 45 N -4.15 0.65 0.14 1.92 6.02 -0.39 -3.97 117.38 117.59 1uhs n GLN 45 Ca -0.02 0.27 -0.01 0.00 -0.01 0.00 0.00 57.00 57.23 1uhs n GLN 45 Cb 0.37 -1.76 0.18 0.00 1.02 0.00 0.00 30.24 30.05 1uhs n GLN 45 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 1uhs h THR 46 N 0.01 1.42 -0.39 5.09 2.02 -0.68 -3.10 112.91 117.27 1uhs h THR 46 Ca -0.32 -2.08 -0.12 0.00 0.77 0.00 0.00 66.41 64.66 1uhs h THR 46 Cb 2.04 2.13 -0.01 0.00 -1.74 0.00 0.00 68.15 70.56 1uhs h THR 46 CO 0.07 0.59 -0.23 -0.61 0.37 0.00 0.00 175.52 175.71 1uhs h GLN 47 N 0.00 0.78 -0.10 6.66 4.15 -1.32 -2.78 115.11 122.49 1uhs h GLN 47 Ca -0.01 -0.32 -0.05 0.00 0.77 0.00 0.00 58.65 59.05 1uhs h GLN 47 Cb 1.08 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.72 1uhs h GLN 47 CO 0.08 0.93 -0.15 0.87 -1.93 0.00 0.00 178.83 178.63 1uhs h LYS 48 N 0.68 0.16 0.06 1.69 1.79 -1.67 -0.33 116.57 118.95 1uhs h LYS 48 Ca 0.09 -0.04 -0.00 0.00 -2.18 0.00 0.00 60.65 58.52 1uhs h LYS 48 Cb 0.75 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.37 1uhs h LYS 48 CO 0.06 0.32 -0.03 2.35 -1.08 0.00 0.00 179.45 181.07 1uhs h TRP 49 N 0.15 -0.08 -0.07 -1.35 7.01 -1.50 -1.32 115.95 118.80 1uhs h TRP 49 Ca 0.03 -0.00 -0.07 0.00 2.11 0.00 0.00 58.89 60.96 1uhs h TRP 49 Cb 0.37 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.44 1uhs h TRP 49 CO 0.00 0.40 -0.26 0.74 -2.79 0.00 0.00 178.44 176.54 1uhs h PHE 50 N -0.59 0.13 0.08 2.65 0.04 -1.37 0.22 116.94 118.10 1uhs h PHE 50 Ca -0.01 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.74 1uhs h PHE 50 Cb 0.51 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1uhs h PHE 50 CO 0.09 0.38 -0.04 -0.22 -0.60 0.00 0.00 178.31 177.92 1uhs h LYS 51 N 0.11 -0.11 -0.32 1.51 3.11 -1.05 -1.72 116.57 118.10 1uhs h LYS 51 Ca 0.02 0.01 -0.11 0.00 -2.81 0.00 0.00 60.65 57.75 1uhs h LYS 51 Cb 0.53 0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.77 1uhs h LYS 51 CO 0.04 0.38 -0.25 1.96 -2.81 0.00 0.00 179.45 178.77 1uhs h GLN 52 N -0.66 0.74 -0.87 1.90 4.20 -1.17 -3.10 115.11 116.14 1uhs h GLN 52 Ca -0.01 -0.36 -0.01 0.00 0.06 0.00 0.00 58.65 58.32 1uhs h GLN 52 Cb 0.54 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 1uhs h GLN 52 CO 0.02 0.98 0.50 -0.09 -0.67 0.00 0.00 178.83 179.57 1uhs h ARG 53 N 0.51 1.20 -0.42 1.46 9.65 -0.65 -2.08 114.38 124.05 1uhs h ARG 53 Ca 0.06 -0.13 0.01 0.00 -1.10 0.00 0.00 59.98 58.83 1uhs h ARG 53 Cb 0.81 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 29.12 1uhs h ARG 53 CO 0.07 0.86 0.28 -0.07 2.80 0.00 0.00 179.97 183.91 1uhs h LEU 54 N 1.21 0.45 -1.69 3.80 3.38 -1.24 -0.08 115.31 121.15 1uhs h LEU 54 Ca 0.31 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 1uhs h LEU 54 Cb -0.01 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1uhs h LEU 54 CO -0.05 0.32 -0.14 0.00 0.09 0.00 0.00 178.44 178.66 1uhs h ALA 55 N 1.74 1.75 0.00 1.53 0.00 -1.31 -2.55 119.26 120.42 1uhs h ALA 55 Ca 0.16 -0.13 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 1uhs h ALA 55 Cb -0.01 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 1uhs h ALA 55 CO -0.04 0.19 -1.66 0.39 0.00 0.00 0.00 179.25 178.14 1uhs n GLU 56 N -4.36 0.63 -0.25 0.00 1.02 -0.46 -3.77 120.64 113.45 1uhs n GLU 56 Ca -0.02 0.26 -0.03 0.00 -0.02 0.00 0.00 57.16 57.36 1uhs n GLU 56 Cb 0.21 -1.79 0.09 0.00 -0.02 0.00 0.00 31.44 29.94 1uhs n GLU 56 CO 0.00 0.00 0.00 2.35 1.18 0.00 0.00 177.13 180.66 1uhs h TRP 57 N 0.00 0.79 -0.39 -0.32 7.01 -0.65 0.13 115.95 122.52 1uhs h TRP 57 Ca -0.26 0.02 -0.16 0.00 2.11 0.00 0.00 58.89 60.61 1uhs h TRP 57 Cb 1.91 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 28.71 1uhs h TRP 57 CO 0.00 0.43 -0.36 0.00 -2.79 0.00 0.00 178.44 175.72 1uhs h ARG 58 N 0.81 0.94 -0.33 2.65 3.08 -1.67 0.36 114.38 120.22 1uhs h ARG 58 Ca 0.29 -0.48 -0.05 0.00 0.07 0.00 0.00 59.98 59.81 1uhs h ARG 58 Cb 0.08 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 1uhs h ARG 58 CO -0.13 1.14 -0.01 0.00 -1.07 0.00 0.00 179.97 179.90 1uhs h ARG 59 N 0.76 0.51 0.09 0.04 3.08 -1.53 0.12 114.38 117.46 1uhs h ARG 59 Ca 0.07 -0.11 -0.22 0.00 0.07 0.00 0.00 59.98 59.79 1uhs h ARG 59 Cb 0.96 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.93 1uhs h ARG 59 CO 0.09 0.54 -1.11 0.77 -1.07 0.00 0.00 179.97 179.19 1uhs h SER 60 N 0.49 0.31 -0.21 7.04 0.02 -0.86 -3.34 113.55 117.00 1uhs h SER 60 Ca 0.10 -0.85 0.00 0.00 -0.84 0.00 0.00 61.79 60.21 1uhs h SER 60 Cb 0.33 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 1uhs h SER 60 CO 0.01 1.49 0.14 -0.33 -1.14 0.00 0.00 176.83 176.99 1uhs h GLU 61 N -0.48 0.27 0.00 3.45 4.39 -0.22 -3.47 114.58 118.52 1uhs h GLU 61 Ca -0.24 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1uhs h GLU 61 Cb 1.60 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.18 1uhs h GLU 61 CO 0.04 0.18 0.00 0.41 -1.16 0.00 0.00 179.01 178.48 1uhs n GLY 62 N -1.51 0.84 3.12 -3.84 0.00 -0.15 -5.06 105.19 98.59 1uhs n GLY 62 Ca 0.00 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 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 1.92 0.00 0.99 1.02 -0.16 -5.04 118.68 117.41 1uhs s LEU 63 Ca 0.00 -0.50 0.00 0.00 0.02 0.00 0.00 54.13 53.65 1uhs s LEU 63 Cb 0.00 -1.25 0.00 0.00 0.02 0.00 0.00 46.19 44.96 1uhs s LEU 63 CO 0.00 0.07 0.00 -2.65 0.02 0.00 0.00 176.35 173.79 1uhs n PRO 64 N 4.00 -0.03 -1.33 1.29 -0.02 -1.26 -4.68 135.00 132.97 1uhs n PRO 64 Ca -0.20 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.27 1uhs n PRO 64 Cb 0.52 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 34.01 1uhs n PRO 64 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1uhs n SER 65 N -1.29 -0.42 -2.87 2.55 3.41 -1.26 -5.02 113.62 108.72 1uhs n SER 65 Ca 0.00 -1.06 -0.07 0.00 -0.26 0.00 0.00 58.87 57.47 1uhs n SER 65 Cb 0.00 0.17 0.01 0.00 -0.26 0.00 0.00 64.21 64.13 1uhs n SER 65 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1uhs n GLU 66 N -0.28 -2.65 -1.59 4.33 4.71 -1.26 -4.74 120.64 119.15 1uhs n GLU 66 Ca -0.08 2.25 -0.30 0.00 -0.01 0.00 0.00 57.16 59.03 1uhs n GLU 66 Cb 0.52 -5.05 -0.04 0.00 -1.01 0.00 0.00 31.44 25.86 1uhs n GLU 66 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1uhs n ARG 68 N 8.96 0.10 -2.93 0.00 3.00 -1.26 -5.08 116.66 119.46 1uhs n ARG 68 Ca 0.39 0.04 -0.21 0.00 -0.00 0.00 0.00 57.85 58.07 1uhs n ARG 68 Cb 0.51 -0.54 0.08 0.00 0.00 0.00 0.00 32.46 32.52 1uhs n ARG 68 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1uhs s SER 69 N -4.84 4.81 -0.26 6.15 0.15 -1.26 -5.10 113.70 113.36 1uhs s SER 69 Ca -0.05 -0.79 0.03 0.00 0.70 0.00 0.00 55.95 55.84 1uhs s SER 69 Cb 0.01 0.35 0.06 0.00 -1.71 0.00 0.00 66.02 64.73 1uhs s SER 69 CO 0.08 -1.56 -0.10 0.68 1.20 0.00 0.00 173.24 173.53 1uhs s VAL 70 N -2.83 2.10 0.23 4.45 -7.23 -1.26 -5.10 120.40 110.76 1uhs s VAL 70 Ca 0.64 -1.60 -0.00 0.00 -1.81 0.00 0.00 61.98 59.21 1uhs s VAL 70 Cb -0.05 -2.23 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1uhs s VAL 70 CO 0.41 -0.04 0.18 0.42 -0.31 0.00 0.00 175.10 175.75 1uhs s THR 71 N 1.13 0.00 0.00 5.32 -4.23 -1.26 -5.32 115.64 111.28 1uhs s THR 71 Ca -0.08 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.46 1uhs s THR 71 Cb -0.20 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.15 1uhs s THR 71 CO -0.05 0.00 0.00 -0.67 -0.54 0.00 0.00 174.62 173.36