#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ze3 s LEU 2 N 0.00 3.86 -0.00 0.64 2.01 -1.26 -5.07 118.68 118.86 1ze3 s LEU 2 Ca 0.00 1.90 0.01 0.00 0.01 0.00 0.00 54.13 56.05 1ze3 s LEU 2 Cb 0.00 -4.56 -0.00 0.00 0.01 0.00 0.00 46.19 41.64 1ze3 s LEU 2 CO 0.00 -0.73 -0.03 -0.47 1.01 0.00 0.00 176.35 176.14 1ze3 s TYR 3 N -2.01 0.25 -0.10 0.29 5.04 -1.26 -4.82 117.35 114.74 1ze3 s TYR 3 Ca 0.67 -0.07 0.01 0.00 -2.44 0.00 0.00 57.07 55.24 1ze3 s TYR 3 Cb -0.15 -0.16 0.02 0.00 0.35 0.00 0.00 41.96 42.02 1ze3 s TYR 3 CO 0.19 -0.01 -0.12 -0.06 -1.34 0.00 0.00 175.55 174.21 1ze3 s PHE 4 N -0.12 1.71 -0.28 4.97 0.08 -1.26 -5.08 117.98 118.00 1ze3 s PHE 4 Ca 0.00 -0.80 -0.29 0.00 0.12 0.00 0.00 56.93 55.97 1ze3 s PHE 4 Cb -0.01 -1.29 -0.00 0.00 -0.57 0.00 0.00 43.02 41.14 1ze3 s PHE 4 CO -0.00 -0.45 1.36 1.21 -0.10 0.00 0.00 175.22 177.23 1ze3 s ASN 5 N 1.16 6.64 0.60 1.36 3.84 -1.26 -4.89 114.94 122.38 1ze3 s ASN 5 Ca -0.04 1.31 0.30 0.00 0.21 0.00 0.00 52.86 54.64 1ze3 s ASN 5 Cb -0.14 -2.54 1.77 0.00 -0.55 0.00 0.00 41.25 39.79 1ze3 s ASN 5 CO -0.03 -1.09 2.18 1.55 -2.79 0.00 0.00 177.10 176.91 1ze3 h PRO 6 N 9.48 0.00 0.00 0.43 0.13 -2.03 -1.65 132.00 138.37 1ze3 h PRO 6 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1ze3 h PRO 6 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1ze3 h PRO 6 CO 1.02 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.33 1ze3 n ARG 7 N -3.75 0.17 0.25 0.86 1.74 -1.26 -1.51 116.66 113.16 1ze3 n ARG 7 Ca -0.01 0.51 0.15 0.00 -0.77 0.00 0.00 57.85 57.73 1ze3 n ARG 7 Cb 0.21 -1.90 0.52 0.00 -1.02 0.00 0.00 32.46 30.27 1ze3 n ARG 7 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1ze3 h PHE 8 N 0.00 0.00 0.00 -1.55 0.04 -1.70 -3.57 116.94 110.16 1ze3 h PHE 8 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1ze3 h PHE 8 Cb 0.21 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.36 1ze3 h PHE 8 CO 0.00 0.05 0.00 1.28 -0.60 0.00 0.00 178.31 179.04 1ze3 n LEU 9 N -3.14 0.00 0.00 1.54 4.77 -0.57 -5.16 117.00 114.43 1ze3 n LEU 9 Ca 0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1ze3 n LEU 9 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1ze3 n LEU 9 CO 0.30 0.00 0.00 0.18 -1.33 0.00 0.00 177.39 176.54 1ze3 n LEU 19 N 0.00 0.00 -0.32 2.23 4.77 -1.26 -5.19 117.00 117.23 1ze3 n LEU 19 Ca 0.00 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.99 1ze3 n LEU 19 Cb 0.00 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.23 1ze3 n LEU 19 CO 0.00 0.00 1.21 0.77 -1.33 0.00 0.00 177.39 178.04 1ze3 h SER 20 N 0.00 0.89 -0.36 -1.43 4.64 -1.98 -1.81 113.55 113.50 1ze3 h SER 20 Ca 0.00 0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.38 1ze3 h SER 20 Cb 0.00 -0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 61.87 1ze3 h SER 20 CO 0.00 0.58 0.10 0.08 -0.87 0.00 0.00 176.83 176.72 1ze3 h ARG 21 N 1.03 0.24 -0.63 4.77 0.11 -1.96 -0.22 114.38 117.72 1ze3 h ARG 21 Ca 0.38 -0.01 -0.06 0.00 0.10 0.00 0.00 59.98 60.38 1ze3 h ARG 21 Cb 0.14 -0.05 -0.03 0.00 1.11 0.00 0.00 29.97 31.14 1ze3 h ARG 21 CO -0.16 0.16 0.15 0.74 0.10 0.00 0.00 179.97 180.95 1ze3 h PHE 22 N 0.24 1.03 0.00 4.08 0.04 -1.65 0.23 116.94 120.92 1ze3 h PHE 22 Ca 0.17 -0.11 0.00 0.00 2.80 0.00 0.00 57.97 60.82 1ze3 h PHE 22 Cb 0.16 -0.30 0.00 0.00 2.20 0.00 0.00 35.95 38.02 1ze3 h PHE 22 CO -0.16 0.85 0.00 0.93 -0.60 0.00 0.00 178.31 179.33 1ze3 h GLU 23 N 0.94 0.00 -0.67 1.51 5.08 -0.55 -2.32 114.58 118.58 1ze3 h GLU 23 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1ze3 h GLU 23 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1ze3 h GLU 23 CO 0.00 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.10 1ze3 n ASN 24 N -2.78 3.97 0.00 1.42 3.02 -0.17 -4.30 115.26 116.42 1ze3 n ASN 24 Ca 0.00 -2.09 0.00 0.00 -0.03 0.00 0.00 54.58 52.46 1ze3 n ASN 24 Cb 0.23 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 38.93 1ze3 n ASN 24 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ze3 n GLY 25 N 1.39 0.29 3.76 7.41 0.00 -0.87 -5.05 105.19 112.13 1ze3 n GLY 25 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.88 1ze3 n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ze3 s GLN 26 N -0.89 3.41 -0.22 1.61 -1.52 -0.05 -4.96 119.66 117.04 1ze3 s GLN 26 Ca 0.00 1.89 0.11 0.00 -1.95 0.00 0.00 55.36 55.41 1ze3 s GLN 26 Cb 0.00 -2.24 -0.22 0.00 -0.22 0.00 0.00 33.01 30.33 1ze3 s GLN 26 CO 0.00 -0.87 -0.05 0.39 -0.25 0.00 0.00 175.29 174.51 1ze3 n GLU 27 N -0.91 0.67 -3.88 2.91 1.02 -1.26 -4.31 120.64 114.88 1ze3 n GLU 27 Ca 0.10 0.06 -0.14 0.00 -0.02 0.00 0.00 57.16 57.16 1ze3 n GLU 27 Cb 0.48 -1.52 -0.15 0.00 -0.02 0.00 0.00 31.44 30.22 1ze3 n GLU 27 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1ze3 s LEU 28 N -5.96 1.63 0.66 -4.62 2.96 -1.26 -5.07 118.68 107.03 1ze3 s LEU 28 Ca -0.21 -0.00 -0.07 0.00 -0.22 0.00 0.00 54.13 53.62 1ze3 s LEU 28 Cb 0.07 -0.08 0.03 0.00 0.50 0.00 0.00 46.19 46.72 1ze3 s LEU 28 CO 0.73 -0.04 0.99 -2.16 -1.32 0.00 0.00 176.35 174.55 1ze3 s PRO 29 N 0.42 2.60 0.49 0.98 0.04 -1.26 -4.81 135.00 133.46 1ze3 s PRO 29 Ca -0.04 -0.01 -0.23 0.00 0.04 0.00 0.00 61.00 60.77 1ze3 s PRO 29 Cb -0.06 -2.17 -0.08 0.00 0.04 0.00 0.00 34.50 32.23 1ze3 s PRO 29 CO -0.01 -1.00 1.12 -2.30 0.04 0.00 0.00 177.00 174.85 1ze3 n PRO 30 N -2.82 1.43 -3.66 0.56 -0.02 -1.26 -4.92 135.00 124.31 1ze3 n PRO 30 Ca 0.06 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 1ze3 n PRO 30 Cb 0.59 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 1ze3 n PRO 30 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ze3 n GLY 31 N 1.05 -2.15 3.40 -1.23 0.00 -0.61 -5.01 105.19 100.64 1ze3 n GLY 31 Ca 0.10 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.58 1ze3 n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ze3 s THR 32 N -2.17 3.64 0.04 2.61 2.01 -1.26 -0.02 115.64 120.49 1ze3 s THR 32 Ca 0.00 -0.42 0.07 0.00 0.31 0.00 0.00 61.69 61.65 1ze3 s THR 32 Cb 0.00 -2.63 -0.02 0.00 0.01 0.00 0.00 72.50 69.85 1ze3 s THR 32 CO 0.00 0.44 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.86 1ze3 s TYR 33 N 1.02 1.76 -0.38 4.92 2.02 -0.40 -4.90 117.35 121.40 1ze3 s TYR 33 Ca 0.01 -0.37 -0.28 0.00 -0.37 0.00 0.00 57.07 56.06 1ze3 s TYR 33 Cb -0.15 -1.06 0.02 0.00 -0.40 0.00 0.00 41.96 40.38 1ze3 s TYR 33 CO 0.01 0.07 1.06 0.50 -1.57 0.00 0.00 175.55 175.62 1ze3 s ARG 34 N -1.08 3.91 0.15 -0.62 3.52 -1.26 -0.81 118.95 122.77 1ze3 s ARG 34 Ca 0.07 0.80 0.05 0.00 -0.13 0.00 0.00 55.73 56.53 1ze3 s ARG 34 Cb -0.09 -3.80 -0.04 0.00 -1.56 0.00 0.00 34.95 29.46 1ze3 s ARG 34 CO 0.01 -1.06 -0.12 0.14 -0.81 0.00 0.00 175.30 173.47 1ze3 s VAL 35 N 3.85 1.31 -0.22 7.11 -7.23 -0.46 -4.92 120.40 119.84 1ze3 s VAL 35 Ca 0.44 -2.04 -0.18 0.00 -1.81 0.00 0.00 61.98 58.39 1ze3 s VAL 35 Cb -0.11 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.97 1ze3 s VAL 35 CO 0.21 -0.66 0.53 -1.81 -0.31 0.00 0.00 175.10 173.05 1ze3 s ASP 36 N -3.08 6.53 -0.21 4.85 1.01 -0.42 -1.71 116.67 123.64 1ze3 s ASP 36 Ca 0.17 0.64 -0.13 0.00 0.71 0.00 0.00 52.55 53.94 1ze3 s ASP 36 Cb 0.01 -2.29 -0.04 0.00 1.01 0.00 0.00 42.92 41.60 1ze3 s ASP 36 CO 0.02 -0.22 0.27 -0.63 0.21 0.00 0.00 175.17 174.82 1ze3 s ILE 37 N 1.88 5.29 0.03 0.77 1.01 0.20 -0.32 121.20 130.07 1ze3 s ILE 37 Ca 0.24 0.44 0.08 0.00 0.00 0.00 0.00 60.65 61.40 1ze3 s ILE 37 Cb -0.15 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 1ze3 s ILE 37 CO 0.09 0.31 -0.21 -0.31 0.00 0.00 0.00 174.94 174.83 1ze3 s TYR 38 N 1.07 2.47 -0.10 3.97 1.51 -0.05 -0.88 117.35 125.34 1ze3 s TYR 38 Ca 0.13 -0.31 -0.00 0.00 -1.01 0.00 0.00 57.07 55.88 1ze3 s TYR 38 Cb -0.14 -1.45 0.02 0.00 -0.11 0.00 0.00 41.96 40.28 1ze3 s TYR 38 CO 0.05 0.19 -0.08 -1.17 -1.11 0.00 0.00 175.55 173.44 1ze3 s LEU 39 N -1.28 1.21 -1.49 -1.29 2.96 -0.45 -0.62 118.68 117.73 1ze3 s LEU 39 Ca 0.13 -0.28 -0.09 0.00 -0.22 0.00 0.00 54.13 53.67 1ze3 s LEU 39 Cb -0.10 -0.79 0.06 0.00 0.50 0.00 0.00 46.19 45.86 1ze3 s LEU 39 CO 0.03 -0.10 0.82 0.59 -1.32 0.00 0.00 176.35 176.37 1ze3 n ASN 40 N 4.74 -3.15 -1.57 3.68 3.02 0.55 -1.53 115.26 121.01 1ze3 n ASN 40 Ca -0.14 -0.85 -0.17 0.00 -0.03 0.00 0.00 54.58 53.39 1ze3 n ASN 40 Cb 0.50 -3.66 -0.05 0.00 -0.61 0.00 0.00 39.78 35.97 1ze3 n ASN 40 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ze3 n ASN 41 N -2.88 -5.05 -4.23 6.41 5.03 -1.26 -5.01 115.26 108.27 1ze3 n ASN 41 Ca -0.08 0.25 -0.30 0.00 0.87 0.00 0.00 54.58 55.31 1ze3 n ASN 41 Cb 0.58 -4.09 -0.17 0.00 -1.02 0.00 0.00 39.78 35.08 1ze3 n ASN 41 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1ze3 s GLY 42 N -2.58 1.22 0.33 7.41 0.00 -0.58 -5.11 107.32 108.01 1ze3 s GLY 42 Ca 0.00 -0.95 -0.29 0.00 0.00 0.00 0.00 44.72 43.48 1ze3 s GLY 42 CO 0.00 -0.50 1.51 -0.47 0.00 0.00 0.00 173.10 173.64 1ze3 s TYR 43 N 0.01 2.73 0.00 1.90 5.04 -1.26 -1.34 117.35 124.42 1ze3 s TYR 43 Ca -0.07 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 55.58 1ze3 s TYR 43 Cb -0.14 -3.99 0.00 0.00 0.35 0.00 0.00 41.96 38.17 1ze3 s TYR 43 CO 0.05 -3.10 0.00 -1.33 -1.34 0.00 0.00 175.55 169.83 1ze3 n MET 44 N 1.33 0.00 -3.79 4.97 2.81 -0.06 -4.88 117.12 117.49 1ze3 n MET 44 Ca 0.04 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.92 1ze3 n MET 44 Cb 0.39 -0.66 0.00 0.00 -0.71 0.00 0.00 33.22 32.24 1ze3 n MET 44 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ze3 s ALA 45 N -1.90 -1.94 -0.16 3.04 0.00 -1.09 -4.98 121.76 114.72 1ze3 s ALA 45 Ca 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 51.96 52.07 1ze3 s ALA 45 Cb 0.00 0.64 0.05 0.00 0.00 0.00 0.00 23.12 23.81 1ze3 s ALA 45 CO 0.00 -1.07 0.03 0.99 0.00 0.00 0.00 175.76 175.71 1ze3 s THR 46 N -2.49 0.44 0.22 0.00 2.01 -1.26 0.62 115.64 115.18 1ze3 s THR 46 Ca 0.19 -0.37 -0.22 0.00 0.31 0.00 0.00 61.69 61.60 1ze3 s THR 46 Cb 0.00 -0.88 0.06 0.00 0.01 0.00 0.00 72.50 71.69 1ze3 s THR 46 CO 0.01 -0.11 0.90 0.00 -0.69 0.00 0.00 174.62 174.73 1ze3 s ARG 47 N 1.91 1.52 0.18 4.92 1.04 -0.69 -4.94 118.95 122.88 1ze3 s ARG 47 Ca 0.01 -0.90 -0.30 0.00 -1.04 0.00 0.00 55.73 53.50 1ze3 s ARG 47 Cb -0.16 0.48 -0.08 0.00 -2.04 0.00 0.00 34.95 33.15 1ze3 s ARG 47 CO -0.07 -0.70 1.16 -0.51 -0.04 0.00 0.00 175.30 175.14 1ze3 s ASP 48 N -3.06 7.15 -0.04 -2.89 1.01 -1.26 -1.35 116.67 116.23 1ze3 s ASP 48 Ca 0.15 2.18 0.01 0.00 0.71 0.00 0.00 52.55 55.60 1ze3 s ASP 48 Cb -0.03 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 41.31 1ze3 s ASP 48 CO 0.05 -0.32 -0.03 -0.69 0.21 0.00 0.00 175.17 174.39 1ze3 s VAL 49 N -0.13 0.42 0.02 -1.27 1.01 0.01 -4.94 120.40 115.53 1ze3 s VAL 49 Ca 0.51 -0.07 -0.24 0.00 0.00 0.00 0.00 61.98 62.18 1ze3 s VAL 49 Cb -0.31 -0.47 -0.05 0.00 0.00 0.00 0.00 36.38 35.55 1ze3 s VAL 49 CO 0.36 0.20 0.74 -0.89 0.00 0.00 0.00 175.10 175.50 1ze3 s THR 50 N 0.88 4.80 -0.19 3.92 2.01 -1.26 -1.27 115.64 124.52 1ze3 s THR 50 Ca -0.11 1.56 -0.01 0.00 0.31 0.00 0.00 61.69 63.44 1ze3 s THR 50 Cb -0.14 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.29 1ze3 s THR 50 CO -0.00 0.35 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.79 1ze3 s PHE 51 N 0.06 2.85 0.28 4.92 0.40 0.97 -0.78 117.98 126.68 1ze3 s PHE 51 Ca 0.38 -1.21 0.08 0.00 -0.60 0.00 0.00 56.93 55.57 1ze3 s PHE 51 Cb -0.20 -1.98 -0.04 0.00 0.51 0.00 0.00 43.02 41.31 1ze3 s PHE 51 CO 0.22 -0.62 0.16 -0.80 0.70 0.00 0.00 175.22 174.88 1ze3 s ASN 52 N 1.24 5.17 0.39 1.36 0.01 -0.32 -1.57 114.94 121.21 1ze3 s ASN 52 Ca 0.03 -0.44 -0.28 0.00 -0.71 0.00 0.00 52.86 51.46 1ze3 s ASN 52 Cb -0.14 -1.12 -0.10 0.00 0.41 0.00 0.00 41.25 40.29 1ze3 s ASN 52 CO -0.06 -0.12 1.47 -0.89 -1.51 0.00 0.00 177.10 175.99 1ze3 s THR 53 N -2.24 2.07 0.09 1.60 2.01 -1.26 -0.08 115.64 117.82 1ze3 s THR 53 Ca 0.35 0.07 -0.27 0.00 0.31 0.00 0.00 61.69 62.15 1ze3 s THR 53 Cb -0.07 -3.04 0.09 0.00 0.01 0.00 0.00 72.50 69.49 1ze3 s THR 53 CO 0.24 0.02 1.11 -0.83 -0.69 0.00 0.00 174.62 174.47 1ze3 s GLY 54 N -0.23 -0.24 -0.54 4.40 0.00 -0.88 -4.70 107.32 105.12 1ze3 s GLY 54 Ca 0.54 0.25 -0.27 0.00 0.00 0.00 0.00 44.72 45.24 1ze3 s GLY 54 CO 0.62 0.78 1.60 -0.35 0.00 0.00 0.00 173.10 175.75 1ze3 s ASP 55 N -3.09 5.84 -0.16 1.64 2.15 -1.26 -4.18 116.67 117.61 1ze3 s ASP 55 Ca 0.16 0.44 -0.30 0.00 0.43 0.00 0.00 52.55 53.28 1ze3 s ASP 55 Cb 0.01 -2.54 0.12 0.00 -0.30 0.00 0.00 42.92 40.21 1ze3 s ASP 55 CO 0.00 -1.91 0.97 -0.55 -0.17 0.00 0.00 175.17 173.51 1ze3 s SER 56 N 5.75 -0.40 0.62 -0.34 0.15 -1.26 -4.97 113.70 113.25 1ze3 s SER 56 Ca 0.61 0.47 0.36 0.00 0.70 0.00 0.00 55.95 58.08 1ze3 s SER 56 Cb -0.13 0.37 2.06 0.00 -1.71 0.00 0.00 66.02 66.61 1ze3 s SER 56 CO 0.25 -0.35 2.30 1.05 1.20 0.00 0.00 173.24 177.68 1ze3 h GLU 57 N 2.72 0.00 0.00 5.44 4.11 -1.93 0.64 114.58 125.56 1ze3 h GLU 57 Ca -0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.23 1ze3 h GLU 57 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1ze3 h GLU 57 CO 0.30 0.00 -0.37 1.96 0.07 0.00 0.00 179.01 180.98 1ze3 h GLN 58 N 0.00 0.00 0.00 1.06 4.20 -1.94 -3.48 115.11 114.95 1ze3 h GLN 58 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ze3 h GLN 58 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 1ze3 h GLN 58 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 1ze3 n GLY 59 N 1.25 2.47 3.10 3.46 0.00 0.22 -4.65 105.19 111.04 1ze3 n GLY 59 Ca 0.04 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1ze3 n GLY 59 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ze3 s ILE 60 N -2.37 0.62 0.02 -0.61 -4.36 -1.26 -2.08 121.20 111.17 1ze3 s ILE 60 Ca 0.00 -1.36 0.03 0.00 -0.26 0.00 0.00 60.65 59.06 1ze3 s ILE 60 Cb 0.00 -0.97 -0.02 0.00 1.25 0.00 0.00 42.46 42.72 1ze3 s ILE 60 CO 0.00 -0.53 -0.10 0.68 0.24 0.00 0.00 174.94 175.24 1ze3 s VAL 61 N -2.08 0.74 0.51 8.37 -7.23 0.88 -4.79 120.40 116.81 1ze3 s VAL 61 Ca -0.03 -0.77 -0.20 0.00 -1.81 0.00 0.00 61.98 59.17 1ze3 s VAL 61 Cb -0.05 -0.69 -0.07 0.00 0.56 0.00 0.00 36.38 36.12 1ze3 s VAL 61 CO -0.01 -0.06 1.06 -2.16 -0.31 0.00 0.00 175.10 173.62 1ze3 s PRO 62 N -0.93 3.64 -0.36 4.82 0.04 -1.26 -1.18 135.00 139.77 1ze3 s PRO 62 Ca -0.01 1.41 -0.05 0.00 0.04 0.00 0.00 61.00 62.38 1ze3 s PRO 62 Cb -0.07 -2.07 0.07 0.00 0.04 0.00 0.00 34.50 32.48 1ze3 s PRO 62 CO 0.00 -0.58 0.14 0.00 0.04 0.00 0.00 177.00 176.60 1ze3 s LEU 64 N 1.31 1.98 0.68 0.00 1.43 -1.26 -4.44 118.68 118.36 1ze3 s LEU 64 Ca 0.01 -0.30 -0.07 0.00 -1.03 0.00 0.00 54.13 52.74 1ze3 s LEU 64 Cb -0.21 -0.85 0.04 0.00 0.03 0.00 0.00 46.19 45.20 1ze3 s LEU 64 CO -0.00 0.18 0.99 0.42 0.23 0.00 0.00 176.35 178.17 1ze3 s THR 65 N -0.22 2.70 0.19 5.49 -4.23 -1.26 -1.06 115.64 117.25 1ze3 s THR 65 Ca 0.03 -0.16 -0.12 0.00 -1.18 0.00 0.00 61.69 60.26 1ze3 s THR 65 Cb -0.08 -3.15 0.09 0.00 1.34 0.00 0.00 72.50 70.70 1ze3 s THR 65 CO 0.00 -0.16 1.80 -0.09 -0.54 0.00 0.00 174.62 175.64 1ze3 h ARG 66 N -0.49 0.57 -0.56 3.99 2.43 -1.77 -1.48 114.38 117.06 1ze3 h ARG 66 Ca -0.45 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.62 1ze3 h ARG 66 Cb 1.30 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 1ze3 h ARG 66 CO 0.61 0.37 0.06 0.00 -1.51 0.00 0.00 179.97 179.51 1ze3 h ALA 67 N 1.27 1.06 -0.18 2.80 0.00 -1.94 -0.23 119.26 122.04 1ze3 h ALA 67 Ca 0.23 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ze3 h ALA 67 Cb 0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ze3 h ALA 67 CO -0.14 0.60 0.05 1.96 0.00 0.00 0.00 179.25 181.72 1ze3 h GLN 68 N 0.86 0.29 -0.56 0.00 4.20 -1.80 -1.48 115.11 116.62 1ze3 h GLN 68 Ca 0.17 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 1ze3 h GLN 68 Cb 0.42 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 1ze3 h GLN 68 CO 0.01 0.42 0.24 -0.07 -0.67 0.00 0.00 178.83 178.77 1ze3 h LEU 69 N 0.11 0.75 -0.57 1.46 3.38 -1.12 -2.84 115.31 116.47 1ze3 h LEU 69 Ca 0.06 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.91 1ze3 h LEU 69 Cb 0.26 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 1ze3 h LEU 69 CO 0.00 0.69 0.33 0.00 0.09 0.00 0.00 178.44 179.56 1ze3 h ALA 70 N 1.09 0.74 0.00 1.53 0.00 -0.91 -1.53 119.26 120.17 1ze3 h ALA 70 Ca 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ze3 h ALA 70 Cb 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ze3 h ALA 70 CO -0.02 0.04 0.00 0.66 0.00 0.00 0.00 179.25 179.93 1ze3 h SER 71 N 0.65 0.00 0.07 0.00 4.64 -1.04 -1.59 113.55 116.28 1ze3 h SER 71 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1ze3 h SER 71 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1ze3 h SER 71 CO -0.12 0.00 -0.50 0.23 -0.87 0.00 0.00 176.83 175.57 1ze3 n MET 72 N -2.75 0.90 0.00 4.77 2.00 -0.63 -4.95 117.12 116.45 1ze3 n MET 72 Ca -0.01 -0.70 0.00 0.00 0.00 0.00 0.00 57.70 56.99 1ze3 n MET 72 Cb 0.13 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 31.86 1ze3 n MET 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ze3 n GLY 73 N 1.42 1.00 3.75 3.03 0.00 -0.60 -5.07 105.19 108.72 1ze3 n GLY 73 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1ze3 n GLY 73 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ze3 s LEU 74 N 0.00 4.42 -0.73 0.99 2.96 -0.88 -0.33 118.68 125.11 1ze3 s LEU 74 Ca 0.00 2.54 -0.17 0.00 -0.22 0.00 0.00 54.13 56.28 1ze3 s LEU 74 Cb 0.00 -3.62 0.15 0.00 0.50 0.00 0.00 46.19 43.21 1ze3 s LEU 74 CO 0.00 -0.55 0.79 0.21 -1.32 0.00 0.00 176.35 175.48 1ze3 s ASN 75 N 0.07 6.46 0.57 3.68 2.47 0.58 -4.32 114.94 124.44 1ze3 s ASN 75 Ca 0.55 -1.99 0.26 0.00 0.42 0.00 0.00 52.86 52.10 1ze3 s ASN 75 Cb -0.38 -2.29 1.55 0.00 -1.45 0.00 0.00 41.25 38.68 1ze3 s ASN 75 CO 0.43 -0.91 2.08 0.71 -3.72 0.00 0.00 177.10 175.70 1ze3 h THR 76 N 5.55 0.60 0.00 -5.21 1.35 -1.93 -0.88 112.91 112.39 1ze3 h THR 76 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1ze3 h THR 76 Cb 1.06 0.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.32 1ze3 h THR 76 CO 0.99 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 176.26 1ze3 h ALA 77 N 1.79 1.00 -0.01 6.62 0.00 -1.95 -2.74 119.26 123.97 1ze3 h ALA 77 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1ze3 h ALA 77 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ze3 h ALA 77 CO -0.00 0.00 -0.22 -1.13 0.00 0.00 0.00 179.25 177.90 1ze3 n SER 78 N -2.73 1.35 -4.46 0.00 3.41 -0.33 -4.82 113.62 106.03 1ze3 n SER 78 Ca 0.01 -1.15 -0.40 0.00 -0.26 0.00 0.00 58.87 57.07 1ze3 n SER 78 Cb 0.26 0.14 -0.11 0.00 -0.26 0.00 0.00 64.21 64.24 1ze3 n SER 78 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ze3 s VAL 79 N -2.36 4.86 0.19 -3.33 1.01 -1.04 -4.96 120.40 114.76 1ze3 s VAL 79 Ca 0.27 -0.43 -0.33 0.00 0.00 0.00 0.00 61.98 61.50 1ze3 s VAL 79 Cb 0.20 -3.53 -0.13 0.00 0.00 0.00 0.00 36.38 32.92 1ze3 s VAL 79 CO 0.48 -0.02 1.68 0.00 0.00 0.00 0.00 175.10 177.24 1ze3 n ALA 80 N 5.03 2.34 -0.84 5.51 0.00 -1.26 -2.19 120.51 129.11 1ze3 n ALA 80 Ca -0.13 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1ze3 n ALA 80 Cb 0.49 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.47 1ze3 n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ze3 n GLY 81 N 3.80 0.75 0.22 0.00 0.00 -1.26 -4.87 105.19 103.83 1ze3 n GLY 81 Ca 0.16 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.26 1ze3 n GLY 81 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1ze3 h MET 82 N 2.14 0.00 0.00 1.61 -1.53 -1.75 -2.41 114.93 112.99 1ze3 h MET 82 Ca 0.00 0.00 -0.02 0.00 -3.44 0.00 0.00 59.70 56.24 1ze3 h MET 82 Cb 0.00 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.05 1ze3 h MET 82 CO 0.00 0.26 -0.08 -2.95 0.14 0.00 0.00 176.91 174.28 1ze3 h ASN 83 N 0.00 0.00 1.25 1.39 7.08 -1.87 -2.48 115.58 120.95 1ze3 h ASN 83 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1ze3 h ASN 83 Cb 0.58 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.82 1ze3 h ASN 83 CO 0.03 0.08 0.00 0.18 -2.08 0.00 0.00 177.43 175.64 1ze3 n LEU 84 N -3.38 0.49 -4.79 6.14 4.77 -0.91 -4.87 117.00 114.45 1ze3 n LEU 84 Ca -0.01 0.55 -0.34 0.00 -0.03 0.00 0.00 56.01 56.18 1ze3 n LEU 84 Cb 0.24 -0.40 -0.01 0.00 -2.33 0.00 0.00 43.42 40.92 1ze3 n LEU 84 CO 0.28 -0.13 0.74 -0.76 -1.33 0.00 0.00 177.39 176.18 1ze3 s LEU 85 N -3.93 3.72 0.65 2.23 1.43 -0.94 -5.03 118.68 116.81 1ze3 s LEU 85 Ca 0.12 1.98 -0.11 0.00 -1.03 0.00 0.00 54.13 55.09 1ze3 s LEU 85 Cb 0.15 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.78 1ze3 s LEU 85 CO 0.56 -1.04 1.04 0.00 0.23 0.00 0.00 176.35 177.14 1ze3 s ALA 86 N -2.04 2.96 0.36 4.21 0.00 -1.26 -4.94 121.76 121.05 1ze3 s ALA 86 Ca 0.68 -0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.64 1ze3 s ALA 86 Cb -0.19 -3.11 0.69 0.00 0.00 0.00 0.00 23.12 20.52 1ze3 s ALA 86 CO 0.27 -0.87 1.98 -0.44 0.00 0.00 0.00 175.76 176.70 1ze3 h ASP 87 N -0.45 0.69 -0.67 0.00 3.32 -1.98 -2.48 116.42 114.85 1ze3 h ASP 87 Ca -0.44 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1ze3 h ASP 87 Cb 1.20 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.59 1ze3 h ASP 87 CO 0.60 0.47 0.00 -0.90 -1.72 0.00 0.00 179.24 177.70 1ze3 n ASP 88 N -4.46 3.60 -4.78 6.45 5.75 -1.26 -4.35 116.55 117.50 1ze3 n ASP 88 Ca 0.09 -2.00 -0.37 0.00 -0.01 0.00 0.00 54.79 52.50 1ze3 n ASP 88 Cb 0.14 -0.45 -0.03 0.00 -1.03 0.00 0.00 41.12 39.76 1ze3 n ASP 88 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ze3 s ALA 89 N -1.11 3.04 -0.36 2.12 0.00 -0.93 -4.94 121.76 119.58 1ze3 s ALA 89 Ca 0.45 0.82 -0.29 0.00 0.00 0.00 0.00 51.96 52.94 1ze3 s ALA 89 Cb 0.23 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 20.05 1ze3 s ALA 89 CO 0.30 -0.43 1.08 0.00 0.00 0.00 0.00 175.76 176.72 1ze3 s VAL 91 N 3.85 3.13 -1.45 0.00 1.01 -0.23 -4.86 120.40 121.84 1ze3 s VAL 91 Ca 0.46 0.47 -0.13 0.00 0.00 0.00 0.00 61.98 62.77 1ze3 s VAL 91 Cb -0.11 -3.30 -0.01 0.00 0.00 0.00 0.00 36.38 32.96 1ze3 s VAL 91 CO 0.20 -0.01 2.40 -0.81 0.00 0.00 0.00 175.10 176.88 1ze3 n PRO 92 N 6.10 2.98 -0.34 2.72 -0.04 -1.26 -4.71 135.00 140.45 1ze3 n PRO 92 Ca 0.17 -2.43 -0.11 0.00 -0.04 0.00 0.00 63.50 61.09 1ze3 n PRO 92 Cb 0.41 -3.12 -0.09 0.00 -0.04 0.00 0.00 33.50 30.65 1ze3 n PRO 92 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1ze3 h LEU 93 N 9.38 -1.98 -2.62 1.53 5.85 -1.94 0.77 115.31 126.30 1ze3 h LEU 93 Ca 0.64 0.29 -0.00 0.00 0.84 0.00 0.00 57.88 59.65 1ze3 h LEU 93 Cb 0.54 0.87 -0.00 0.00 0.37 0.00 0.00 40.66 42.43 1ze3 h LEU 93 CO 1.86 -0.25 -0.01 0.71 -0.34 0.00 0.00 178.44 180.41 1ze3 h THR 94 N -0.07 0.09 0.00 1.05 1.35 -1.80 0.31 112.91 113.83 1ze3 h THR 94 Ca 0.13 -0.12 -0.38 0.00 -0.55 0.00 0.00 66.41 65.50 1ze3 h THR 94 Cb 0.42 1.11 -0.07 0.00 -1.73 0.00 0.00 68.15 67.88 1ze3 h THR 94 CO -0.82 0.01 -2.42 0.35 -0.25 0.00 0.00 175.52 172.38 1ze3 n THR 95 N -3.20 1.43 0.10 6.82 -2.24 -0.82 -4.43 114.28 111.95 1ze3 n THR 95 Ca -0.02 -0.55 -0.05 0.00 -2.27 0.00 0.00 64.05 61.16 1ze3 n THR 95 Cb 0.12 -1.39 0.08 0.00 -2.10 0.00 0.00 70.33 67.04 1ze3 n THR 95 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1ze3 h MET 96 N -0.01 0.09 -4.62 -0.78 1.85 -0.80 -3.40 114.93 107.27 1ze3 h MET 96 Ca -0.56 -0.08 -0.68 0.00 -0.61 0.00 0.00 59.70 57.76 1ze3 h MET 96 Cb 1.86 0.02 -0.35 0.00 0.43 0.00 0.00 31.60 33.56 1ze3 h MET 96 CO -0.09 0.78 -0.63 0.08 -0.40 0.00 0.00 176.91 176.65 1ze3 s VAL 97 N -3.42 2.99 -0.24 -5.77 1.01 0.09 -4.67 120.40 110.40 1ze3 s VAL 97 Ca -0.02 -1.89 -0.37 0.00 0.00 0.00 0.00 61.98 59.70 1ze3 s VAL 97 Cb 0.12 -2.97 -0.13 0.00 0.00 0.00 0.00 36.38 33.40 1ze3 s VAL 97 CO 0.79 -0.48 1.90 1.67 0.00 0.00 0.00 175.10 178.99 1ze3 n GLN 98 N 4.54 1.48 -1.30 2.72 7.27 -1.26 -1.49 117.38 129.33 1ze3 n GLN 98 Ca -0.05 0.52 -0.10 0.00 0.07 0.00 0.00 57.00 57.43 1ze3 n GLN 98 Cb 0.42 -2.37 -0.04 0.00 2.41 0.00 0.00 30.24 30.65 1ze3 n GLN 98 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1ze3 n ASP 99 N 6.92 -4.28 -4.84 1.69 8.00 -1.26 -4.75 116.55 118.03 1ze3 n ASP 99 Ca 0.29 0.26 -0.32 0.00 0.71 0.00 0.00 54.79 55.72 1ze3 n ASP 99 Cb 0.21 -2.70 -0.05 0.00 -0.02 0.00 0.00 41.12 38.55 1ze3 n ASP 99 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ze3 s ALA 100 N -2.39 3.14 0.15 2.24 0.00 -0.56 -4.66 121.76 119.69 1ze3 s ALA 100 Ca 0.00 0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.19 1ze3 s ALA 100 Cb 0.00 -3.01 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 1ze3 s ALA 100 CO 0.00 0.06 -0.06 0.95 0.00 0.00 0.00 175.76 176.71 1ze3 s THR 101 N -2.28 0.94 -0.14 0.00 -4.23 0.08 -4.39 115.64 105.63 1ze3 s THR 101 Ca 0.58 -2.01 -0.07 0.00 -1.18 0.00 0.00 61.69 59.02 1ze3 s THR 101 Cb -0.10 -1.93 0.06 0.00 1.34 0.00 0.00 72.50 71.87 1ze3 s THR 101 CO 0.21 -0.66 0.32 0.00 -0.54 0.00 0.00 174.62 173.94 1ze3 s ALA 102 N -3.48 -0.77 -0.10 3.99 0.00 -1.26 -1.38 121.76 118.76 1ze3 s ALA 102 Ca 0.19 1.21 -0.06 0.00 0.00 0.00 0.00 51.96 53.29 1ze3 s ALA 102 Cb 0.04 -0.87 0.04 0.00 0.00 0.00 0.00 23.12 22.33 1ze3 s ALA 102 CO 0.01 -0.36 0.23 -1.58 0.00 0.00 0.00 175.76 174.06 1ze3 s HIS 103 N 1.67 -0.29 -0.27 0.00 5.04 -0.48 -5.00 115.29 115.95 1ze3 s HIS 103 Ca -0.07 0.70 -0.10 0.00 -1.54 0.00 0.00 55.06 54.05 1ze3 s HIS 103 Cb -0.10 0.06 -0.05 0.00 0.04 0.00 0.00 32.58 32.53 1ze3 s HIS 103 CO -0.10 -0.19 0.17 -1.17 -2.34 0.00 0.00 174.74 171.11 1ze3 s LEU 104 N 0.80 3.94 -0.66 8.88 2.96 -1.26 -0.30 118.68 133.04 1ze3 s LEU 104 Ca -0.06 -0.03 -0.23 0.00 -0.22 0.00 0.00 54.13 53.60 1ze3 s LEU 104 Cb -0.07 -2.09 0.06 0.00 0.50 0.00 0.00 46.19 44.59 1ze3 s LEU 104 CO -0.05 -0.04 1.00 -0.62 -1.32 0.00 0.00 176.35 175.32 1ze3 s ASP 105 N 1.67 6.19 0.22 3.68 -1.08 0.33 -4.89 116.67 122.78 1ze3 s ASP 105 Ca 0.07 -0.86 -0.09 0.00 -0.52 0.00 0.00 52.55 51.15 1ze3 s ASP 105 Cb -0.16 -2.44 0.23 0.00 -1.46 0.00 0.00 42.92 39.09 1ze3 s ASP 105 CO 0.09 -1.47 1.86 0.58 0.52 0.00 0.00 175.17 176.75 1ze3 h VAL 106 N 5.98 1.11 -0.92 1.11 2.07 -1.96 0.35 116.25 124.00 1ze3 h VAL 106 Ca -0.28 -0.32 0.04 0.00 0.82 0.00 0.00 66.70 66.95 1ze3 h VAL 106 Cb 1.07 0.08 -0.05 0.00 -1.52 0.00 0.00 31.29 30.86 1ze3 h VAL 106 CO 1.18 0.17 0.60 1.23 0.02 0.00 0.00 177.57 180.78 1ze3 h GLY 107 N 0.95 1.33 0.51 2.17 0.00 -1.97 -2.21 103.07 103.84 1ze3 h GLY 107 Ca 0.31 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.20 1ze3 h GLY 107 CO -0.12 0.37 -0.80 -1.06 0.00 0.00 0.00 176.54 174.93 1ze3 n GLN 108 N -4.46 0.05 -3.65 4.80 6.02 -1.05 -4.96 117.38 114.14 1ze3 n GLN 108 Ca 0.13 -0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.90 1ze3 n GLN 108 Cb 0.13 -1.51 0.05 0.00 1.02 0.00 0.00 30.24 29.93 1ze3 n GLN 108 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.06 177.09 1ze3 n GLN 109 N -1.57 -5.83 -4.13 -1.09 6.02 0.12 -4.79 117.38 106.10 1ze3 n GLN 109 Ca 0.04 0.70 -0.33 0.00 -0.01 0.00 0.00 57.00 57.40 1ze3 n GLN 109 Cb 0.35 -5.50 -0.16 0.00 1.02 0.00 0.00 30.24 25.96 1ze3 n GLN 109 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 1ze3 s ARG 110 N -5.95 3.03 -0.44 -1.09 3.52 -0.73 -1.29 118.95 116.00 1ze3 s ARG 110 Ca 0.17 -0.81 -0.20 0.00 -0.13 0.00 0.00 55.73 54.76 1ze3 s ARG 110 Cb -0.08 -2.61 0.03 0.00 -1.56 0.00 0.00 34.95 30.73 1ze3 s ARG 110 CO 0.78 -0.20 0.62 -1.17 -0.81 0.00 0.00 175.30 174.52 1ze3 s LEU 111 N 1.28 4.57 -0.36 -0.88 2.96 0.56 -0.51 118.68 126.30 1ze3 s LEU 111 Ca 0.04 -0.41 -0.17 0.00 -0.22 0.00 0.00 54.13 53.37 1ze3 s LEU 111 Cb -0.13 -2.67 -0.00 0.00 0.50 0.00 0.00 46.19 43.88 1ze3 s LEU 111 CO -0.11 -0.76 0.44 0.20 -1.32 0.00 0.00 176.35 174.80 1ze3 s ASN 112 N 2.01 6.24 -0.02 3.68 0.02 0.58 -0.87 114.94 126.58 1ze3 s ASN 112 Ca 0.21 -0.19 0.02 0.00 -1.02 0.00 0.00 52.86 51.88 1ze3 s ASN 112 Cb -0.15 -2.23 -0.03 0.00 0.02 0.00 0.00 41.25 38.86 1ze3 s ASN 112 CO 0.18 -0.43 -0.05 -0.76 0.02 0.00 0.00 177.10 176.06 1ze3 s LEU 113 N 2.21 3.26 -0.02 0.60 1.43 0.21 -1.39 118.68 124.99 1ze3 s LEU 113 Ca 0.15 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 1ze3 s LEU 113 Cb -0.16 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.25 1ze3 s LEU 113 CO 0.13 0.31 -0.06 -0.89 0.23 0.00 0.00 176.35 176.07 1ze3 s THR 114 N -0.96 0.55 -0.05 5.49 2.01 -0.48 -0.33 115.64 121.87 1ze3 s THR 114 Ca 0.16 -0.21 0.01 0.00 0.31 0.00 0.00 61.69 61.96 1ze3 s THR 114 Cb -0.11 -0.51 0.02 0.00 0.01 0.00 0.00 72.50 71.90 1ze3 s THR 114 CO 0.06 0.19 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.50 1ze3 s ILE 115 N 0.36 0.65 0.55 1.82 1.01 -1.26 -0.74 121.20 123.59 1ze3 s ILE 115 Ca -0.05 -0.17 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 1ze3 s ILE 115 Cb -0.09 -0.66 -0.05 0.00 0.01 0.00 0.00 42.46 41.67 1ze3 s ILE 115 CO 0.00 0.26 1.27 -2.65 0.00 0.00 0.00 174.94 173.81 1ze3 n PRO 116 N 4.16 1.53 0.04 2.79 -0.02 -1.26 -4.87 135.00 137.37 1ze3 n PRO 116 Ca -0.22 0.56 0.16 0.00 -2.02 0.00 0.00 63.50 61.99 1ze3 n PRO 116 Cb 0.51 -2.46 0.65 0.00 -0.02 0.00 0.00 33.50 32.17 1ze3 n PRO 116 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1ze3 h GLN 117 N 1.27 0.06 0.00 -0.52 1.08 -1.99 -1.22 115.11 113.80 1ze3 h GLN 117 Ca -0.50 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 1ze3 h GLN 117 Cb 1.32 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.73 1ze3 h GLN 117 CO 0.56 0.04 0.00 0.00 -0.95 0.00 0.00 178.83 178.48 1ze3 h ALA 118 N 1.78 1.00 -0.03 3.87 0.00 -2.01 -2.02 119.26 121.86 1ze3 h ALA 118 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ze3 h ALA 118 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1ze3 h ALA 118 CO -0.01 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.43 1ze3 n PHE 119 N -2.85 0.03 -3.27 0.00 3.72 -0.46 -4.97 117.46 109.66 1ze3 n PHE 119 Ca -0.02 -0.03 -0.29 0.00 -0.05 0.00 0.00 57.45 57.06 1ze3 n PHE 119 Cb 0.07 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.58 1ze3 n PHE 119 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1ze3 s MET 120 N -0.99 3.65 -1.42 -1.08 -1.94 -0.76 -0.31 119.30 116.46 1ze3 s MET 120 Ca 0.14 0.06 -0.13 0.00 -1.71 0.00 0.00 55.69 54.05 1ze3 s MET 120 Cb 0.10 -2.61 0.07 0.00 2.01 0.00 0.00 34.83 34.39 1ze3 s MET 120 CO 0.15 0.18 2.13 0.43 -0.01 0.00 0.00 175.02 177.89 1ze3 n SER 121 N -1.01 4.17 -0.56 3.03 7.64 0.56 -4.55 113.62 122.89 1ze3 n SER 121 Ca -0.01 -2.89 0.06 0.00 1.01 0.00 0.00 58.87 57.03 1ze3 n SER 121 Cb 0.54 -1.63 0.16 0.00 -1.01 0.00 0.00 64.21 62.27 1ze3 n SER 121 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1ze3 n ASN 122 N 5.84 3.01 -4.74 6.43 0.23 -1.26 -5.04 115.26 119.74 1ze3 n ASN 122 Ca 0.49 -2.39 -0.41 0.00 -0.53 0.00 0.00 54.58 51.74 1ze3 n ASN 122 Cb 0.39 -0.30 0.01 0.00 -2.08 0.00 0.00 39.78 37.79 1ze3 n ASN 122 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 1ze3 n ARG 123 N -0.12 2.30 -1.64 -3.83 0.63 -1.26 -4.83 116.66 107.92 1ze3 n ARG 123 Ca 0.13 0.81 -0.53 0.00 -0.92 0.00 0.00 57.85 57.35 1ze3 n ARG 123 Cb 0.55 -2.54 -0.06 0.00 0.45 0.00 0.00 32.46 30.86 1ze3 n ARG 123 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ze3 n ALA 124 N 0.09 -0.35 -0.03 5.13 0.00 -1.26 -5.27 120.51 118.82 1ze3 n ALA 124 Ca 0.04 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1ze3 n ALA 124 Cb 0.39 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.66 1ze3 n ALA 124 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37