#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ucx h GLN 15 N 0.00 -0.07 -3.39 0.38 -0.00 -2.02 -3.47 115.11 106.53 1ucx h GLN 15 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 58.65 58.41 1ucx h GLN 15 Cb 0.00 0.02 -0.31 0.00 -0.00 0.00 0.00 27.48 27.19 1ucx h GLN 15 CO 0.00 -0.05 -0.64 0.15 -0.00 0.00 0.00 178.83 178.30 1ucx s LYS 16 N -1.92 0.06 0.33 0.06 1.02 -1.26 -4.77 119.74 113.25 1ucx s LYS 16 Ca -0.01 0.26 -0.13 0.00 0.02 0.00 0.00 55.97 56.11 1ucx s LYS 16 Cb 0.00 -0.14 -0.08 0.00 -0.52 0.00 0.00 37.83 37.09 1ucx s LYS 16 CO 0.03 -0.13 0.71 -0.51 -0.92 0.00 0.00 175.35 174.54 1ucx s LEU 17 N 0.85 4.03 0.03 3.17 1.43 -0.70 -5.02 118.68 122.46 1ucx s LEU 17 Ca -0.07 1.19 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 1ucx s LEU 17 Cb -0.09 -4.00 -0.02 0.00 0.03 0.00 0.00 46.19 42.11 1ucx s LEU 17 CO -0.04 -0.23 -0.05 0.20 0.23 0.00 0.00 176.35 176.47 1ucx s ASN 18 N -2.48 0.48 -0.78 2.29 -0.87 -1.26 -4.71 114.94 107.59 1ucx s ASN 18 Ca 0.52 -0.47 -0.26 0.00 -1.57 0.00 0.00 52.86 51.08 1ucx s ASN 18 Cb -0.10 0.06 0.01 0.00 -0.02 0.00 0.00 41.25 41.20 1ucx s ASN 18 CO 0.21 -0.23 1.55 0.00 -2.57 0.00 0.00 177.10 176.06 1ucx s ALA 19 N -1.29 2.46 0.21 0.60 0.00 -1.26 -4.67 121.76 117.81 1ucx s ALA 19 Ca -0.12 -1.38 -0.30 0.00 0.00 0.00 0.00 51.96 50.16 1ucx s ALA 19 Cb -0.09 -4.36 -0.08 0.00 0.00 0.00 0.00 23.12 18.58 1ucx s ALA 19 CO -0.00 -3.70 1.10 -0.51 0.00 0.00 0.00 175.76 172.64 1ucx s LEU 20 N 6.99 4.52 0.44 0.00 1.43 0.72 -4.67 118.68 128.10 1ucx s LEU 20 Ca 0.50 2.15 0.07 0.00 -1.03 0.00 0.00 54.13 55.82 1ucx s LEU 20 Cb -0.07 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.51 1ucx s LEU 20 CO 0.09 -0.18 0.32 -1.59 0.23 0.00 0.00 176.35 175.23 1ucx s LYS 21 N -0.75 2.39 0.72 1.70 -2.85 -1.26 -1.49 119.74 118.20 1ucx s LYS 21 Ca 0.47 -1.72 -0.13 0.00 -1.00 0.00 0.00 55.97 53.60 1ucx s LYS 21 Cb -0.30 -2.21 0.03 0.00 -2.06 0.00 0.00 37.83 33.29 1ucx s LYS 21 CO 0.37 -0.25 1.11 -1.25 0.10 0.00 0.00 175.35 175.43 1ucx s PRO 22 N -4.09 2.47 -0.28 1.78 0.04 -1.26 -4.83 135.00 128.82 1ucx s PRO 22 Ca 0.44 1.34 0.14 0.00 0.04 0.00 0.00 61.00 62.95 1ucx s PRO 22 Cb -0.01 -1.91 0.48 0.00 0.04 0.00 0.00 34.50 33.10 1ucx s PRO 22 CO 0.25 -1.50 1.14 -0.40 0.04 0.00 0.00 177.00 176.53 1ucx n ASP 23 N -2.94 3.36 -3.10 6.66 5.75 -1.05 -4.99 116.55 120.24 1ucx n ASP 23 Ca 0.10 -2.97 0.04 0.00 -0.01 0.00 0.00 54.79 51.95 1ucx n ASP 23 Cb 0.52 -0.41 -0.00 0.00 -1.03 0.00 0.00 41.12 40.20 1ucx n ASP 23 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1ucx s ASN 24 N -3.67 -0.86 -0.11 -1.12 2.47 -1.16 -4.93 114.94 105.57 1ucx s ASN 24 Ca 0.40 -0.04 -0.12 0.00 0.42 0.00 0.00 52.86 53.52 1ucx s ASN 24 Cb 0.37 1.42 -0.05 0.00 -1.45 0.00 0.00 41.25 41.54 1ucx s ASN 24 CO -0.00 -0.14 0.28 -0.13 -3.72 0.00 0.00 177.10 173.38 1ucx s ARG 25 N 2.65 3.96 -0.16 0.43 0.52 -1.26 -1.85 118.95 123.23 1ucx s ARG 25 Ca 0.20 0.11 -0.00 0.00 -0.52 0.00 0.00 55.73 55.51 1ucx s ARG 25 Cb -0.03 -3.31 0.04 0.00 0.52 0.00 0.00 34.95 32.16 1ucx s ARG 25 CO -0.21 0.50 -0.06 0.42 0.02 0.00 0.00 175.30 175.97 1ucx s ILE 26 N -0.33 1.12 -0.24 1.52 1.01 0.71 -5.01 121.20 119.99 1ucx s ILE 26 Ca 0.18 -0.61 -0.10 0.00 0.00 0.00 0.00 60.65 60.11 1ucx s ILE 26 Cb -0.14 -1.28 -0.05 0.00 0.01 0.00 0.00 42.46 41.01 1ucx s ILE 26 CO 0.06 0.15 0.14 -1.61 0.00 0.00 0.00 174.94 173.68 1ucx s GLU 27 N 1.63 4.01 0.32 2.79 2.02 -1.26 -0.78 118.70 127.42 1ucx s GLU 27 Ca 0.01 -0.30 0.10 0.00 0.02 0.00 0.00 54.97 54.79 1ucx s GLU 27 Cb -0.15 -3.49 -0.05 0.00 0.10 0.00 0.00 34.13 30.53 1ucx s GLU 27 CO -0.08 0.04 -0.07 0.45 0.02 0.00 0.00 175.26 175.62 1ucx s SER 28 N 1.11 3.97 0.18 -0.19 0.15 -0.53 -4.90 113.70 113.49 1ucx s SER 28 Ca 0.07 -1.02 -0.11 0.00 0.70 0.00 0.00 55.95 55.59 1ucx s SER 28 Cb -0.14 -0.46 0.23 0.00 -1.71 0.00 0.00 66.02 63.94 1ucx s SER 28 CO 0.05 -0.14 1.16 1.21 1.20 0.00 0.00 173.24 176.71 1ucx n GLU 29 N -0.83 -0.14 -0.02 5.44 2.13 -1.22 -1.94 120.64 124.06 1ucx n GLU 29 Ca -0.05 1.15 0.06 0.00 0.66 0.00 0.00 57.16 58.98 1ucx n GLU 29 Cb 0.62 -1.71 0.06 0.00 0.27 0.00 0.00 31.44 30.68 1ucx n GLU 29 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ucx n GLY 30 N -1.39 0.09 0.00 8.31 0.00 0.48 -4.80 105.19 107.87 1ucx n GLY 30 Ca 0.09 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1ucx n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ucx n GLY 31 N 0.67 2.60 3.27 -0.02 0.00 -0.82 -0.47 105.19 110.42 1ucx n GLY 31 Ca 0.08 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.45 1ucx n GLY 31 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ucx s LEU 32 N 0.00 0.29 -0.08 0.99 2.96 -0.26 -1.45 118.68 121.13 1ucx s LEU 32 Ca 0.00 0.82 0.04 0.00 -0.22 0.00 0.00 54.13 54.77 1ucx s LEU 32 Cb 0.00 1.33 -0.01 0.00 0.50 0.00 0.00 46.19 48.01 1ucx s LEU 32 CO 0.00 -0.16 -0.22 -0.63 -1.32 0.00 0.00 176.35 174.03 1ucx s ILE 33 N 0.65 2.32 -0.01 6.68 1.01 0.04 -0.82 121.20 131.07 1ucx s ILE 33 Ca -0.04 -0.96 0.05 0.00 0.00 0.00 0.00 60.65 59.71 1ucx s ILE 33 Cb -0.05 -1.88 -0.01 0.00 0.01 0.00 0.00 42.46 40.53 1ucx s ILE 33 CO -0.04 0.56 -0.15 -1.61 0.00 0.00 0.00 174.94 173.70 1ucx s GLU 34 N -0.03 1.25 0.10 2.79 2.02 -0.71 -0.21 118.70 123.91 1ucx s GLU 34 Ca -0.07 -0.55 0.05 0.00 0.02 0.00 0.00 54.97 54.41 1ucx s GLU 34 Cb -0.15 -1.21 -0.04 0.00 0.10 0.00 0.00 34.13 32.84 1ucx s GLU 34 CO 0.05 0.33 -0.12 0.95 0.02 0.00 0.00 175.26 176.49 1ucx s THR 35 N -0.37 1.09 -0.13 3.63 -4.23 -0.77 -1.23 115.64 113.64 1ucx s THR 35 Ca 0.06 -1.65 -0.07 0.00 -1.18 0.00 0.00 61.69 58.85 1ucx s THR 35 Cb -0.06 -1.40 -0.04 0.00 1.34 0.00 0.00 72.50 72.34 1ucx s THR 35 CO -0.01 -0.49 0.13 0.26 -0.54 0.00 0.00 174.62 173.98 1ucx s TRP 36 N -2.26 3.56 -0.05 3.99 0.51 -1.08 -2.52 118.94 121.09 1ucx s TRP 36 Ca 0.06 0.49 -0.30 0.00 -2.12 0.00 0.00 56.10 54.24 1ucx s TRP 36 Cb -0.04 -1.96 -0.06 0.00 -0.81 0.00 0.00 33.47 30.60 1ucx s TRP 36 CO 0.01 0.68 1.76 1.21 -0.51 0.00 0.00 176.95 180.10 1ucx s ASN 37 N -0.87 6.54 0.48 2.95 3.84 -1.26 -4.47 114.94 122.15 1ucx s ASN 37 Ca 0.14 2.29 0.27 0.00 0.21 0.00 0.00 52.86 55.77 1ucx s ASN 37 Cb -0.12 -2.53 0.81 0.00 -0.55 0.00 0.00 41.25 38.86 1ucx s ASN 37 CO 0.03 -1.02 1.78 1.55 -2.79 0.00 0.00 177.10 176.65 1ucx h PRO 38 N 10.12 0.00 -0.01 0.43 0.13 -1.93 -3.13 132.00 137.61 1ucx h PRO 38 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1ucx h PRO 38 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1ucx h PRO 38 CO 0.95 0.05 -0.01 0.09 -0.23 0.00 0.00 178.00 178.86 1ucx n ASN 39 N -3.13 0.91 -4.74 1.44 3.02 -1.26 -3.39 115.26 108.12 1ucx n ASN 39 Ca 0.02 -1.28 -0.37 0.00 -0.03 0.00 0.00 54.58 52.91 1ucx n ASN 39 Cb 0.44 -0.00 0.06 0.00 -0.61 0.00 0.00 39.78 39.67 1ucx n ASN 39 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1ucx s ASN 40 N -2.02 4.81 0.40 6.41 -0.87 -1.18 -4.82 114.94 117.67 1ucx s ASN 40 Ca 0.41 2.69 0.07 0.00 -1.57 0.00 0.00 52.86 54.46 1ucx s ASN 40 Cb 0.21 -2.63 0.83 0.00 -0.02 0.00 0.00 41.25 39.65 1ucx s ASN 40 CO 0.35 -1.87 2.04 0.50 -2.57 0.00 0.00 177.10 175.55 1ucx h LYS 41 N 0.85 0.58 -0.04 -0.60 3.64 -1.92 -1.79 116.57 117.29 1ucx h LYS 41 Ca -0.51 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 58.84 1ucx h LYS 41 Cb 1.33 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1ucx h LYS 41 CO 0.54 0.39 -0.00 -1.35 -2.27 0.00 0.00 179.45 176.76 1ucx h PRO 42 N 0.60 0.01 -0.13 1.90 0.11 -1.94 -2.01 132.00 130.53 1ucx h PRO 42 Ca 0.18 -0.00 -0.12 0.00 0.11 0.00 0.00 66.00 66.17 1ucx h PRO 42 Cb 0.00 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1ucx h PRO 42 CO -0.04 0.00 -0.44 0.74 -0.21 0.00 0.00 178.00 178.05 1ucx h PHE 43 N 0.01 0.37 -0.63 0.65 0.04 -1.80 0.07 116.94 115.63 1ucx h PHE 43 Ca 0.02 -0.11 -0.09 0.00 2.80 0.00 0.00 57.97 60.59 1ucx h PHE 43 Cb 0.02 -0.08 -0.02 0.00 2.20 0.00 0.00 35.95 38.07 1ucx h PHE 43 CO -0.10 0.70 0.06 1.96 -0.60 0.00 0.00 178.31 180.33 1ucx h GLN 44 N 0.25 1.07 -0.02 1.51 1.08 -1.21 0.25 115.11 118.04 1ucx h GLN 44 Ca 0.02 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 56.90 1ucx h GLN 44 Cb 0.88 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.20 1ucx h GLN 44 CO 0.07 1.01 -0.03 0.00 -0.95 0.00 0.00 178.83 178.94 1ucx h ALA 46 N 0.51 1.70 0.00 0.00 0.00 -0.76 -3.46 119.26 117.25 1ucx h ALA 46 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ucx h ALA 46 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ucx h ALA 46 CO 0.01 -0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1ucx n GLY 47 N -1.34 0.52 3.77 0.00 0.00 0.86 -4.93 105.19 104.08 1ucx n GLY 47 Ca 0.23 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 1ucx n GLY 47 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ucx s VAL 48 N -2.00 2.27 -0.21 1.61 -7.23 -1.17 -2.20 120.40 111.48 1ucx s VAL 48 Ca 0.00 -1.63 -0.02 0.00 -1.81 0.00 0.00 61.98 58.51 1ucx s VAL 48 Cb 0.00 -2.90 0.06 0.00 0.56 0.00 0.00 36.38 34.10 1ucx s VAL 48 CO 0.00 0.00 0.02 0.00 -0.31 0.00 0.00 175.10 174.81 1ucx s ALA 49 N -2.60 1.20 0.26 1.32 0.00 -0.85 -4.73 121.76 116.35 1ucx s ALA 49 Ca 0.40 -0.85 -0.03 0.00 0.00 0.00 0.00 51.96 51.49 1ucx s ALA 49 Cb 0.02 -1.24 -0.05 0.00 0.00 0.00 0.00 23.12 21.86 1ucx s ALA 49 CO 0.23 -1.20 0.49 -1.17 0.00 0.00 0.00 175.76 174.11 1ucx s LEU 50 N 1.77 4.12 0.01 0.00 0.20 -1.26 -2.27 118.68 121.24 1ucx s LEU 50 Ca -0.02 0.56 -0.28 0.00 0.69 0.00 0.00 54.13 55.08 1ucx s LEU 50 Cb -0.17 -3.36 0.09 0.00 -0.43 0.00 0.00 46.19 42.32 1ucx s LEU 50 CO -0.08 -0.15 0.78 -0.55 -0.29 0.00 0.00 176.35 176.06 1ucx s SER 51 N -3.27 -0.48 -0.15 3.68 0.15 -1.00 -2.62 113.70 110.01 1ucx s SER 51 Ca 0.41 0.21 -0.04 0.00 0.70 0.00 0.00 55.95 57.23 1ucx s SER 51 Cb -0.11 0.46 0.05 0.00 -1.71 0.00 0.00 66.02 64.72 1ucx s SER 51 CO 0.30 -0.67 0.08 -0.60 1.20 0.00 0.00 173.24 173.55 1ucx s ARG 52 N -2.57 0.09 -0.18 5.44 3.52 -0.36 -0.67 118.95 124.22 1ucx s ARG 52 Ca -0.01 -0.03 -0.07 0.00 -0.13 0.00 0.00 55.73 55.49 1ucx s ARG 52 Cb -0.01 -1.62 -0.04 0.00 -1.56 0.00 0.00 34.95 31.72 1ucx s ARG 52 CO -0.05 -0.61 0.06 0.00 -0.81 0.00 0.00 175.30 173.90 1ucx s THR 54 N 0.34 2.39 -0.10 0.00 -4.23 0.00 -1.27 115.64 112.77 1ucx s THR 54 Ca 0.03 -0.87 -0.01 0.00 -1.18 0.00 0.00 61.69 59.66 1ucx s THR 54 Cb -0.12 -1.98 -0.03 0.00 1.34 0.00 0.00 72.50 71.70 1ucx s THR 54 CO 0.00 0.53 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.82 1ucx s LEU 55 N 0.76 3.33 0.00 4.79 1.43 -0.03 -1.11 118.68 127.86 1ucx s LEU 55 Ca -0.07 0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.03 1ucx s LEU 55 Cb -0.16 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.30 1ucx s LEU 55 CO 0.00 0.31 0.00 0.59 0.23 0.00 0.00 176.35 177.48 1ucx n ASN 56 N 2.59 0.00 -4.77 2.29 5.03 0.38 -1.89 115.26 118.89 1ucx n ASN 56 Ca -0.18 -0.62 -0.41 0.00 0.87 0.00 0.00 54.58 54.24 1ucx n ASN 56 Cb 0.53 0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 39.28 1ucx n ASN 56 CO 0.00 0.00 0.00 -0.60 -1.83 0.00 0.00 177.26 174.83 1ucx s ARG 57 N -0.58 4.19 -1.33 3.52 3.52 -1.25 -2.55 118.95 124.46 1ucx s ARG 57 Ca 0.00 2.45 0.00 0.00 -0.13 0.00 0.00 55.73 58.05 1ucx s ARG 57 Cb 0.00 -3.01 0.00 0.00 -1.56 0.00 0.00 34.95 30.38 1ucx s ARG 57 CO 0.00 -0.44 0.00 0.09 -0.81 0.00 0.00 175.30 174.14 1ucx n ASN 58 N 0.85 -5.49 -4.82 -2.12 5.03 -1.17 -4.87 115.26 102.68 1ucx n ASN 58 Ca 0.02 0.31 -0.36 0.00 0.87 0.00 0.00 54.58 55.42 1ucx n ASN 58 Cb 0.40 -4.09 -0.06 0.00 -1.02 0.00 0.00 39.78 35.01 1ucx n ASN 58 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ucx s ALA 59 N -2.14 3.44 -0.15 5.41 0.00 -1.06 -0.34 121.76 126.92 1ucx s ALA 59 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1ucx s ALA 59 Cb 0.00 -2.76 0.03 0.00 0.00 0.00 0.00 23.12 20.39 1ucx s ALA 59 CO 0.00 0.35 -0.11 -1.17 0.00 0.00 0.00 175.76 174.83 1ucx s LEU 60 N -1.97 1.68 -0.26 0.00 1.98 -0.22 -2.04 118.68 117.86 1ucx s LEU 60 Ca 0.42 -0.54 -0.27 0.00 -2.89 0.00 0.00 54.13 50.85 1ucx s LEU 60 Cb -0.16 -1.08 0.01 0.00 0.66 0.00 0.00 46.19 45.61 1ucx s LEU 60 CO 0.21 -0.10 0.95 -0.60 -1.89 0.00 0.00 176.35 174.92 1ucx s ARG 61 N 1.54 4.16 0.76 1.98 3.52 0.09 -2.09 118.95 128.90 1ucx s ARG 61 Ca 0.03 1.08 -0.14 0.00 -0.13 0.00 0.00 55.73 56.57 1ucx s ARG 61 Cb -0.14 -3.67 0.06 0.00 -1.56 0.00 0.00 34.95 29.64 1ucx s ARG 61 CO -0.09 -0.66 1.20 1.03 -0.81 0.00 0.00 175.30 175.96 1ucx s ARG 62 N 3.16 1.96 0.22 5.12 0.52 -0.64 -3.14 118.95 126.14 1ucx s ARG 62 Ca 0.40 1.71 -0.30 0.00 -0.52 0.00 0.00 55.73 57.02 1ucx s ARG 62 Cb -0.14 -1.82 -0.10 0.00 0.52 0.00 0.00 34.95 33.41 1ucx s ARG 62 CO 0.09 -1.96 1.44 -2.14 0.02 0.00 0.00 175.30 172.75 1ucx s PRO 63 N -4.06 4.28 0.31 3.54 0.02 -1.25 -4.69 135.00 133.14 1ucx s PRO 63 Ca 0.73 2.27 -0.09 0.00 0.02 0.00 0.00 61.00 63.92 1ucx s PRO 63 Cb -0.28 -3.13 0.01 0.00 0.02 0.00 0.00 34.50 31.11 1ucx s PRO 63 CO 0.48 -0.43 0.53 -1.54 -0.33 0.00 0.00 177.00 175.70 1ucx s SER 64 N 0.53 0.32 -0.25 2.53 1.04 -1.02 -1.52 113.70 115.32 1ucx s SER 64 Ca 0.61 -1.18 -0.25 0.00 0.48 0.00 0.00 55.95 55.61 1ucx s SER 64 Cb -0.41 0.66 0.07 0.00 0.10 0.00 0.00 66.02 66.44 1ucx s SER 64 CO 0.40 -1.29 0.71 -0.72 0.98 0.00 0.00 173.24 173.32 1ucx s TYR 65 N -3.36 -0.77 0.48 5.02 -0.85 -0.36 -1.95 117.35 115.55 1ucx s TYR 65 Ca 0.24 1.86 0.08 0.00 -0.52 0.00 0.00 57.07 58.73 1ucx s TYR 65 Cb -0.01 0.27 0.02 0.00 0.38 0.00 0.00 41.96 42.62 1ucx s TYR 65 CO 0.14 -0.39 0.52 0.95 -1.52 0.00 0.00 175.55 175.25 1ucx s THR 66 N 0.29 2.38 -0.74 -3.49 -4.23 -1.26 -0.39 115.64 108.21 1ucx s THR 66 Ca -0.01 -1.23 -0.01 0.00 -1.18 0.00 0.00 61.69 59.27 1ucx s THR 66 Cb -0.05 -2.61 0.38 0.00 1.34 0.00 0.00 72.50 71.56 1ucx s THR 66 CO 0.01 0.00 1.89 -0.46 -0.54 0.00 0.00 174.62 175.52 1ucx n ASN 67 N -1.82 7.12 -3.67 3.99 6.94 -1.26 -2.60 115.26 123.96 1ucx n ASN 67 Ca 0.06 -3.81 -0.03 0.00 -0.02 0.00 0.00 54.58 50.78 1ucx n ASN 67 Cb 0.62 -0.95 -0.01 0.00 -2.36 0.00 0.00 39.78 37.08 1ucx n ASN 67 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1ucx s GLY 68 N -1.64 -0.32 0.18 4.83 0.00 -1.26 -4.16 107.32 104.95 1ucx s GLY 68 Ca 0.54 0.50 -0.32 0.00 0.00 0.00 0.00 44.72 45.45 1ucx s GLY 68 CO -0.29 0.11 1.74 -4.14 0.00 0.00 0.00 173.10 170.53 1ucx s PRO 69 N -2.95 4.13 0.09 2.90 0.02 -1.26 -4.21 135.00 133.72 1ucx s PRO 69 Ca 0.12 2.59 0.09 0.00 0.02 0.00 0.00 61.00 63.81 1ucx s PRO 69 Cb 0.01 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.26 1ucx s PRO 69 CO -0.01 -0.77 -0.20 -1.14 -0.33 0.00 0.00 177.00 174.54 1ucx s GLN 70 N 1.64 1.83 -0.22 5.54 0.74 -0.86 -1.06 119.66 127.26 1ucx s GLN 70 Ca 0.76 -1.13 -0.03 0.00 0.05 0.00 0.00 55.36 55.01 1ucx s GLN 70 Cb -0.48 -2.10 0.07 0.00 1.10 0.00 0.00 33.01 31.60 1ucx s GLN 70 CO 0.33 0.50 0.06 -2.00 -0.55 0.00 0.00 175.29 173.63 1ucx s GLU 71 N -1.82 0.59 -0.32 1.67 2.12 -0.42 -1.41 118.70 119.12 1ucx s GLU 71 Ca 0.16 -0.52 -0.12 0.00 0.36 0.00 0.00 54.97 54.84 1ucx s GLU 71 Cb -0.10 -1.99 -0.03 0.00 0.26 0.00 0.00 34.13 32.26 1ucx s GLU 71 CO 0.07 -0.74 0.22 0.42 -0.54 0.00 0.00 175.26 174.69 1ucx s ILE 72 N 1.85 5.24 -0.13 -3.70 1.01 -0.69 -2.10 121.20 122.69 1ucx s ILE 72 Ca 0.02 -0.09 -0.13 0.00 0.00 0.00 0.00 60.65 60.44 1ucx s ILE 72 Cb -0.17 -3.62 -0.05 0.00 0.01 0.00 0.00 42.46 38.64 1ucx s ILE 72 CO -0.14 0.09 0.30 -0.47 0.00 0.00 0.00 174.94 174.72 1ucx s TYR 73 N 1.73 3.52 -0.58 3.97 5.04 -0.78 -1.51 117.35 128.74 1ucx s TYR 73 Ca 0.06 0.66 -0.19 0.00 -2.44 0.00 0.00 57.07 55.16 1ucx s TYR 73 Cb -0.17 -2.29 0.09 0.00 0.35 0.00 0.00 41.96 39.95 1ucx s TYR 73 CO 0.10 0.37 0.72 0.42 -1.34 0.00 0.00 175.55 175.82 1ucx s ILE 74 N 0.03 4.77 0.14 3.14 1.09 -0.46 -1.42 121.20 128.48 1ucx s ILE 74 Ca 0.18 -0.83 -0.16 0.00 -1.10 0.00 0.00 60.65 58.74 1ucx s ILE 74 Cb -0.13 -4.48 0.01 0.00 -1.06 0.00 0.00 42.46 36.79 1ucx s ILE 74 CO 0.05 -1.11 1.73 -0.61 -0.10 0.00 0.00 174.94 174.91 1ucx h GLN 75 N 9.20 0.60 -2.69 2.79 4.15 -0.85 0.94 115.11 129.25 1ucx h GLN 75 Ca -0.29 -0.08 -0.06 0.00 0.77 0.00 0.00 58.65 58.99 1ucx h GLN 75 Cb 1.09 -0.11 -0.16 0.00 0.21 0.00 0.00 27.48 28.50 1ucx h GLN 75 CO 1.09 0.50 0.07 1.14 -1.93 0.00 0.00 178.83 179.70 1ucx s GLN 76 N -5.77 1.06 0.00 1.69 -2.07 -1.14 -4.66 119.66 108.76 1ucx s GLN 76 Ca -0.13 -0.19 0.00 0.00 -1.82 0.00 0.00 55.36 53.22 1ucx s GLN 76 Cb 0.11 0.49 0.00 0.00 -1.09 0.00 0.00 33.01 32.51 1ucx s GLN 76 CO 0.74 -0.38 0.00 0.41 -1.32 0.00 0.00 175.29 174.74 1ucx n GLY 77 N 0.41 0.88 3.00 2.60 0.00 -1.25 -0.90 105.19 109.93 1ucx n GLY 77 Ca -0.18 -2.11 -0.10 0.00 0.00 0.00 0.00 46.02 43.63 1ucx n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ucx s LYS 78 N -1.35 0.31 0.00 1.61 1.02 -1.26 -2.72 119.74 117.34 1ucx s LYS 78 Ca 0.00 -0.50 0.00 0.00 0.02 0.00 0.00 55.97 55.49 1ucx s LYS 78 Cb 0.00 0.12 0.00 0.00 -0.52 0.00 0.00 37.83 37.43 1ucx s LYS 78 CO 0.00 -0.06 0.00 0.41 -0.92 0.00 0.00 175.35 174.78 1ucx n GLY 79 N 1.73 0.95 3.23 -3.33 0.00 -1.02 -4.33 105.19 102.42 1ucx n GLY 79 Ca -0.22 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.09 1ucx n GLY 79 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ucx s ILE 80 N -1.90 1.17 0.03 -0.61 -4.36 -0.66 -0.71 121.20 114.17 1ucx s ILE 80 Ca 0.00 -1.84 -0.06 0.00 -0.26 0.00 0.00 60.65 58.50 1ucx s ILE 80 Cb 0.00 -1.61 -0.01 0.00 1.25 0.00 0.00 42.46 42.09 1ucx s ILE 80 CO 0.00 -0.59 0.10 0.72 0.24 0.00 0.00 174.94 175.41 1ucx s PHE 81 N -2.70 0.18 -0.01 1.37 -0.71 -0.02 -1.46 117.98 114.63 1ucx s PHE 81 Ca 0.11 -0.46 -0.00 0.00 -1.04 0.00 0.00 56.93 55.54 1ucx s PHE 81 Cb -0.01 -0.13 0.01 0.00 -1.21 0.00 0.00 43.02 41.68 1ucx s PHE 81 CO 0.01 -0.35 0.03 0.20 -1.34 0.00 0.00 175.22 173.77 1ucx s GLY 82 N -2.03 0.03 0.53 1.99 0.00 -0.25 -1.12 107.32 106.47 1ucx s GLY 82 Ca -0.06 0.17 -0.06 0.00 0.00 0.00 0.00 44.72 44.77 1ucx s GLY 82 CO -0.04 0.33 0.85 1.06 0.00 0.00 0.00 173.10 175.30 1ucx s MET 83 N 0.47 3.35 -0.55 2.90 -1.94 -1.26 -2.51 119.30 119.76 1ucx s MET 83 Ca -0.04 0.19 0.06 0.00 -1.71 0.00 0.00 55.69 54.19 1ucx s MET 83 Cb -0.06 -2.31 0.32 0.00 2.01 0.00 0.00 34.83 34.80 1ucx s MET 83 CO -0.01 -0.40 0.87 -0.89 -0.01 0.00 0.00 175.02 174.57 1ucx n ILE 84 N -2.41 2.32 -2.01 2.53 5.41 -0.58 -4.77 119.36 119.85 1ucx n ILE 84 Ca 0.02 -5.31 -0.42 0.00 1.00 0.00 0.00 62.75 58.04 1ucx n ILE 84 Cb 0.56 -1.36 -0.03 0.00 -0.71 0.00 0.00 39.64 38.10 1ucx n ILE 84 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 1ucx s TYR 85 N -3.07 2.27 0.16 1.39 6.14 -1.26 -4.50 117.35 118.48 1ucx s TYR 85 Ca 0.46 0.33 -0.18 0.00 0.64 0.00 0.00 57.07 58.32 1ucx s TYR 85 Cb 0.27 -3.90 0.07 0.00 0.42 0.00 0.00 41.96 38.82 1ucx s TYR 85 CO -0.11 -3.66 1.67 -1.00 0.64 0.00 0.00 175.55 173.09 1ucx h PRO 86 N 8.84 -0.02 -2.28 4.97 0.13 -1.98 -3.13 132.00 138.52 1ucx h PRO 86 Ca -0.40 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.31 1ucx h PRO 86 Cb 1.19 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.25 1ucx h PRO 86 CO 0.94 -0.01 0.98 0.41 -0.23 0.00 0.00 178.00 180.08 1ucx n GLY 87 N -1.30 3.77 3.02 1.56 0.00 -1.26 -4.93 105.19 106.05 1ucx n GLY 87 Ca 0.01 -1.50 -0.10 0.00 0.00 0.00 0.00 46.02 44.43 1ucx n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucx s PRO 89 N -1.68 4.08 0.05 0.00 0.04 -1.26 -5.06 135.00 131.17 1ucx s PRO 89 Ca -0.12 1.64 0.01 0.00 0.04 0.00 0.00 61.00 62.57 1ucx s PRO 89 Cb -0.09 -2.57 -0.04 0.00 0.04 0.00 0.00 34.50 31.84 1ucx s PRO 89 CO -0.01 -0.25 0.13 -1.12 0.04 0.00 0.00 177.00 175.79 1ucx s SER 90 N -1.41 5.88 0.85 6.66 0.01 -1.26 -4.69 113.70 119.75 1ucx s SER 90 Ca 0.58 0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.98 1ucx s SER 90 Cb -0.26 -1.70 0.00 0.00 0.21 0.00 0.00 66.02 64.27 1ucx s SER 90 CO 0.32 0.20 0.00 0.41 0.41 0.00 0.00 173.24 174.58 1ucx n THR 91 N 0.59 0.00 0.00 1.44 -1.04 -1.26 -4.79 114.28 109.23 1ucx n THR 91 Ca -0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1ucx n THR 91 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1ucx n THR 91 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1ucx n ARG 110 N 0.00 0.00 -3.68 -2.82 5.12 -1.26 -4.78 116.66 109.25 1ucx n ARG 110 Ca 0.00 0.00 -0.15 0.00 -1.93 0.00 0.00 57.85 55.77 1ucx n ARG 110 Cb 0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.22 1ucx n ARG 110 CO 0.00 0.00 0.00 -3.38 -1.93 0.00 0.00 177.63 172.32 1ucx s HIS 111 N 0.00 -0.36 1.01 -1.55 -3.43 -1.26 -5.16 115.29 104.54 1ucx s HIS 111 Ca 0.00 0.61 -0.12 0.00 -0.80 0.00 0.00 55.06 54.75 1ucx s HIS 111 Cb 0.00 0.20 0.20 0.00 -1.43 0.00 0.00 32.58 31.55 1ucx s HIS 111 CO 0.00 -0.45 1.08 -0.65 -2.00 0.00 0.00 174.74 172.72 1ucx s GLN 112 N -1.18 0.28 0.25 -0.38 -0.21 -1.26 -4.73 119.66 112.43 1ucx s GLN 112 Ca -0.12 1.00 -0.31 0.00 0.02 0.00 0.00 55.36 55.95 1ucx s GLN 112 Cb -0.03 -1.68 -0.11 0.00 1.00 0.00 0.00 33.01 32.18 1ucx s GLN 112 CO 0.06 -2.96 1.59 0.21 -2.12 0.00 0.00 175.29 172.07 1ucx s LYS 113 N -4.68 4.16 -0.13 2.91 2.36 -1.26 -4.78 119.74 118.32 1ucx s LYS 113 Ca 0.66 2.51 -0.01 0.00 -2.55 0.00 0.00 55.97 56.58 1ucx s LYS 113 Cb -0.22 -3.07 -0.02 0.00 -1.05 0.00 0.00 37.83 33.48 1ucx s LYS 113 CO 0.60 -0.62 -0.11 0.42 1.55 0.00 0.00 175.35 177.19 1ucx s ILE 114 N 0.38 3.22 0.25 5.43 1.01 -1.26 -4.02 121.20 126.21 1ucx s ILE 114 Ca 0.66 -0.60 0.08 0.00 0.00 0.00 0.00 60.65 60.78 1ucx s ILE 114 Cb -0.47 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 1ucx s ILE 114 CO 0.42 0.52 0.11 -0.31 0.00 0.00 0.00 174.94 175.68 1ucx s TYR 115 N 0.29 2.94 0.60 3.97 1.51 -0.28 -4.85 117.35 121.53 1ucx s TYR 115 Ca -0.08 -0.15 0.02 0.00 -1.01 0.00 0.00 57.07 55.85 1ucx s TYR 115 Cb -0.15 -1.32 0.07 0.00 -0.11 0.00 0.00 41.96 40.44 1ucx s TYR 115 CO 0.05 0.56 0.83 -0.80 -1.11 0.00 0.00 175.55 175.08 1ucx s ASN 116 N -3.70 4.99 -0.04 2.29 -0.87 -1.26 -0.84 114.94 115.52 1ucx s ASN 116 Ca 0.32 -0.25 -0.27 0.00 -1.57 0.00 0.00 52.86 51.09 1ucx s ASN 116 Cb -0.07 -0.45 0.06 0.00 -0.02 0.00 0.00 41.25 40.77 1ucx s ASN 116 CO 0.23 -1.37 0.58 0.72 -2.57 0.00 0.00 177.10 174.69 1ucx s PHE 117 N -2.84 -0.53 0.51 2.20 -0.12 0.11 -4.77 117.98 112.55 1ucx s PHE 117 Ca 0.61 0.89 0.03 0.00 -0.05 0.00 0.00 56.93 58.40 1ucx s PHE 117 Cb -0.08 0.33 -0.00 0.00 -0.63 0.00 0.00 43.02 42.63 1ucx s PHE 117 CO 0.40 -0.55 0.14 1.03 -0.05 0.00 0.00 175.22 176.18 1ucx s ARG 118 N -1.25 2.21 0.67 1.99 0.52 -1.26 -2.43 118.95 119.39 1ucx s ARG 118 Ca -0.12 -2.24 -0.16 0.00 -0.52 0.00 0.00 55.73 52.69 1ucx s ARG 118 Cb -0.01 -1.74 0.01 0.00 0.52 0.00 0.00 34.95 33.73 1ucx s ARG 118 CO 0.08 -0.42 1.18 -1.21 0.02 0.00 0.00 175.30 174.96 1ucx s GLU 119 N -4.00 2.55 0.00 3.54 2.02 -1.10 -2.86 118.70 118.86 1ucx s GLU 119 Ca 0.17 1.69 0.00 0.00 0.02 0.00 0.00 54.97 56.85 1ucx s GLU 119 Cb 0.01 -1.89 0.00 0.00 0.10 0.00 0.00 34.13 32.35 1ucx s GLU 119 CO 0.10 -1.50 0.00 0.41 0.02 0.00 0.00 175.26 174.29 1ucx n GLY 120 N 0.21 0.70 3.73 -1.39 0.00 0.33 -4.74 105.19 104.04 1ucx n GLY 120 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1ucx n GLY 120 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ucx s ASP 121 N -2.70 7.35 -0.29 1.61 1.11 -1.13 -0.69 116.67 121.93 1ucx s ASP 121 Ca 0.00 1.97 -0.03 0.00 0.18 0.00 0.00 52.55 54.67 1ucx s ASP 121 Cb 0.00 -2.60 0.03 0.00 1.07 0.00 0.00 42.92 41.42 1ucx s ASP 121 CO 0.00 -0.17 0.01 -0.22 1.18 0.00 0.00 175.17 175.98 1ucx s LEU 122 N -0.19 3.72 -0.25 1.23 2.96 -0.50 -1.36 118.68 124.29 1ucx s LEU 122 Ca 0.49 -1.00 -0.11 0.00 -0.22 0.00 0.00 54.13 53.28 1ucx s LEU 122 Cb -0.27 -1.75 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 1ucx s LEU 122 CO 0.33 -0.21 0.21 -0.63 -1.32 0.00 0.00 176.35 174.72 1ucx s ILE 123 N 1.35 5.32 -0.17 6.68 1.01 -0.57 -1.78 121.20 133.05 1ucx s ILE 123 Ca -0.01 0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.72 1ucx s ILE 123 Cb -0.18 -3.54 -0.04 0.00 0.01 0.00 0.00 42.46 38.71 1ucx s ILE 123 CO -0.01 0.30 0.47 0.00 0.00 0.00 0.00 174.94 175.70 1ucx s ALA 124 N 1.32 3.52 -0.33 9.38 0.00 -1.22 -1.71 121.76 132.73 1ucx s ALA 124 Ca 0.09 -0.34 0.02 0.00 0.00 0.00 0.00 51.96 51.73 1ucx s ALA 124 Cb -0.14 -2.69 0.09 0.00 0.00 0.00 0.00 23.12 20.37 1ucx s ALA 124 CO 0.07 -0.22 0.04 0.08 0.00 0.00 0.00 175.76 175.73 1ucx s VAL 125 N 1.13 2.50 0.65 0.00 1.01 -0.50 -4.87 120.40 120.31 1ucx s VAL 125 Ca 0.23 -2.07 -0.17 0.00 0.00 0.00 0.00 61.98 59.97 1ucx s VAL 125 Cb -0.15 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 1ucx s VAL 125 CO 0.09 -0.46 0.63 -2.65 0.00 0.00 0.00 175.10 172.72 1ucx n PRO 126 N 4.38 0.49 -1.69 2.72 -0.02 -1.26 -2.03 135.00 137.60 1ucx n PRO 126 Ca -0.02 0.21 -0.50 0.00 -2.02 0.00 0.00 63.50 61.17 1ucx n PRO 126 Cb 0.42 -1.87 -0.05 0.00 -0.02 0.00 0.00 33.50 31.98 1ucx n PRO 126 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1ucx n THR 127 N -2.03 0.54 -0.45 3.45 -1.04 -1.26 -2.38 114.28 111.10 1ucx n THR 127 Ca 0.12 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1ucx n THR 127 Cb 0.49 -1.78 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 1ucx n THR 127 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ucx n GLY 128 N 4.37 1.63 3.76 3.41 0.00 -1.07 -4.93 105.19 112.36 1ucx n GLY 128 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 1ucx n GLY 128 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ucx s VAL 129 N -3.28 3.12 0.37 1.61 1.01 -1.00 -4.87 120.40 117.36 1ucx s VAL 129 Ca 0.00 1.11 -0.05 0.00 0.00 0.00 0.00 61.98 63.05 1ucx s VAL 129 Cb 0.00 -3.70 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 1ucx s VAL 129 CO 0.00 0.26 0.65 0.00 0.00 0.00 0.00 175.10 176.01 1ucx s ALA 130 N -1.17 3.53 0.16 5.51 0.00 -1.26 -4.58 121.76 123.96 1ucx s ALA 130 Ca 0.47 -0.56 -0.23 0.00 0.00 0.00 0.00 51.96 51.64 1ucx s ALA 130 Cb -0.35 -2.40 0.07 0.00 0.00 0.00 0.00 23.12 20.43 1ucx s ALA 130 CO 0.46 -0.02 0.60 1.67 0.00 0.00 0.00 175.76 178.48 1ucx s TRP 131 N -2.36 -0.52 0.06 0.00 1.48 -0.82 -1.53 118.94 115.24 1ucx s TRP 131 Ca 0.45 0.30 0.03 0.00 -1.06 0.00 0.00 56.10 55.83 1ucx s TRP 131 Cb -0.10 0.56 -0.03 0.00 -1.16 0.00 0.00 33.47 32.74 1ucx s TRP 131 CO 0.36 -0.86 -0.09 1.67 -4.06 0.00 0.00 176.95 173.96 1ucx s TRP 132 N -3.76 0.86 -0.01 1.66 1.48 -1.04 -2.43 118.94 115.71 1ucx s TRP 132 Ca 0.01 -0.55 0.01 0.00 -1.06 0.00 0.00 56.10 54.51 1ucx s TRP 132 Cb -0.01 -0.50 0.01 0.00 -1.16 0.00 0.00 33.47 31.81 1ucx s TRP 132 CO -0.12 -0.05 -0.01 1.41 -4.06 0.00 0.00 176.95 174.12 1ucx s MET 133 N -2.01 0.20 0.08 3.25 1.75 -1.19 -1.09 119.30 120.30 1ucx s MET 133 Ca -0.04 -0.03 0.06 0.00 -1.25 0.00 0.00 55.69 54.44 1ucx s MET 133 Cb -0.07 -0.26 -0.03 0.00 2.84 0.00 0.00 34.83 37.30 1ucx s MET 133 CO 0.00 -0.01 -0.17 -0.47 -0.65 0.00 0.00 175.02 173.72 1ucx s TYR 134 N 0.28 1.46 0.14 4.11 5.04 -0.54 -0.73 117.35 127.11 1ucx s TYR 134 Ca -0.02 -0.44 0.10 0.00 -2.44 0.00 0.00 57.07 54.27 1ucx s TYR 134 Cb -0.05 -0.82 -0.04 0.00 0.35 0.00 0.00 41.96 41.41 1ucx s TYR 134 CO -0.01 0.12 -0.25 1.21 -1.34 0.00 0.00 175.55 175.28 1ucx s ASN 135 N -1.77 3.17 0.00 4.32 2.47 -0.86 -1.65 114.94 120.62 1ucx s ASN 135 Ca 0.02 -0.77 0.00 0.00 0.42 0.00 0.00 52.86 52.52 1ucx s ASN 135 Cb -0.10 -0.21 0.00 0.00 -1.45 0.00 0.00 41.25 39.49 1ucx s ASN 135 CO 0.03 0.13 0.17 -3.20 -3.72 0.00 0.00 177.10 170.51 1ucx n ASN 136 N 0.75 0.26 -4.25 -4.21 5.15 -1.26 -3.03 115.26 108.66 1ucx n ASN 136 Ca -0.17 -1.03 -0.18 0.00 -0.60 0.00 0.00 54.58 52.61 1ucx n ASN 136 Cb 0.54 0.00 0.08 0.00 -0.53 0.00 0.00 39.78 39.87 1ucx n ASN 136 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1ucx n GLU 137 N -0.01 0.25 0.10 1.20 -0.58 -1.26 -4.64 120.64 115.69 1ucx n GLU 137 Ca 0.00 -2.40 -0.16 0.00 -0.42 0.00 0.00 57.16 54.17 1ucx n GLU 137 Cb 0.22 -0.43 -0.14 0.00 -0.57 0.00 0.00 31.44 30.52 1ucx n GLU 137 CO 0.00 0.00 0.00 -0.44 -0.48 0.00 0.00 177.13 176.21 1ucx h ASP 138 N -0.29 0.44 -2.64 1.62 3.32 -1.98 -3.34 116.42 113.55 1ucx h ASP 138 Ca -0.26 -0.49 -0.55 0.00 0.02 0.00 0.00 57.03 55.75 1ucx h ASP 138 Cb 1.03 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.44 1ucx h ASP 138 CO 0.31 1.39 1.06 0.42 -1.72 0.00 0.00 179.24 180.70 1ucx s THR 139 N -2.64 3.54 0.31 0.35 -4.23 -1.26 -4.62 115.64 107.08 1ucx s THR 139 Ca -0.05 0.72 -0.28 0.00 -1.18 0.00 0.00 61.69 60.89 1ucx s THR 139 Cb 0.07 -3.46 -0.09 0.00 1.34 0.00 0.00 72.50 70.35 1ucx s THR 139 CO 0.88 -0.05 1.11 -2.84 -0.54 0.00 0.00 174.62 173.18 1ucx s PRO 140 N 3.76 4.53 0.13 3.99 0.02 -1.26 -4.70 135.00 141.47 1ucx s PRO 140 Ca 0.73 1.80 -0.30 0.00 0.02 0.00 0.00 61.00 63.24 1ucx s PRO 140 Cb -0.34 -3.07 -0.07 0.00 0.02 0.00 0.00 34.50 31.04 1ucx s PRO 140 CO 0.29 0.11 1.16 0.08 -0.33 0.00 0.00 177.00 178.31 1ucx s VAL 141 N -1.24 3.87 -0.24 3.83 1.01 -0.79 -3.96 120.40 122.88 1ucx s VAL 141 Ca 0.47 1.49 0.00 0.00 0.00 0.00 0.00 61.98 63.95 1ucx s VAL 141 Cb -0.31 -3.95 0.07 0.00 0.00 0.00 0.00 36.38 32.18 1ucx s VAL 141 CO 0.40 0.20 -0.02 -0.69 0.00 0.00 0.00 175.10 174.99 1ucx s VAL 142 N 0.29 1.41 -0.30 2.92 1.01 -0.07 -0.85 120.40 124.80 1ucx s VAL 142 Ca 0.54 -1.23 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1ucx s VAL 142 Cb -0.30 -1.75 0.08 0.00 0.00 0.00 0.00 36.38 34.41 1ucx s VAL 142 CO 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 175.10 175.22 1ucx s ALA 143 N 1.44 2.75 -0.15 5.51 0.00 -0.40 -0.10 121.76 130.81 1ucx s ALA 143 Ca -0.03 -2.13 -0.19 0.00 0.00 0.00 0.00 51.96 49.62 1ucx s ALA 143 Cb -0.19 -1.81 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 1ucx s ALA 143 CO -0.08 -1.44 0.52 0.54 0.00 0.00 0.00 175.76 175.30 1ucx s VAL 144 N 1.03 5.14 0.14 0.00 0.11 -0.51 -2.32 120.40 123.98 1ucx s VAL 144 Ca 0.00 1.00 0.03 0.00 -2.93 0.00 0.00 61.98 60.09 1ucx s VAL 144 Cb -0.20 -3.85 -0.04 0.00 -1.53 0.00 0.00 36.38 30.76 1ucx s VAL 144 CO -0.06 0.25 -0.08 -0.94 -3.33 0.00 0.00 175.10 170.94 1ucx s SER 145 N 0.88 1.55 -0.04 3.54 1.04 0.15 -1.87 113.70 118.95 1ucx s SER 145 Ca 0.26 -1.03 0.05 0.00 0.48 0.00 0.00 55.95 55.72 1ucx s SER 145 Cb -0.15 0.03 -0.01 0.00 0.10 0.00 0.00 66.02 65.99 1ucx s SER 145 CO 0.10 -0.40 -0.21 0.27 0.98 0.00 0.00 173.24 173.99 1ucx s ILE 146 N -3.45 1.71 -0.25 -1.02 -4.36 -0.89 -2.36 121.20 110.58 1ucx s ILE 146 Ca 0.16 -0.88 -0.10 0.00 -0.26 0.00 0.00 60.65 59.57 1ucx s ILE 146 Cb 0.04 -1.45 -0.04 0.00 1.25 0.00 0.00 42.46 42.25 1ucx s ILE 146 CO -0.01 0.48 0.14 -0.63 0.24 0.00 0.00 174.94 175.17 1ucx s ILE 147 N -0.13 5.02 -0.71 8.37 1.01 -0.96 -1.30 121.20 132.49 1ucx s ILE 147 Ca -0.02 0.07 -0.26 0.00 0.00 0.00 0.00 60.65 60.44 1ucx s ILE 147 Cb -0.12 -3.36 0.04 0.00 0.01 0.00 0.00 42.46 39.03 1ucx s ILE 147 CO 0.02 0.32 1.21 -0.62 0.00 0.00 0.00 174.94 175.87 1ucx s ASP 148 N 1.42 6.18 0.00 3.58 2.15 -0.22 -2.02 116.67 127.76 1ucx s ASP 148 Ca 0.06 -0.51 0.24 0.00 0.43 0.00 0.00 52.55 52.77 1ucx s ASP 148 Cb -0.15 -2.53 1.38 0.00 -0.30 0.00 0.00 42.92 41.32 1ucx s ASP 148 CO 0.07 -1.74 1.89 0.35 -0.17 0.00 0.00 175.17 175.57 1ucx n THR 149 N 6.31 0.01 -2.79 1.71 -2.24 -0.93 -3.79 114.28 112.56 1ucx n THR 149 Ca 0.02 -0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.51 1ucx n THR 149 Cb 0.48 -0.29 -0.02 0.00 -2.10 0.00 0.00 70.33 68.40 1ucx n THR 149 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1ucx n ASN 150 N -0.76 4.16 -4.69 3.42 5.15 -1.16 -4.56 115.26 116.82 1ucx n ASN 150 Ca 0.18 -3.60 -0.29 0.00 -0.60 0.00 0.00 54.58 50.26 1ucx n ASN 150 Cb 0.11 -0.53 -0.08 0.00 -0.53 0.00 0.00 39.78 38.75 1ucx n ASN 150 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1ucx s SER 151 N -3.41 4.99 0.54 1.20 0.15 -1.25 -4.99 113.70 110.94 1ucx s SER 151 Ca 0.47 -0.22 0.19 0.00 0.70 0.00 0.00 55.95 57.10 1ucx s SER 151 Cb 0.33 -1.17 1.40 0.00 -1.71 0.00 0.00 66.02 64.88 1ucx s SER 151 CO -0.14 0.15 2.17 -0.07 1.20 0.00 0.00 173.24 176.55 1ucx h LEU 152 N 3.26 0.00 -0.62 3.45 4.07 -1.95 -1.68 115.31 121.84 1ucx h LEU 152 Ca -0.48 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.35 1ucx h LEU 152 Cb 1.17 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.89 1ucx h LEU 152 CO 0.59 0.00 -0.62 -0.33 -1.08 0.00 0.00 178.44 177.01 1ucx h GLU 153 N 0.00 0.00 -6.12 1.13 4.39 -1.94 -3.40 114.58 108.63 1ucx h GLU 153 Ca -0.00 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.10 1ucx h GLU 153 Cb 0.01 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 28.56 1ucx h GLU 153 CO 0.00 0.62 0.58 1.21 -1.16 0.00 0.00 179.01 180.27 1ucx s ASN 154 N -6.70 6.57 -0.04 1.42 2.47 -0.63 -4.83 114.94 113.20 1ucx s ASN 154 Ca -0.00 0.31 0.20 0.00 0.42 0.00 0.00 52.86 53.79 1ucx s ASN 154 Cb 0.11 -2.45 0.64 0.00 -1.45 0.00 0.00 41.25 38.10 1ucx s ASN 154 CO 0.75 -0.96 1.54 0.00 -3.72 0.00 0.00 177.10 174.71 1ucx n GLN 155 N 6.99 3.11 0.00 0.43 6.02 -1.26 -4.68 117.38 127.99 1ucx n GLN 155 Ca 0.06 -2.69 0.00 0.00 -0.01 0.00 0.00 57.00 54.36 1ucx n GLN 155 Cb 0.48 -1.66 0.00 0.00 1.02 0.00 0.00 30.24 30.08 1ucx n GLN 155 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1ucx n LEU 156 N 1.31 0.00 -4.28 1.08 4.77 -1.26 -5.14 117.00 113.47 1ucx n LEU 156 Ca 0.24 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 56.06 1ucx n LEU 156 Cb 0.71 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.70 1ucx n LEU 156 CO 0.18 0.00 -0.22 1.51 -1.33 0.00 0.00 177.39 177.53 1ucx s ASP 157 N -0.93 1.02 0.00 -1.43 1.47 -1.26 -5.04 116.67 110.50 1ucx s ASP 157 Ca 0.00 -1.47 0.01 0.00 1.18 0.00 0.00 52.55 52.27 1ucx s ASP 157 Cb 0.00 0.33 0.04 0.00 -0.34 0.00 0.00 42.92 42.95 1ucx s ASP 157 CO 0.00 -0.84 1.00 0.00 0.68 0.00 0.00 175.17 176.01 1ucx n GLN 158 N -0.46 0.00 -2.21 2.11 10.64 -1.26 -4.72 117.38 121.48 1ucx n GLN 158 Ca 0.01 0.45 -0.43 0.00 -1.83 0.00 0.00 57.00 55.21 1ucx n GLN 158 Cb 0.65 -1.50 -0.02 0.00 -0.86 0.00 0.00 30.24 28.51 1ucx n GLN 158 CO 0.00 0.00 0.00 -1.64 -1.83 0.00 0.00 177.06 173.59 1ucx s MET 159 N -2.94 4.04 0.24 2.61 -1.94 -1.26 -4.90 119.30 115.16 1ucx s MET 159 Ca 0.01 1.75 -0.30 0.00 -1.71 0.00 0.00 55.69 55.44 1ucx s MET 159 Cb 0.01 -3.92 -0.09 0.00 2.01 0.00 0.00 34.83 32.83 1ucx s MET 159 CO 0.02 -0.98 1.33 -1.25 -0.01 0.00 0.00 175.02 174.12 1ucx s PRO 160 N 4.10 4.37 -0.04 2.03 0.04 -1.26 -5.03 135.00 139.20 1ucx s PRO 160 Ca 0.65 2.13 -0.14 0.00 0.04 0.00 0.00 61.00 63.68 1ucx s PRO 160 Cb -0.25 -3.15 0.03 0.00 0.04 0.00 0.00 34.50 31.16 1ucx s PRO 160 CO 0.24 -0.25 0.31 -0.98 0.04 0.00 0.00 177.00 176.37 1ucx s ARG 161 N -0.60 0.61 -0.03 4.56 1.70 -1.26 -4.74 118.95 119.19 1ucx s ARG 161 Ca 0.55 -0.04 0.08 0.00 -0.47 0.00 0.00 55.73 55.84 1ucx s ARG 161 Cb -0.38 0.27 -0.02 0.00 -0.57 0.00 0.00 34.95 34.25 1ucx s ARG 161 CO 0.43 -0.15 -0.25 0.50 -1.08 0.00 0.00 175.30 174.74 1ucx s ARG 162 N -0.99 2.18 -0.32 3.89 3.52 -1.26 -4.13 118.95 121.83 1ucx s ARG 162 Ca -0.11 -0.91 -0.04 0.00 -0.13 0.00 0.00 55.73 54.54 1ucx s ARG 162 Cb -0.05 -2.07 0.05 0.00 -1.56 0.00 0.00 34.95 31.32 1ucx s ARG 162 CO 0.03 0.55 0.05 -0.06 -0.81 0.00 0.00 175.30 175.07 1ucx s PHE 163 N -0.58 3.27 -0.01 5.12 0.40 0.48 -4.85 117.98 121.81 1ucx s PHE 163 Ca 0.09 -1.66 -0.21 0.00 -0.60 0.00 0.00 56.93 54.54 1ucx s PHE 163 Cb -0.10 -2.21 -0.05 0.00 0.51 0.00 0.00 43.02 41.16 1ucx s PHE 163 CO -0.00 -0.77 0.62 0.71 0.70 0.00 0.00 175.22 176.47 1ucx s TYR 164 N 1.32 3.67 0.05 0.36 2.02 -1.26 -1.22 117.35 122.29 1ucx s TYR 164 Ca -0.03 1.22 -0.17 0.00 -0.37 0.00 0.00 57.07 57.72 1ucx s TYR 164 Cb -0.20 -2.65 -0.18 0.00 -0.40 0.00 0.00 41.96 38.53 1ucx s TYR 164 CO 0.01 0.31 1.23 -0.07 -1.57 0.00 0.00 175.55 175.46 1ucx h LEU 165 N 5.79 0.67 -9.00 -1.29 4.07 -1.64 -1.01 115.31 112.91 1ucx h LEU 165 Ca -0.44 -0.65 -0.60 0.00 0.08 0.00 0.00 57.88 56.26 1ucx h LEU 165 Cb 1.20 -0.20 -0.17 0.00 1.08 0.00 0.00 40.66 42.57 1ucx h LEU 165 CO 0.71 1.22 -0.80 0.00 -1.08 0.00 0.00 178.44 178.48 1ucx s ALA 166 N -3.65 2.41 0.02 1.53 0.00 -1.26 -3.85 121.76 116.95 1ucx s ALA 166 Ca -0.12 -1.64 0.00 0.00 0.00 0.00 0.00 51.96 50.20 1ucx s ALA 166 Cb 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.91 1ucx s ALA 166 CO 0.84 0.34 0.00 0.41 0.00 0.00 0.00 175.76 177.35 1ucx n GLY 167 N 0.10 -3.11 3.68 0.00 0.00 -1.26 -4.72 105.19 99.88 1ucx n GLY 167 Ca -0.11 -1.11 -0.43 0.00 0.00 0.00 0.00 46.02 44.37 1ucx n GLY 167 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ucx s ASN 168 N -1.84 7.20 0.00 1.61 0.01 -1.26 -2.73 114.94 117.93 1ucx s ASN 168 Ca 0.00 1.49 0.00 0.00 -0.71 0.00 0.00 52.86 53.64 1ucx s ASN 168 Cb 0.00 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 39.11 1ucx s ASN 168 CO 0.00 -0.50 0.00 0.00 -1.51 0.00 0.00 177.10 175.09 1ucx n GLN 169 N 5.31 0.00 -3.16 -0.60 0.00 -1.26 -4.72 117.38 112.95 1ucx n GLN 169 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 57.00 56.70 1ucx n GLN 169 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.66 1ucx n GLN 169 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 1ucx s GLU 170 N -2.00 4.34 0.57 2.61 -1.05 -1.26 -2.55 118.70 119.37 1ucx s GLU 170 Ca 0.00 0.85 -0.20 0.00 -0.15 0.00 0.00 54.97 55.46 1ucx s GLU 170 Cb 0.00 -3.30 -0.04 0.00 -0.44 0.00 0.00 34.13 30.35 1ucx s GLU 170 CO 0.00 0.47 1.27 0.94 0.95 0.00 0.00 175.26 178.89 1ucx n GLN 171 N 2.25 1.42 -0.09 -4.83 0.00 -1.26 -4.92 117.38 109.95 1ucx n GLN 171 Ca -0.07 0.53 0.21 0.00 -0.00 0.00 0.00 57.00 57.67 1ucx n GLN 171 Cb 0.50 -2.48 0.65 0.00 0.00 0.00 0.00 30.24 28.92 1ucx n GLN 171 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 1ucx h GLU 172 N 1.08 0.10 -0.51 3.69 3.07 -1.96 -1.65 114.58 118.40 1ucx h GLU 172 Ca -0.50 -0.01 -0.12 0.00 -0.50 0.00 0.00 59.36 58.23 1ucx h GLU 172 Cb 1.32 -0.02 -0.07 0.00 -0.84 0.00 0.00 28.75 29.14 1ucx h GLU 172 CO 0.55 0.06 0.10 1.19 -1.40 0.00 0.00 179.01 179.52 1ucx n PHE 173 N -4.38 1.71 0.04 4.33 3.72 -1.26 -4.20 117.46 117.42 1ucx n PHE 173 Ca 0.13 -1.11 -0.16 0.00 -0.05 0.00 0.00 57.45 56.26 1ucx n PHE 173 Cb 0.68 -0.52 -0.06 0.00 -0.94 0.00 0.00 39.48 38.64 1ucx n PHE 173 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1ucx h LEU 174 N 2.25 0.73 -0.71 4.37 7.12 -1.63 -3.08 115.31 124.36 1ucx h LEU 174 Ca 0.15 -0.55 0.16 0.00 0.13 0.00 0.00 57.88 57.76 1ucx h LEU 174 Cb 1.91 -0.22 -0.12 0.00 -0.53 0.00 0.00 40.66 41.70 1ucx h LEU 174 CO 0.49 1.34 0.06 0.50 -0.13 0.00 0.00 178.44 180.71 1ucx h LYS 175 N 0.35 0.15 0.00 1.25 3.11 -1.76 -1.30 116.57 118.36 1ucx h LYS 175 Ca -0.09 -0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.74 1ucx h LYS 175 Cb 1.56 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.75 1ucx h LYS 175 CO 0.17 0.10 -0.20 0.66 -2.81 0.00 0.00 179.45 177.37 1ucx n TYR 176 N -5.27 0.51 0.21 1.91 4.01 -1.22 -3.60 117.16 113.71 1ucx n TYR 176 Ca 0.13 0.15 -0.09 0.00 -0.16 0.00 0.00 57.90 57.92 1ucx n TYR 176 Cb 0.44 -0.69 -0.04 0.00 -0.31 0.00 0.00 39.34 38.74 1ucx n TYR 176 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 1ucx h GLN 177 N 0.00 -0.57 0.00 -0.72 4.20 -1.15 -3.50 115.11 113.36 1ucx h GLN 177 Ca 0.00 0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1ucx h GLN 177 Cb 0.65 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.56 1ucx h GLN 177 CO 0.00 -0.38 0.00 0.00 -0.67 0.00 0.00 178.83 177.78 1ucx n GLN 178 N -5.05 0.00 0.00 1.46 10.64 -1.04 -5.13 117.38 118.26 1ucx n GLN 178 Ca -0.07 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.10 1ucx n GLN 178 Cb 0.23 -0.19 0.00 0.00 -0.86 0.00 0.00 30.24 29.42 1ucx n GLN 178 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ucx n GLY 198 N 1.67 1.55 0.00 2.61 0.00 -1.26 -5.09 105.19 104.67 1ucx n GLY 198 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1ucx n GLY 198 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ucx n GLY 199 N 0.00 -0.16 3.94 -0.02 0.00 -1.06 -4.84 105.19 103.04 1ucx n GLY 199 Ca 0.00 -1.85 -0.23 0.00 0.00 0.00 0.00 46.02 43.94 1ucx n GLY 199 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ucx s SER 200 N -1.31 4.85 0.30 1.61 1.04 -1.11 -4.44 113.70 114.64 1ucx s SER 200 Ca 0.00 -1.04 0.01 0.00 0.48 0.00 0.00 55.95 55.40 1ucx s SER 200 Cb 0.00 0.20 0.48 0.00 0.10 0.00 0.00 66.02 66.80 1ucx s SER 200 CO 0.00 -1.09 1.84 0.16 0.98 0.00 0.00 173.24 175.13 1ucx h ILE 201 N 0.64 1.21 -0.11 -1.02 3.07 -1.33 -2.74 117.51 117.23 1ucx h ILE 201 Ca -0.36 -0.82 -0.13 0.00 1.55 0.00 0.00 64.86 65.10 1ucx h ILE 201 Cb 1.29 0.81 -0.01 0.00 -0.27 0.00 0.00 36.82 38.64 1ucx h ILE 201 CO 0.52 0.29 -0.52 0.25 -1.05 0.00 0.00 178.15 177.65 1ucx h LEU 202 N 0.66 0.33 -0.32 0.16 5.85 -1.81 -3.15 115.31 117.03 1ucx h LEU 202 Ca 0.14 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1ucx h LEU 202 Cb 0.33 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1ucx h LEU 202 CO 0.01 0.79 0.00 -1.54 -0.34 0.00 0.00 178.44 177.36 1ucx n SER 203 N -3.94 0.29 -0.06 1.25 3.41 -1.03 -3.25 113.62 110.29 1ucx n SER 203 Ca -0.02 -1.81 -0.02 0.00 -0.26 0.00 0.00 58.87 56.76 1ucx n SER 203 Cb 0.56 -0.15 -0.13 0.00 -0.26 0.00 0.00 64.21 64.24 1ucx n SER 203 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ucx n GLY 204 N 0.29 -0.79 3.73 5.00 0.00 -1.19 -4.76 105.19 107.47 1ucx n GLY 204 Ca 0.00 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.40 1ucx n GLY 204 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ucx s PHE 205 N -2.66 2.39 0.35 1.61 0.08 -1.20 -5.00 117.98 113.56 1ucx s PHE 205 Ca -0.07 1.29 -0.28 0.00 0.12 0.00 0.00 56.93 57.99 1ucx s PHE 205 Cb 0.07 -3.14 -0.10 0.00 -0.57 0.00 0.00 43.02 39.28 1ucx s PHE 205 CO 0.68 -2.27 1.30 0.99 -0.10 0.00 0.00 175.22 175.83 1ucx s THR 206 N -2.94 2.70 0.51 0.64 2.01 -1.26 -4.92 115.64 112.37 1ucx s THR 206 Ca 0.63 0.68 0.29 0.00 0.31 0.00 0.00 61.69 63.60 1ucx s THR 206 Cb -0.18 -3.43 0.46 0.00 0.01 0.00 0.00 72.50 69.37 1ucx s THR 206 CO 0.57 0.15 1.87 0.25 -0.69 0.00 0.00 174.62 176.76 1ucx h LEU 207 N 3.18 0.10 0.00 4.42 5.85 -1.95 0.28 115.31 127.20 1ucx h LEU 207 Ca -0.49 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.18 1ucx h LEU 207 Cb 1.23 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 1ucx h LEU 207 CO 0.65 0.03 -0.92 1.05 -0.34 0.00 0.00 178.44 178.91 1ucx h GLU 208 N 0.10 0.00 -0.20 1.25 9.09 -1.98 -3.03 114.58 119.82 1ucx h GLU 208 Ca 0.45 0.00 -0.17 0.00 0.05 0.00 0.00 59.36 59.70 1ucx h GLU 208 Cb 1.64 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.73 1ucx h GLU 208 CO -0.06 0.16 -0.56 0.74 0.05 0.00 0.00 179.01 179.34 1ucx h PHE 209 N 0.00 0.75 -0.14 2.06 -1.00 -0.81 0.06 116.94 117.87 1ucx h PHE 209 Ca -0.05 -0.27 -0.16 0.00 2.81 0.00 0.00 57.97 60.30 1ucx h PHE 209 Cb 1.23 -0.14 0.01 0.00 3.61 0.00 0.00 35.95 40.66 1ucx h PHE 209 CO 0.00 1.02 -0.54 -0.07 -1.61 0.00 0.00 178.31 177.11 1ucx h LEU 210 N 0.46 0.71 -0.81 1.54 -0.00 -1.63 -0.25 115.31 115.32 1ucx h LEU 210 Ca 0.01 -0.62 0.16 0.00 -0.00 0.00 0.00 57.88 57.43 1ucx h LEU 210 Cb 1.11 -0.21 -0.10 0.00 -0.00 0.00 0.00 40.66 41.46 1ucx h LEU 210 CO 0.11 1.21 0.35 -0.08 -0.00 0.00 0.00 178.44 180.03 1ucx h GLU 211 N 0.25 0.46 -0.04 1.13 4.81 -1.44 -0.04 114.58 119.71 1ucx h GLU 211 Ca -0.03 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.08 1ucx h GLU 211 Cb 1.17 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.45 1ucx h GLU 211 CO 0.11 0.30 -0.33 1.25 -0.73 0.00 0.00 179.01 179.62 1ucx h HIS 212 N 0.47 0.41 0.33 0.92 2.76 -0.96 -2.83 115.15 116.26 1ucx h HIS 212 Ca 0.46 -0.19 -0.02 0.00 -2.20 0.00 0.00 60.37 58.42 1ucx h HIS 212 Cb 0.74 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.65 1ucx h HIS 212 CO -0.15 0.95 -0.16 0.00 -1.30 0.00 0.00 177.93 177.28 1ucx h ALA 213 N 0.37 -0.44 0.00 5.26 0.00 -0.05 -3.21 119.26 121.19 1ucx h ALA 213 Ca -0.03 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1ucx h ALA 213 Cb 1.01 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ucx h ALA 213 CO 0.07 -0.67 0.00 1.19 0.00 0.00 0.00 179.25 179.84 1ucx n PHE 214 N -5.21 0.65 -2.80 0.00 3.72 -0.12 -4.94 117.46 108.75 1ucx n PHE 214 Ca -0.10 0.20 -0.10 0.00 -0.05 0.00 0.00 57.45 57.40 1ucx n PHE 214 Cb 0.24 -0.82 0.05 0.00 -0.94 0.00 0.00 39.48 38.01 1ucx n PHE 214 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ucx n SER 215 N -2.04 -2.18 -4.01 4.37 2.88 -1.18 -5.05 113.62 106.41 1ucx n SER 215 Ca 0.05 -0.36 -0.13 0.00 -1.33 0.00 0.00 58.87 57.10 1ucx n SER 215 Cb 0.37 -3.17 -0.09 0.00 -0.75 0.00 0.00 64.21 60.57 1ucx n SER 215 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1ucx s VAL 216 N -3.21 0.00 0.61 2.46 -7.23 -1.07 -5.08 120.40 106.88 1ucx s VAL 216 Ca 0.02 -1.94 -0.13 0.00 -1.81 0.00 0.00 61.98 58.11 1ucx s VAL 216 Cb -0.00 -2.48 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 1ucx s VAL 216 CO 0.42 0.00 1.03 1.51 -0.31 0.00 0.00 175.10 177.75 1ucx s ASP 217 N -3.19 5.97 0.27 4.85 -4.77 -1.26 -4.63 116.67 113.91 1ucx s ASP 217 Ca 0.38 1.60 0.04 0.00 -3.30 0.00 0.00 52.55 51.27 1ucx s ASP 217 Cb 0.05 -2.50 0.73 0.00 -1.09 0.00 0.00 42.92 40.11 1ucx s ASP 217 CO 0.15 -1.04 1.32 0.29 0.70 0.00 0.00 175.17 176.59 1ucx n LYS 218 N -2.44 -0.06 0.41 2.11 5.02 -1.26 -1.34 118.16 120.60 1ucx n LYS 218 Ca 0.07 1.24 -0.18 0.00 -2.02 0.00 0.00 58.31 57.43 1ucx n LYS 218 Cb 0.54 -2.02 -0.09 0.00 -0.02 0.00 0.00 35.03 33.44 1ucx n LYS 218 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1ucx h GLN 219 N 0.00 -1.00 -0.00 1.97 4.20 -1.99 -1.52 115.11 116.76 1ucx h GLN 219 Ca 0.55 0.07 0.00 0.00 0.06 0.00 0.00 58.65 59.32 1ucx h GLN 219 Cb 1.20 0.23 0.00 0.00 0.30 0.00 0.00 27.48 29.21 1ucx h GLN 219 CO -0.77 -0.65 -0.02 0.44 -0.67 0.00 0.00 178.83 177.16 1ucx n ILE 220 N -5.50 0.00 0.10 2.54 -5.35 -0.54 -1.26 119.36 109.34 1ucx n ILE 220 Ca -0.14 -0.02 -0.16 0.00 -0.27 0.00 0.00 62.75 62.16 1ucx n ILE 220 Cb 0.42 -0.40 -0.14 0.00 -1.74 0.00 0.00 39.64 37.78 1ucx n ILE 220 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ucx h ALA 221 N 3.75 0.12 0.00 -1.28 0.00 -1.17 -2.57 119.26 118.11 1ucx h ALA 221 Ca 0.00 -0.93 -0.10 0.00 0.00 0.00 0.00 54.91 53.88 1ucx h ALA 221 Cb 0.18 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ucx h ALA 221 CO 0.00 1.00 -0.49 -0.22 0.00 0.00 0.00 179.25 179.54 1ucx h LYS 222 N 0.08 0.00 -0.09 0.00 3.64 -0.10 -1.11 116.57 118.99 1ucx h LYS 222 Ca -0.16 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.17 1ucx h LYS 222 Cb 1.99 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.81 1ucx h LYS 222 CO 0.20 0.49 -0.16 -0.91 -2.27 0.00 0.00 179.45 176.80 1ucx h ASN 223 N 0.00 0.30 -0.09 4.20 4.21 -1.50 -3.01 115.58 119.69 1ucx h ASN 223 Ca -0.00 -0.54 -0.04 0.00 1.21 0.00 0.00 56.30 56.92 1ucx h ASN 223 Cb 0.87 -0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 37.98 1ucx h ASN 223 CO 0.06 0.79 -0.05 -0.07 -1.29 0.00 0.00 177.43 176.87 1ucx h LEU 224 N -0.18 0.32 -6.27 1.61 4.07 -1.44 -3.26 115.31 110.15 1ucx h LEU 224 Ca 0.01 -0.06 -0.73 0.00 0.08 0.00 0.00 57.88 57.18 1ucx h LEU 224 Cb 0.73 -0.08 -0.10 0.00 1.08 0.00 0.00 40.66 42.29 1ucx h LEU 224 CO 0.04 0.42 2.58 1.67 -1.08 0.00 0.00 178.44 182.06 1ucx n GLN 225 N -4.30 3.22 0.00 1.13 7.27 -0.42 -4.29 117.38 119.99 1ucx n GLN 225 Ca 0.00 -3.06 0.00 0.00 0.07 0.00 0.00 57.00 54.01 1ucx n GLN 225 Cb 0.24 -3.12 0.00 0.00 2.41 0.00 0.00 30.24 29.77 1ucx n GLN 225 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ucx n GLY 226 N 3.53 0.38 3.53 1.69 0.00 -1.23 -4.84 105.19 108.24 1ucx n GLY 226 Ca 0.46 0.73 -0.26 0.00 0.00 0.00 0.00 46.02 46.95 1ucx n GLY 226 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ucx n GLU 227 N 0.00 0.47 -1.95 1.61 -0.58 -1.24 -4.76 120.64 114.19 1ucx n GLU 227 Ca 0.00 -0.31 0.00 0.00 -0.42 0.00 0.00 57.16 56.43 1ucx n GLU 227 Cb 0.00 -2.68 0.00 0.00 -0.57 0.00 0.00 31.44 28.19 1ucx n GLU 227 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1ucx n LYS 233 N 8.08 -4.79 0.00 3.49 2.85 -1.26 -4.70 118.16 121.82 1ucx n LYS 233 Ca 0.52 3.42 0.00 0.00 -1.05 0.00 0.00 58.31 61.20 1ucx n LYS 233 Cb 0.33 -3.81 0.00 0.00 -0.65 0.00 0.00 35.03 30.90 1ucx n LYS 233 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1ucx n GLY 234 N 1.14 2.40 0.49 2.58 0.00 -1.26 -4.84 105.19 105.70 1ucx n GLY 234 Ca 0.00 -1.75 0.31 0.00 0.00 0.00 0.00 46.02 44.58 1ucx n GLY 234 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucx h ALA 235 N -0.70 2.91 -3.42 4.61 0.00 -1.92 -3.30 119.26 117.43 1ucx h ALA 235 Ca 0.00 -0.03 -0.66 0.00 0.00 0.00 0.00 54.91 54.22 1ucx h ALA 235 Cb 0.00 0.07 -0.40 0.00 0.00 0.00 0.00 17.79 17.47 1ucx h ALA 235 CO 0.00 -1.24 -0.61 0.42 0.00 0.00 0.00 179.25 177.82 1ucx s ILE 236 N -4.92 2.69 0.34 0.00 1.01 -1.26 -1.63 121.20 117.44 1ucx s ILE 236 Ca -0.05 -2.97 -0.13 0.00 0.00 0.00 0.00 60.65 57.51 1ucx s ILE 236 Cb 0.21 -2.88 -0.08 0.00 0.01 0.00 0.00 42.46 39.73 1ucx s ILE 236 CO 0.76 -0.75 0.73 -0.69 0.00 0.00 0.00 174.94 174.98 1ucx s VAL 237 N 0.11 4.75 -0.18 2.92 1.01 -0.89 -0.39 120.40 127.73 1ucx s VAL 237 Ca 0.15 0.76 -0.13 0.00 0.00 0.00 0.00 61.98 62.77 1ucx s VAL 237 Cb -0.23 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 1ucx s VAL 237 CO -0.03 -0.30 0.25 0.42 0.00 0.00 0.00 175.10 175.45 1ucx s THR 238 N -2.11 5.33 -0.77 3.92 -4.23 -1.26 -1.05 115.64 115.46 1ucx s THR 238 Ca 0.52 0.45 -0.20 0.00 -1.18 0.00 0.00 61.69 61.28 1ucx s THR 238 Cb -0.10 -3.59 0.10 0.00 1.34 0.00 0.00 72.50 70.25 1ucx s THR 238 CO 0.23 0.39 1.01 -0.69 -0.54 0.00 0.00 174.62 175.01 1ucx s VAL 239 N 0.56 4.56 0.00 2.29 1.01 0.53 -4.98 120.40 124.38 1ucx s VAL 239 Ca 0.14 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1ucx s VAL 239 Cb -0.13 -4.71 0.00 0.00 0.00 0.00 0.00 36.38 31.55 1ucx s VAL 239 CO 0.03 -1.44 0.35 1.17 0.00 0.00 0.00 175.10 175.20 1ucx n LYS 240 N 7.03 0.00 -0.03 2.72 4.81 -1.26 -1.87 118.16 129.56 1ucx n LYS 240 Ca 0.08 0.35 -0.13 0.00 -0.87 0.00 0.00 58.31 57.74 1ucx n LYS 240 Cb 0.47 -0.54 -0.11 0.00 0.02 0.00 0.00 35.03 34.87 1ucx n LYS 240 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 1ucx h GLY 241 N 0.00 -0.03 0.00 3.14 0.00 -1.96 -3.50 103.07 100.71 1ucx h GLY 241 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1ucx h GLY 241 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 176.54 177.14 1ucx n GLY 242 N 0.91 4.46 3.59 4.60 0.00 -0.78 -5.04 105.19 112.93 1ucx n GLY 242 Ca -0.09 -1.28 -0.42 0.00 0.00 0.00 0.00 46.02 44.23 1ucx n GLY 242 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ucx s LEU 243 N 0.00 3.48 -0.01 0.99 2.96 -1.26 -4.85 118.68 119.99 1ucx s LEU 243 Ca 0.00 0.67 0.00 0.00 -0.22 0.00 0.00 54.13 54.58 1ucx s LEU 243 Cb 0.00 -3.26 0.02 0.00 0.50 0.00 0.00 46.19 43.45 1ucx s LEU 243 CO 0.00 -1.68 0.68 -0.24 -1.32 0.00 0.00 176.35 173.79 1ucx n SER 244 N 9.74 1.68 -4.63 3.68 2.88 -1.26 -4.78 113.62 120.94 1ucx n SER 244 Ca 0.17 -2.03 -0.43 0.00 -1.33 0.00 0.00 58.87 55.25 1ucx n SER 244 Cb 0.49 -0.51 -0.02 0.00 -0.75 0.00 0.00 64.21 63.42 1ucx n SER 244 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1ucx s VAL 245 N -0.76 4.39 0.23 2.46 1.01 -1.26 -4.97 120.40 121.50 1ucx s VAL 245 Ca 0.01 1.55 -0.18 0.00 0.00 0.00 0.00 61.98 63.37 1ucx s VAL 245 Cb 0.01 -4.46 -0.12 0.00 0.00 0.00 0.00 36.38 31.81 1ucx s VAL 245 CO 0.00 -0.65 0.21 0.00 0.00 0.00 0.00 175.10 174.66 1ucx n ILE 246 N 6.20 0.93 -2.93 2.22 0.13 -1.26 -4.92 119.36 119.74 1ucx n ILE 246 Ca 0.12 -0.37 -0.42 0.00 -1.10 0.00 0.00 62.75 60.98 1ucx n ILE 246 Cb 0.48 0.00 -0.05 0.00 -0.84 0.00 0.00 39.64 39.23 1ucx n ILE 246 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 1ucx s LYS 247 N -0.73 3.82 0.00 9.51 2.20 -1.26 -5.12 119.74 128.16 1ucx s LYS 247 Ca 0.45 0.43 0.00 0.00 -0.36 0.00 0.00 55.97 56.49 1ucx s LYS 247 Cb -0.57 -3.79 0.00 0.00 -1.51 0.00 0.00 37.83 31.97 1ucx s LYS 247 CO 0.44 -0.82 0.00 -0.35 -0.36 0.00 0.00 175.35 174.25 1ucx n PRO 248 N 6.43 0.00 -0.25 4.03 -0.04 -1.26 -5.16 135.00 138.74 1ucx n PRO 248 Ca 0.04 0.00 0.23 0.00 -0.04 0.00 0.00 63.50 63.73 1ucx n PRO 248 Cb 0.48 0.00 0.41 0.00 -0.04 0.00 0.00 33.50 34.35 1ucx n PRO 248 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1ucx n ILE 297 N 0.00 -0.23 -0.29 0.52 0.13 -1.26 -5.08 119.36 113.15 1ucx n ILE 297 Ca 0.00 1.27 -0.02 0.00 -1.10 0.00 0.00 62.75 62.90 1ucx n ILE 297 Cb 0.00 -2.07 0.10 0.00 -0.84 0.00 0.00 39.64 36.83 1ucx n ILE 297 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 1ucx n THR 299 N -4.61 0.00 -1.77 0.00 -2.24 -1.26 -4.93 114.28 99.47 1ucx n THR 299 Ca 0.10 -0.01 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 1ucx n THR 299 Cb 0.10 -0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.10 1ucx n THR 299 CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 1ucx s MET 300 N -2.94 4.15 -0.51 -0.78 0.00 -0.87 -4.92 119.30 113.44 1ucx s MET 300 Ca 0.15 2.52 -0.27 0.00 0.00 0.00 0.00 55.69 58.08 1ucx s MET 300 Cb 0.19 -3.63 -0.02 0.00 0.00 0.00 0.00 34.83 31.37 1ucx s MET 300 CO 0.58 -0.82 1.79 0.50 0.00 0.00 0.00 175.02 177.07 1ucx s ARG 301 N 2.81 2.95 -1.04 4.11 3.52 -1.26 -4.89 118.95 125.14 1ucx s ARG 301 Ca 0.79 0.88 -0.02 0.00 -0.13 0.00 0.00 55.73 57.25 1ucx s ARG 301 Cb -0.44 -4.29 0.28 0.00 -1.56 0.00 0.00 34.95 28.94 1ucx s ARG 301 CO 0.35 -2.34 1.98 1.47 -0.81 0.00 0.00 175.30 175.95 1ucx n LEU 302 N 11.55 7.48 -3.64 -0.88 -0.00 -1.26 -4.51 117.00 125.74 1ucx n LEU 302 Ca 0.20 -5.20 -0.08 0.00 -0.00 0.00 0.00 56.01 50.93 1ucx n LEU 302 Cb 0.50 -1.19 -0.07 0.00 -0.00 0.00 0.00 43.42 42.66 1ucx n LEU 302 CO 0.70 2.01 0.60 -0.60 -0.00 0.00 0.00 177.39 180.10 1ucx s ARG 303 N -3.68 0.57 -0.26 1.47 3.52 -1.25 -3.40 118.95 115.91 1ucx s ARG 303 Ca 0.44 0.80 -0.14 0.00 -0.13 0.00 0.00 55.73 56.70 1ucx s ARG 303 Cb 0.22 0.22 0.09 0.00 -1.56 0.00 0.00 34.95 33.91 1ucx s ARG 303 CO -0.16 -0.09 0.63 -1.58 -0.81 0.00 0.00 175.30 173.29 1ucx s HIS 304 N 0.78 -1.04 -0.48 5.12 2.46 -0.73 -4.94 115.29 116.45 1ucx s HIS 304 Ca -0.03 2.02 -0.20 0.00 0.47 0.00 0.00 55.06 57.33 1ucx s HIS 304 Cb -0.05 0.60 0.04 0.00 -0.13 0.00 0.00 32.58 33.05 1ucx s HIS 304 CO -0.09 -0.53 0.65 1.21 -2.47 0.00 0.00 174.74 173.51 1ucx s ASN 305 N 1.87 6.27 -0.00 9.88 3.84 -1.26 -1.41 114.94 134.12 1ucx s ASN 305 Ca -0.09 -0.64 0.21 0.00 0.21 0.00 0.00 52.86 52.55 1ucx s ASN 305 Cb -0.07 -2.31 -0.22 0.00 -0.55 0.00 0.00 41.25 38.10 1ucx s ASN 305 CO -0.18 -0.87 0.84 2.30 -2.79 0.00 0.00 177.10 176.39 1ucx n ILE 306 N 5.75 0.01 0.00 -5.21 -5.35 0.14 -4.76 119.36 109.93 1ucx n ILE 306 Ca -0.04 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.33 1ucx n ILE 306 Cb 0.47 0.75 0.00 0.00 -1.74 0.00 0.00 39.64 39.12 1ucx n ILE 306 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ucx n GLY 307 N 1.45 -1.71 0.29 3.28 0.00 -1.07 -4.69 105.19 102.73 1ucx n GLY 307 Ca 0.02 -1.26 0.15 0.00 0.00 0.00 0.00 46.02 44.93 1ucx n GLY 307 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ucx h GLN 308 N 0.00 0.00 -2.85 1.61 7.50 -1.91 -3.23 115.11 116.22 1ucx h GLN 308 Ca 0.00 0.00 -0.76 0.00 0.50 0.00 0.00 58.65 58.39 1ucx h GLN 308 Cb 0.00 0.00 -0.31 0.00 0.05 0.00 0.00 27.48 27.22 1ucx h GLN 308 CO 0.00 0.03 0.41 2.41 -1.50 0.00 0.00 178.83 180.18 1ucx n THR 309 N -3.80 4.51 -4.18 -0.54 -1.04 -1.26 -4.95 114.28 103.02 1ucx n THR 309 Ca -0.03 -5.69 -0.13 0.00 -2.04 0.00 0.00 64.05 56.16 1ucx n THR 309 Cb 0.12 -2.15 -0.05 0.00 -1.82 0.00 0.00 70.33 66.43 1ucx n THR 309 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1ucx n SER 310 N 1.41 -0.47 -4.10 8.00 2.88 -1.22 -4.91 113.62 115.20 1ucx n SER 310 Ca 0.26 -2.44 -0.34 0.00 -1.33 0.00 0.00 58.87 55.02 1ucx n SER 310 Cb 0.35 1.10 -0.13 0.00 -0.75 0.00 0.00 64.21 64.78 1ucx n SER 310 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1ucx s SER 311 N -2.53 5.03 0.78 -3.46 1.04 -1.26 -5.10 113.70 108.20 1ucx s SER 311 Ca 0.26 -1.88 -0.13 0.00 0.48 0.00 0.00 55.95 54.68 1ucx s SER 311 Cb 0.01 -1.74 0.07 0.00 0.10 0.00 0.00 66.02 64.46 1ucx s SER 311 CO 0.19 -0.43 1.18 -2.16 0.98 0.00 0.00 173.24 172.99 1ucx s PRO 312 N 1.10 1.87 -0.14 4.02 0.04 -1.26 -4.98 135.00 135.65 1ucx s PRO 312 Ca 0.06 1.64 -0.12 0.00 0.04 0.00 0.00 61.00 62.62 1ucx s PRO 312 Cb -0.21 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 1ucx s PRO 312 CO -0.05 -2.01 0.09 -0.44 0.04 0.00 0.00 177.00 174.63 1ucx h ASP 313 N -0.78 0.00 -3.32 6.66 5.19 -1.52 -3.44 116.42 119.20 1ucx h ASP 313 Ca -0.46 -0.25 -0.64 0.00 -0.62 0.00 0.00 57.03 55.06 1ucx h ASP 313 Cb 1.28 0.00 -0.20 0.00 0.18 0.00 0.00 39.33 40.59 1ucx h ASP 313 CO 0.48 0.85 -0.65 -0.63 -3.12 0.00 0.00 179.24 176.17 1ucx s ILE 314 N -2.05 4.04 -0.02 0.35 1.09 -0.96 -4.96 121.20 118.69 1ucx s ILE 314 Ca -0.13 -0.31 0.00 0.00 -1.10 0.00 0.00 60.65 59.10 1ucx s ILE 314 Cb 0.01 -2.76 0.02 0.00 -1.06 0.00 0.00 42.46 38.67 1ucx s ILE 314 CO 0.29 0.51 0.01 -0.47 -0.10 0.00 0.00 174.94 175.18 1ucx s TYR 315 N 0.18 0.13 -0.24 3.97 5.04 -1.26 -0.88 117.35 124.29 1ucx s TYR 315 Ca -0.01 0.07 -0.02 0.00 -2.44 0.00 0.00 57.07 54.66 1ucx s TYR 315 Cb -0.14 -0.26 0.12 0.00 0.35 0.00 0.00 41.96 42.04 1ucx s TYR 315 CO 0.02 -0.09 0.32 1.21 -1.34 0.00 0.00 175.55 175.67 1ucx s ASN 316 N 0.88 0.87 0.35 4.32 3.84 -0.57 -5.03 114.94 119.60 1ucx s ASN 316 Ca -0.08 -0.14 0.25 0.00 0.21 0.00 0.00 52.86 53.10 1ucx s ASN 316 Cb -0.11 0.77 1.27 0.00 -0.55 0.00 0.00 41.25 42.63 1ucx s ASN 316 CO -0.02 -0.33 1.75 1.55 -2.79 0.00 0.00 177.10 177.27 1ucx h PRO 317 N 8.24 0.00 0.00 0.43 0.13 -2.00 0.14 132.00 138.93 1ucx h PRO 317 Ca -0.17 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.92 1ucx h PRO 317 Cb 1.14 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1ucx h PRO 317 CO 0.29 0.00 -1.40 1.04 -0.23 0.00 0.00 178.00 177.70 1ucx n GLN 318 N -2.37 0.63 -0.00 0.86 6.02 -1.26 -4.64 117.38 116.62 1ucx n GLN 318 Ca -0.01 0.05 0.02 0.00 -0.01 0.00 0.00 57.00 57.05 1ucx n GLN 318 Cb 0.09 -1.73 -0.02 0.00 1.02 0.00 0.00 30.24 29.60 1ucx n GLN 318 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ucx n ALA 319 N -2.26 2.29 0.00 -1.58 0.00 -0.30 -4.36 120.51 114.30 1ucx n ALA 319 Ca -0.04 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1ucx n ALA 319 Cb 0.63 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1ucx n ALA 319 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ucx n GLY 320 N 1.62 0.24 3.47 0.00 0.00 0.33 -1.44 105.19 109.40 1ucx n GLY 320 Ca 0.00 -2.13 -0.15 0.00 0.00 0.00 0.00 46.02 43.74 1ucx n GLY 320 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ucx s SER 321 N -4.00 -0.61 0.10 1.61 1.04 -0.43 -1.51 113.70 109.90 1ucx s SER 321 Ca 0.00 0.33 0.08 0.00 0.48 0.00 0.00 55.95 56.84 1ucx s SER 321 Cb 0.00 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.66 1ucx s SER 321 CO 0.00 -0.81 -0.21 -0.69 0.98 0.00 0.00 173.24 172.51 1ucx s VAL 322 N -2.58 1.72 -0.01 5.02 1.01 -0.06 -1.37 120.40 124.13 1ucx s VAL 322 Ca -0.04 -1.55 0.00 0.00 0.00 0.00 0.00 61.98 60.39 1ucx s VAL 322 Cb -0.01 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.83 1ucx s VAL 322 CO -0.03 -0.06 0.02 -0.89 0.00 0.00 0.00 175.10 174.15 1ucx s THR 323 N -1.16 -0.04 -0.06 3.92 2.01 0.16 -1.15 115.64 119.32 1ucx s THR 323 Ca 0.07 0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.24 1ucx s THR 323 Cb -0.10 -0.06 0.01 0.00 0.01 0.00 0.00 72.50 72.36 1ucx s THR 323 CO 0.04 0.06 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.03 1ucx s THR 324 N 0.74 1.05 -0.61 -0.82 2.01 -1.26 -0.83 115.64 115.92 1ucx s THR 324 Ca -0.06 -0.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.45 1ucx s THR 324 Cb -0.09 -0.97 0.16 0.00 0.01 0.00 0.00 72.50 71.61 1ucx s THR 324 CO -0.02 0.34 0.46 0.00 -0.69 0.00 0.00 174.62 174.71 1ucx s ALA 325 N 0.71 3.60 0.53 7.40 0.00 -1.09 -5.01 121.76 127.91 1ucx s ALA 325 Ca -0.14 -3.05 0.00 0.00 0.00 0.00 0.00 51.96 48.77 1ucx s ALA 325 Cb -0.16 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.12 1ucx s ALA 325 CO 0.03 -2.07 0.00 0.25 0.00 0.00 0.00 175.76 173.97 1ucx n THR 326 N 3.99 0.00 1.40 0.00 -2.24 -1.26 -3.62 114.28 112.56 1ucx n THR 326 Ca 0.05 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.97 1ucx n THR 326 Cb 0.41 -1.53 0.57 0.00 -2.10 0.00 0.00 70.33 67.67 1ucx n THR 326 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1ucx n SER 327 N -2.64 0.64 -0.24 3.42 3.41 0.37 -3.28 113.62 115.30 1ucx n SER 327 Ca 0.00 -0.72 -0.04 0.00 -0.26 0.00 0.00 58.87 57.85 1ucx n SER 327 Cb 0.00 -0.02 0.13 0.00 -0.26 0.00 0.00 64.21 64.06 1ucx n SER 327 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1ucx h LEU 328 N 0.80 0.97 0.00 1.04 7.12 -1.94 -3.30 115.31 120.01 1ucx h LEU 328 Ca 0.00 -0.13 -0.07 0.00 0.13 0.00 0.00 57.88 57.81 1ucx h LEU 328 Cb 0.38 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 40.25 1ucx h LEU 328 CO 0.00 0.85 -1.76 -0.90 -0.13 0.00 0.00 178.44 176.50 1ucx n ASP 329 N -4.30 1.56 -3.66 1.25 5.68 -1.25 -4.77 116.55 111.06 1ucx n ASP 329 Ca 0.07 0.00 -0.29 0.00 -0.50 0.00 0.00 54.79 54.06 1ucx n ASP 329 Cb 0.16 1.45 -0.13 0.00 -1.14 0.00 0.00 41.12 41.46 1ucx n ASP 329 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1ucx s PHE 330 N -2.84 1.74 -0.08 2.11 5.36 -1.21 -5.02 117.98 118.04 1ucx s PHE 330 Ca -0.06 -2.28 0.30 0.00 -0.96 0.00 0.00 56.93 53.94 1ucx s PHE 330 Cb 0.08 -1.69 1.07 0.00 -0.34 0.00 0.00 43.02 42.14 1ucx s PHE 330 CO 0.61 -0.79 1.87 -1.00 -1.46 0.00 0.00 175.22 174.45 1ucx h PRO 331 N 6.75 0.00 0.00 10.12 0.13 -1.86 -2.04 132.00 145.11 1ucx h PRO 331 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1ucx h PRO 331 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1ucx h PRO 331 CO 0.44 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.21 1ucx n ALA 332 N -2.07 1.57 0.27 -0.56 0.00 -1.26 -2.44 120.51 116.02 1ucx n ALA 332 Ca 0.02 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.55 1ucx n ALA 332 Cb 0.36 -1.20 0.32 0.00 0.00 0.00 0.00 19.45 18.94 1ucx n ALA 332 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ucx h LEU 333 N 0.00 0.00 -0.06 0.00 5.85 -1.70 -2.89 115.31 116.51 1ucx h LEU 333 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ucx h LEU 333 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1ucx h LEU 333 CO 0.00 0.00 0.00 -1.54 -0.34 0.00 0.00 178.44 176.56 1ucx n SER 334 N -3.00 0.21 0.10 1.25 3.41 -1.02 -0.70 113.62 113.86 1ucx n SER 334 Ca 0.03 0.53 -0.18 0.00 -0.26 0.00 0.00 58.87 58.99 1ucx n SER 334 Cb 0.46 -0.58 -0.12 0.00 -0.26 0.00 0.00 64.21 63.70 1ucx n SER 334 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 1ucx h TRP 335 N 0.00 0.67 0.19 7.33 4.06 -1.69 -3.36 115.95 123.14 1ucx h TRP 335 Ca 0.00 -0.45 -0.31 0.00 2.06 0.00 0.00 58.89 60.19 1ucx h TRP 335 Cb 0.47 -0.04 0.02 0.00 -1.00 0.00 0.00 29.16 28.61 1ucx h TRP 335 CO 0.00 1.33 -1.41 -0.07 -3.56 0.00 0.00 178.44 174.73 1ucx h LEU 336 N 0.14 0.63 0.95 -4.49 3.38 -1.41 -3.47 115.31 111.04 1ucx h LEU 336 Ca -0.15 -0.70 -0.23 0.00 0.09 0.00 0.00 57.88 56.88 1ucx h LEU 336 Cb 1.93 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 42.49 1ucx h LEU 336 CO 0.21 1.55 -0.33 -1.14 0.09 0.00 0.00 178.44 178.83 1ucx n ARG 337 N -3.61 -1.97 -4.21 1.13 3.00 0.12 -4.76 116.66 106.35 1ucx n ARG 337 Ca -0.14 0.55 -0.20 0.00 -0.00 0.00 0.00 57.85 58.06 1ucx n ARG 337 Cb 1.07 -4.65 -0.12 0.00 0.00 0.00 0.00 32.46 28.76 1ucx n ARG 337 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1ucx s LEU 338 N -3.76 2.28 0.28 6.15 1.43 -1.24 -2.82 118.68 121.01 1ucx s LEU 338 Ca 0.10 -0.63 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1ucx s LEU 338 Cb -0.04 -0.61 -0.06 0.00 0.03 0.00 0.00 46.19 45.51 1ucx s LEU 338 CO 0.12 -0.04 0.05 -0.55 0.23 0.00 0.00 176.35 176.16 1ucx s SER 339 N -1.75 1.99 0.06 2.29 0.15 -0.77 -4.28 113.70 111.39 1ucx s SER 339 Ca 0.00 -1.33 -0.10 0.00 0.70 0.00 0.00 55.95 55.22 1ucx s SER 339 Cb -0.10 -0.01 0.01 0.00 -1.71 0.00 0.00 66.02 64.21 1ucx s SER 339 CO 0.03 -0.60 0.22 0.00 1.20 0.00 0.00 173.24 174.08 1ucx s ALA 340 N -3.42 -0.37 -0.07 5.45 0.00 -1.24 -1.98 121.76 120.13 1ucx s ALA 340 Ca 0.34 -0.36 -0.06 0.00 0.00 0.00 0.00 51.96 51.88 1ucx s ALA 340 Cb 0.08 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.60 1ucx s ALA 340 CO 0.13 -0.44 0.18 -2.00 0.00 0.00 0.00 175.76 173.64 1ucx s GLU 341 N -3.12 0.20 -0.06 0.00 2.12 -0.25 -2.68 118.70 114.92 1ucx s GLU 341 Ca -0.01 0.27 0.04 0.00 0.36 0.00 0.00 54.97 55.63 1ucx s GLU 341 Cb 0.01 0.08 -0.02 0.00 0.26 0.00 0.00 34.13 34.46 1ucx s GLU 341 CO -0.07 -0.04 -0.19 0.12 -0.54 0.00 0.00 175.26 174.54 1ucx s PHE 342 N 0.21 2.59 0.03 5.30 5.36 -0.01 0.28 117.98 131.73 1ucx s PHE 342 Ca -0.01 -0.43 0.01 0.00 -0.96 0.00 0.00 56.93 55.54 1ucx s PHE 342 Cb -0.02 -1.63 -0.02 0.00 -0.34 0.00 0.00 43.02 41.00 1ucx s PHE 342 CO -0.01 -0.02 -0.05 0.20 -1.46 0.00 0.00 175.22 173.89 1ucx s GLY 343 N -0.40 0.33 -0.35 13.12 0.00 -0.87 -0.66 107.32 118.50 1ucx s GLY 343 Ca 0.04 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.17 1ucx s GLY 343 CO 0.02 -0.65 0.32 -0.45 0.00 0.00 0.00 173.10 172.34 1ucx s SER 344 N -1.34 1.63 -0.02 1.64 0.15 -0.47 -1.31 113.70 113.99 1ucx s SER 344 Ca -0.12 -1.47 -0.22 0.00 0.70 0.00 0.00 55.95 54.85 1ucx s SER 344 Cb -0.09 0.38 -0.05 0.00 -1.71 0.00 0.00 66.02 64.55 1ucx s SER 344 CO -0.00 -0.30 0.66 -0.76 1.20 0.00 0.00 173.24 174.03 1ucx s LEU 345 N 1.62 4.39 0.75 3.45 1.43 -0.79 -1.31 118.68 128.22 1ucx s LEU 345 Ca 0.15 1.22 -0.11 0.00 -1.03 0.00 0.00 54.13 54.35 1ucx s LEU 345 Cb -0.16 -3.03 0.05 0.00 0.03 0.00 0.00 46.19 43.08 1ucx s LEU 345 CO -0.11 0.01 1.09 -0.13 0.23 0.00 0.00 176.35 177.45 1ucx s ARG 346 N 0.17 2.34 0.21 1.70 1.81 -0.52 -2.15 118.95 122.51 1ucx s ARG 346 Ca 0.34 1.21 -0.32 0.00 -1.72 0.00 0.00 55.73 55.24 1ucx s ARG 346 Cb -0.18 -1.91 -0.12 0.00 -0.45 0.00 0.00 34.95 32.29 1ucx s ARG 346 CO 0.18 -1.58 1.73 0.21 -0.68 0.00 0.00 175.30 175.16 1ucx s LYS 347 N -4.76 4.12 0.00 3.54 2.20 -0.73 -1.22 119.74 122.90 1ucx s LYS 347 Ca 0.62 2.61 0.00 0.00 -0.36 0.00 0.00 55.97 58.85 1ucx s LYS 347 Cb -0.18 -3.08 0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1ucx s LYS 347 CO 0.53 -0.76 0.00 0.09 -0.36 0.00 0.00 175.35 174.86 1ucx n ASN 348 N 4.00 -4.42 -4.86 1.43 5.03 0.69 -4.78 115.26 112.36 1ucx n ASN 348 Ca 0.16 0.00 -0.31 0.00 0.87 0.00 0.00 54.58 55.30 1ucx n ASN 348 Cb 0.35 -2.40 -0.04 0.00 -1.02 0.00 0.00 39.78 36.68 1ucx n ASN 348 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1ucx s ALA 349 N -1.41 3.27 0.05 5.41 0.00 -0.35 -4.20 121.76 124.52 1ucx s ALA 349 Ca 0.00 -0.05 0.07 0.00 0.00 0.00 0.00 51.96 51.97 1ucx s ALA 349 Cb 0.00 -2.83 -0.03 0.00 0.00 0.00 0.00 23.12 20.27 1ucx s ALA 349 CO 0.00 0.00 -0.18 1.41 0.00 0.00 0.00 175.76 176.99 1ucx s MET 350 N -3.73 1.18 -0.23 0.00 0.00 -0.71 -1.25 119.30 114.57 1ucx s MET 350 Ca 0.54 -0.91 -0.13 0.00 0.00 0.00 0.00 55.69 55.19 1ucx s MET 350 Cb -0.10 -1.28 -0.05 0.00 0.00 0.00 0.00 34.83 33.40 1ucx s MET 350 CO 0.28 0.32 0.25 -0.59 0.00 0.00 0.00 175.02 175.29 1ucx s PHE 351 N -0.88 3.32 0.66 4.11 -0.12 -0.75 -1.43 117.98 122.89 1ucx s PHE 351 Ca 0.05 0.36 -0.17 0.00 -0.05 0.00 0.00 56.93 57.12 1ucx s PHE 351 Cb -0.09 -2.38 -0.04 0.00 -0.63 0.00 0.00 43.02 39.88 1ucx s PHE 351 CO 0.02 0.00 0.77 1.33 -0.05 0.00 0.00 175.22 177.29 1ucx n VAL 352 N 4.43 2.75 -1.67 -2.49 0.24 -1.07 -2.58 118.33 117.95 1ucx n VAL 352 Ca -0.12 -0.44 -0.53 0.00 -2.04 0.00 0.00 64.34 61.21 1ucx n VAL 352 Cb 0.52 -0.95 -0.06 0.00 -1.47 0.00 0.00 33.84 31.88 1ucx n VAL 352 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1ucx n PRO 353 N -1.02 1.47 -3.73 7.34 -0.04 -1.25 -4.63 135.00 133.15 1ucx n PRO 353 Ca 0.12 0.53 -0.11 0.00 -0.04 0.00 0.00 63.50 64.01 1ucx n PRO 353 Cb 0.49 -2.25 -0.07 0.00 -0.04 0.00 0.00 33.50 31.63 1ucx n PRO 353 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1ucx s HIS 354 N 2.45 -0.12 0.31 0.54 -3.43 -0.34 -0.76 115.29 113.94 1ucx s HIS 354 Ca 0.91 -0.08 0.06 0.00 -0.80 0.00 0.00 55.06 55.15 1ucx s HIS 354 Cb -0.92 0.13 -0.06 0.00 -1.43 0.00 0.00 32.58 30.30 1ucx s HIS 354 CO 0.54 -0.56 -0.01 1.52 -2.00 0.00 0.00 174.74 174.23 1ucx s TYR 355 N -2.99 2.03 -0.28 0.38 -0.85 -0.64 -0.80 117.35 114.21 1ucx s TYR 355 Ca -0.02 -0.78 -0.08 0.00 -0.52 0.00 0.00 57.07 55.67 1ucx s TYR 355 Cb 0.01 -1.25 -0.02 0.00 0.38 0.00 0.00 41.96 41.07 1ucx s TYR 355 CO -0.06 0.22 0.11 -0.80 -1.52 0.00 0.00 175.55 173.49 1ucx s ASN 356 N -3.49 5.34 0.29 -0.18 0.01 -1.25 -1.11 114.94 114.55 1ucx s ASN 356 Ca 0.32 -0.34 -0.02 0.00 -0.71 0.00 0.00 52.86 52.11 1ucx s ASN 356 Cb 0.06 -1.96 0.42 0.00 0.41 0.00 0.00 41.25 40.19 1ucx s ASN 356 CO 0.14 -0.10 1.97 -0.07 -1.51 0.00 0.00 177.10 177.52 1ucx h LEU 357 N 8.28 0.97 -2.86 0.60 4.07 -1.12 -3.36 115.31 121.90 1ucx h LEU 357 Ca -0.35 -0.02 -0.10 0.00 0.08 0.00 0.00 57.88 57.48 1ucx h LEU 357 Cb 1.16 -0.24 -0.21 0.00 1.08 0.00 0.00 40.66 42.45 1ucx h LEU 357 CO 0.59 0.70 -0.75 -0.46 -1.08 0.00 0.00 178.44 177.44 1ucx n ASN 358 N -4.41 1.14 -3.62 -0.43 0.23 -1.26 -4.87 115.26 102.04 1ucx n ASN 358 Ca 0.10 -2.57 -0.11 0.00 -0.53 0.00 0.00 54.58 51.47 1ucx n ASN 358 Cb 0.02 -0.35 -0.04 0.00 -2.08 0.00 0.00 39.78 37.33 1ucx n ASN 358 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ucx s ALA 359 N -1.04 -0.98 0.03 -2.53 0.00 -1.26 -4.68 121.76 111.30 1ucx s ALA 359 Ca 0.30 -0.01 -0.03 0.00 0.00 0.00 0.00 51.96 52.22 1ucx s ALA 359 Cb 0.32 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 24.11 1ucx s ALA 359 CO -0.11 -0.66 0.23 -0.80 0.00 0.00 0.00 175.76 174.43 1ucx s ASN 360 N -2.80 6.41 -0.02 0.00 0.01 -1.26 -4.32 114.94 112.96 1ucx s ASN 360 Ca 0.03 0.40 0.06 0.00 -0.71 0.00 0.00 52.86 52.63 1ucx s ASN 360 Cb 0.02 -2.02 -0.03 0.00 0.41 0.00 0.00 41.25 39.63 1ucx s ASN 360 CO -0.12 0.21 -0.18 -0.44 -1.51 0.00 0.00 177.10 175.06 1ucx s SER 361 N -2.11 3.76 -0.33 -1.22 0.01 -0.97 -0.32 113.70 112.52 1ucx s SER 361 Ca 0.31 -0.32 0.02 0.00 1.31 0.00 0.00 55.95 57.27 1ucx s SER 361 Cb -0.13 -0.67 0.09 0.00 0.21 0.00 0.00 66.02 65.51 1ucx s SER 361 CO 0.21 0.31 0.04 -0.63 0.41 0.00 0.00 173.24 173.59 1ucx s ILE 362 N -0.77 2.52 -0.54 1.44 1.09 0.23 -2.39 121.20 122.78 1ucx s ILE 362 Ca 0.12 -2.03 -0.19 0.00 -1.10 0.00 0.00 60.65 57.45 1ucx s ILE 362 Cb -0.10 -2.71 0.07 0.00 -1.06 0.00 0.00 42.46 38.66 1ucx s ILE 362 CO 0.02 -0.43 0.67 -0.63 -0.10 0.00 0.00 174.94 174.46 1ucx s ILE 363 N 1.03 4.82 -0.26 2.92 1.01 -0.64 -1.51 121.20 128.58 1ucx s ILE 363 Ca 0.04 -0.64 -0.16 0.00 0.00 0.00 0.00 60.65 59.90 1ucx s ILE 363 Cb -0.20 -4.38 -0.04 0.00 0.01 0.00 0.00 42.46 37.85 1ucx s ILE 363 CO -0.06 -0.95 0.40 -0.47 0.00 0.00 0.00 174.94 173.87 1ucx s TYR 364 N 2.73 3.27 -0.23 3.97 5.04 -0.60 -1.13 117.35 130.41 1ucx s TYR 364 Ca 0.14 0.48 -0.24 0.00 -2.44 0.00 0.00 57.07 55.02 1ucx s TYR 364 Cb -0.21 -2.59 -0.01 0.00 0.35 0.00 0.00 41.96 39.50 1ucx s TYR 364 CO 0.10 -0.20 0.77 0.00 -1.34 0.00 0.00 175.55 174.88 1ucx s ALA 365 N 1.99 3.61 -0.11 3.97 0.00 -0.60 -1.33 121.76 129.29 1ucx s ALA 365 Ca 0.17 -0.18 -0.25 0.00 0.00 0.00 0.00 51.96 51.70 1ucx s ALA 365 Cb -0.16 -3.20 -0.27 0.00 0.00 0.00 0.00 23.12 19.49 1ucx s ALA 365 CO 0.09 -0.83 0.74 -0.07 0.00 0.00 0.00 175.76 175.70 1ucx h LEU 366 N 8.91 0.17 -8.10 0.00 3.38 -0.49 -0.92 115.31 118.27 1ucx h LEU 366 Ca -0.25 -0.93 -0.26 0.00 0.09 0.00 0.00 57.88 56.53 1ucx h LEU 366 Cb 1.11 -0.06 -0.22 0.00 0.09 0.00 0.00 40.66 41.58 1ucx h LEU 366 CO 0.84 1.21 -0.73 0.21 0.09 0.00 0.00 178.44 180.06 1ucx s ASN 367 N -6.57 0.69 0.40 -0.43 2.47 -0.10 -4.62 114.94 106.78 1ucx s ASN 367 Ca -0.18 -0.49 0.00 0.00 0.42 0.00 0.00 52.86 52.61 1ucx s ASN 367 Cb -0.00 0.04 0.00 0.00 -1.45 0.00 0.00 41.25 39.83 1ucx s ASN 367 CO 0.73 -0.19 0.00 0.61 -3.72 0.00 0.00 177.10 174.53 1ucx n GLY 368 N 1.66 -0.69 3.07 1.21 0.00 -1.26 -0.32 105.19 108.86 1ucx n GLY 368 Ca -0.22 -1.14 -0.09 0.00 0.00 0.00 0.00 46.02 44.58 1ucx n GLY 368 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ucx s ARG 369 N 0.00 0.52 -0.05 1.61 3.52 -1.26 -1.65 118.95 121.64 1ucx s ARG 369 Ca 0.00 -0.84 -0.14 0.00 -0.13 0.00 0.00 55.73 54.62 1ucx s ARG 369 Cb 0.00 0.19 0.03 0.00 -1.56 0.00 0.00 34.95 33.61 1ucx s ARG 369 CO 0.00 -0.11 0.33 0.00 -0.81 0.00 0.00 175.30 174.71 1ucx s ALA 370 N -2.65 -0.83 -0.58 6.12 0.00 -0.63 -1.28 121.76 121.92 1ucx s ALA 370 Ca -0.05 0.55 -0.19 0.00 0.00 0.00 0.00 51.96 52.27 1ucx s ALA 370 Cb -0.01 -0.13 0.09 0.00 0.00 0.00 0.00 23.12 23.07 1ucx s ALA 370 CO -0.05 -0.23 0.69 -1.17 0.00 0.00 0.00 175.76 175.00 1ucx s LEU 371 N -0.84 5.28 0.17 0.00 0.20 0.09 -1.29 118.68 122.28 1ucx s LEU 371 Ca -0.09 -1.32 -0.02 0.00 0.69 0.00 0.00 54.13 53.39 1ucx s LEU 371 Cb -0.04 -2.33 -0.05 0.00 -0.43 0.00 0.00 46.19 43.34 1ucx s LEU 371 CO 0.03 -1.08 0.37 -0.63 -0.29 0.00 0.00 176.35 174.76 1ucx s ILE 372 N 2.70 5.20 -0.10 6.68 1.01 -0.45 -1.12 121.20 135.13 1ucx s ILE 372 Ca 0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 60.65 60.54 1ucx s ILE 372 Cb -0.23 -3.68 0.05 0.00 0.01 0.00 0.00 42.46 38.61 1ucx s ILE 372 CO 0.07 -0.07 0.11 -1.10 0.00 0.00 0.00 174.94 173.96 1ucx s GLN 373 N -3.00 0.01 -0.04 2.79 -0.21 -0.03 -2.54 119.66 116.64 1ucx s GLN 373 Ca 0.39 0.33 0.06 0.00 0.02 0.00 0.00 55.36 56.16 1ucx s GLN 373 Cb -0.12 -0.76 -0.01 0.00 1.00 0.00 0.00 33.01 33.12 1ucx s GLN 373 CO 0.27 -0.42 -0.22 0.54 -2.12 0.00 0.00 175.29 173.34 1ucx s VAL 374 N 2.22 1.76 0.16 1.09 0.11 -0.88 -2.24 120.40 122.62 1ucx s VAL 374 Ca 0.04 -0.92 0.10 0.00 -2.93 0.00 0.00 61.98 58.27 1ucx s VAL 374 Cb -0.13 -1.48 -0.04 0.00 -1.53 0.00 0.00 36.38 33.20 1ucx s VAL 374 CO -0.06 0.50 -0.23 0.54 -3.33 0.00 0.00 175.10 172.52 1ucx s VAL 375 N -0.27 2.11 0.00 2.04 0.11 -0.92 -1.49 120.40 121.98 1ucx s VAL 375 Ca 0.02 -1.87 0.00 0.00 -2.93 0.00 0.00 61.98 57.20 1ucx s VAL 375 Cb -0.11 -1.94 0.00 0.00 -1.53 0.00 0.00 36.38 32.80 1ucx s VAL 375 CO 0.01 -0.11 0.00 -0.46 -3.33 0.00 0.00 175.10 171.21 1ucx n ASN 376 N 0.54 0.12 0.12 3.54 0.23 -0.92 -2.00 115.26 116.88 1ucx n ASN 376 Ca -0.15 0.00 -0.02 0.00 -0.53 0.00 0.00 54.58 53.88 1ucx n ASN 376 Cb 0.55 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.31 1ucx n ASN 376 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ucx n ASN 378 N -3.49 4.14 -1.52 0.00 5.03 -1.26 -4.92 115.26 113.24 1ucx n ASN 378 Ca -0.00 -2.97 -0.17 0.00 0.87 0.00 0.00 54.58 52.31 1ucx n ASN 378 Cb 0.74 -0.70 -0.05 0.00 -1.02 0.00 0.00 39.78 38.75 1ucx n ASN 378 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ucx n GLY 379 N -0.12 0.93 3.73 7.41 0.00 -1.24 -4.98 105.19 110.91 1ucx n GLY 379 Ca 0.33 -0.21 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1ucx n GLY 379 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ucx s GLU 380 N -3.95 4.25 -1.01 1.61 2.02 -1.26 -4.87 118.70 115.49 1ucx s GLU 380 Ca 0.00 0.06 -0.21 0.00 0.02 0.00 0.00 54.97 54.83 1ucx s GLU 380 Cb 0.00 -3.43 0.08 0.00 0.10 0.00 0.00 34.13 30.88 1ucx s GLU 380 CO 0.00 0.24 1.37 0.50 0.02 0.00 0.00 175.26 177.39 1ucx s ARG 381 N 0.48 3.62 0.30 1.61 3.52 -1.26 -2.15 118.95 125.06 1ucx s ARG 381 Ca 0.15 -1.36 0.25 0.00 -0.13 0.00 0.00 55.73 54.64 1ucx s ARG 381 Cb -0.13 -5.24 1.05 0.00 -1.56 0.00 0.00 34.95 29.07 1ucx s ARG 381 CO 0.03 -2.08 1.74 -0.39 -0.81 0.00 0.00 175.30 173.79 1ucx h VAL 382 N 6.44 0.00 -2.54 7.11 -1.51 -1.56 -3.42 116.25 120.76 1ucx h VAL 382 Ca 0.20 -0.25 -0.10 0.00 -1.23 0.00 0.00 66.70 65.33 1ucx h VAL 382 Cb 1.01 0.99 -0.26 0.00 -2.13 0.00 0.00 31.29 30.89 1ucx h VAL 382 CO 1.34 0.00 -0.30 0.12 -1.23 0.00 0.00 177.57 177.50 1ucx s PHE 383 N -3.37 -0.71 -0.38 5.19 5.36 -1.15 -1.73 117.98 121.19 1ucx s PHE 383 Ca 0.03 1.44 0.02 0.00 -0.96 0.00 0.00 56.93 57.47 1ucx s PHE 383 Cb 0.09 0.31 0.15 0.00 -0.34 0.00 0.00 43.02 43.24 1ucx s PHE 383 CO 0.40 -0.41 0.29 0.34 -1.46 0.00 0.00 175.22 174.38 1ucx s ASP 384 N 1.84 2.08 0.00 6.13 2.15 -1.26 -2.06 116.67 125.55 1ucx s ASP 384 Ca -0.07 -2.51 0.00 0.00 0.43 0.00 0.00 52.55 50.40 1ucx s ASP 384 Cb -0.09 -0.29 0.00 0.00 -0.30 0.00 0.00 42.92 42.23 1ucx s ASP 384 CO -0.13 -0.24 0.00 0.61 -0.17 0.00 0.00 175.17 175.23 1ucx n GLY 385 N 3.52 2.62 3.11 2.66 0.00 -1.05 -5.04 105.19 111.01 1ucx n GLY 385 Ca 0.20 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.73 1ucx n GLY 385 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ucx s GLU 386 N 3.28 1.37 -0.29 1.61 2.02 -1.26 -1.34 118.70 124.09 1ucx s GLU 386 Ca 0.00 -0.53 -0.05 0.00 0.02 0.00 0.00 54.97 54.41 1ucx s GLU 386 Cb 0.00 -1.27 0.02 0.00 0.10 0.00 0.00 34.13 32.99 1ucx s GLU 386 CO 0.00 0.27 0.04 -1.17 0.02 0.00 0.00 175.26 174.42 1ucx s LEU 387 N -0.15 3.80 0.43 1.80 2.96 -0.41 -4.82 118.68 122.29 1ucx s LEU 387 Ca 0.02 -0.92 0.08 0.00 -0.22 0.00 0.00 54.13 53.08 1ucx s LEU 387 Cb -0.08 -1.81 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 1ucx s LEU 387 CO 0.00 -0.22 0.36 0.00 -1.32 0.00 0.00 176.35 175.18 1ucx s GLN 388 N 1.41 2.47 0.18 1.98 -2.07 -1.26 -1.60 119.66 120.77 1ucx s GLN 388 Ca 0.00 -1.61 -0.24 0.00 -1.82 0.00 0.00 55.36 51.69 1ucx s GLN 388 Cb -0.18 -2.31 -0.15 0.00 -1.09 0.00 0.00 33.01 29.28 1ucx s GLN 388 CO 0.00 -0.22 0.44 0.39 -1.32 0.00 0.00 175.29 174.59 1ucx n GLU 389 N -1.53 0.00 -1.35 9.60 1.02 -0.66 -2.47 120.64 125.26 1ucx n GLU 389 Ca 0.03 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 1ucx n GLU 389 Cb 0.62 -0.88 -0.05 0.00 -0.02 0.00 0.00 31.44 31.11 1ucx n GLU 389 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ucx n GLY 390 N 1.77 1.23 3.53 0.62 0.00 -0.35 -4.98 105.19 107.01 1ucx n GLY 390 Ca 0.16 -0.18 -0.24 0.00 0.00 0.00 0.00 46.02 45.75 1ucx n GLY 390 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ucx s ARG 391 N -2.89 1.88 0.05 1.61 3.52 -1.03 -4.79 118.95 117.30 1ucx s ARG 391 Ca 0.00 -1.59 0.04 0.00 -0.13 0.00 0.00 55.73 54.05 1ucx s ARG 391 Cb 0.00 -1.93 -0.02 0.00 -1.56 0.00 0.00 34.95 31.44 1ucx s ARG 391 CO 0.00 0.36 -0.12 0.54 -0.81 0.00 0.00 175.30 175.26 1ucx s VAL 392 N -2.29 0.96 -0.08 7.11 0.11 -0.55 -1.55 120.40 124.10 1ucx s VAL 392 Ca 0.29 -1.08 0.00 0.00 -2.93 0.00 0.00 61.98 58.27 1ucx s VAL 392 Cb -0.06 -0.91 0.02 0.00 -1.53 0.00 0.00 36.38 33.90 1ucx s VAL 392 CO 0.16 -0.15 -0.06 -0.22 -3.33 0.00 0.00 175.10 171.50 1ucx s LEU 393 N -1.38 1.17 -0.20 2.54 2.96 -0.28 -0.20 118.68 123.29 1ucx s LEU 393 Ca -0.02 -0.20 -0.17 0.00 -0.22 0.00 0.00 54.13 53.52 1ucx s LEU 393 Cb -0.09 -0.64 -0.04 0.00 0.50 0.00 0.00 46.19 45.93 1ucx s LEU 393 CO 0.01 -0.09 0.43 -0.63 -1.32 0.00 0.00 176.35 174.75 1ucx s ILE 394 N 1.37 5.18 -0.32 6.68 1.01 -1.26 -1.62 121.20 132.23 1ucx s ILE 394 Ca -0.03 0.78 -0.04 0.00 0.00 0.00 0.00 60.65 61.36 1ucx s ILE 394 Cb -0.14 -3.76 0.04 0.00 0.01 0.00 0.00 42.46 38.62 1ucx s ILE 394 CO -0.03 0.24 0.04 -0.69 0.00 0.00 0.00 174.94 174.50 1ucx s VAL 395 N 1.34 3.32 0.00 2.92 1.01 -1.00 -4.98 120.40 123.01 1ucx s VAL 395 Ca 0.21 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 60.92 1ucx s VAL 395 Cb -0.15 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.34 1ucx s VAL 395 CO 0.08 -0.13 0.00 -2.65 0.00 0.00 0.00 175.10 172.40 1ucx n PRO 396 N 4.70 -0.60 0.00 2.72 -0.02 -1.26 -2.30 135.00 138.25 1ucx n PRO 396 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 1ucx n PRO 396 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.92 1ucx n PRO 396 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1ucx n GLN 397 N -1.27 0.00 -0.51 -0.52 7.27 -1.26 -4.02 117.38 117.07 1ucx n GLN 397 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 1ucx n GLN 397 Cb 0.00 -0.75 0.18 0.00 2.41 0.00 0.00 30.24 32.07 1ucx n GLN 397 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1ucx n ASN 398 N -0.43 3.41 -4.77 1.69 5.03 -1.26 -3.93 115.26 115.00 1ucx n ASN 398 Ca 0.00 -2.57 -0.39 0.00 0.87 0.00 0.00 54.58 52.49 1ucx n ASN 398 Cb 0.00 -0.62 -0.02 0.00 -1.02 0.00 0.00 39.78 38.12 1ucx n ASN 398 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1ucx s PHE 399 N -1.84 3.12 -0.01 3.10 0.40 -1.26 -4.85 117.98 116.64 1ucx s PHE 399 Ca 0.28 1.52 -0.19 0.00 -0.60 0.00 0.00 56.93 57.95 1ucx s PHE 399 Cb 0.22 -3.49 -0.05 0.00 0.51 0.00 0.00 43.02 40.20 1ucx s PHE 399 CO 0.07 -1.44 0.53 0.08 0.70 0.00 0.00 175.22 175.17 1ucx s VAL 400 N -1.27 4.96 -0.01 -0.44 1.01 -0.85 -4.37 120.40 119.43 1ucx s VAL 400 Ca 0.52 1.11 0.05 0.00 0.00 0.00 0.00 61.98 63.66 1ucx s VAL 400 Cb -0.34 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.16 1ucx s VAL 400 CO 0.44 0.45 -0.16 -0.69 0.00 0.00 0.00 175.10 175.15 1ucx s VAL 401 N -0.34 1.27 -0.08 2.92 1.01 0.02 -2.17 120.40 123.02 1ucx s VAL 401 Ca 0.28 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.50 1ucx s VAL 401 Cb -0.18 -1.06 0.02 0.00 0.00 0.00 0.00 36.38 35.17 1ucx s VAL 401 CO 0.15 0.36 0.23 0.00 0.00 0.00 0.00 175.10 175.84 1ucx s ALA 402 N -0.35 -0.56 0.02 5.51 0.00 -0.95 -1.20 121.76 124.22 1ucx s ALA 402 Ca 0.06 0.62 0.01 0.00 0.00 0.00 0.00 51.96 52.65 1ucx s ALA 402 Cb -0.06 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 1ucx s ALA 402 CO -0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 175.76 175.59 1ucx s ALA 403 N 0.07 0.37 -0.08 0.00 0.00 -1.06 -0.86 121.76 120.19 1ucx s ALA 403 Ca -0.01 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 51.52 1ucx s ALA 403 Cb -0.02 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.09 1ucx s ALA 403 CO 0.00 -0.00 -0.15 0.50 0.00 0.00 0.00 175.76 176.11 1ucx s ARG 404 N -0.89 2.87 0.19 0.00 3.52 -0.28 -1.81 118.95 122.54 1ucx s ARG 404 Ca -0.06 -0.71 -0.28 0.00 -0.13 0.00 0.00 55.73 54.55 1ucx s ARG 404 Cb -0.06 -2.46 -0.08 0.00 -1.56 0.00 0.00 34.95 30.79 1ucx s ARG 404 CO -0.00 0.43 0.87 0.45 -0.81 0.00 0.00 175.30 176.24 1ucx s SER 405 N -0.24 7.51 -0.06 -2.12 0.15 -0.38 -0.73 113.70 117.83 1ucx s SER 405 Ca 0.01 1.79 0.10 0.00 0.70 0.00 0.00 55.95 58.55 1ucx s SER 405 Cb -0.13 -2.56 0.25 0.00 -1.71 0.00 0.00 66.02 61.87 1ucx s SER 405 CO 0.03 0.14 1.18 0.00 1.20 0.00 0.00 173.24 175.80 1ucx n GLN 406 N 1.76 2.58 -4.15 5.44 6.02 -0.40 -0.22 117.38 128.40 1ucx n GLN 406 Ca -0.03 -2.14 -0.10 0.00 -0.01 0.00 0.00 57.00 54.72 1ucx n GLN 406 Cb 0.48 -1.35 -0.10 0.00 1.02 0.00 0.00 30.24 30.30 1ucx n GLN 406 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1ucx s SER 407 N -1.59 0.76 -0.63 1.08 0.01 -1.23 -4.84 113.70 107.26 1ucx s SER 407 Ca 0.21 -1.08 -0.17 0.00 1.31 0.00 0.00 55.95 56.22 1ucx s SER 407 Cb 0.16 0.18 0.13 0.00 0.21 0.00 0.00 66.02 66.70 1ucx s SER 407 CO 0.07 -0.59 0.65 -0.62 0.41 0.00 0.00 173.24 173.16 1ucx s ASP 408 N -3.03 6.30 -0.08 2.44 -1.08 -1.26 -1.77 116.67 118.19 1ucx s ASP 408 Ca 0.15 -1.81 -0.03 0.00 -0.52 0.00 0.00 52.55 50.34 1ucx s ASP 408 Cb 0.07 -2.25 0.01 0.00 -1.46 0.00 0.00 42.92 39.28 1ucx s ASP 408 CO -0.03 -0.92 0.05 0.59 0.52 0.00 0.00 175.17 175.38 1ucx n ASN 409 N 5.53 -2.46 -4.63 -0.34 4.13 -1.20 -4.95 115.26 111.34 1ucx n ASN 409 Ca -0.06 0.49 -0.43 0.00 1.68 0.00 0.00 54.58 56.26 1ucx n ASN 409 Cb 0.42 -2.51 -0.03 0.00 -1.54 0.00 0.00 39.78 36.12 1ucx n ASN 409 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1ucx s PHE 410 N -0.37 3.17 -0.05 3.10 5.36 -0.91 -4.29 117.98 123.99 1ucx s PHE 410 Ca -0.06 1.02 0.04 0.00 -0.96 0.00 0.00 56.93 56.97 1ucx s PHE 410 Cb 0.00 -3.48 -0.02 0.00 -0.34 0.00 0.00 43.02 39.18 1ucx s PHE 410 CO 0.28 -0.68 -0.18 -1.21 -1.46 0.00 0.00 175.22 171.97 1ucx s GLU 411 N 3.34 2.53 0.14 10.12 2.02 0.57 -1.89 118.70 135.53 1ucx s GLU 411 Ca 0.40 -0.77 0.03 0.00 0.02 0.00 0.00 54.97 54.64 1ucx s GLU 411 Cb -0.13 -2.31 -0.04 0.00 0.10 0.00 0.00 34.13 31.75 1ucx s GLU 411 CO 0.14 0.53 -0.05 1.52 0.02 0.00 0.00 175.26 177.41 1ucx s TYR 412 N -0.49 1.11 -0.04 1.61 -0.85 -0.43 0.28 117.35 118.54 1ucx s TYR 412 Ca 0.06 -0.90 0.06 0.00 -0.52 0.00 0.00 57.07 55.77 1ucx s TYR 412 Cb -0.12 -0.62 -0.02 0.00 0.38 0.00 0.00 41.96 41.59 1ucx s TYR 412 CO 0.01 -0.10 -0.22 0.08 -1.52 0.00 0.00 175.55 173.80 1ucx s VAL 413 N -3.55 2.38 -0.35 -3.49 1.01 -0.44 -2.05 120.40 113.91 1ucx s VAL 413 Ca 0.17 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1ucx s VAL 413 Cb 0.05 -1.87 0.10 0.00 0.00 0.00 0.00 36.38 34.66 1ucx s VAL 413 CO -0.00 0.58 0.09 -0.55 0.00 0.00 0.00 175.10 175.22 1ucx s SER 414 N -0.53 4.40 -0.55 3.32 0.15 0.14 -1.55 113.70 119.08 1ucx s SER 414 Ca 0.07 -2.07 -0.28 0.00 0.70 0.00 0.00 55.95 54.36 1ucx s SER 414 Cb -0.11 -1.32 0.03 0.00 -1.71 0.00 0.00 66.02 62.90 1ucx s SER 414 CO 0.00 -0.37 1.24 -0.36 1.20 0.00 0.00 173.24 174.96 1ucx s PHE 415 N 1.02 2.56 0.24 3.44 0.08 -0.57 -1.09 117.98 123.67 1ucx s PHE 415 Ca 0.11 0.49 -0.13 0.00 0.12 0.00 0.00 56.93 57.53 1ucx s PHE 415 Cb -0.19 -4.47 -0.08 0.00 -0.57 0.00 0.00 43.02 37.71 1ucx s PHE 415 CO -0.13 -1.65 0.62 0.15 -0.10 0.00 0.00 175.22 174.12 1ucx s LYS 416 N 4.99 3.94 -0.98 0.44 -0.14 -0.84 -0.60 119.74 126.54 1ucx s LYS 416 Ca 0.47 0.49 -0.03 0.00 -1.36 0.00 0.00 55.97 55.55 1ucx s LYS 416 Cb -0.08 -2.66 0.29 0.00 -1.68 0.00 0.00 37.83 33.69 1ucx s LYS 416 CO 0.27 0.31 1.23 0.25 -0.76 0.00 0.00 175.35 176.65 1ucx n THR 417 N 0.07 4.46 -3.65 2.17 -2.24 0.56 -1.85 114.28 113.81 1ucx n THR 417 Ca -0.00 -5.66 -0.01 0.00 -2.27 0.00 0.00 64.05 56.11 1ucx n THR 417 Cb 0.52 -2.17 -0.06 0.00 -2.10 0.00 0.00 70.33 66.51 1ucx n THR 417 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ucx s ASN 418 N -1.37 -0.34 0.00 3.42 3.84 -1.13 -4.32 114.94 115.04 1ucx s ASN 418 Ca 0.32 0.56 0.09 0.00 0.21 0.00 0.00 52.86 54.04 1ucx s ASN 418 Cb 0.04 1.08 0.39 0.00 -0.55 0.00 0.00 41.25 42.20 1ucx s ASN 418 CO 0.04 -0.09 1.27 -0.90 -2.79 0.00 0.00 177.10 174.63 1ucx n ASP 419 N 3.31 0.00 -3.20 -4.21 5.75 -1.18 -3.30 116.55 113.72 1ucx n ASP 419 Ca -0.17 0.47 -0.15 0.00 -0.01 0.00 0.00 54.79 54.92 1ucx n ASP 419 Cb 0.57 -0.48 -0.06 0.00 -1.03 0.00 0.00 41.12 40.13 1ucx n ASP 419 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1ucx s THR 420 N -2.96 -0.35 0.30 2.12 -4.23 -1.26 -0.48 115.64 108.78 1ucx s THR 420 Ca 0.05 -1.44 -0.22 0.00 -1.18 0.00 0.00 61.69 58.90 1ucx s THR 420 Cb 0.06 -0.62 -0.09 0.00 1.34 0.00 0.00 72.50 73.18 1ucx s THR 420 CO 0.16 -0.59 0.83 -2.84 -0.54 0.00 0.00 174.62 171.64 1ucx s PRO 421 N 0.88 4.34 -0.09 3.99 0.02 -1.25 -5.01 135.00 137.88 1ucx s PRO 421 Ca 0.25 1.04 0.03 0.00 0.02 0.00 0.00 61.00 62.34 1ucx s PRO 421 Cb -0.05 -2.70 -0.01 0.00 0.02 0.00 0.00 34.50 31.76 1ucx s PRO 421 CO -0.08 0.27 -0.18 -1.64 -0.33 0.00 0.00 177.00 175.03 1ucx s MET 422 N -2.29 2.93 -0.09 5.54 -1.94 -1.26 -5.04 119.30 117.14 1ucx s MET 422 Ca 0.49 -0.77 0.01 0.00 -1.71 0.00 0.00 55.69 53.71 1ucx s MET 422 Cb -0.16 -2.41 -0.02 0.00 2.01 0.00 0.00 34.83 34.25 1ucx s MET 422 CO 0.20 0.35 -0.11 0.96 -0.01 0.00 0.00 175.02 176.41 1ucx s ILE 423 N -0.03 3.27 -0.32 2.53 -4.36 -1.26 -0.55 121.20 120.48 1ucx s ILE 423 Ca -0.05 -0.62 -0.18 0.00 -0.26 0.00 0.00 60.65 59.54 1ucx s ILE 423 Cb -0.14 -2.34 -0.01 0.00 1.25 0.00 0.00 42.46 41.21 1ucx s ILE 423 CO 0.04 0.56 0.50 -0.83 0.24 0.00 0.00 174.94 175.45 1ucx s GLY 424 N -0.27 1.83 -0.03 6.27 0.00 -0.27 -4.93 107.32 109.93 1ucx s GLY 424 Ca 0.02 -0.90 -0.24 0.00 0.00 0.00 0.00 44.72 43.60 1ucx s GLY 424 CO 0.03 1.23 0.72 -1.59 0.00 0.00 0.00 173.10 173.49 1ucx s THR 425 N 2.35 4.94 -1.31 0.90 2.01 -1.26 -1.61 115.64 121.65 1ucx s THR 425 Ca 0.19 1.50 0.24 0.00 0.31 0.00 0.00 61.69 63.92 1ucx s THR 425 Cb -0.15 -4.06 -0.03 0.00 0.01 0.00 0.00 72.50 68.26 1ucx s THR 425 CO 0.12 0.30 1.22 0.18 -0.69 0.00 0.00 174.62 175.74 1ucx n LEU 426 N 3.41 1.01 -3.73 4.42 4.32 0.06 -0.36 117.00 126.13 1ucx n LEU 426 Ca -0.02 -0.34 -0.13 0.00 -0.02 0.00 0.00 56.01 55.50 1ucx n LEU 426 Cb 0.51 -0.10 -0.10 0.00 -1.62 0.00 0.00 43.42 42.11 1ucx n LEU 426 CO 0.47 0.22 0.10 0.00 -1.22 0.00 0.00 177.39 176.96 1ucx s ALA 427 N -2.83 -1.05 0.00 -1.18 0.00 -1.26 -4.54 121.76 110.90 1ucx s ALA 427 Ca 0.14 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1ucx s ALA 427 Cb 0.17 -0.70 0.00 0.00 0.00 0.00 0.00 23.12 22.59 1ucx s ALA 427 CO 0.70 -0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.67 1ucx n GLY 428 N 2.88 1.47 0.43 0.00 0.00 -1.26 -4.66 105.19 104.05 1ucx n GLY 428 Ca -0.13 -2.15 0.24 0.00 0.00 0.00 0.00 46.02 43.98 1ucx n GLY 428 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ucx h ALA 429 N 0.00 2.54 0.00 4.61 0.00 -0.87 -1.70 119.26 123.84 1ucx h ALA 429 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ucx h ALA 429 Cb 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ucx h ALA 429 CO 0.00 -0.90 -0.15 0.27 0.00 0.00 0.00 179.25 178.47 1ucx n ASN 430 N -4.06 1.72 -4.59 0.00 6.94 -1.26 -4.98 115.26 109.04 1ucx n ASN 430 Ca 0.13 -2.82 -0.30 0.00 -0.02 0.00 0.00 54.58 51.57 1ucx n ASN 430 Cb 0.80 -0.37 0.20 0.00 -2.36 0.00 0.00 39.78 38.06 1ucx n ASN 430 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1ucx s SER 431 N -2.40 2.06 0.25 0.53 1.04 -0.64 -4.80 113.70 109.74 1ucx s SER 431 Ca 0.24 1.91 -0.04 0.00 0.48 0.00 0.00 55.95 58.54 1ucx s SER 431 Cb 0.21 -2.46 0.29 0.00 0.10 0.00 0.00 66.02 64.16 1ucx s SER 431 CO 0.02 -3.59 1.76 -0.07 0.98 0.00 0.00 173.24 172.34 1ucx h LEU 432 N -2.21 0.85 -1.25 2.42 4.07 -0.96 -1.88 115.31 116.35 1ucx h LEU 432 Ca -0.51 -0.19 -0.08 0.00 0.08 0.00 0.00 57.88 57.18 1ucx h LEU 432 Cb 1.30 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.80 1ucx h LEU 432 CO 0.45 0.87 -0.37 -0.07 -1.08 0.00 0.00 178.44 178.24 1ucx h LEU 433 N 0.85 0.01 -1.58 1.67 3.38 -1.81 -2.72 115.31 115.12 1ucx h LEU 433 Ca 0.17 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1ucx h LEU 433 Cb 0.39 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1ucx h LEU 433 CO 0.01 0.38 -0.21 -1.13 0.09 0.00 0.00 178.44 177.58 1ucx h ASN 434 N 0.01 0.00 -0.17 -0.43 -0.73 -1.66 -2.73 115.58 109.88 1ucx h ASN 434 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1ucx h ASN 434 Cb 0.66 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.25 1ucx h ASN 434 CO 0.05 0.21 0.00 0.00 -0.37 0.00 0.00 177.43 177.32 1ucx n ALA 435 N -2.33 2.47 -1.98 1.57 0.00 -1.03 -4.91 120.51 114.29 1ucx n ALA 435 Ca -0.02 -0.75 -0.36 0.00 0.00 0.00 0.00 53.44 52.32 1ucx n ALA 435 Cb 0.32 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.80 1ucx n ALA 435 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ucx s LEU 436 N -1.78 4.27 0.16 0.00 1.43 -1.03 -5.04 118.68 116.69 1ucx s LEU 436 Ca 0.33 1.55 -0.34 0.00 -1.03 0.00 0.00 54.13 54.65 1ucx s LEU 436 Cb 0.21 -3.86 -0.15 0.00 0.03 0.00 0.00 46.19 42.41 1ucx s LEU 436 CO 0.31 -0.06 1.33 -2.65 0.23 0.00 0.00 176.35 175.50 1ucx n PRO 437 N 0.42 1.48 -0.32 1.29 -0.02 -1.26 -4.89 135.00 131.70 1ucx n PRO 437 Ca 0.01 0.53 0.10 0.00 -2.02 0.00 0.00 63.50 62.11 1ucx n PRO 437 Cb 0.51 -2.14 0.27 0.00 -0.02 0.00 0.00 33.50 32.12 1ucx n PRO 437 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ucx h GLU 438 N 4.29 0.65 -0.43 -0.52 4.81 -1.94 -0.67 114.58 120.77 1ucx h GLU 438 Ca -0.45 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 58.64 1ucx h GLU 438 Cb 1.31 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.53 1ucx h GLU 438 CO 0.76 0.43 -0.12 1.49 -0.73 0.00 0.00 179.01 180.85 1ucx h GLU 439 N 0.67 0.78 0.00 1.92 4.81 -1.97 -2.31 114.58 118.48 1ucx h GLU 439 Ca 0.52 -0.26 -0.02 0.00 -0.13 0.00 0.00 59.36 59.46 1ucx h GLU 439 Cb 0.77 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.09 1ucx h GLU 439 CO -0.38 0.86 -0.10 -0.39 -0.73 0.00 0.00 179.01 178.27 1ucx h VAL 440 N 0.70 0.21 -0.15 0.32 -1.51 -1.51 -2.72 116.25 111.58 1ucx h VAL 440 Ca 0.12 -0.96 -0.14 0.00 -1.23 0.00 0.00 66.70 64.49 1ucx h VAL 440 Cb 0.60 1.81 -0.01 0.00 -2.13 0.00 0.00 31.29 31.56 1ucx h VAL 440 CO 0.04 0.10 -0.49 0.40 -1.23 0.00 0.00 177.57 176.39 1ucx h ILE 441 N 0.00 1.33 -0.14 7.19 2.04 -0.89 -1.00 117.51 126.04 1ucx h ILE 441 Ca -0.00 -1.71 -0.02 0.00 1.00 0.00 0.00 64.86 64.13 1ucx h ILE 441 Cb 0.80 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 1ucx h ILE 441 CO 0.01 0.52 0.02 1.56 0.00 0.00 0.00 178.15 180.26 1ucx h GLN 442 N 0.32 0.23 0.00 2.37 4.20 -1.16 -2.90 115.11 118.17 1ucx h GLN 442 Ca 0.02 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1ucx h GLN 442 Cb 0.97 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.73 1ucx h GLN 442 CO 0.08 0.43 -0.06 0.45 -0.67 0.00 0.00 178.83 179.07 1ucx h HIS 443 N -0.01 0.00 0.11 2.96 3.86 -1.21 0.29 115.15 121.15 1ucx h HIS 443 Ca 0.04 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.92 1ucx h HIS 443 Cb 0.32 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1ucx h HIS 443 CO 0.02 0.06 -1.75 1.79 0.86 0.00 0.00 177.93 178.91 1ucx h THR 444 N 0.00 0.89 -0.36 2.45 1.35 -1.28 -3.38 112.91 112.58 1ucx h THR 444 Ca -0.00 -2.59 0.00 0.00 -0.55 0.00 0.00 66.41 63.27 1ucx h THR 444 Cb 0.90 2.61 0.00 0.00 -1.73 0.00 0.00 68.15 69.93 1ucx h THR 444 CO 0.01 0.79 0.00 0.49 -0.25 0.00 0.00 175.52 176.56 1ucx n PHE 445 N -3.40 0.46 -2.26 4.73 3.72 -1.09 -4.99 117.46 114.62 1ucx n PHE 445 Ca -0.23 -0.27 -0.21 0.00 -0.05 0.00 0.00 57.45 56.70 1ucx n PHE 445 Cb 1.05 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.56 1ucx n PHE 445 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1ucx n ASN 446 N 1.30 -5.79 -4.51 4.37 5.15 0.98 -5.01 115.26 111.74 1ucx n ASN 446 Ca 0.17 0.07 -0.25 0.00 -0.60 0.00 0.00 54.58 53.97 1ucx n ASN 446 Cb 0.55 -4.85 0.14 0.00 -0.53 0.00 0.00 39.78 35.09 1ucx n ASN 446 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ucx s LEU 447 N -5.72 2.90 0.35 1.20 1.43 -0.86 -5.02 118.68 112.96 1ucx s LEU 447 Ca 0.00 -0.34 0.08 0.00 -1.03 0.00 0.00 54.13 52.84 1ucx s LEU 447 Cb 0.00 -1.85 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1ucx s LEU 447 CO 0.00 -2.15 0.29 -0.54 0.23 0.00 0.00 176.35 174.18 1ucx s LYS 448 N -5.34 2.64 0.27 1.70 1.02 -1.26 -4.70 119.74 114.07 1ucx s LYS 448 Ca 0.69 -1.38 -0.01 0.00 0.02 0.00 0.00 55.97 55.29 1ucx s LYS 448 Cb -0.04 -2.41 0.59 0.00 -0.52 0.00 0.00 37.83 35.44 1ucx s LYS 448 CO 0.47 0.04 1.67 1.03 -0.92 0.00 0.00 175.35 177.64 1ucx h SER 449 N 1.25 0.03 -0.38 2.83 0.87 -1.97 -1.22 113.55 114.97 1ucx h SER 449 Ca -0.44 0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.27 1ucx h SER 449 Cb 1.26 0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 63.42 1ucx h SER 449 CO 0.59 -0.08 0.17 -0.61 -0.53 0.00 0.00 176.83 176.36 1ucx h GLN 450 N 0.26 0.55 -0.08 2.24 -0.00 -1.98 0.78 115.11 116.88 1ucx h GLN 450 Ca 0.49 -0.09 -0.11 0.00 -0.00 0.00 0.00 58.65 58.93 1ucx h GLN 450 Cb 0.90 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 28.28 1ucx h GLN 450 CO -0.58 0.51 -0.46 1.96 0.00 0.00 0.00 178.83 180.27 1ucx h GLN 451 N 0.46 0.19 0.00 1.69 4.20 -1.81 -1.86 115.11 117.99 1ucx h GLN 451 Ca 0.13 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1ucx h GLN 451 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1ucx h GLN 451 CO -0.01 0.62 0.00 0.00 -0.67 0.00 0.00 178.83 178.76 1ucx h ALA 452 N 1.37 1.00 0.00 3.87 0.00 -1.00 -1.56 119.26 122.95 1ucx h ALA 452 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.75 1ucx h ALA 452 Cb 0.87 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1ucx h ALA 452 CO 0.07 0.00 -0.80 0.00 0.00 0.00 0.00 179.25 178.52 1ucx h ARG 453 N 0.00 0.00 0.10 0.00 2.47 -0.04 -3.33 114.38 113.58 1ucx h ARG 453 Ca 0.00 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 58.55 1ucx h ARG 453 Cb 0.71 0.00 0.02 0.00 -1.65 0.00 0.00 29.97 29.04 1ucx h ARG 453 CO 0.00 0.80 -0.73 1.96 0.56 0.00 0.00 179.97 182.56 1ucx h GLN 454 N 0.00 0.31 0.00 0.04 4.20 -0.88 -2.51 115.11 116.28 1ucx h GLN 454 Ca -0.01 -0.47 -0.01 0.00 0.06 0.00 0.00 58.65 58.22 1ucx h GLN 454 Cb 1.44 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 29.39 1ucx h GLN 454 CO 0.10 1.20 -0.02 0.82 -0.67 0.00 0.00 178.83 180.26 1ucx h ILE 455 N -0.33 0.52 0.20 2.54 2.04 -1.49 0.61 117.51 121.59 1ucx h ILE 455 Ca -0.12 -0.11 -0.32 0.00 1.00 0.00 0.00 64.86 65.31 1ucx h ILE 455 Cb 1.54 1.07 0.02 0.00 -0.74 0.00 0.00 36.82 38.71 1ucx h ILE 455 CO 0.14 0.02 -1.46 0.11 0.00 0.00 0.00 178.15 176.96 1ucx h LYS 456 N 0.00 0.43 -0.00 2.37 1.57 -1.67 -3.43 116.57 115.83 1ucx h LYS 456 Ca -0.00 -0.73 0.00 0.00 -1.87 0.00 0.00 60.65 58.05 1ucx h LYS 456 Cb 0.07 0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1ucx h LYS 456 CO 0.00 1.34 -0.00 0.09 -0.57 0.00 0.00 179.45 180.31 1ucx n ASN 457 N -3.63 0.81 0.12 0.86 3.02 -0.71 -4.68 115.26 111.05 1ucx n ASN 457 Ca -0.16 -0.91 -0.02 0.00 -0.03 0.00 0.00 54.58 53.46 1ucx n ASN 457 Cb 1.08 0.20 0.17 0.00 -0.61 0.00 0.00 39.78 40.61 1ucx n ASN 457 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 1ucx h ASN 458 N 0.02 0.11 -3.57 6.41 4.21 -1.16 -3.38 115.58 118.21 1ucx h ASN 458 Ca 0.00 -0.06 -0.70 0.00 1.21 0.00 0.00 56.30 56.74 1ucx h ASN 458 Cb 0.00 -0.03 -0.28 0.00 -1.12 0.00 0.00 38.32 36.89 1ucx h ASN 458 CO 0.00 0.67 -0.54 0.21 -1.29 0.00 0.00 177.43 176.48 1ucx s ASN 459 N -6.87 5.50 0.00 5.81 3.84 -1.26 -4.95 114.94 117.00 1ucx s ASN 459 Ca -0.03 -1.28 0.20 0.00 0.21 0.00 0.00 52.86 51.96 1ucx s ASN 459 Cb 0.13 -1.93 0.86 0.00 -0.55 0.00 0.00 41.25 39.75 1ucx s ASN 459 CO 0.77 -0.42 1.60 -0.81 -2.79 0.00 0.00 177.10 175.45 1ucx n PRO 460 N 4.87 1.50 -3.76 0.43 -0.04 -1.26 -3.96 135.00 132.78 1ucx n PRO 460 Ca -0.11 -0.75 -0.30 0.00 -0.04 0.00 0.00 63.50 62.30 1ucx n PRO 460 Cb 0.44 -1.36 -0.04 0.00 -0.04 0.00 0.00 33.50 32.50 1ucx n PRO 460 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1ucx s PHE 461 N -1.86 3.49 -0.23 0.54 0.08 -1.26 -4.49 117.98 114.25 1ucx s PHE 461 Ca 0.31 0.40 -0.08 0.00 0.12 0.00 0.00 56.93 57.68 1ucx s PHE 461 Cb 0.16 -1.89 -0.04 0.00 -0.57 0.00 0.00 43.02 40.68 1ucx s PHE 461 CO 0.25 0.46 0.09 0.21 -0.10 0.00 0.00 175.22 176.13 1ucx s LYS 462 N -2.81 3.85 0.00 0.44 2.36 -1.26 -0.43 119.74 121.89 1ucx s LYS 462 Ca 0.38 -0.39 0.00 0.00 -2.55 0.00 0.00 55.97 53.42 1ucx s LYS 462 Cb -0.12 -3.35 0.00 0.00 -1.05 0.00 0.00 37.83 33.31 1ucx s LYS 462 CO 0.27 0.01 0.00 0.34 1.55 0.00 0.00 175.35 177.52 1ucx n PHE 463 N 4.36 0.00 -2.89 4.03 7.35 -1.26 -4.82 117.46 124.23 1ucx n PHE 463 Ca -0.16 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.12 1ucx n PHE 463 Cb 0.52 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.31 1ucx n PHE 463 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1ucx s LEU 464 N 0.00 4.34 -0.15 -2.13 2.01 -1.26 -2.59 118.68 118.90 1ucx s LEU 464 Ca 0.00 1.40 -0.05 0.00 0.01 0.00 0.00 54.13 55.49 1ucx s LEU 464 Cb 0.00 -3.30 -0.03 0.00 0.01 0.00 0.00 46.19 42.86 1ucx s LEU 464 CO 0.00 -0.19 0.01 0.54 1.01 0.00 0.00 176.35 177.73 1ucx s VAL 465 N 0.92 4.35 1.15 -1.59 0.11 -0.51 -4.84 120.40 119.99 1ucx s VAL 465 Ca 0.44 -0.20 -0.13 0.00 -2.93 0.00 0.00 61.98 59.15 1ucx s VAL 465 Cb -0.19 -2.91 0.25 0.00 -1.53 0.00 0.00 36.38 32.00 1ucx s VAL 465 CO 0.22 0.51 0.86 -2.65 -3.33 0.00 0.00 175.10 170.72 1ucx n PRO 466 N 3.13 -2.21 -1.57 1.54 -0.02 -1.26 -1.73 135.00 132.89 1ucx n PRO 466 Ca -0.17 -0.61 -0.38 0.00 -2.02 0.00 0.00 63.50 60.31 1ucx n PRO 466 Cb 0.53 -2.11 0.04 0.00 -0.02 0.00 0.00 33.50 31.94 1ucx n PRO 466 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ucx n PRO 467 N -4.45 0.82 0.25 0.52 -0.02 -1.26 -4.55 135.00 126.32 1ucx n PRO 467 Ca 0.03 0.31 0.10 0.00 -2.02 0.00 0.00 63.50 61.93 1ucx n PRO 467 Cb 0.55 -2.00 0.67 0.00 -0.02 0.00 0.00 33.50 32.70 1ucx n PRO 467 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1ucx h GLN 468 N 0.53 0.00 -5.03 -0.52 4.15 -1.93 -3.48 115.11 108.84 1ucx h GLN 468 Ca -0.47 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1ucx h GLN 468 Cb 1.37 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.06 1ucx h GLN 468 CO 0.50 0.13 -0.36 0.39 -1.93 0.00 0.00 178.83 177.56 1ucx n GLU 469 N -3.87 -1.94 0.00 1.69 4.71 -1.26 -5.26 120.64 114.71 1ucx n GLU 469 Ca -0.02 1.84 0.13 0.00 -0.01 0.00 0.00 57.16 59.10 1ucx n GLU 469 Cb 0.23 -5.21 0.34 0.00 -1.01 0.00 0.00 31.44 25.79 1ucx n GLU 469 CO 0.00 0.00 0.00 0.43 0.09 0.00 0.00 177.13 177.65