#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uqx n GLN 2 N 0.00 2.56 -4.28 0.00 7.27 -1.26 -5.02 117.38 116.65 1uqx n GLN 2 Ca 0.00 0.90 -0.16 0.00 0.07 0.00 0.00 57.00 57.81 1uqx n GLN 2 Cb 0.00 -2.64 -0.10 0.00 2.41 0.00 0.00 30.24 29.91 1uqx n GLN 2 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 1uqx s GLN 3 N -2.17 1.15 0.00 3.69 -1.52 -1.26 -4.81 119.66 114.74 1uqx s GLN 3 Ca 0.55 -1.49 0.00 0.00 -1.95 0.00 0.00 55.36 52.47 1uqx s GLN 3 Cb -0.47 -0.79 0.00 0.00 -0.22 0.00 0.00 33.01 31.52 1uqx s GLN 3 CO 0.62 0.11 0.00 0.41 -0.25 0.00 0.00 175.29 176.19 1uqx n GLY 4 N -0.25 0.69 3.55 3.09 0.00 -1.26 -4.88 105.19 106.13 1uqx n GLY 4 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 1uqx n GLY 4 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uqx s VAL 5 N -2.66 4.35 -0.00 1.61 1.01 -1.26 -0.43 120.40 123.00 1uqx s VAL 5 Ca 0.00 -0.19 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1uqx s VAL 5 Cb 0.00 -2.95 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 1uqx s VAL 5 CO 0.00 0.46 -0.04 -0.36 0.00 0.00 0.00 175.10 175.16 1uqx s PHE 6 N 0.54 0.35 -0.39 5.22 0.08 -0.28 -5.02 117.98 118.48 1uqx s PHE 6 Ca 0.01 -0.07 -0.15 0.00 0.12 0.00 0.00 56.93 56.84 1uqx s PHE 6 Cb -0.13 -0.23 0.01 0.00 -0.57 0.00 0.00 43.02 42.09 1uqx s PHE 6 CO 0.02 -0.01 0.33 0.99 -0.10 0.00 0.00 175.22 176.45 1uqx s THR 7 N -0.07 5.21 0.40 0.64 2.01 -1.26 -1.19 115.64 121.37 1uqx s THR 7 Ca 0.01 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.64 1uqx s THR 7 Cb -0.02 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.58 1uqx s THR 7 CO -0.00 -0.24 0.61 -0.76 -0.69 0.00 0.00 174.62 173.54 1uqx s LEU 8 N 1.86 3.84 0.55 4.42 1.02 0.40 -5.03 118.68 125.74 1uqx s LEU 8 Ca 0.08 0.39 -0.22 0.00 0.02 0.00 0.00 54.13 54.40 1uqx s LEU 8 Cb -0.18 -3.26 -0.05 0.00 0.02 0.00 0.00 46.19 42.72 1uqx s LEU 8 CO 0.11 -0.49 1.34 -0.81 0.02 0.00 0.00 176.35 176.52 1uqx n PRO 9 N -1.93 1.63 -2.12 1.29 -0.04 -1.26 -4.30 135.00 128.27 1uqx n PRO 9 Ca -0.02 0.60 -0.35 0.00 -0.04 0.00 0.00 63.50 63.70 1uqx n PRO 9 Cb 0.57 -2.55 0.01 0.00 -0.04 0.00 0.00 33.50 31.49 1uqx n PRO 9 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1uqx s ALA 10 N -1.30 2.63 -1.43 0.55 0.00 -1.26 -3.98 121.76 116.98 1uqx s ALA 10 Ca 0.72 0.76 -0.03 0.00 0.00 0.00 0.00 51.96 53.42 1uqx s ALA 10 Cb -0.42 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.37 1uqx s ALA 10 CO 0.49 -0.91 0.54 -1.71 0.00 0.00 0.00 175.76 174.17 1uqx n ASN 11 N -1.59 -1.05 -4.05 0.00 5.15 0.66 -4.94 115.26 109.45 1uqx n ASN 11 Ca 0.11 -0.96 -0.25 0.00 -0.60 0.00 0.00 54.58 52.88 1uqx n ASN 11 Cb 0.51 -3.26 -0.16 0.00 -0.53 0.00 0.00 39.78 36.34 1uqx n ASN 11 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1uqx s THR 12 N -3.80 1.23 0.28 -0.44 2.01 -1.26 -4.88 115.64 108.78 1uqx s THR 12 Ca 0.12 -0.54 -0.29 0.00 0.31 0.00 0.00 61.69 61.28 1uqx s THR 12 Cb -0.06 -1.10 -0.10 0.00 0.01 0.00 0.00 72.50 71.25 1uqx s THR 12 CO 0.87 0.37 1.29 -0.44 -0.69 0.00 0.00 174.62 176.03 1uqx s SER 13 N 0.55 6.87 0.03 3.53 0.01 -1.26 -1.06 113.70 122.36 1uqx s SER 13 Ca -0.13 2.54 -0.00 0.00 1.31 0.00 0.00 55.95 59.67 1uqx s SER 13 Cb -0.15 -2.63 -0.03 0.00 0.21 0.00 0.00 66.02 63.42 1uqx s SER 13 CO 0.04 -0.49 -0.03 0.72 0.41 0.00 0.00 173.24 173.89 1uqx s PHE 14 N -0.68 0.34 0.03 2.43 -0.71 -0.03 -4.20 117.98 115.15 1uqx s PHE 14 Ca 0.51 -0.69 -0.08 0.00 -1.04 0.00 0.00 56.93 55.63 1uqx s PHE 14 Cb -0.38 -0.25 -0.05 0.00 -1.21 0.00 0.00 43.02 41.13 1uqx s PHE 14 CO 0.46 -0.25 0.32 0.20 -1.34 0.00 0.00 175.22 174.61 1uqx s GLY 15 N -1.90 2.30 -0.04 1.99 0.00 -0.44 -1.24 107.32 108.00 1uqx s GLY 15 Ca -0.09 -0.48 0.01 0.00 0.00 0.00 0.00 44.72 44.16 1uqx s GLY 15 CO -0.04 -0.26 -0.05 0.54 0.00 0.00 0.00 173.10 173.29 1uqx s VAL 16 N -1.30 0.59 -0.05 1.40 0.11 -0.09 -1.20 120.40 119.85 1uqx s VAL 16 Ca 0.28 -0.17 0.02 0.00 -2.93 0.00 0.00 61.98 59.19 1uqx s VAL 16 Cb -0.14 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.13 1uqx s VAL 16 CO 0.16 0.23 -0.11 -0.89 -3.33 0.00 0.00 175.10 171.16 1uqx s THR 17 N 0.78 0.98 0.06 5.04 2.01 -0.09 -1.06 115.64 123.36 1uqx s THR 17 Ca -0.11 -0.42 0.10 0.00 0.31 0.00 0.00 61.69 61.57 1uqx s THR 17 Cb -0.14 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 1uqx s THR 17 CO 0.01 0.31 -0.26 0.00 -0.69 0.00 0.00 174.62 173.98 1uqx s ALA 18 N 0.50 2.26 0.06 7.40 0.00 -0.51 -0.61 121.76 130.86 1uqx s ALA 18 Ca -0.10 -1.30 0.02 0.00 0.00 0.00 0.00 51.96 50.59 1uqx s ALA 18 Cb -0.13 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.50 1uqx s ALA 18 CO 0.02 0.53 -0.08 -0.06 0.00 0.00 0.00 175.76 176.17 1uqx s PHE 19 N -0.85 0.80 0.03 0.00 0.40 -0.14 -0.54 117.98 117.68 1uqx s PHE 19 Ca 0.12 -0.61 0.06 0.00 -0.60 0.00 0.00 56.93 55.89 1uqx s PHE 19 Cb -0.10 -0.46 -0.03 0.00 0.51 0.00 0.00 43.02 42.93 1uqx s PHE 19 CO 0.03 -0.08 -0.13 0.00 0.70 0.00 0.00 175.22 175.73 1uqx s ALA 20 N -2.02 2.78 -0.40 5.36 0.00 -0.31 -1.10 121.76 126.07 1uqx s ALA 20 Ca -0.03 -1.14 0.07 0.00 0.00 0.00 0.00 51.96 50.87 1uqx s ALA 20 Cb -0.06 -0.90 0.24 0.00 0.00 0.00 0.00 23.12 22.41 1uqx s ALA 20 CO -0.01 0.59 0.50 0.09 0.00 0.00 0.00 175.76 176.93 1uqx n ASN 21 N 1.46 0.13 -3.56 0.00 3.02 -0.45 -1.37 115.26 114.49 1uqx n ASN 21 Ca -0.16 -2.65 -0.16 0.00 -0.03 0.00 0.00 54.58 51.58 1uqx n ASN 21 Cb 0.52 -0.63 -0.06 0.00 -0.61 0.00 0.00 39.78 39.00 1uqx n ASN 21 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1uqx s ALA 22 N -1.02 -1.77 0.20 5.41 0.00 0.16 -4.05 121.76 120.69 1uqx s ALA 22 Ca 0.35 1.59 0.05 0.00 0.00 0.00 0.00 51.96 53.95 1uqx s ALA 22 Cb 0.15 -0.45 0.11 0.00 0.00 0.00 0.00 23.12 22.93 1uqx s ALA 22 CO -0.12 -0.36 1.46 0.00 0.00 0.00 0.00 175.76 176.74 1uqx h ALA 23 N 3.77 0.68 -2.46 0.00 0.00 -1.95 -0.93 119.26 118.37 1uqx h ALA 23 Ca -0.28 -0.67 -0.51 0.00 0.00 0.00 0.00 54.91 53.46 1uqx h ALA 23 Cb 1.15 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1uqx h ALA 23 CO 0.26 0.88 0.13 -0.80 0.00 0.00 0.00 179.25 179.71 1uqx s ASN 24 N -6.88 7.00 -0.00 0.00 0.01 -1.26 -4.76 114.94 109.05 1uqx s ASN 24 Ca -0.02 1.42 -0.30 0.00 -0.71 0.00 0.00 52.86 53.25 1uqx s ASN 24 Cb 0.11 -2.42 -0.07 0.00 0.41 0.00 0.00 41.25 39.27 1uqx s ASN 24 CO 0.81 -0.04 1.82 -0.89 -1.51 0.00 0.00 177.10 177.29 1uqx s THR 25 N -1.66 3.26 0.13 1.60 2.01 -1.26 -4.55 115.64 115.16 1uqx s THR 25 Ca 0.47 0.33 -0.15 0.00 0.31 0.00 0.00 61.69 62.64 1uqx s THR 25 Cb -0.15 -3.21 -0.07 0.00 0.01 0.00 0.00 72.50 69.08 1uqx s THR 25 CO 0.20 -0.03 0.55 -1.10 -0.69 0.00 0.00 174.62 173.55 1uqx s GLN 26 N 4.22 4.02 -0.23 4.92 -1.52 0.29 -4.30 119.66 127.06 1uqx s GLN 26 Ca 0.82 0.54 0.02 0.00 -1.95 0.00 0.00 55.36 54.78 1uqx s GLN 26 Cb -0.39 -2.99 0.05 0.00 -0.22 0.00 0.00 33.01 29.47 1uqx s GLN 26 CO 0.36 0.51 -0.12 0.99 -0.25 0.00 0.00 175.29 176.78 1uqx s THR 27 N -1.40 1.99 -0.24 -0.19 2.01 -0.03 -1.77 115.64 116.01 1uqx s THR 27 Ca 0.36 -1.37 -0.01 0.00 0.31 0.00 0.00 61.69 60.99 1uqx s THR 27 Cb -0.16 -2.06 0.03 0.00 0.01 0.00 0.00 72.50 70.32 1uqx s THR 27 CO 0.19 0.10 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.50 1uqx s ILE 28 N 1.21 2.71 -0.06 1.82 1.01 0.14 -1.36 121.20 126.68 1uqx s ILE 28 Ca -0.05 -1.07 0.01 0.00 0.00 0.00 0.00 60.65 59.54 1uqx s ILE 28 Cb -0.18 -2.37 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 1uqx s ILE 28 CO -0.07 0.22 -0.06 -1.10 0.00 0.00 0.00 174.94 173.93 1uqx s GLN 29 N 1.30 2.74 -0.27 2.79 -0.21 -0.01 -0.38 119.66 125.61 1uqx s GLN 29 Ca -0.00 -0.56 -0.03 0.00 0.02 0.00 0.00 55.36 54.79 1uqx s GLN 29 Cb -0.16 -2.59 0.03 0.00 1.00 0.00 0.00 33.01 31.28 1uqx s GLN 29 CO -0.06 0.66 -0.02 0.08 -2.12 0.00 0.00 175.29 173.84 1uqx s VAL 30 N -0.84 3.11 -0.13 1.09 1.01 -0.32 -1.44 120.40 122.88 1uqx s VAL 30 Ca 0.13 -1.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.00 1uqx s VAL 30 Cb -0.11 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 1uqx s VAL 30 CO 0.02 0.09 0.07 -0.76 0.00 0.00 0.00 175.10 174.53 1uqx s LEU 31 N 1.34 3.94 -0.16 3.92 1.02 0.81 -0.67 118.68 128.89 1uqx s LEU 31 Ca -0.01 0.24 0.02 0.00 0.02 0.00 0.00 54.13 54.40 1uqx s LEU 31 Cb -0.18 -1.95 0.02 0.00 0.02 0.00 0.00 46.19 44.10 1uqx s LEU 31 CO -0.02 0.33 -0.20 -0.69 0.02 0.00 0.00 176.35 175.78 1uqx s VAL 32 N -0.56 2.01 -1.52 -1.59 1.01 -0.36 -1.31 120.40 118.08 1uqx s VAL 32 Ca 0.11 -0.93 -0.07 0.00 0.00 0.00 0.00 61.98 61.09 1uqx s VAL 32 Cb -0.12 -1.80 0.06 0.00 0.00 0.00 0.00 36.38 34.52 1uqx s VAL 32 CO 0.02 0.54 0.56 0.47 0.00 0.00 0.00 175.10 176.69 1uqx n ASP 33 N 4.35 -1.53 -0.50 3.32 8.00 0.26 -1.63 116.55 128.82 1uqx n ASP 33 Ca -0.20 -1.01 -0.06 0.00 0.71 0.00 0.00 54.79 54.23 1uqx n ASP 33 Cb 0.51 -2.93 -0.03 0.00 -0.02 0.00 0.00 41.12 38.65 1uqx n ASP 33 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1uqx n ASN 34 N -2.86 -4.52 -4.27 -2.24 5.03 -1.26 -4.99 115.26 100.15 1uqx n ASN 34 Ca -0.16 0.16 -0.33 0.00 0.87 0.00 0.00 54.58 55.12 1uqx n ASN 34 Cb 0.61 -2.59 -0.15 0.00 -1.02 0.00 0.00 39.78 36.63 1uqx n ASN 34 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1uqx s VAL 35 N -1.99 2.62 -0.04 2.41 1.01 -0.64 -5.04 120.40 118.72 1uqx s VAL 35 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 60.89 1uqx s VAL 35 Cb 0.00 -2.09 -0.05 0.00 0.00 0.00 0.00 36.38 34.23 1uqx s VAL 35 CO 0.00 0.52 1.54 -0.69 0.00 0.00 0.00 175.10 176.47 1uqx s VAL 36 N 0.73 3.64 -0.17 2.92 1.01 -1.26 -1.22 120.40 126.05 1uqx s VAL 36 Ca -0.07 0.89 0.10 0.00 0.00 0.00 0.00 61.98 62.90 1uqx s VAL 36 Cb -0.16 -3.57 -0.14 0.00 0.00 0.00 0.00 36.38 32.52 1uqx s VAL 36 CO 0.01 -0.05 0.28 0.29 0.00 0.00 0.00 175.10 175.63 1uqx n LYS 37 N 6.46 1.52 -3.70 2.72 4.76 0.16 -4.96 118.16 125.12 1uqx n LYS 37 Ca 0.16 -0.06 -0.14 0.00 -2.87 0.00 0.00 58.31 55.40 1uqx n LYS 37 Cb 0.43 -1.14 -0.08 0.00 -1.84 0.00 0.00 35.03 32.40 1uqx n LYS 37 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1uqx s ALA 38 N -2.42 -1.11 -0.04 7.82 0.00 -1.17 -5.00 121.76 119.85 1uqx s ALA 38 Ca -0.01 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.85 1uqx s ALA 38 Cb 0.07 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.95 1uqx s ALA 38 CO 0.41 -0.26 -0.03 0.99 0.00 0.00 0.00 175.76 176.86 1uqx s THR 39 N -0.70 0.40 -0.07 0.00 2.01 -1.26 -1.17 115.64 114.84 1uqx s THR 39 Ca -0.08 -0.06 0.05 0.00 0.31 0.00 0.00 61.69 61.91 1uqx s THR 39 Cb -0.03 -0.44 -0.01 0.00 0.01 0.00 0.00 72.50 72.03 1uqx s THR 39 CO 0.04 0.19 -0.22 -0.36 -0.69 0.00 0.00 174.62 173.58 1uqx s PHE 40 N 0.85 2.55 -0.02 4.92 0.08 0.48 -4.97 117.98 121.88 1uqx s PHE 40 Ca -0.10 -0.70 0.01 0.00 0.12 0.00 0.00 56.93 56.26 1uqx s PHE 40 Cb -0.13 -1.66 0.01 0.00 -0.57 0.00 0.00 43.02 40.67 1uqx s PHE 40 CO -0.00 -0.20 -0.02 0.99 -0.10 0.00 0.00 175.22 175.89 1uqx s THR 41 N -0.07 0.21 -4.99 0.64 2.01 -1.26 -0.68 115.64 111.50 1uqx s THR 41 Ca -0.05 -0.02 0.00 0.00 0.31 0.00 0.00 61.69 61.92 1uqx s THR 41 Cb -0.14 -0.24 0.00 0.00 0.01 0.00 0.00 72.50 72.12 1uqx s THR 41 CO 0.04 0.11 0.00 0.61 -0.69 0.00 0.00 174.62 174.69 1uqx n GLY 42 N 3.59 -2.89 3.25 4.40 0.00 -0.73 -4.96 105.19 107.86 1uqx n GLY 42 Ca -0.20 -1.32 -0.14 0.00 0.00 0.00 0.00 46.02 44.35 1uqx n GLY 42 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uqx s SER 43 N -0.18 0.64 0.00 1.61 1.04 -1.26 -0.55 113.70 115.00 1uqx s SER 43 Ca 0.00 -1.49 0.00 0.00 0.48 0.00 0.00 55.95 54.94 1uqx s SER 43 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1uqx s SER 43 CO 0.00 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 173.89 1uqx n GLY 44 N -0.39 4.79 0.83 7.32 0.00 -0.35 -4.87 105.19 112.51 1uqx n GLY 44 Ca 0.04 -1.10 0.09 0.00 0.00 0.00 0.00 46.02 45.04 1uqx n GLY 44 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uqx n THR 45 N -1.93 0.30 -3.10 2.61 -2.24 -1.26 -0.66 114.28 108.00 1uqx n THR 45 Ca 0.00 -0.65 -0.27 0.00 -2.27 0.00 0.00 64.05 60.85 1uqx n THR 45 Cb 0.00 1.12 -0.05 0.00 -2.10 0.00 0.00 70.33 69.29 1uqx n THR 45 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1uqx n SER 46 N 1.07 4.33 -3.79 3.42 2.88 -1.26 -4.72 113.62 115.56 1uqx n SER 46 Ca 0.13 -3.60 -0.23 0.00 -1.33 0.00 0.00 58.87 53.84 1uqx n SER 46 Cb 0.48 -0.62 0.02 0.00 -0.75 0.00 0.00 64.21 63.34 1uqx n SER 46 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1uqx n ASP 47 N 0.15 -1.01 -4.65 -3.46 2.03 -1.14 -4.84 116.55 103.62 1uqx n ASP 47 Ca 0.31 -0.88 -0.43 0.00 0.52 0.00 0.00 54.79 54.32 1uqx n ASP 47 Cb 0.39 -3.74 -0.03 0.00 -0.72 0.00 0.00 41.12 37.02 1uqx n ASP 47 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1uqx n LYS 48 N -4.32 2.75 -2.34 -0.67 3.00 -0.47 -4.79 118.16 111.31 1uqx n LYS 48 Ca -0.29 0.99 -0.43 0.00 -0.00 0.00 0.00 58.31 58.58 1uqx n LYS 48 Cb 0.68 -3.02 -0.02 0.00 0.00 0.00 0.00 35.03 32.67 1uqx n LYS 48 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1uqx s LEU 49 N 4.85 3.78 0.24 3.14 2.96 -1.26 -1.16 118.68 131.22 1uqx s LEU 49 Ca 0.91 1.15 0.20 0.00 -0.22 0.00 0.00 54.13 56.17 1uqx s LEU 49 Cb -0.44 -3.54 0.06 0.00 0.50 0.00 0.00 46.19 42.77 1uqx s LEU 49 CO 0.42 -1.23 1.21 -0.07 -1.32 0.00 0.00 176.35 175.35 1uqx h LEU 50 N 11.49 0.00 0.00 -0.68 3.38 -1.17 -3.49 115.31 124.84 1uqx h LEU 50 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1uqx h LEU 50 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1uqx h LEU 50 CO 1.04 0.25 0.00 0.61 0.09 0.00 0.00 178.44 180.43 1uqx n GLY 51 N 1.22 1.96 3.18 0.83 0.00 -1.22 -4.69 105.19 106.48 1uqx n GLY 51 Ca -0.01 -1.27 -0.12 0.00 0.00 0.00 0.00 46.02 44.62 1uqx n GLY 51 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uqx s SER 52 N 0.00 -0.37 0.03 1.61 0.15 -1.26 -1.43 113.70 112.43 1uqx s SER 52 Ca 0.00 0.69 -0.03 0.00 0.70 0.00 0.00 55.95 57.30 1uqx s SER 52 Cb 0.00 0.61 -0.02 0.00 -1.71 0.00 0.00 66.02 64.90 1uqx s SER 52 CO 0.00 -0.16 0.04 -1.10 1.20 0.00 0.00 173.24 173.23 1uqx s GLN 53 N 0.98 0.49 -0.17 5.44 -0.21 -0.22 -4.99 119.66 120.97 1uqx s GLN 53 Ca -0.07 -0.73 -0.04 0.00 0.02 0.00 0.00 55.36 54.54 1uqx s GLN 53 Cb -0.07 0.19 -0.03 0.00 1.00 0.00 0.00 33.01 34.10 1uqx s GLN 53 CO -0.07 -0.11 -0.03 0.08 -2.12 0.00 0.00 175.29 173.04 1uqx s VAL 54 N -2.29 3.89 0.18 1.09 1.01 -1.26 -0.92 120.40 122.09 1uqx s VAL 54 Ca -0.08 -0.35 0.06 0.00 0.00 0.00 0.00 61.98 61.62 1uqx s VAL 54 Cb -0.03 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 1uqx s VAL 54 CO -0.03 0.47 -0.13 -0.76 0.00 0.00 0.00 175.10 174.65 1uqx s LEU 55 N 0.58 2.53 0.09 3.92 1.43 -0.37 -4.96 118.68 121.91 1uqx s LEU 55 Ca -0.02 -0.99 -0.18 0.00 -1.03 0.00 0.00 54.13 51.91 1uqx s LEU 55 Cb -0.14 -0.56 -0.07 0.00 0.03 0.00 0.00 46.19 45.45 1uqx s LEU 55 CO 0.02 -0.22 0.56 0.21 0.23 0.00 0.00 176.35 177.16 1uqx s ASN 56 N -3.17 6.99 0.00 2.29 3.84 -1.26 -0.85 114.94 122.78 1uqx s ASN 56 Ca 0.19 1.21 0.30 0.00 0.21 0.00 0.00 52.86 54.77 1uqx s ASN 56 Cb -0.00 -2.34 1.59 0.00 -0.55 0.00 0.00 41.25 39.95 1uqx s ASN 56 CO 0.04 0.23 2.08 -1.54 -2.79 0.00 0.00 177.10 175.13 1uqx n SER 57 N 1.47 0.00 0.00 -4.21 3.41 -0.23 -4.92 113.62 109.14 1uqx n SER 57 Ca -0.09 -0.31 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 1uqx n SER 57 Cb 0.51 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1uqx n SER 57 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1uqx n GLY 58 N 1.21 3.67 0.18 5.00 0.00 -1.26 -0.40 105.19 113.58 1uqx n GLY 58 Ca 0.16 -0.06 0.14 0.00 0.00 0.00 0.00 46.02 46.25 1uqx n GLY 58 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1uqx h SER 59 N 0.00 0.00 0.00 1.61 4.64 -1.94 0.19 113.55 118.05 1uqx h SER 59 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1uqx h SER 59 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1uqx h SER 59 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1uqx n GLY 60 N -0.03 0.80 3.50 -0.77 0.00 0.46 -4.21 105.19 104.95 1uqx n GLY 60 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1uqx n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uqx s ALA 61 N -2.00 3.07 -0.08 4.61 0.00 -1.25 -0.45 121.76 125.65 1uqx s ALA 61 Ca 0.00 -1.48 -0.01 0.00 0.00 0.00 0.00 51.96 50.48 1uqx s ALA 61 Cb 0.00 -3.88 -0.03 0.00 0.00 0.00 0.00 23.12 19.21 1uqx s ALA 61 CO 0.00 -2.69 -0.04 0.42 0.00 0.00 0.00 175.76 173.45 1uqx s ILE 62 N 4.31 3.95 -0.02 0.00 1.09 -0.34 -0.58 121.20 129.63 1uqx s ILE 62 Ca 0.28 -0.38 0.03 0.00 -1.10 0.00 0.00 60.65 59.48 1uqx s ILE 62 Cb -0.13 -2.64 -0.00 0.00 -1.06 0.00 0.00 42.46 38.62 1uqx s ILE 62 CO 0.15 0.59 -0.09 -0.75 -0.10 0.00 0.00 174.94 174.74 1uqx s LYS 63 N -0.76 0.86 -0.10 2.79 2.20 -0.43 -1.13 119.74 123.17 1uqx s LYS 63 Ca 0.12 -0.32 0.01 0.00 -0.36 0.00 0.00 55.97 55.41 1uqx s LYS 63 Cb -0.11 -0.82 -0.02 0.00 -1.51 0.00 0.00 37.83 35.37 1uqx s LYS 63 CO 0.02 0.16 -0.12 0.42 -0.36 0.00 0.00 175.35 175.47 1uqx s ILE 64 N -0.03 3.15 0.00 5.43 -1.09 0.42 -0.13 121.20 128.95 1uqx s ILE 64 Ca 0.01 -0.65 0.07 0.00 -2.23 0.00 0.00 60.65 57.85 1uqx s ILE 64 Cb -0.06 -2.30 -0.02 0.00 -1.58 0.00 0.00 42.46 38.50 1uqx s ILE 64 CO -0.00 0.55 -0.22 -1.10 -1.23 0.00 0.00 174.94 172.94 1uqx s GLN 65 N -0.08 1.71 -0.04 2.79 -0.21 -0.52 -4.71 119.66 118.61 1uqx s GLN 65 Ca -0.02 -0.85 0.02 0.00 0.02 0.00 0.00 55.36 54.53 1uqx s GLN 65 Cb -0.14 -1.71 0.01 0.00 1.00 0.00 0.00 33.01 32.17 1uqx s GLN 65 CO 0.04 0.46 -0.09 0.08 -2.12 0.00 0.00 175.29 173.66 1uqx s VAL 66 N -0.60 0.81 0.08 1.09 1.01 -1.26 -0.83 120.40 120.70 1uqx s VAL 66 Ca 0.09 -0.34 -0.09 0.00 0.00 0.00 0.00 61.98 61.63 1uqx s VAL 66 Cb -0.09 -0.74 0.00 0.00 0.00 0.00 0.00 36.38 35.55 1uqx s VAL 66 CO -0.00 0.26 0.21 -0.94 0.00 0.00 0.00 175.10 174.63 1uqx s SER 67 N 0.40 0.08 -0.21 3.32 1.04 -0.47 -0.91 113.70 116.96 1uqx s SER 67 Ca -0.07 -0.57 0.01 0.00 0.48 0.00 0.00 55.95 55.80 1uqx s SER 67 Cb -0.11 0.34 0.05 0.00 0.10 0.00 0.00 66.02 66.39 1uqx s SER 67 CO 0.01 -0.70 -0.09 -0.69 0.98 0.00 0.00 173.24 172.75 1uqx s VAL 68 N -3.60 1.61 -1.44 5.02 1.01 -0.43 -0.86 120.40 121.72 1uqx s VAL 68 Ca 0.03 -1.05 -0.06 0.00 0.00 0.00 0.00 61.98 60.91 1uqx s VAL 68 Cb 0.04 -1.73 0.04 0.00 0.00 0.00 0.00 36.38 34.73 1uqx s VAL 68 CO -0.10 0.11 0.70 0.59 0.00 0.00 0.00 175.10 176.41 1uqx n ASN 69 N 4.68 -2.08 0.00 3.32 3.02 -1.26 -1.30 115.26 121.65 1uqx n ASN 69 Ca -0.14 -0.89 0.00 0.00 -0.03 0.00 0.00 54.58 53.52 1uqx n ASN 69 Cb 0.46 -3.57 0.00 0.00 -0.61 0.00 0.00 39.78 36.06 1uqx n ASN 69 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uqx n GLY 70 N -1.71 2.01 3.58 7.41 0.00 -1.26 -5.01 105.19 110.21 1uqx n GLY 70 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1uqx n GLY 70 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1uqx s LYS 71 N -0.16 3.79 0.31 1.61 2.20 -0.42 -5.04 119.74 122.03 1uqx s LYS 71 Ca 0.00 -0.05 -0.29 0.00 -0.36 0.00 0.00 55.97 55.26 1uqx s LYS 71 Cb 0.00 -3.74 -0.11 0.00 -1.51 0.00 0.00 37.83 32.47 1uqx s LYS 71 CO 0.00 -0.49 1.48 -2.14 -0.36 0.00 0.00 175.35 173.84 1uqx s PRO 72 N 2.26 4.20 0.75 4.03 0.02 -1.26 -1.31 135.00 143.68 1uqx s PRO 72 Ca 0.17 2.44 -0.11 0.00 0.02 0.00 0.00 61.00 63.53 1uqx s PRO 72 Cb -0.16 -3.04 0.05 0.00 0.02 0.00 0.00 34.50 31.38 1uqx s PRO 72 CO 0.12 -0.48 1.11 -1.12 -0.33 0.00 0.00 177.00 176.30 1uqx s SER 73 N 0.13 4.90 -0.27 2.53 0.01 -0.09 -4.90 113.70 116.00 1uqx s SER 73 Ca 0.57 0.82 -0.22 0.00 1.31 0.00 0.00 55.95 58.44 1uqx s SER 73 Cb -0.44 -1.46 -0.01 0.00 0.21 0.00 0.00 66.02 64.31 1uqx s SER 73 CO 0.51 -1.64 0.70 -0.62 0.41 0.00 0.00 173.24 172.61 1uqx s ASP 74 N -4.49 6.63 0.16 2.44 2.15 -0.58 -4.88 116.67 118.10 1uqx s ASP 74 Ca 0.60 0.71 -0.00 0.00 0.43 0.00 0.00 52.55 54.29 1uqx s ASP 74 Cb -0.11 -2.37 -0.04 0.00 -0.30 0.00 0.00 42.92 40.10 1uqx s ASP 74 CO 0.49 -0.47 0.33 -0.76 -0.17 0.00 0.00 175.17 174.59 1uqx s LEU 75 N 2.69 4.28 0.01 -1.34 1.43 -1.26 -1.08 118.68 123.41 1uqx s LEU 75 Ca 0.29 0.33 0.01 0.00 -1.03 0.00 0.00 54.13 53.74 1uqx s LEU 75 Cb -0.15 -3.07 -0.01 0.00 0.03 0.00 0.00 46.19 42.99 1uqx s LEU 75 CO 0.10 0.03 -0.05 0.54 0.23 0.00 0.00 176.35 177.19 1uqx s VAL 76 N -1.76 0.36 0.21 -1.59 0.11 -0.64 -4.81 120.40 112.28 1uqx s VAL 76 Ca 0.37 -0.45 -0.15 0.00 -2.93 0.00 0.00 61.98 58.82 1uqx s VAL 76 Cb -0.11 -0.36 0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1uqx s VAL 76 CO 0.28 -0.06 0.49 -0.94 -3.33 0.00 0.00 175.10 171.54 1uqx s SER 77 N -0.55 -0.18 -0.05 3.54 1.04 -1.26 -0.71 113.70 115.53 1uqx s SER 77 Ca -0.02 -0.64 -0.29 0.00 0.48 0.00 0.00 55.95 55.47 1uqx s SER 77 Cb -0.04 0.57 0.10 0.00 0.10 0.00 0.00 66.02 66.74 1uqx s SER 77 CO -0.00 -1.07 0.82 0.21 0.98 0.00 0.00 173.24 174.19 1uqx s ASN 78 N -2.92 -0.49 -0.05 7.02 3.84 -0.76 -4.93 114.94 116.65 1uqx s ASN 78 Ca 0.13 0.37 0.06 0.00 0.21 0.00 0.00 52.86 53.62 1uqx s ASN 78 Cb -0.01 0.43 -0.01 0.00 -0.55 0.00 0.00 41.25 41.12 1uqx s ASN 78 CO 0.01 -0.57 -0.22 -1.58 -2.79 0.00 0.00 177.10 171.95 1uqx s GLN 79 N -1.90 2.26 0.09 0.43 0.74 -1.26 -0.78 119.66 119.23 1uqx s GLN 79 Ca -0.03 -0.80 0.09 0.00 0.05 0.00 0.00 55.36 54.67 1uqx s GLN 79 Cb -0.00 -1.94 -0.03 0.00 1.10 0.00 0.00 33.01 32.13 1uqx s GLN 79 CO 0.00 0.34 -0.25 0.99 -0.55 0.00 0.00 175.29 175.83 1uqx s THR 80 N -0.12 2.02 -0.08 -0.34 2.01 0.12 -5.01 115.64 114.25 1uqx s THR 80 Ca -0.03 -1.55 0.01 0.00 0.31 0.00 0.00 61.69 60.43 1uqx s THR 80 Cb -0.13 -1.78 0.02 0.00 0.01 0.00 0.00 72.50 70.62 1uqx s THR 80 CO 0.03 0.14 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.38 1uqx s ILE 81 N -0.99 0.93 -0.08 1.82 1.01 -1.26 -1.34 121.20 121.29 1uqx s ILE 81 Ca 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.45 1uqx s ILE 81 Cb -0.10 -0.91 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 1uqx s ILE 81 CO 0.04 0.33 -0.07 -0.76 0.00 0.00 0.00 174.94 174.47 1uqx s LEU 82 N 1.12 3.13 -1.54 2.97 1.02 0.21 -4.57 118.68 121.01 1uqx s LEU 82 Ca -0.07 -0.06 0.00 0.00 0.02 0.00 0.00 54.13 54.02 1uqx s LEU 82 Cb -0.14 -1.69 0.00 0.00 0.02 0.00 0.00 46.19 44.38 1uqx s LEU 82 CO -0.01 0.33 0.00 0.00 0.02 0.00 0.00 176.35 176.69 1uqx n ALA 83 N 2.44 -0.56 -2.55 4.21 0.00 -1.26 -1.05 120.51 121.74 1uqx n ALA 83 Ca -0.18 0.18 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1uqx n ALA 83 Cb 0.53 -1.81 -0.00 0.00 0.00 0.00 0.00 19.45 18.16 1uqx n ALA 83 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1uqx n ASN 84 N -1.60 -4.36 0.00 0.00 5.15 -1.26 -4.66 115.26 108.53 1uqx n ASN 84 Ca -0.19 0.08 0.00 0.00 -0.60 0.00 0.00 54.58 53.87 1uqx n ASN 84 Cb 0.62 -3.67 0.00 0.00 -0.53 0.00 0.00 39.78 36.20 1uqx n ASN 84 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1uqx n LYS 85 N -2.99 0.00 -3.33 1.20 3.00 -0.52 -5.09 118.16 110.42 1uqx n LYS 85 Ca -0.15 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.77 1uqx n LYS 85 Cb 0.62 -0.14 -0.09 0.00 0.00 0.00 0.00 35.03 35.42 1uqx n LYS 85 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1uqx s LEU 86 N -3.77 4.06 -0.10 3.14 2.96 -0.21 -4.32 118.68 120.43 1uqx s LEU 86 Ca 0.00 0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 54.24 1uqx s LEU 86 Cb 0.00 -2.51 -0.03 0.00 0.50 0.00 0.00 46.19 44.15 1uqx s LEU 86 CO 0.00 -0.23 -0.03 0.20 -1.32 0.00 0.00 176.35 174.97 1uqx s ASN 87 N 1.61 4.97 -0.04 3.68 0.01 0.48 -0.62 114.94 125.04 1uqx s ASN 87 Ca 0.17 0.03 0.05 0.00 -0.71 0.00 0.00 52.86 52.40 1uqx s ASN 87 Cb -0.16 -1.47 -0.01 0.00 0.41 0.00 0.00 41.25 40.03 1uqx s ASN 87 CO 0.10 0.32 -0.18 -0.36 -1.51 0.00 0.00 177.10 175.47 1uqx s PHE 88 N -0.53 1.75 -0.12 2.20 0.08 -0.45 -1.96 117.98 118.95 1uqx s PHE 88 Ca 0.09 -0.47 0.03 0.00 0.12 0.00 0.00 56.93 56.70 1uqx s PHE 88 Cb -0.12 -1.17 0.00 0.00 -0.57 0.00 0.00 43.02 41.17 1uqx s PHE 88 CO 0.02 -0.14 -0.23 0.00 -0.10 0.00 0.00 175.22 174.77 1uqx s ALA 89 N -0.07 2.20 -0.06 5.36 0.00 -0.30 -0.70 121.76 128.19 1uqx s ALA 89 Ca -0.02 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 50.98 1uqx s ALA 89 Cb -0.11 -0.90 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 1uqx s ALA 89 CO 0.02 0.14 -0.25 -1.64 0.00 0.00 0.00 175.76 174.02 1uqx s MET 90 N 0.57 2.54 -0.09 0.00 1.00 0.04 -0.51 119.30 122.84 1uqx s MET 90 Ca -0.13 -0.91 0.01 0.00 0.00 0.00 0.00 55.69 54.66 1uqx s MET 90 Cb -0.17 -2.16 0.02 0.00 0.00 0.00 0.00 34.83 32.52 1uqx s MET 90 CO 0.04 0.39 -0.11 0.08 0.00 0.00 0.00 175.02 175.42 1uqx s VAL 91 N -0.18 1.15 0.49 -6.03 1.01 0.09 -1.83 120.40 115.09 1uqx s VAL 91 Ca -0.03 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.56 1uqx s VAL 91 Cb -0.14 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.14 1uqx s VAL 91 CO 0.04 0.37 0.21 -0.83 0.00 0.00 0.00 175.10 174.88 1uqx s GLY 92 N 1.09 2.55 -0.01 4.51 0.00 0.11 -1.47 107.32 114.11 1uqx s GLY 92 Ca -0.06 -1.31 -0.29 0.00 0.00 0.00 0.00 44.72 43.06 1uqx s GLY 92 CO -0.02 -2.01 0.72 -1.35 0.00 0.00 0.00 173.10 170.44 1uqx s SER 93 N -4.03 -0.58 -0.14 1.64 1.04 -0.76 -1.61 113.70 109.26 1uqx s SER 93 Ca 0.28 0.43 0.01 0.00 0.48 0.00 0.00 55.95 57.15 1uqx s SER 93 Cb 0.01 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.67 1uqx s SER 93 CO 0.16 -0.67 -0.15 -0.70 0.98 0.00 0.00 173.24 172.86 1uqx s GLU 94 N -2.01 2.35 0.00 4.02 2.56 -0.24 -1.61 118.70 123.77 1uqx s GLU 94 Ca -0.05 -0.58 0.24 0.00 0.00 0.00 0.00 54.97 54.58 1uqx s GLU 94 Cb -0.00 -2.11 0.27 0.00 2.00 0.00 0.00 34.13 34.29 1uqx s GLU 94 CO 0.01 -0.20 1.30 -0.40 -0.56 0.00 0.00 175.26 175.42 1uqx n ASP 95 N 4.65 2.82 0.00 -1.70 5.68 -1.26 -1.53 116.55 125.22 1uqx n ASP 95 Ca -0.18 -1.94 0.00 0.00 -0.50 0.00 0.00 54.79 52.18 1uqx n ASP 95 Cb 0.50 0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1uqx n ASP 95 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1uqx n GLY 96 N 1.33 4.85 0.00 6.12 0.00 -1.26 -5.03 105.19 111.20 1uqx n GLY 96 Ca 0.14 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1uqx n GLY 96 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1uqx n THR 97 N 0.00 0.00 0.71 2.61 -2.24 -1.26 -4.72 114.28 109.38 1uqx n THR 97 Ca 0.00 -0.33 0.13 0.00 -2.27 0.00 0.00 64.05 61.57 1uqx n THR 97 Cb 0.00 0.86 0.48 0.00 -2.10 0.00 0.00 70.33 69.57 1uqx n THR 97 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1uqx n ASP 98 N -0.99 0.44 -3.82 3.42 5.75 -1.26 -4.93 116.55 115.16 1uqx n ASP 98 Ca 0.00 0.55 -0.28 0.00 -0.01 0.00 0.00 54.79 55.05 1uqx n ASP 98 Cb 0.00 -0.67 0.04 0.00 -1.03 0.00 0.00 41.12 39.47 1uqx n ASP 98 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1uqx n ASN 99 N -1.93 -5.33 0.20 -1.12 3.02 -1.26 -4.89 115.26 103.96 1uqx n ASN 99 Ca 0.05 -0.70 0.12 0.00 -0.03 0.00 0.00 54.58 54.02 1uqx n ASN 99 Cb 0.35 -4.25 0.16 0.00 -0.61 0.00 0.00 39.78 35.43 1uqx n ASN 99 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 1uqx h ASP 100 N -2.29 0.00 -1.51 6.41 2.03 -1.93 -3.48 116.42 115.65 1uqx h ASP 100 Ca -0.58 -0.00 -0.41 0.00 -0.73 0.00 0.00 57.03 55.31 1uqx h ASP 100 Cb 1.37 0.00 -0.13 0.00 -0.83 0.00 0.00 39.33 39.74 1uqx h ASP 100 CO 0.64 0.00 -0.41 -1.22 -1.03 0.00 0.00 179.24 177.22 1uqx n TYR 101 N -3.02 -0.27 -0.05 4.15 4.01 -1.26 -4.81 117.16 115.92 1uqx n TYR 101 Ca 0.04 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.81 1uqx n TYR 101 Cb 0.53 -3.54 0.08 0.00 -0.31 0.00 0.00 39.34 36.10 1uqx n TYR 101 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1uqx n ASN 102 N -1.48 2.38 -0.09 7.72 0.23 -1.12 -1.82 115.26 121.08 1uqx n ASN 102 Ca -0.21 -1.91 -0.11 0.00 -0.53 0.00 0.00 54.58 51.82 1uqx n ASN 102 Cb 0.67 -0.11 -0.04 0.00 -2.08 0.00 0.00 39.78 38.22 1uqx n ASN 102 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1uqx h ASP 103 N 1.11 0.44 -3.26 0.53 3.32 -1.44 -3.05 116.42 114.07 1uqx h ASP 103 Ca 0.00 -0.30 -0.45 0.00 0.02 0.00 0.00 57.03 56.30 1uqx h ASP 103 Cb 0.58 -0.12 -0.38 0.00 0.22 0.00 0.00 39.33 39.63 1uqx h ASP 103 CO 0.00 0.64 -0.77 -0.83 -1.72 0.00 0.00 179.24 176.55 1uqx s GLY 104 N -3.12 0.53 -0.01 2.75 0.00 -1.26 -1.35 107.32 104.86 1uqx s GLY 104 Ca -0.14 -0.19 0.07 0.00 0.00 0.00 0.00 44.72 44.47 1uqx s GLY 104 CO 0.75 1.02 -0.24 -0.42 0.00 0.00 0.00 173.10 174.21 1uqx s ILE 105 N 1.83 1.86 -0.03 0.90 1.01 -0.26 -2.86 121.20 123.65 1uqx s ILE 105 Ca 0.03 -1.04 0.05 0.00 0.00 0.00 0.00 60.65 59.70 1uqx s ILE 105 Cb -0.12 -1.55 -0.01 0.00 0.01 0.00 0.00 42.46 40.78 1uqx s ILE 105 CO -0.05 0.50 -0.19 0.00 0.00 0.00 0.00 174.94 175.20 1uqx s ALA 106 N -0.58 1.63 -0.14 9.38 0.00 -0.54 -0.97 121.76 130.54 1uqx s ALA 106 Ca 0.09 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.27 1uqx s ALA 106 Cb -0.09 -0.47 0.01 0.00 0.00 0.00 0.00 23.12 22.57 1uqx s ALA 106 CO -0.01 0.35 -0.19 0.08 0.00 0.00 0.00 175.76 176.00 1uqx s VAL 107 N -0.23 1.84 -0.01 0.00 1.01 0.22 -0.73 120.40 122.50 1uqx s VAL 107 Ca 0.02 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1uqx s VAL 107 Cb -0.10 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.59 1uqx s VAL 107 CO 0.01 0.51 -0.02 -0.76 0.00 0.00 0.00 175.10 174.83 1uqx s LEU 108 N 1.04 3.40 -0.01 3.92 1.02 0.33 -0.91 118.68 127.47 1uqx s LEU 108 Ca -0.03 -0.03 -0.02 0.00 0.02 0.00 0.00 54.13 54.06 1uqx s LEU 108 Cb -0.15 -1.92 0.00 0.00 0.02 0.00 0.00 46.19 44.14 1uqx s LEU 108 CO -0.05 0.29 0.05 0.54 0.02 0.00 0.00 176.35 177.21 1uqx s ASN 109 N -1.41 0.01 0.15 2.29 4.22 -0.34 -1.15 114.94 118.70 1uqx s ASN 109 Ca 0.18 -0.05 -0.24 0.00 -2.14 0.00 0.00 52.86 50.61 1uqx s ASN 109 Cb -0.11 0.13 0.07 0.00 1.28 0.00 0.00 41.25 42.62 1uqx s ASN 109 CO 0.08 -0.13 0.64 -1.66 -2.04 0.00 0.00 177.10 174.00 1uqx s TRP 110 N -0.46 -0.49 0.69 1.54 -2.14 -0.83 -1.32 118.94 115.92 1uqx s TRP 110 Ca -0.05 0.28 -0.11 0.00 2.66 0.00 0.00 56.10 58.87 1uqx s TRP 110 Cb -0.03 0.57 0.00 0.00 -3.10 0.00 0.00 33.47 30.91 1uqx s TRP 110 CO 0.00 -0.84 1.08 -1.25 -2.66 0.00 0.00 176.95 173.28 1uqx s PRO 111 N -3.68 2.99 0.00 3.25 0.04 -1.26 -0.39 135.00 135.95 1uqx s PRO 111 Ca 0.02 0.56 0.00 0.00 0.04 0.00 0.00 61.00 61.63 1uqx s PRO 111 Cb -0.01 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.50 1uqx s PRO 111 CO -0.11 -0.96 0.00 1.28 0.04 0.00 0.00 177.00 177.25 1uqx n LEU 112 N -2.98 0.00 0.00 -3.56 4.77 -1.26 -4.97 117.00 109.00 1uqx n LEU 112 Ca 0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1uqx n LEU 112 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1uqx n LEU 112 CO 0.58 -0.41 0.00 0.61 -1.33 0.00 0.00 177.39 176.84