#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uzh s MET 2 N 0.00 3.25 -0.25 0.03 1.00 -1.26 -5.02 119.30 117.05 1uzh s MET 2 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 55.69 55.19 1uzh s MET 2 Cb 0.00 -2.98 -0.04 0.00 0.00 0.00 0.00 34.83 31.81 1uzh s MET 2 CO 0.00 0.66 0.12 0.08 0.00 0.00 0.00 175.02 175.88 1uzh s VAL 3 N -1.27 4.86 -0.11 -6.03 1.01 -1.26 -4.84 120.40 112.74 1uzh s VAL 3 Ca 0.26 0.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.95 1uzh s VAL 3 Cb -0.12 -3.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 1uzh s VAL 3 CO 0.17 0.33 1.62 0.86 0.00 0.00 0.00 175.10 178.08 1uzh s TRP 4 N 1.37 2.08 0.16 5.22 -0.11 -1.26 -0.48 118.94 125.93 1uzh s TRP 4 Ca 0.06 0.38 -0.30 0.00 1.22 0.00 0.00 56.10 57.46 1uzh s TRP 4 Cb -0.15 -3.89 -0.08 0.00 -1.50 0.00 0.00 33.47 27.85 1uzh s TRP 4 CO 0.06 -3.39 1.20 -0.08 -4.62 0.00 0.00 176.95 170.12 1uzh s THR 5 N 4.39 3.63 -1.24 5.86 -1.32 0.31 -4.92 115.64 122.35 1uzh s THR 5 Ca 0.71 1.33 0.28 0.00 -1.21 0.00 0.00 61.69 62.81 1uzh s THR 5 Cb -0.30 -3.85 0.29 0.00 -1.51 0.00 0.00 72.50 67.14 1uzh s THR 5 CO 0.28 0.19 1.82 -0.81 -2.21 0.00 0.00 174.62 173.90 1uzh n PRO 6 N 2.76 0.26 -3.32 7.08 -0.04 -1.26 -4.72 135.00 135.76 1uzh n PRO 6 Ca 0.05 -0.07 -0.39 0.00 -0.04 0.00 0.00 63.50 63.06 1uzh n PRO 6 Cb 0.45 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.34 1uzh n PRO 6 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1uzh s VAL 7 N -2.79 5.15 -1.33 0.52 1.01 -1.26 -4.43 120.40 117.26 1uzh s VAL 7 Ca 0.20 0.80 -0.21 0.00 0.00 0.00 0.00 61.98 62.76 1uzh s VAL 7 Cb 0.19 -3.78 0.03 0.00 0.00 0.00 0.00 36.38 32.82 1uzh s VAL 7 CO 0.54 0.19 0.45 0.59 0.00 0.00 0.00 175.10 176.87 1uzh n ASN 8 N 4.81 -2.29 -2.24 3.32 3.02 -1.26 -4.87 115.26 115.74 1uzh n ASN 8 Ca -0.07 -1.27 -0.16 0.00 -0.03 0.00 0.00 54.58 53.05 1uzh n ASN 8 Cb 0.51 -1.77 0.03 0.00 -0.61 0.00 0.00 39.78 37.94 1uzh n ASN 8 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1uzh n ASN 9 N -2.46 3.83 -4.77 6.41 4.05 -1.07 -2.50 115.26 118.77 1uzh n ASN 9 Ca -0.19 -3.21 -0.37 0.00 0.45 0.00 0.00 54.58 51.26 1uzh n ASN 9 Cb 0.62 -0.39 0.00 0.00 1.23 0.00 0.00 39.78 41.24 1uzh n ASN 9 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1uzh s LYS 10 N -3.63 3.51 0.34 1.20 -0.14 -0.52 -4.84 119.74 115.66 1uzh s LYS 10 Ca 0.43 1.79 0.07 0.00 -1.36 0.00 0.00 55.97 56.90 1uzh s LYS 10 Cb 0.38 -2.24 -0.07 0.00 -1.68 0.00 0.00 37.83 34.23 1uzh s LYS 10 CO 0.01 -0.76 -0.04 -1.64 -0.76 0.00 0.00 175.35 172.16 1uzh s MET 11 N -2.94 1.76 -0.29 1.68 -1.94 -1.26 -4.65 119.30 111.66 1uzh s MET 11 Ca 0.68 -1.94 0.20 0.00 -1.71 0.00 0.00 55.69 52.92 1uzh s MET 11 Cb -0.29 -1.42 0.48 0.00 2.01 0.00 0.00 34.83 35.61 1uzh s MET 11 CO 0.34 0.01 1.02 1.19 -0.01 0.00 0.00 175.02 177.58 1uzh n PHE 12 N -0.77 1.18 -4.80 -0.03 3.01 -1.26 -5.07 117.46 109.71 1uzh n PHE 12 Ca -0.05 -2.50 0.00 0.00 1.01 0.00 0.00 57.45 55.92 1uzh n PHE 12 Cb 0.65 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 1uzh n PHE 12 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1uzh n GLU 13 N -0.30 0.00 -1.67 -1.08 -0.58 -1.26 -4.68 120.64 111.07 1uzh n GLU 13 Ca 0.08 0.00 -0.50 0.00 -0.42 0.00 0.00 57.16 56.32 1uzh n GLU 13 Cb 0.81 0.00 -0.05 0.00 -0.57 0.00 0.00 31.44 31.63 1uzh n GLU 13 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1uzh n THR 14 N 0.00 0.24 -0.49 2.62 -1.04 -1.26 -1.71 114.28 112.64 1uzh n THR 14 Ca 0.00 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1uzh n THR 14 Cb 0.00 -1.43 0.00 0.00 -1.82 0.00 0.00 70.33 67.08 1uzh n THR 14 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1uzh n PHE 15 N 4.61 0.00 0.30 -1.42 0.99 -1.26 -4.60 117.46 116.08 1uzh n PHE 15 Ca 0.21 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.82 1uzh n PHE 15 Cb 0.24 0.00 0.92 0.00 -1.00 0.00 0.00 39.48 39.64 1uzh n PHE 15 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.76 177.53 1uzh h SER 16 N 0.00 0.00 -0.08 4.37 0.02 -1.62 -1.87 113.55 114.37 1uzh h SER 16 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1uzh h SER 16 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1uzh h SER 16 CO 0.00 0.03 0.00 -1.22 -1.14 0.00 0.00 176.83 174.50 1uzh n TYR 17 N -3.68 0.09 -3.13 3.45 4.02 -1.26 -4.90 117.16 111.75 1uzh n TYR 17 Ca -0.03 -0.04 -0.18 0.00 -0.01 0.00 0.00 57.90 57.64 1uzh n TYR 17 Cb 0.12 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.44 1uzh n TYR 17 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1uzh s LEU 18 N -1.84 3.74 0.73 7.72 1.43 -0.70 -5.08 118.68 124.68 1uzh s LEU 18 Ca 0.35 -0.35 -0.16 0.00 -1.03 0.00 0.00 54.13 52.95 1uzh s LEU 18 Cb 0.20 -2.69 0.03 0.00 0.03 0.00 0.00 46.19 43.76 1uzh s LEU 18 CO 0.31 -0.68 1.18 -2.65 0.23 0.00 0.00 176.35 174.74 1uzh n PRO 19 N -1.80 0.59 -1.65 1.29 -0.02 -1.26 -4.90 135.00 127.25 1uzh n PRO 19 Ca 0.06 0.27 -0.43 0.00 -2.02 0.00 0.00 63.50 61.37 1uzh n PRO 19 Cb 0.59 -2.42 -0.01 0.00 -0.02 0.00 0.00 33.50 31.64 1uzh n PRO 19 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1uzh n PRO 20 N -2.44 1.80 -2.22 0.52 -0.02 -1.26 -4.88 135.00 126.50 1uzh n PRO 20 Ca 0.14 0.63 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 1uzh n PRO 20 Cb 0.49 -2.13 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 1uzh n PRO 20 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1uzh s LEU 21 N -0.42 4.36 0.77 2.45 1.43 -1.26 -5.02 118.68 120.99 1uzh s LEU 21 Ca 0.57 2.24 -0.11 0.00 -1.03 0.00 0.00 54.13 55.79 1uzh s LEU 21 Cb -0.62 -3.58 0.05 0.00 0.03 0.00 0.00 46.19 42.07 1uzh s LEU 21 CO 0.61 -0.64 1.09 0.42 0.23 0.00 0.00 176.35 178.06 1uzh s THR 22 N 1.39 3.27 0.26 5.49 -4.23 -1.26 -4.82 115.64 115.73 1uzh s THR 22 Ca 0.64 0.41 -0.02 0.00 -1.18 0.00 0.00 61.69 61.54 1uzh s THR 22 Cb -0.35 -3.18 0.23 0.00 1.34 0.00 0.00 72.50 70.54 1uzh s THR 22 CO 0.29 -0.54 1.76 0.44 -0.54 0.00 0.00 174.62 176.04 1uzh h ASP 23 N -0.98 0.49 -0.71 3.99 3.32 -1.99 -0.43 116.42 120.12 1uzh h ASP 23 Ca -0.46 0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.67 1uzh h ASP 23 Cb 1.26 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.79 1uzh h ASP 23 CO 0.59 0.21 0.40 -0.08 -1.72 0.00 0.00 179.24 178.64 1uzh h GLU 24 N 0.60 0.98 -0.48 3.56 4.81 -1.99 -0.95 114.58 121.12 1uzh h GLU 24 Ca 0.45 -0.11 -0.06 0.00 -0.13 0.00 0.00 59.36 59.50 1uzh h GLU 24 Cb 0.62 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1uzh h GLU 24 CO -0.36 0.72 0.05 1.96 -0.73 0.00 0.00 179.01 180.65 1uzh h GLN 25 N 0.97 0.81 -0.32 1.92 4.20 -1.65 -0.52 115.11 120.53 1uzh h GLN 25 Ca 0.25 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1uzh h GLN 25 Cb 0.02 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1uzh h GLN 25 CO -0.04 0.84 0.18 0.82 -0.67 0.00 0.00 178.83 179.96 1uzh h ILE 26 N 0.68 1.12 -0.96 2.54 2.04 -1.01 -1.95 117.51 119.97 1uzh h ILE 26 Ca 0.14 -0.30 0.09 0.00 1.00 0.00 0.00 64.86 65.79 1uzh h ILE 26 Cb 0.44 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 37.19 1uzh h ILE 26 CO 0.02 0.12 0.62 0.00 0.00 0.00 0.00 178.15 178.90 1uzh h ALA 27 N 1.06 1.51 -0.57 1.87 0.00 -0.90 -1.64 119.26 120.59 1uzh h ALA 27 Ca 0.11 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1uzh h ALA 27 Cb 0.03 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1uzh h ALA 27 CO -0.02 0.30 -0.02 0.00 0.00 0.00 0.00 179.25 179.51 1uzh h ALA 28 N 1.51 0.87 -0.78 0.00 0.00 -0.65 -1.01 119.26 119.20 1uzh h ALA 28 Ca 0.44 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1uzh h ALA 28 Cb 0.32 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1uzh h ALA 28 CO -0.20 0.66 0.37 1.96 0.00 0.00 0.00 179.25 182.04 1uzh h GLN 29 N 0.92 1.12 -0.77 0.00 1.08 -0.69 -1.63 115.11 115.16 1uzh h GLN 29 Ca 0.16 -0.17 -0.05 0.00 -1.45 0.00 0.00 58.65 57.14 1uzh h GLN 29 Cb 0.57 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.76 1uzh h GLN 29 CO 0.03 0.87 0.27 0.28 -0.95 0.00 0.00 178.83 179.34 1uzh h VAL 30 N 1.10 1.26 -0.78 -0.54 2.07 -1.04 -1.73 116.25 116.60 1uzh h VAL 30 Ca 0.27 -0.87 0.03 0.00 0.82 0.00 0.00 66.70 66.94 1uzh h VAL 30 Cb 0.12 0.38 -0.05 0.00 -1.52 0.00 0.00 31.29 30.23 1uzh h VAL 30 CO -0.03 0.35 0.50 0.44 0.02 0.00 0.00 177.57 178.84 1uzh h ASP 31 N 1.13 0.83 -0.38 0.57 3.32 -0.83 -1.86 116.42 119.19 1uzh h ASP 31 Ca 0.25 -0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.34 1uzh h ASP 31 Cb 0.27 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 1uzh h ASP 31 CO -0.01 0.58 0.14 0.22 -1.72 0.00 0.00 179.24 178.44 1uzh h TYR 32 N 0.98 0.25 -0.19 4.55 3.20 -0.70 0.15 116.97 125.21 1uzh h TYR 32 Ca 0.31 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.24 1uzh h TYR 32 Cb -0.01 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.16 1uzh h TYR 32 CO -0.03 0.10 -0.09 0.82 -1.64 0.00 0.00 178.16 177.32 1uzh h ILE 33 N 0.30 0.71 -0.44 1.81 2.04 -0.97 -2.15 117.51 118.80 1uzh h ILE 33 Ca 0.17 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.00 1uzh h ILE 33 Cb 0.15 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1uzh h ILE 33 CO -0.17 0.00 0.16 0.58 0.00 0.00 0.00 178.15 178.72 1uzh h VAL 34 N -0.07 1.21 -0.06 1.67 2.07 -1.03 -2.27 116.25 117.77 1uzh h VAL 34 Ca 0.10 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1uzh h VAL 34 Cb 0.23 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 30.81 1uzh h VAL 34 CO -0.24 0.25 -0.02 0.00 0.02 0.00 0.00 177.57 177.58 1uzh h ALA 35 N 1.01 1.86 -0.01 1.67 0.00 -0.51 -2.21 119.26 121.07 1uzh h ALA 35 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1uzh h ALA 35 Cb 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1uzh h ALA 35 CO -0.01 0.11 -0.30 0.09 0.00 0.00 0.00 179.25 179.14 1uzh n ASN 36 N -4.46 1.45 -0.71 0.00 3.02 -0.83 -4.96 115.26 108.78 1uzh n ASN 36 Ca -0.02 -1.18 -0.08 0.00 -0.03 0.00 0.00 54.58 53.27 1uzh n ASN 36 Cb 0.14 0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.51 1uzh n ASN 36 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uzh n GLY 37 N 1.35 0.76 3.87 7.41 0.00 -0.83 -5.03 105.19 112.72 1uzh n GLY 37 Ca 0.12 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.20 1uzh n GLY 37 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1uzh s TRP 38 N -2.33 3.34 -0.39 1.61 0.51 -0.93 -4.98 118.94 115.77 1uzh s TRP 38 Ca 0.00 1.12 -0.19 0.00 -2.12 0.00 0.00 56.10 54.92 1uzh s TRP 38 Cb 0.00 -2.99 0.01 0.00 -0.81 0.00 0.00 33.47 29.68 1uzh s TRP 38 CO 0.00 -1.12 0.54 0.42 -0.51 0.00 0.00 176.95 176.28 1uzh s ILE 39 N -3.29 4.97 0.40 2.03 1.01 0.25 -4.75 121.20 121.82 1uzh s ILE 39 Ca 0.58 0.14 -0.25 0.00 0.00 0.00 0.00 60.65 61.12 1uzh s ILE 39 Cb -0.11 -4.05 -0.09 0.00 0.01 0.00 0.00 42.46 38.22 1uzh s ILE 39 CO 0.53 -0.37 1.10 -2.84 0.00 0.00 0.00 174.94 173.35 1uzh s PRO 40 N 2.48 4.12 -0.10 2.79 0.02 -1.26 0.29 135.00 143.34 1uzh s PRO 40 Ca 0.19 1.65 -0.19 0.00 0.02 0.00 0.00 61.00 62.66 1uzh s PRO 40 Cb -0.15 -2.61 0.05 0.00 0.02 0.00 0.00 34.50 31.80 1uzh s PRO 40 CO 0.15 -0.21 0.48 0.00 -0.33 0.00 0.00 177.00 177.09 1uzh s LEU 42 N -0.54 3.52 0.05 0.00 1.43 -1.26 -0.80 118.68 121.08 1uzh s LEU 42 Ca -0.07 0.05 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1uzh s LEU 42 Cb -0.03 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 1uzh s LEU 42 CO 0.04 0.32 -0.07 -1.61 0.23 0.00 0.00 176.35 175.25 1uzh s GLU 43 N -1.28 0.58 0.06 1.70 2.02 -0.75 -0.47 118.70 120.55 1uzh s GLU 43 Ca 0.17 -0.87 -0.10 0.00 0.02 0.00 0.00 54.97 54.20 1uzh s GLU 43 Cb -0.11 -0.25 0.00 0.00 0.10 0.00 0.00 34.13 33.87 1uzh s GLU 43 CO 0.07 0.03 0.21 -0.59 0.02 0.00 0.00 175.26 175.00 1uzh s PHE 44 N -1.84 0.08 -0.03 1.61 -0.12 -0.08 -0.81 117.98 116.79 1uzh s PHE 44 Ca -0.06 -0.39 -0.25 0.00 -0.05 0.00 0.00 56.93 56.19 1uzh s PHE 44 Cb -0.07 -0.03 0.05 0.00 -0.63 0.00 0.00 43.02 42.35 1uzh s PHE 44 CO -0.01 -0.49 0.54 0.00 -0.05 0.00 0.00 175.22 175.21 1uzh s ALA 45 N -3.17 -1.38 0.13 1.99 0.00 -0.32 -1.32 121.76 117.69 1uzh s ALA 45 Ca -0.00 0.89 -0.16 0.00 0.00 0.00 0.00 51.96 52.70 1uzh s ALA 45 Cb 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.20 1uzh s ALA 45 CO -0.07 -0.35 1.64 0.93 0.00 0.00 0.00 175.76 177.91 1uzh h GLU 46 N 3.26 0.63 -5.63 0.00 5.08 -1.92 0.11 114.58 116.10 1uzh h GLU 46 Ca -0.28 -0.14 -0.46 0.00 -1.00 0.00 0.00 59.36 57.48 1uzh h GLU 46 Cb 1.16 -0.09 -0.18 0.00 0.50 0.00 0.00 28.75 30.15 1uzh h GLU 46 CO 0.40 0.63 -0.76 -1.01 -1.00 0.00 0.00 179.01 177.27 1uzh s HIS 47 N -5.37 1.60 -0.22 4.33 3.76 -1.26 -4.51 115.29 113.61 1uzh s HIS 47 Ca -0.13 -0.53 0.01 0.00 -0.15 0.00 0.00 55.06 54.26 1uzh s HIS 47 Cb 0.10 -0.81 0.05 0.00 1.11 0.00 0.00 32.58 33.04 1uzh s HIS 47 CO 0.76 0.24 -0.08 0.45 -0.85 0.00 0.00 174.74 175.27 1uzh s SER 48 N -2.66 3.72 -0.05 1.40 0.15 -1.26 -4.97 113.70 110.03 1uzh s SER 48 Ca 0.13 -1.08 0.05 0.00 0.70 0.00 0.00 55.95 55.75 1uzh s SER 48 Cb -0.04 -1.22 -0.01 0.00 -1.71 0.00 0.00 66.02 63.04 1uzh s SER 48 CO 0.05 -0.20 -0.20 0.20 1.20 0.00 0.00 173.24 174.29 1uzh s ASN 49 N 1.37 2.51 0.44 5.45 0.01 -1.26 -5.04 114.94 118.42 1uzh s ASN 49 Ca -0.04 -0.42 0.16 0.00 -0.71 0.00 0.00 52.86 51.85 1uzh s ASN 49 Cb -0.18 -0.72 1.08 0.00 0.41 0.00 0.00 41.25 41.84 1uzh s ASN 49 CO -0.07 0.18 1.95 1.55 -1.51 0.00 0.00 177.10 179.21 1uzh h PRO 50 N 6.22 0.35 0.00 -0.60 0.13 -1.99 -0.59 132.00 135.53 1uzh h PRO 50 Ca -0.32 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1uzh h PRO 50 Cb 1.18 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1uzh h PRO 50 CO 0.47 0.23 0.00 0.93 -0.23 0.00 0.00 178.00 179.41 1uzh h GLU 51 N 0.36 0.00 -4.83 0.86 3.07 -2.05 -3.43 114.58 108.57 1uzh h GLU 51 Ca 0.32 0.00 -0.70 0.00 -0.50 0.00 0.00 59.36 58.49 1uzh h GLU 51 Cb 0.75 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 28.47 1uzh h GLU 51 CO -0.09 0.00 -0.09 -1.21 -1.40 0.00 0.00 179.01 176.22 1uzh s GLU 52 N -3.62 3.10 0.01 2.33 0.41 -0.23 -4.97 118.70 115.72 1uzh s GLU 52 Ca 0.01 -0.92 -0.25 0.00 -0.41 0.00 0.00 54.97 53.41 1uzh s GLU 52 Cb 0.09 -4.06 -0.17 0.00 -1.78 0.00 0.00 34.13 28.21 1uzh s GLU 52 CO 0.46 -1.07 1.25 0.74 -0.49 0.00 0.00 175.26 176.15 1uzh h PHE 53 N 8.87 -0.30 -3.05 1.61 0.04 -1.85 -3.46 116.94 118.81 1uzh h PHE 53 Ca -0.27 -0.01 -0.61 0.00 2.80 0.00 0.00 57.97 59.88 1uzh h PHE 53 Cb 1.10 0.10 -0.06 0.00 2.20 0.00 0.00 35.95 39.29 1uzh h PHE 53 CO 0.69 0.04 -0.22 0.71 -0.60 0.00 0.00 178.31 178.93 1uzh s TYR 54 N -4.63 3.69 0.57 -0.55 2.02 -1.26 -5.10 117.35 112.09 1uzh s TYR 54 Ca -0.14 0.94 0.07 0.00 -0.37 0.00 0.00 57.07 57.57 1uzh s TYR 54 Cb 0.02 -2.30 0.07 0.00 -0.40 0.00 0.00 41.96 39.34 1uzh s TYR 54 CO 0.56 0.58 0.57 -1.58 -1.57 0.00 0.00 175.55 174.12 1uzh s TRP 55 N -0.81 1.41 0.01 2.71 0.52 -1.26 -5.09 118.94 116.43 1uzh s TRP 55 Ca 0.23 -0.83 -0.21 0.00 0.02 0.00 0.00 56.10 55.31 1uzh s TRP 55 Cb -0.16 -2.01 -0.06 0.00 -1.15 0.00 0.00 33.47 30.09 1uzh s TRP 55 CO 0.12 -0.81 0.63 0.99 0.02 0.00 0.00 176.95 177.90 1uzh s THR 56 N -2.76 4.85 0.06 2.01 2.01 -0.43 -4.87 115.64 116.51 1uzh s THR 56 Ca 0.45 1.32 -0.30 0.00 0.31 0.00 0.00 61.69 63.46 1uzh s THR 56 Cb -0.04 -3.97 -0.05 0.00 0.01 0.00 0.00 72.50 68.45 1uzh s THR 56 CO 0.28 0.42 1.13 -0.32 -0.69 0.00 0.00 174.62 175.45 1uzh s MET 57 N -0.26 4.48 -0.39 4.92 1.75 -1.26 -0.91 119.30 127.63 1uzh s MET 57 Ca 0.32 1.68 -0.27 0.00 -1.25 0.00 0.00 55.69 56.17 1uzh s MET 57 Cb -0.19 -3.36 0.02 0.00 2.84 0.00 0.00 34.83 34.14 1uzh s MET 57 CO 0.19 -0.16 1.01 -0.46 -0.65 0.00 0.00 175.02 174.94 1uzh s TRP 58 N 0.86 3.02 0.00 4.11 -0.11 0.38 -4.87 118.94 122.32 1uzh s TRP 58 Ca 0.56 0.81 0.00 0.00 1.22 0.00 0.00 56.10 58.68 1uzh s TRP 58 Cb -0.28 -3.88 0.00 0.00 -1.50 0.00 0.00 33.47 27.82 1uzh s TRP 58 CO 0.30 -0.95 0.00 1.63 -4.62 0.00 0.00 176.95 173.31 1uzh n LYS 59 N 7.09 0.00 -4.22 5.86 5.02 -1.26 -4.51 118.16 126.13 1uzh n LYS 59 Ca 0.09 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.25 1uzh n LYS 59 Cb 0.48 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.39 1uzh n LYS 59 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1uzh s LEU 60 N 0.00 2.51 0.51 -0.35 1.43 -1.26 -5.10 118.68 116.43 1uzh s LEU 60 Ca 0.00 -1.02 -0.23 0.00 -1.03 0.00 0.00 54.13 51.85 1uzh s LEU 60 Cb 0.00 -0.25 -0.06 0.00 0.03 0.00 0.00 46.19 45.91 1uzh s LEU 60 CO 0.00 -0.38 1.38 -2.65 0.23 0.00 0.00 176.35 174.93 1uzh n PRO 61 N -0.15 1.88 -2.27 1.29 -0.02 -1.26 -4.81 135.00 129.66 1uzh n PRO 61 Ca -0.11 0.68 -0.42 0.00 -2.02 0.00 0.00 63.50 61.63 1uzh n PRO 61 Cb 0.61 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 1uzh n PRO 61 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1uzh n MET 62 N -0.71 3.56 -1.83 -0.52 2.81 0.24 -4.96 117.12 115.71 1uzh n MET 62 Ca 0.09 -3.44 -0.42 0.00 -1.81 0.00 0.00 57.70 52.12 1uzh n MET 62 Cb 0.43 -2.96 -0.02 0.00 -0.71 0.00 0.00 33.22 29.97 1uzh n MET 62 CO 0.00 0.00 0.00 -0.06 1.51 0.00 0.00 175.97 177.42 1uzh s PHE 63 N 0.63 2.84 0.00 2.03 0.08 -1.26 -1.85 117.98 120.45 1uzh s PHE 63 Ca 0.40 0.76 0.00 0.00 0.12 0.00 0.00 56.93 58.21 1uzh s PHE 63 Cb 0.10 -4.02 0.00 0.00 -0.57 0.00 0.00 43.02 38.53 1uzh s PHE 63 CO -0.00 -3.50 0.00 0.41 -0.10 0.00 0.00 175.22 172.03 1uzh n GLY 64 N 2.51 1.08 3.68 4.36 0.00 -1.26 -4.99 105.19 110.57 1uzh n GLY 64 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1uzh n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uzh n ARG 66 N 5.81 1.09 -4.00 0.00 1.74 -1.26 -4.91 116.66 115.12 1uzh n ARG 66 Ca 0.13 -2.19 -0.31 0.00 -0.77 0.00 0.00 57.85 54.71 1uzh n ARG 66 Cb 0.45 -1.26 -0.15 0.00 -1.02 0.00 0.00 32.46 30.47 1uzh n ARG 66 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1uzh s ASP 67 N -2.38 4.46 0.40 0.55 -1.08 -1.26 -5.00 116.67 112.37 1uzh s ASP 67 Ca 0.24 -1.71 0.11 0.00 -0.52 0.00 0.00 52.55 50.66 1uzh s ASP 67 Cb 0.21 -1.47 0.91 0.00 -1.46 0.00 0.00 42.92 41.11 1uzh s ASP 67 CO 0.02 -0.30 1.97 1.55 0.52 0.00 0.00 175.17 178.93 1uzh h PRO 68 N 7.76 0.53 -0.51 4.34 0.13 -1.94 -1.69 132.00 140.62 1uzh h PRO 68 Ca -0.12 -0.03 -0.03 0.00 -0.87 0.00 0.00 66.00 64.95 1uzh h PRO 68 Cb 1.03 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 32.02 1uzh h PRO 68 CO 0.48 0.35 0.21 0.52 -0.23 0.00 0.00 178.00 179.33 1uzh h MET 69 N 0.55 0.72 -0.50 0.86 2.86 -1.99 -1.04 114.93 116.39 1uzh h MET 69 Ca 0.30 -0.10 -0.04 0.00 -2.06 0.00 0.00 59.70 57.79 1uzh h MET 69 Cb 0.44 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.94 1uzh h MET 69 CO -0.09 0.59 0.14 0.37 1.06 0.00 0.00 176.91 178.98 1uzh h GLN 70 N 0.72 0.79 -0.35 1.72 4.15 -1.74 -0.55 115.11 119.84 1uzh h GLN 70 Ca 0.17 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 1uzh h GLN 70 Cb 0.14 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 1uzh h GLN 70 CO -0.02 0.75 0.17 0.28 -1.93 0.00 0.00 178.83 178.08 1uzh h VAL 71 N 0.68 1.16 -0.55 2.39 2.07 -1.31 -2.18 116.25 118.52 1uzh h VAL 71 Ca 0.16 -0.45 -0.04 0.00 0.82 0.00 0.00 66.70 67.20 1uzh h VAL 71 Cb 0.30 0.81 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 1uzh h VAL 71 CO -0.00 0.17 0.20 -0.07 0.02 0.00 0.00 177.57 177.88 1uzh h LEU 72 N 0.43 0.74 -0.76 2.57 3.38 -1.00 -1.64 115.31 119.03 1uzh h LEU 72 Ca 0.12 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 1uzh h LEU 72 Cb 0.11 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1uzh h LEU 72 CO -0.02 0.68 -0.11 0.03 0.09 0.00 0.00 178.44 179.11 1uzh h ARG 73 N 0.79 0.83 -0.30 1.13 3.08 -0.88 -2.24 114.38 116.79 1uzh h ARG 73 Ca 0.19 -0.28 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 1uzh h ARG 73 Cb 0.19 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1uzh h ARG 73 CO -0.01 0.90 -0.22 0.93 -1.07 0.00 0.00 179.97 180.50 1uzh h GLU 74 N 0.75 0.56 -0.24 0.04 4.39 -0.86 -0.67 114.58 118.55 1uzh h GLU 74 Ca 0.12 -0.21 0.04 0.00 0.34 0.00 0.00 59.36 59.65 1uzh h GLU 74 Cb 0.61 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 1uzh h GLU 74 CO 0.04 0.75 0.02 0.82 -1.16 0.00 0.00 179.01 179.48 1uzh h ILE 75 N 0.50 0.86 -0.20 3.13 2.04 -0.99 0.11 117.51 122.95 1uzh h ILE 75 Ca 0.08 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.93 1uzh h ILE 75 Cb 0.66 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1uzh h ILE 75 CO 0.05 0.02 0.03 0.58 0.00 0.00 0.00 178.15 178.82 1uzh h VAL 76 N 0.10 0.89 -0.60 1.67 2.07 -1.19 -0.88 116.25 118.32 1uzh h VAL 76 Ca 0.11 -0.03 -0.05 0.00 0.82 0.00 0.00 66.70 67.55 1uzh h VAL 76 Cb 0.13 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1uzh h VAL 76 CO -0.17 0.02 0.19 0.00 0.02 0.00 0.00 177.57 177.63 1uzh h ALA 77 N 1.15 0.78 0.09 1.67 0.00 -0.84 -0.03 119.26 122.08 1uzh h ALA 77 Ca 0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1uzh h ALA 77 Cb 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1uzh h ALA 77 CO -0.13 0.45 -0.04 0.00 0.00 0.00 0.00 179.25 179.52 1uzh h THR 79 N -0.27 1.22 -0.39 0.00 1.35 -1.10 -0.72 112.91 113.00 1uzh h THR 79 Ca -0.01 -1.05 -0.05 0.00 -0.55 0.00 0.00 66.41 64.75 1uzh h THR 79 Cb 0.23 1.54 -0.02 0.00 -1.73 0.00 0.00 68.15 68.18 1uzh h THR 79 CO 0.02 0.30 0.06 0.50 -0.25 0.00 0.00 175.52 176.15 1uzh h LYS 80 N 0.02 0.64 -0.17 4.72 3.64 -0.82 -2.28 116.57 122.32 1uzh h LYS 80 Ca 0.00 -0.17 -0.11 0.00 -1.27 0.00 0.00 60.65 59.10 1uzh h LYS 80 Cb 0.54 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1uzh h LYS 80 CO 0.04 0.69 -0.37 0.00 -2.27 0.00 0.00 179.45 177.54 1uzh h ALA 81 N 0.92 1.05 -2.38 5.00 0.00 -0.89 -3.36 119.26 119.60 1uzh h ALA 81 Ca 0.12 -0.40 -0.59 0.00 0.00 0.00 0.00 54.91 54.03 1uzh h ALA 81 Cb 0.36 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 17.65 1uzh h ALA 81 CO 0.01 0.59 -0.80 1.19 0.00 0.00 0.00 179.25 180.24 1uzh n PHE 82 N -4.05 1.56 0.55 0.00 3.01 -0.31 -4.96 117.46 113.26 1uzh n PHE 82 Ca -0.01 -3.86 0.11 0.00 1.01 0.00 0.00 57.45 54.70 1uzh n PHE 82 Cb 0.47 -0.35 0.45 0.00 -0.01 0.00 0.00 39.48 40.04 1uzh n PHE 82 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1uzh n PRO 83 N 1.65 0.14 -0.06 -1.08 -0.04 -0.86 -2.65 135.00 132.10 1uzh n PRO 83 Ca 0.25 0.28 0.09 0.00 -0.04 0.00 0.00 63.50 64.09 1uzh n PRO 83 Cb 0.44 -1.72 0.11 0.00 -0.04 0.00 0.00 33.50 32.29 1uzh n PRO 83 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1uzh n ASP 84 N -1.98 2.71 -4.91 3.54 8.00 -1.26 -4.73 116.55 117.93 1uzh n ASP 84 Ca 0.04 -1.81 -0.27 0.00 0.71 0.00 0.00 54.79 53.46 1uzh n ASP 84 Cb 0.27 -0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.28 1uzh n ASP 84 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1uzh s ALA 85 N -1.42 3.59 0.17 2.24 0.00 -1.09 -3.85 121.76 121.41 1uzh s ALA 85 Ca 0.25 -0.61 -0.30 0.00 0.00 0.00 0.00 51.96 51.30 1uzh s ALA 85 Cb 0.16 -2.32 -0.08 0.00 0.00 0.00 0.00 23.12 20.88 1uzh s ALA 85 CO 0.23 0.09 1.26 0.71 0.00 0.00 0.00 175.76 178.06 1uzh s TYR 86 N -2.24 3.34 -0.04 0.00 1.51 0.39 -3.90 117.35 116.41 1uzh s TYR 86 Ca 0.44 1.29 0.01 0.00 -1.01 0.00 0.00 57.07 57.80 1uzh s TYR 86 Cb -0.10 -3.52 0.02 0.00 -0.11 0.00 0.00 41.96 38.24 1uzh s TYR 86 CO 0.33 -1.59 -0.06 0.08 -1.11 0.00 0.00 175.55 173.20 1uzh s VAL 87 N 0.23 0.61 0.06 0.71 1.01 -0.67 -1.17 120.40 121.18 1uzh s VAL 87 Ca 0.56 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.43 1uzh s VAL 87 Cb -0.34 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1uzh s VAL 87 CO 0.36 0.23 -0.21 0.00 0.00 0.00 0.00 175.10 175.48 1uzh s ARG 88 N 0.75 1.32 -0.16 2.72 1.70 0.01 -0.32 118.95 124.98 1uzh s ARG 88 Ca -0.11 -1.01 -0.14 0.00 -0.47 0.00 0.00 55.73 54.00 1uzh s ARG 88 Cb -0.14 -1.49 -0.05 0.00 -0.57 0.00 0.00 34.95 32.71 1uzh s ARG 88 CO 0.01 0.37 0.29 -1.17 -1.08 0.00 0.00 175.30 173.72 1uzh s LEU 89 N -1.39 4.24 0.30 -1.89 2.96 -0.30 -1.82 118.68 120.78 1uzh s LEU 89 Ca 0.07 0.50 0.03 0.00 -0.22 0.00 0.00 54.13 54.52 1uzh s LEU 89 Cb -0.09 -2.37 -0.06 0.00 0.50 0.00 0.00 46.19 44.16 1uzh s LEU 89 CO 0.03 0.09 0.06 0.68 -1.32 0.00 0.00 176.35 175.89 1uzh s VAL 90 N 0.51 1.04 -0.03 1.68 -7.23 0.02 -1.48 120.40 114.91 1uzh s VAL 90 Ca 0.16 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.27 1uzh s VAL 90 Cb -0.13 -2.73 0.01 0.00 0.56 0.00 0.00 36.38 34.09 1uzh s VAL 90 CO 0.04 -0.03 0.14 0.00 -0.31 0.00 0.00 175.10 174.94 1uzh s ALA 91 N -3.41 -0.33 0.05 1.32 0.00 -1.00 -0.89 121.76 117.50 1uzh s ALA 91 Ca 0.36 0.15 0.05 0.00 0.00 0.00 0.00 51.96 52.52 1uzh s ALA 91 Cb 0.08 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 1uzh s ALA 91 CO 0.15 -0.13 -0.06 -0.06 0.00 0.00 0.00 175.76 175.65 1uzh s PHE 92 N -0.59 2.87 -0.27 0.00 0.08 0.15 -0.32 117.98 119.89 1uzh s PHE 92 Ca -0.07 -0.07 -0.03 0.00 0.12 0.00 0.00 56.93 56.88 1uzh s PHE 92 Cb -0.04 -1.55 0.02 0.00 -0.57 0.00 0.00 43.02 40.89 1uzh s PHE 92 CO 0.01 0.41 -0.01 0.34 -0.10 0.00 0.00 175.22 175.87 1uzh s ASP 93 N -1.83 4.63 0.00 1.36 -1.08 -0.47 -0.58 116.67 118.70 1uzh s ASP 93 Ca 0.20 -0.87 0.29 0.00 -0.52 0.00 0.00 52.55 51.65 1uzh s ASP 93 Cb -0.11 -1.74 1.26 0.00 -1.46 0.00 0.00 42.92 40.87 1uzh s ASP 93 CO 0.12 -0.16 1.93 -0.46 0.52 0.00 0.00 175.17 177.11 1uzh n ASN 94 N 4.72 0.00 -0.05 -0.34 6.94 -1.26 -0.95 115.26 124.32 1uzh n ASN 94 Ca -0.15 0.43 -0.17 0.00 -0.02 0.00 0.00 54.58 54.66 1uzh n ASN 94 Cb 0.47 -0.47 -0.13 0.00 -2.36 0.00 0.00 39.78 37.28 1uzh n ASN 94 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 1uzh h GLN 95 N 0.00 0.07 -0.00 -3.83 1.08 -1.95 -3.27 115.11 107.20 1uzh h GLN 95 Ca 0.00 -0.11 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1uzh h GLN 95 Cb 0.47 0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1uzh h GLN 95 CO 0.00 1.05 -0.19 1.63 -0.95 0.00 0.00 178.83 180.37 1uzh n LYS 96 N -4.45 0.29 -3.79 1.46 5.02 -1.25 -4.98 118.16 110.46 1uzh n LYS 96 Ca -0.15 -0.10 -0.30 0.00 -2.02 0.00 0.00 58.31 55.73 1uzh n LYS 96 Cb 0.60 -1.50 0.01 0.00 -0.02 0.00 0.00 35.03 34.12 1uzh n LYS 96 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1uzh n GLN 97 N -1.26 -1.08 -3.61 1.97 7.27 -0.12 -5.02 117.38 115.53 1uzh n GLN 97 Ca 0.10 0.57 -0.14 0.00 0.07 0.00 0.00 57.00 57.60 1uzh n GLN 97 Cb 0.31 -2.97 -0.06 0.00 2.41 0.00 0.00 30.24 29.93 1uzh n GLN 97 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1uzh s VAL 98 N -3.23 0.03 0.15 1.69 0.11 -0.87 -5.01 120.40 113.28 1uzh s VAL 98 Ca 0.23 -0.27 -0.31 0.00 -2.93 0.00 0.00 61.98 58.70 1uzh s VAL 98 Cb -0.11 -0.93 -0.08 0.00 -1.53 0.00 0.00 36.38 33.73 1uzh s VAL 98 CO 0.90 -0.15 1.32 -1.58 -3.33 0.00 0.00 175.10 172.26 1uzh s GLN 99 N -2.08 4.37 -0.00 1.54 0.74 -1.26 -1.37 119.66 121.60 1uzh s GLN 99 Ca -0.07 2.02 0.07 0.00 0.05 0.00 0.00 55.36 57.43 1uzh s GLN 99 Cb -0.01 -3.23 -0.10 0.00 1.10 0.00 0.00 33.01 30.77 1uzh s GLN 99 CO 0.01 -0.31 0.23 1.51 -0.55 0.00 0.00 175.29 176.18 1uzh n ILE 100 N 3.24 0.00 -3.89 -2.34 3.06 0.56 -4.92 119.36 115.07 1uzh n ILE 100 Ca 0.08 -0.25 -0.09 0.00 -2.50 0.00 0.00 62.75 59.99 1uzh n ILE 100 Cb 0.43 0.67 -0.05 0.00 0.54 0.00 0.00 39.64 41.24 1uzh n ILE 100 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1uzh s MET 101 N -2.08 1.48 0.00 9.51 0.23 -1.20 -4.98 119.30 122.25 1uzh s MET 101 Ca 0.00 -1.08 0.00 0.00 -1.03 0.00 0.00 55.69 53.58 1uzh s MET 101 Cb 0.05 0.50 0.00 0.00 -1.53 0.00 0.00 34.83 33.85 1uzh s MET 101 CO 0.30 -0.62 0.00 0.41 -2.03 0.00 0.00 175.02 173.08 1uzh n GLY 102 N -0.36 2.14 3.48 3.16 0.00 -1.26 -2.37 105.19 109.98 1uzh n GLY 102 Ca -0.05 0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 1uzh n GLY 102 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1uzh s PHE 103 N -0.86 -0.53 0.26 1.61 -0.71 -0.55 -4.46 117.98 112.74 1uzh s PHE 103 Ca 0.00 0.58 -0.30 0.00 -1.04 0.00 0.00 56.93 56.17 1uzh s PHE 103 Cb 0.00 0.50 -0.10 0.00 -1.21 0.00 0.00 43.02 42.22 1uzh s PHE 103 CO 0.00 -0.69 1.35 -0.51 -1.34 0.00 0.00 175.22 174.04 1uzh s LEU 104 N -2.10 4.41 -0.00 -1.99 1.02 -1.26 -1.15 118.68 117.61 1uzh s LEU 104 Ca -0.02 2.59 0.04 0.00 0.02 0.00 0.00 54.13 56.75 1uzh s LEU 104 Cb -0.01 -3.63 -0.04 0.00 0.02 0.00 0.00 46.19 42.54 1uzh s LEU 104 CO -0.04 -0.59 0.15 1.33 0.02 0.00 0.00 176.35 177.22 1uzh n VAL 105 N 1.92 0.00 -3.68 -1.59 0.24 0.57 -4.86 118.33 110.93 1uzh n VAL 105 Ca 0.04 -0.42 -0.15 0.00 -2.04 0.00 0.00 64.34 61.78 1uzh n VAL 105 Cb 0.42 1.00 -0.08 0.00 -1.47 0.00 0.00 33.84 33.70 1uzh n VAL 105 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1uzh s GLN 106 N -1.34 0.73 0.19 7.34 0.74 -0.96 -4.95 119.66 121.41 1uzh s GLN 106 Ca 0.01 0.25 0.07 0.00 0.05 0.00 0.00 55.36 55.74 1uzh s GLN 106 Cb 0.03 0.34 -0.05 0.00 1.10 0.00 0.00 33.01 34.43 1uzh s GLN 106 CO 0.15 -0.18 -0.14 1.03 -0.55 0.00 0.00 175.29 175.60 1uzh s ARG 107 N -0.70 1.26 0.48 1.67 0.52 -1.26 -1.67 118.95 119.24 1uzh s ARG 107 Ca -0.08 -1.54 -0.24 0.00 -0.52 0.00 0.00 55.73 53.35 1uzh s ARG 107 Cb -0.03 -1.01 -0.07 0.00 0.52 0.00 0.00 34.95 34.36 1uzh s ARG 107 CO 0.04 0.16 1.36 -2.30 0.02 0.00 0.00 175.30 174.59 1uzh n PRO 108 N -0.29 1.97 0.13 3.54 -0.02 -1.25 -4.78 135.00 134.30 1uzh n PRO 108 Ca -0.09 0.71 -0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1uzh n PRO 108 Cb 0.60 -2.55 0.12 0.00 -0.02 0.00 0.00 33.50 31.65 1uzh n PRO 108 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1uzh h LYS 109 N 1.92 0.00 0.00 -0.52 1.79 -1.85 -3.16 116.57 114.75 1uzh h LYS 109 Ca -0.50 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 1uzh h LYS 109 Cb 1.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 1uzh h LYS 109 CO 0.59 0.64 0.00 0.25 -1.08 0.00 0.00 179.45 179.85 1uzh n THR 110 N -3.54 0.50 -2.42 -0.16 -2.24 -1.26 -4.78 114.28 100.37 1uzh n THR 110 Ca -0.00 0.12 -0.42 0.00 -2.27 0.00 0.00 64.05 61.48 1uzh n THR 110 Cb 0.69 -0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 68.10 1uzh n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uzh s ALA 111 N -2.74 3.53 -0.12 6.98 0.00 -1.20 -4.90 121.76 123.31 1uzh s ALA 111 Ca 0.15 0.63 0.14 0.00 0.00 0.00 0.00 51.96 52.89 1uzh s ALA 111 Cb 0.13 -3.55 0.31 0.00 0.00 0.00 0.00 23.12 20.02 1uzh s ALA 111 CO 0.33 -0.85 1.15 2.89 0.00 0.00 0.00 175.76 179.27 1uzh n ARG 112 N 5.47 1.01 -0.13 0.00 0.00 -1.26 -4.81 116.66 116.95 1uzh n ARG 112 Ca 0.12 -2.50 0.11 0.00 -0.00 0.00 0.00 57.85 55.57 1uzh n ARG 112 Cb 0.46 -1.18 0.30 0.00 -0.00 0.00 0.00 32.46 32.04 1uzh n ARG 112 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1uzh n ASP 113 N -0.85 2.28 -4.30 2.89 3.85 -1.26 -4.87 116.55 114.29 1uzh n ASP 113 Ca 0.13 -1.83 -0.17 0.00 -0.71 0.00 0.00 54.79 52.22 1uzh n ASP 113 Cb 0.74 -0.16 -0.10 0.00 -1.35 0.00 0.00 41.12 40.24 1uzh n ASP 113 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 1uzh s PHE 114 N -1.67 1.51 -0.01 2.11 -0.12 -1.17 -1.43 117.98 117.20 1uzh s PHE 114 Ca 0.34 -0.64 0.00 0.00 -0.05 0.00 0.00 56.93 56.58 1uzh s PHE 114 Cb 0.19 -0.73 -0.04 0.00 -0.63 0.00 0.00 43.02 41.81 1uzh s PHE 114 CO 0.27 0.23 0.05 -0.65 -0.05 0.00 0.00 175.22 175.07 1uzh s GLN 115 N -3.54 2.96 0.65 1.99 -1.52 -1.04 -4.83 119.66 114.33 1uzh s GLN 115 Ca 0.18 -0.52 -0.18 0.00 -1.95 0.00 0.00 55.36 52.89 1uzh s GLN 115 Cb -0.00 -2.79 -0.01 0.00 -0.22 0.00 0.00 33.01 29.98 1uzh s GLN 115 CO 0.04 0.64 1.21 -0.35 -0.25 0.00 0.00 175.29 176.58 1uzh n PRO 116 N 1.30 1.02 -0.30 2.91 -0.04 -1.26 -4.89 135.00 133.74 1uzh n PRO 116 Ca -0.14 0.40 0.13 0.00 -0.04 0.00 0.00 63.50 63.86 1uzh n PRO 116 Cb 0.53 -2.45 0.30 0.00 -0.04 0.00 0.00 33.50 31.84 1uzh n PRO 116 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uzh h ALA 117 N 0.45 1.29 -0.01 0.55 0.00 -1.97 -0.71 119.26 118.85 1uzh h ALA 117 Ca -0.50 0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1uzh h ALA 117 Cb 1.34 0.34 0.00 0.00 0.00 0.00 0.00 17.79 19.47 1uzh h ALA 117 CO 0.52 -0.49 0.00 0.27 0.00 0.00 0.00 179.25 179.55 1uzh n ASN 118 N -5.25 0.30 -0.65 0.00 6.94 -1.26 -3.22 115.26 112.12 1uzh n ASN 118 Ca 0.22 -1.15 0.06 0.00 -0.02 0.00 0.00 54.58 53.68 1uzh n ASN 118 Cb 0.70 -0.00 0.14 0.00 -2.36 0.00 0.00 39.78 38.26 1uzh n ASN 118 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1uzh n LYS 119 N -0.74 2.47 0.19 -3.83 4.76 -0.28 -4.61 118.16 116.13 1uzh n LYS 119 Ca 0.22 -1.94 0.08 0.00 -2.87 0.00 0.00 58.31 53.80 1uzh n LYS 119 Cb 0.15 -1.28 0.27 0.00 -1.84 0.00 0.00 35.03 32.33 1uzh n LYS 119 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1uzh h ARG 120 N 2.22 0.00 -5.17 1.97 3.08 -1.56 -3.45 114.38 111.47 1uzh h ARG 120 Ca 0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.67 1uzh h ARG 120 Cb 0.71 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 30.54 1uzh h ARG 120 CO 0.00 0.28 -0.77 -1.54 -1.07 0.00 0.00 179.97 176.87 1uzh s SER 121 N -6.27 1.49 0.00 7.04 1.04 -1.26 -0.53 113.70 115.21 1uzh s SER 121 Ca 0.03 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.85 1uzh s SER 121 Cb 0.08 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.17 1uzh s SER 121 CO 0.68 -0.11 0.35 1.33 0.98 0.00 0.00 173.24 176.47