#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oxu s VAL 2 N 0.00 -0.01 -0.03 2.03 0.11 -1.26 -4.90 120.40 116.34 1oxu s VAL 2 Ca 0.00 0.05 -0.20 0.00 -2.93 0.00 0.00 61.98 58.89 1oxu s VAL 2 Cb 0.00 -0.58 -0.05 0.00 -1.53 0.00 0.00 36.38 34.22 1oxu s VAL 2 CO 0.00 0.02 0.58 -0.13 -3.33 0.00 0.00 175.10 172.24 1oxu s ARG 3 N 0.76 4.32 -0.31 1.54 0.52 -1.26 -3.72 118.95 120.80 1oxu s ARG 3 Ca -0.04 0.69 -0.07 0.00 -0.52 0.00 0.00 55.73 55.79 1oxu s ARG 3 Cb -0.05 -3.37 0.02 0.00 0.52 0.00 0.00 34.95 32.06 1oxu s ARG 3 CO -0.05 0.31 0.09 0.42 0.02 0.00 0.00 175.30 176.08 1oxu s ILE 4 N 0.03 3.96 -0.32 1.52 -1.09 -0.02 0.15 121.20 125.44 1oxu s ILE 4 Ca 0.31 -0.78 -0.07 0.00 -2.23 0.00 0.00 60.65 57.87 1oxu s ILE 4 Cb -0.18 -3.09 0.02 0.00 -1.58 0.00 0.00 42.46 37.64 1oxu s ILE 4 CO 0.16 0.02 0.11 -0.63 -1.23 0.00 0.00 174.94 173.37 1oxu s ILE 5 N 1.48 4.05 -0.32 2.92 1.01 0.32 -0.83 121.20 129.83 1oxu s ILE 5 Ca 0.02 -0.83 -0.09 0.00 0.00 0.00 0.00 60.65 59.75 1oxu s ILE 5 Cb -0.18 -3.17 0.01 0.00 0.01 0.00 0.00 42.46 39.14 1oxu s ILE 5 CO 0.03 -0.04 0.14 -0.69 0.00 0.00 0.00 174.94 174.37 1oxu s VAL 6 N 1.49 4.32 -0.28 2.92 1.01 -0.11 -0.93 120.40 128.83 1oxu s VAL 6 Ca 0.01 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.31 1oxu s VAL 6 Cb -0.18 -3.29 0.05 0.00 0.00 0.00 0.00 36.38 32.96 1oxu s VAL 6 CO 0.03 -0.03 -0.05 -0.75 0.00 0.00 0.00 175.10 174.31 1oxu s LYS 7 N 1.54 2.43 -1.45 2.72 2.20 -0.41 -1.76 119.74 125.02 1oxu s LYS 7 Ca 0.03 -1.25 -0.05 0.00 -0.36 0.00 0.00 55.97 54.34 1oxu s LYS 7 Cb -0.18 -3.05 0.04 0.00 -1.51 0.00 0.00 37.83 33.13 1oxu s LYS 7 CO 0.05 -0.57 0.64 0.09 -0.36 0.00 0.00 175.35 175.20 1oxu n ASN 8 N 4.57 -1.77 -4.68 1.43 3.02 -0.87 -1.66 115.26 115.31 1oxu n ASN 8 Ca -0.14 -0.92 -0.41 0.00 -0.03 0.00 0.00 54.58 53.07 1oxu n ASN 8 Cb 0.43 -3.39 -0.04 0.00 -0.61 0.00 0.00 39.78 36.17 1oxu n ASN 8 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1oxu s VAL 9 N -3.67 4.89 0.14 2.41 1.01 -0.53 -3.53 120.40 121.12 1oxu s VAL 9 Ca 0.23 1.65 0.09 0.00 0.00 0.00 0.00 61.98 63.95 1oxu s VAL 9 Cb -0.12 -4.14 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 1oxu s VAL 9 CO 0.87 0.05 -0.20 -0.44 0.00 0.00 0.00 175.10 175.38 1oxu s SER 10 N 1.11 2.70 -0.11 3.32 0.01 -0.50 -0.86 113.70 119.39 1oxu s SER 10 Ca 0.39 -0.80 -0.04 0.00 1.31 0.00 0.00 55.95 56.81 1oxu s SER 10 Cb -0.17 -0.16 0.05 0.00 0.21 0.00 0.00 66.02 65.95 1oxu s SER 10 CO 0.14 0.01 0.22 -0.75 0.41 0.00 0.00 173.24 173.27 1oxu s LYS 11 N -2.47 0.13 0.16 12.44 2.47 -0.38 -0.36 119.74 131.73 1oxu s LYS 11 Ca 0.13 0.61 0.08 0.00 -1.56 0.00 0.00 55.97 55.23 1oxu s LYS 11 Cb -0.07 -0.13 -0.04 0.00 -1.46 0.00 0.00 37.83 36.13 1oxu s LYS 11 CO 0.06 -0.25 -0.10 0.14 0.16 0.00 0.00 175.35 175.36 1oxu s VAL 12 N 1.97 3.20 0.35 4.02 -7.23 -1.26 -0.96 120.40 120.49 1oxu s VAL 12 Ca -0.02 -1.56 0.03 0.00 -1.81 0.00 0.00 61.98 58.63 1oxu s VAL 12 Cb -0.12 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 1oxu s VAL 12 CO -0.08 -0.04 0.09 -0.36 -0.31 0.00 0.00 175.10 174.41 1oxu s PHE 13 N -1.54 1.83 -1.39 2.82 0.40 0.98 -4.81 117.98 116.28 1oxu s PHE 13 Ca 0.23 -1.13 -0.03 0.00 -0.60 0.00 0.00 56.93 55.40 1oxu s PHE 13 Cb -0.09 -1.18 0.02 0.00 0.51 0.00 0.00 43.02 42.27 1oxu s PHE 13 CO 0.14 -0.17 0.65 1.63 0.70 0.00 0.00 175.22 178.17 1oxu n LYS 14 N -0.76 -4.41 -2.51 0.44 5.02 -1.26 -1.90 118.16 112.79 1oxu n LYS 14 Ca -0.04 0.54 -0.18 0.00 -2.02 0.00 0.00 58.31 56.61 1oxu n LYS 14 Cb 0.66 -5.01 -0.00 0.00 -0.02 0.00 0.00 35.03 30.65 1oxu n LYS 14 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1oxu n LYS 15 N -4.37 -2.24 0.00 1.97 5.02 -1.26 -1.95 118.16 115.33 1oxu n LYS 15 Ca -0.24 0.82 0.00 0.00 -2.02 0.00 0.00 58.31 56.86 1oxu n LYS 15 Cb 0.65 -5.48 0.00 0.00 -0.02 0.00 0.00 35.03 30.19 1oxu n LYS 15 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oxu n GLY 16 N -0.98 2.52 0.30 0.72 0.00 -0.82 -4.97 105.19 101.95 1oxu n GLY 16 Ca -0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 1oxu n GLY 16 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1oxu h LYS 17 N 2.38 0.71 -4.99 1.61 3.64 -1.17 -3.41 116.57 115.34 1oxu h LYS 17 Ca 0.00 -0.13 -0.65 0.00 -1.27 0.00 0.00 60.65 58.60 1oxu h LYS 17 Cb 0.00 -0.11 -0.25 0.00 -0.41 0.00 0.00 32.23 31.45 1oxu h LYS 17 CO 0.00 0.64 -0.68 0.08 -2.27 0.00 0.00 179.45 177.23 1oxu s VAL 18 N -5.19 3.82 -0.61 2.00 1.01 -0.80 -5.00 120.40 115.63 1oxu s VAL 18 Ca -0.09 -0.34 -0.14 0.00 0.00 0.00 0.00 61.98 61.41 1oxu s VAL 18 Cb 0.16 -2.76 0.15 0.00 0.00 0.00 0.00 36.38 33.93 1oxu s VAL 18 CO 0.78 0.39 0.55 -0.69 0.00 0.00 0.00 175.10 176.13 1oxu s VAL 19 N 1.48 5.16 0.14 2.92 1.01 -1.26 -0.01 120.40 129.84 1oxu s VAL 19 Ca 0.06 -1.84 -0.02 0.00 0.00 0.00 0.00 61.98 60.18 1oxu s VAL 19 Cb -0.15 -4.28 -0.17 0.00 0.00 0.00 0.00 36.38 31.78 1oxu s VAL 19 CO 0.00 -0.90 1.33 0.00 0.00 0.00 0.00 175.10 175.53 1oxu h ALA 20 N 8.49 0.42 -3.63 5.51 0.00 -1.41 -3.43 119.26 125.20 1oxu h ALA 20 Ca -0.17 -0.72 -0.41 0.00 0.00 0.00 0.00 54.91 53.61 1oxu h ALA 20 Cb 1.08 -0.04 -0.32 0.00 0.00 0.00 0.00 17.79 18.51 1oxu h ALA 20 CO 0.93 0.85 -0.78 -0.51 0.00 0.00 0.00 179.25 179.75 1oxu s LEU 21 N -7.61 1.58 -0.29 0.00 1.43 -1.07 -3.62 118.68 109.10 1oxu s LEU 21 Ca -0.05 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 52.92 1oxu s LEU 21 Cb 0.09 -0.47 0.09 0.00 0.03 0.00 0.00 46.19 45.93 1oxu s LEU 21 CO 0.85 0.00 0.03 -0.62 0.23 0.00 0.00 176.35 176.85 1oxu s ASP 22 N 0.53 4.15 -1.33 2.29 3.68 0.30 -1.25 116.67 125.04 1oxu s ASP 22 Ca -0.08 -1.61 -0.00 0.00 2.13 0.00 0.00 52.55 53.00 1oxu s ASP 22 Cb -0.11 -1.18 0.00 0.00 -1.45 0.00 0.00 42.92 40.18 1oxu s ASP 22 CO 0.00 -0.34 0.64 0.59 0.13 0.00 0.00 175.17 176.19 1oxu n ASN 23 N 4.63 -0.95 -4.71 -0.34 4.13 -1.07 -4.66 115.26 112.29 1oxu n ASN 23 Ca -0.04 -0.86 -0.42 0.00 1.68 0.00 0.00 54.58 54.94 1oxu n ASN 23 Cb 0.43 -3.84 -0.03 0.00 -1.54 0.00 0.00 39.78 34.80 1oxu n ASN 23 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1oxu s VAL 24 N -3.74 4.26 -0.08 2.41 1.01 -0.04 -4.65 120.40 119.59 1oxu s VAL 24 Ca 0.00 1.62 0.02 0.00 0.00 0.00 0.00 61.98 63.62 1oxu s VAL 24 Cb -0.00 -4.04 0.01 0.00 0.00 0.00 0.00 36.38 32.36 1oxu s VAL 24 CO 0.83 0.10 -0.12 0.20 0.00 0.00 0.00 175.10 176.11 1oxu s ASN 25 N 1.12 1.93 -0.26 3.32 0.01 -1.26 -1.46 114.94 118.35 1oxu s ASN 25 Ca 0.57 -0.32 -0.26 0.00 -0.71 0.00 0.00 52.86 52.14 1oxu s ASN 25 Cb -0.27 -0.87 0.12 0.00 0.41 0.00 0.00 41.25 40.65 1oxu s ASN 25 CO 0.27 0.01 1.01 -0.51 -1.51 0.00 0.00 177.10 176.37 1oxu s ILE 26 N 0.86 0.00 -0.36 0.60 1.10 -0.72 -5.02 121.20 117.66 1oxu s ILE 26 Ca -0.11 0.00 -0.00 0.00 -0.51 0.00 0.00 60.65 60.03 1oxu s ILE 26 Cb -0.15 -1.00 0.10 0.00 0.15 0.00 0.00 42.46 41.55 1oxu s ILE 26 CO 0.01 0.00 0.11 0.20 -2.11 0.00 0.00 174.94 173.15 1oxu s ASN 27 N -0.01 5.01 -0.17 4.50 0.01 -1.26 -0.93 114.94 122.08 1oxu s ASN 27 Ca 0.02 -1.95 -0.22 0.00 -0.71 0.00 0.00 52.86 49.99 1oxu s ASN 27 Cb -0.04 -1.73 -0.02 0.00 0.41 0.00 0.00 41.25 39.86 1oxu s ASN 27 CO -0.04 -0.44 0.70 -0.63 -1.51 0.00 0.00 177.10 175.18 1oxu s ILE 28 N 1.07 4.98 0.56 0.60 1.01 -0.01 -4.95 121.20 124.46 1oxu s ILE 28 Ca 0.07 1.35 -0.17 0.00 0.00 0.00 0.00 60.65 61.89 1oxu s ILE 28 Cb -0.21 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 1oxu s ILE 28 CO -0.05 0.10 1.05 -1.61 0.00 0.00 0.00 174.94 174.43 1oxu s GLU 29 N 1.85 3.48 0.19 2.79 0.41 -1.26 -0.84 118.70 125.33 1oxu s GLU 29 Ca 0.33 1.25 -0.32 0.00 -0.41 0.00 0.00 54.97 55.81 1oxu s GLU 29 Cb -0.16 -2.05 -0.11 0.00 -1.78 0.00 0.00 34.13 30.02 1oxu s GLU 29 CO 0.12 -0.68 1.64 0.54 -0.49 0.00 0.00 175.26 176.39 1oxu s ASN 30 N -2.55 6.49 0.00 -0.19 6.03 -1.24 -1.93 114.94 121.53 1oxu s ASN 30 Ca 0.65 2.74 0.00 0.00 -1.03 0.00 0.00 52.86 55.22 1oxu s ASN 30 Cb -0.16 -2.60 0.00 0.00 -3.03 0.00 0.00 41.25 35.46 1oxu s ASN 30 CO 0.32 -0.90 0.00 0.61 -2.03 0.00 0.00 177.10 175.10 1oxu n GLY 31 N 3.85 0.90 3.80 0.45 0.00 -1.26 -4.53 105.19 108.41 1oxu n GLY 31 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 1oxu n GLY 31 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1oxu s GLU 32 N -0.00 4.18 -0.51 1.61 2.12 -0.81 -4.71 118.70 120.58 1oxu s GLU 32 Ca 0.00 1.26 -0.17 0.00 0.36 0.00 0.00 54.97 56.42 1oxu s GLU 32 Cb 0.00 -2.30 0.08 0.00 0.26 0.00 0.00 34.13 32.17 1oxu s GLU 32 CO 0.00 -0.09 0.51 1.03 -0.54 0.00 0.00 175.26 176.17 1oxu s ARG 33 N -2.93 3.02 -0.07 4.30 0.52 -1.26 -0.64 118.95 121.88 1oxu s ARG 33 Ca 0.61 -1.32 0.04 0.00 -0.52 0.00 0.00 55.73 54.54 1oxu s ARG 33 Cb -0.14 -4.18 -0.02 0.00 0.52 0.00 0.00 34.95 31.14 1oxu s ARG 33 CO 0.18 -1.20 -0.19 0.12 0.02 0.00 0.00 175.30 174.23 1oxu s PHE 34 N 1.99 2.60 0.12 -0.53 5.36 0.11 -0.77 117.98 126.86 1oxu s PHE 34 Ca 0.07 -0.54 0.10 0.00 -0.96 0.00 0.00 56.93 55.61 1oxu s PHE 34 Cb -0.24 -1.66 -0.04 0.00 -0.34 0.00 0.00 43.02 40.74 1oxu s PHE 34 CO 0.07 -0.10 -0.26 0.20 -1.46 0.00 0.00 175.22 173.68 1oxu s GLY 35 N -0.22 1.51 -0.10 13.12 0.00 -0.40 -1.51 107.32 119.72 1oxu s GLY 35 Ca -0.01 -1.42 0.03 0.00 0.00 0.00 0.00 44.72 43.32 1oxu s GLY 35 CO 0.03 -1.40 -0.19 -0.42 0.00 0.00 0.00 173.10 171.12 1oxu s ILE 36 N -1.06 1.73 -0.10 0.90 1.01 -0.50 -0.54 121.20 122.64 1oxu s ILE 36 Ca 0.13 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.99 1oxu s ILE 36 Cb -0.10 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 40.82 1oxu s ILE 36 CO 0.05 0.49 -0.17 -0.22 0.00 0.00 0.00 174.94 175.09 1oxu s LEU 37 N 0.65 2.50 -0.24 2.97 2.96 -0.24 -1.32 118.68 125.96 1oxu s LEU 37 Ca -0.13 -0.38 -0.29 0.00 -0.22 0.00 0.00 54.13 53.11 1oxu s LEU 37 Cb -0.16 -1.53 0.16 0.00 0.50 0.00 0.00 46.19 45.16 1oxu s LEU 37 CO 0.03 0.21 1.20 -0.83 -1.32 0.00 0.00 176.35 175.64 1oxu s GLY 38 N 0.09 -0.04 1.03 7.98 0.00 -0.99 -0.34 107.32 115.05 1oxu s GLY 38 Ca -0.08 2.59 -0.12 0.00 0.00 0.00 0.00 44.72 47.11 1oxu s GLY 38 CO 0.05 1.25 1.07 -4.14 0.00 0.00 0.00 173.10 171.33 1oxu s PRO 39 N -0.81 0.13 0.15 2.90 0.02 -1.26 -3.99 135.00 132.15 1oxu s PRO 39 Ca 0.04 0.84 -0.34 0.00 0.02 0.00 0.00 61.00 61.56 1oxu s PRO 39 Cb -0.02 -1.68 -0.15 0.00 0.02 0.00 0.00 34.50 32.68 1oxu s PRO 39 CO -0.05 -3.02 1.49 0.45 -0.33 0.00 0.00 177.00 175.54 1oxu n SER 40 N -4.42 2.67 0.00 2.53 2.88 -1.26 -1.63 113.62 114.39 1oxu n SER 40 Ca 0.05 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.69 1oxu n SER 40 Cb 0.55 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.64 1oxu n SER 40 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1oxu n GLY 41 N 3.02 0.79 0.27 0.46 0.00 -1.26 -4.93 105.19 103.54 1oxu n GLY 41 Ca 0.17 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.33 1oxu n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oxu h ALA 42 N 0.00 1.21 0.00 4.61 0.00 -1.62 -3.44 119.26 120.02 1oxu h ALA 42 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1oxu h ALA 42 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1oxu h ALA 42 CO 0.00 0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.79 1oxu n GLY 43 N -0.59 1.48 0.15 0.00 0.00 -1.26 -1.06 105.19 103.91 1oxu n GLY 43 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 1oxu n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oxu h LYS 44 N 0.52 -0.29 -0.64 1.61 1.57 -1.90 -1.16 116.57 116.27 1oxu h LYS 44 Ca 0.00 0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1oxu h LYS 44 Cb 0.00 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1oxu h LYS 44 CO 0.00 -0.20 0.10 1.15 -0.57 0.00 0.00 179.45 179.94 1oxu h THR 45 N -0.30 1.26 -0.59 -0.16 2.02 -1.99 -1.29 112.91 111.86 1oxu h THR 45 Ca -0.03 -1.03 0.06 0.00 0.77 0.00 0.00 66.41 66.19 1oxu h THR 45 Cb 0.24 0.68 -0.06 0.00 -1.74 0.00 0.00 68.15 67.27 1oxu h THR 45 CO 0.05 0.38 0.29 0.74 0.37 0.00 0.00 175.52 177.35 1oxu h THR 46 N 0.98 0.90 0.07 3.16 2.02 -1.95 0.26 112.91 118.36 1oxu h THR 46 Ca 0.19 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 67.19 1oxu h THR 46 Cb 0.44 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.17 1oxu h THR 46 CO 0.01 0.10 -0.03 0.15 0.37 0.00 0.00 175.52 176.12 1oxu h PHE 47 N 0.54 -0.09 -0.66 3.16 3.57 -0.77 -2.12 116.94 120.56 1oxu h PHE 47 Ca 0.27 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 1oxu h PHE 47 Cb 0.23 0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1oxu h PHE 47 CO -0.11 -0.05 0.32 0.52 -2.23 0.00 0.00 178.31 176.75 1oxu h MET 48 N -0.09 0.94 -0.54 1.11 2.86 -0.76 -1.47 114.93 116.97 1oxu h MET 48 Ca -0.01 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.46 1oxu h MET 48 Cb 0.07 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 31.53 1oxu h MET 48 CO 0.02 0.73 0.13 0.00 1.06 0.00 0.00 176.91 178.84 1oxu h ARG 49 N 0.94 0.83 -0.43 1.72 3.08 -0.74 -0.18 114.38 119.60 1oxu h ARG 49 Ca 0.23 -0.17 -0.14 0.00 0.07 0.00 0.00 59.98 59.97 1oxu h ARG 49 Cb 0.10 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1oxu h ARG 49 CO -0.03 0.75 -0.27 0.82 -1.07 0.00 0.00 179.97 180.17 1oxu h ILE 50 N 0.80 1.27 -0.67 2.04 2.04 -0.69 -0.01 117.51 122.30 1oxu h ILE 50 Ca 0.18 -1.43 -0.07 0.00 1.00 0.00 0.00 64.86 64.53 1oxu h ILE 50 Cb 0.30 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1oxu h ILE 50 CO -0.00 0.49 0.14 0.40 0.00 0.00 0.00 178.15 179.17 1oxu h ILE 51 N 0.79 1.26 -0.01 -0.67 1.08 -0.87 -2.80 117.51 116.29 1oxu h ILE 51 Ca 0.09 -0.98 -0.10 0.00 -0.39 0.00 0.00 64.86 63.48 1oxu h ILE 51 Cb 0.84 0.59 -0.01 0.00 -3.07 0.00 0.00 36.82 35.17 1oxu h ILE 51 CO 0.07 0.37 -0.49 0.00 -0.69 0.00 0.00 178.15 177.42 1oxu h ALA 52 N 1.13 1.18 0.00 1.87 0.00 -0.81 -3.47 119.26 119.16 1oxu h ALA 52 Ca 0.21 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1oxu h ALA 52 Cb 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1oxu h ALA 52 CO 0.01 0.61 0.00 0.41 0.00 0.00 0.00 179.25 180.28 1oxu n GLY 53 N -0.12 0.77 0.05 0.00 0.00 -0.25 -4.35 105.19 101.28 1oxu n GLY 53 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 1oxu n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oxu n LEU 54 N 0.00 0.30 -3.99 0.99 4.77 -0.18 -4.30 117.00 114.59 1oxu n LEU 54 Ca 0.00 0.55 -0.09 0.00 -0.03 0.00 0.00 56.01 56.43 1oxu n LEU 54 Cb 0.00 -0.47 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 1oxu n LEU 54 CO 0.00 -0.21 0.14 -0.62 -1.33 0.00 0.00 177.39 175.37 1oxu s ASP 55 N -3.56 -0.07 0.17 -1.43 -1.08 -1.07 -4.95 116.67 104.68 1oxu s ASP 55 Ca 0.10 -0.92 0.06 0.00 -0.52 0.00 0.00 52.55 51.27 1oxu s ASP 55 Cb 0.13 0.56 -0.04 0.00 -1.46 0.00 0.00 42.92 42.10 1oxu s ASP 55 CO 0.45 -1.09 -0.13 0.68 0.52 0.00 0.00 175.17 175.61 1oxu s VAL 56 N -4.01 1.46 0.42 1.11 -7.23 -1.26 -4.23 120.40 106.66 1oxu s VAL 56 Ca 0.22 -2.11 -0.25 0.00 -1.81 0.00 0.00 61.98 58.02 1oxu s VAL 56 Cb 0.00 -1.92 -0.08 0.00 0.56 0.00 0.00 36.38 34.94 1oxu s VAL 56 CO 0.07 -0.65 1.27 -2.84 -0.31 0.00 0.00 175.10 172.64 1oxu s PRO 57 N -3.62 3.91 0.07 4.82 0.02 -1.26 -4.83 135.00 134.11 1oxu s PRO 57 Ca 0.19 2.08 -0.16 0.00 0.02 0.00 0.00 61.00 63.12 1oxu s PRO 57 Cb 0.00 -2.68 -0.13 0.00 0.02 0.00 0.00 34.50 31.71 1oxu s PRO 57 CO 0.04 -0.51 1.33 0.77 -0.33 0.00 0.00 177.00 178.30 1oxu h SER 58 N 2.55 0.68 -4.85 2.53 0.02 -1.06 0.67 113.55 114.09 1oxu h SER 58 Ca -0.49 -0.55 -0.21 0.00 -0.84 0.00 0.00 61.79 59.70 1oxu h SER 58 Cb 1.25 -0.19 -0.18 0.00 0.14 0.00 0.00 62.40 63.42 1oxu h SER 58 CO 0.62 1.10 -0.70 0.42 -1.14 0.00 0.00 176.83 177.12 1oxu s THR 59 N -4.06 0.46 0.00 -2.27 -4.23 -1.16 -3.08 115.64 101.30 1oxu s THR 59 Ca -0.13 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 1oxu s THR 59 Cb 0.07 -1.14 0.00 0.00 1.34 0.00 0.00 72.50 72.77 1oxu s THR 59 CO 0.83 -0.71 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 1oxu n GLY 60 N 0.65 0.58 3.17 3.99 0.00 -1.23 -1.41 105.19 110.94 1oxu n GLY 60 Ca -0.17 -2.07 -0.11 0.00 0.00 0.00 0.00 46.02 43.67 1oxu n GLY 60 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oxu s GLU 61 N -1.26 0.84 -0.04 1.61 2.02 -0.66 -0.42 118.70 120.78 1oxu s GLU 61 Ca 0.00 -1.30 0.02 0.00 0.02 0.00 0.00 54.97 53.71 1oxu s GLU 61 Cb 0.00 -0.28 0.01 0.00 0.10 0.00 0.00 34.13 33.96 1oxu s GLU 61 CO 0.00 0.00 -0.09 -1.17 0.02 0.00 0.00 175.26 174.02 1oxu s LEU 62 N -2.93 1.62 -0.02 1.80 2.96 -0.11 -1.29 118.68 120.72 1oxu s LEU 62 Ca 0.11 -0.21 0.06 0.00 -0.22 0.00 0.00 54.13 53.86 1oxu s LEU 62 Cb 0.03 -0.61 -0.01 0.00 0.50 0.00 0.00 46.19 46.10 1oxu s LEU 62 CO -0.04 0.03 -0.18 -0.31 -1.32 0.00 0.00 176.35 174.53 1oxu s TYR 63 N 0.52 1.65 -0.31 5.38 1.51 -0.10 -1.17 117.35 124.84 1oxu s TYR 63 Ca -0.09 -0.32 -0.08 0.00 -1.01 0.00 0.00 57.07 55.57 1oxu s TYR 63 Cb -0.12 -1.07 0.01 0.00 -0.11 0.00 0.00 41.96 40.67 1oxu s TYR 63 CO 0.01 -0.03 0.11 -0.06 -1.11 0.00 0.00 175.55 174.47 1oxu s PHE 64 N -0.41 3.17 0.00 2.71 0.40 0.10 -0.52 117.98 123.43 1oxu s PHE 64 Ca 0.07 -0.87 0.00 0.00 -0.60 0.00 0.00 56.93 55.52 1oxu s PHE 64 Cb -0.07 -2.30 0.00 0.00 0.51 0.00 0.00 43.02 41.16 1oxu s PHE 64 CO -0.01 -0.55 0.00 -0.25 0.70 0.00 0.00 175.22 175.11 1oxu n ASP 65 N 4.91 0.00 -1.19 1.36 8.00 0.12 -0.59 116.55 129.17 1oxu n ASP 65 Ca -0.14 0.00 0.10 0.00 0.71 0.00 0.00 54.79 55.46 1oxu n ASP 65 Cb 0.48 0.00 0.28 0.00 -0.02 0.00 0.00 41.12 41.86 1oxu n ASP 65 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1oxu n ASP 66 N 4.95 3.45 -4.61 -2.24 5.75 -1.26 -4.83 116.55 117.77 1oxu n ASP 66 Ca 0.00 -2.00 -0.40 0.00 -0.01 0.00 0.00 54.79 52.38 1oxu n ASP 66 Cb 0.00 -0.43 -0.08 0.00 -1.03 0.00 0.00 41.12 39.58 1oxu n ASP 66 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1oxu s ARG 67 N -1.14 4.00 0.03 0.11 0.52 0.25 -5.04 118.95 117.69 1oxu s ARG 67 Ca 0.43 0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 55.57 1oxu s ARG 67 Cb 0.22 -3.68 -0.06 0.00 0.52 0.00 0.00 34.95 31.96 1oxu s ARG 67 CO 0.29 -0.39 1.38 -1.17 0.02 0.00 0.00 175.30 175.43 1oxu s LEU 68 N 2.32 4.33 -0.00 2.53 2.96 -1.26 -0.72 118.68 128.83 1oxu s LEU 68 Ca 0.20 2.16 0.03 0.00 -0.22 0.00 0.00 54.13 56.30 1oxu s LEU 68 Cb -0.16 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1oxu s LEU 68 CO 0.10 -0.68 0.09 1.33 -1.32 0.00 0.00 176.35 175.87 1oxu n VAL 69 N 4.43 0.00 -3.60 1.68 0.24 -0.31 -4.45 118.33 116.31 1oxu n VAL 69 Ca 0.12 -0.21 -0.13 0.00 -2.04 0.00 0.00 64.34 62.09 1oxu n VAL 69 Cb 0.44 0.65 -0.07 0.00 -1.47 0.00 0.00 33.84 33.39 1oxu n VAL 69 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1oxu s ALA 70 N -1.85 -1.86 -0.21 2.33 0.00 -1.19 -0.86 121.76 118.11 1oxu s ALA 70 Ca -0.00 1.79 -0.09 0.00 0.00 0.00 0.00 51.96 53.66 1oxu s ALA 70 Cb 0.02 -0.98 0.09 0.00 0.00 0.00 0.00 23.12 22.25 1oxu s ALA 70 CO 0.12 -0.31 0.47 0.45 0.00 0.00 0.00 175.76 176.50 1oxu s SER 71 N -0.15 -0.50 -1.07 0.00 0.15 -0.32 -0.94 113.70 110.87 1oxu s SER 71 Ca -0.01 1.10 -0.26 0.00 0.70 0.00 0.00 55.95 57.48 1oxu s SER 71 Cb -0.03 1.36 0.04 0.00 -1.71 0.00 0.00 66.02 65.67 1oxu s SER 71 CO 0.01 -0.22 0.63 0.59 1.20 0.00 0.00 173.24 175.44 1oxu n ASN 72 N 5.06 -4.08 0.00 5.45 3.02 0.44 -0.84 115.26 124.31 1oxu n ASN 72 Ca -0.13 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 1oxu n ASN 72 Cb 0.51 -1.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.17 1oxu n ASN 72 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1oxu n GLY 73 N -1.95 1.28 3.40 7.41 0.00 0.23 -4.85 105.19 110.72 1oxu n GLY 73 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 1oxu n GLY 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oxu s LYS 74 N -0.18 3.29 -0.33 1.61 2.20 -0.02 -4.97 119.74 121.33 1oxu s LYS 74 Ca 0.00 -0.67 -0.23 0.00 -0.36 0.00 0.00 55.97 54.71 1oxu s LYS 74 Cb 0.00 -2.63 0.00 0.00 -1.51 0.00 0.00 37.83 33.70 1oxu s LYS 74 CO 0.00 0.28 0.76 -1.17 -0.36 0.00 0.00 175.35 174.86 1oxu s LEU 75 N 0.19 4.12 -0.20 5.43 2.96 -1.26 -1.17 118.68 128.75 1oxu s LEU 75 Ca -0.07 0.48 -0.08 0.00 -0.22 0.00 0.00 54.13 54.23 1oxu s LEU 75 Cb -0.15 -3.01 -0.20 0.00 0.50 0.00 0.00 46.19 43.32 1oxu s LEU 75 CO 0.05 -0.65 0.08 -0.38 -1.32 0.00 0.00 176.35 174.12 1oxu n ILE 76 N 5.64 1.62 -4.00 6.68 2.08 -0.04 -4.83 119.36 126.52 1oxu n ILE 76 Ca 0.03 -0.47 -0.31 0.00 0.56 0.00 0.00 62.75 62.56 1oxu n ILE 76 Cb 0.48 -1.73 -0.16 0.00 -0.75 0.00 0.00 39.64 37.48 1oxu n ILE 76 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1oxu s VAL 77 N -2.50 1.67 0.76 1.39 1.01 -0.41 -4.97 120.40 117.36 1oxu s VAL 77 Ca -0.29 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 60.50 1oxu s VAL 77 Cb 0.08 -1.76 0.06 0.00 0.00 0.00 0.00 36.38 34.75 1oxu s VAL 77 CO 0.65 0.13 1.12 -2.84 0.00 0.00 0.00 175.10 174.17 1oxu s PRO 78 N 1.38 2.15 0.25 2.72 0.02 -1.26 -4.85 135.00 135.40 1oxu s PRO 78 Ca -0.02 1.37 -0.03 0.00 0.02 0.00 0.00 61.00 62.34 1oxu s PRO 78 Cb -0.17 -1.87 0.47 0.00 0.02 0.00 0.00 34.50 32.95 1oxu s PRO 78 CO -0.08 -1.75 1.75 -1.00 -0.33 0.00 0.00 177.00 175.59 1oxu h PRO 79 N -0.86 0.50 0.00 5.54 0.13 -1.76 0.28 132.00 135.83 1oxu h PRO 79 Ca -0.45 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1oxu h PRO 79 Cb 1.25 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1oxu h PRO 79 CO 0.50 0.33 0.00 1.05 -0.23 0.00 0.00 178.00 179.65 1oxu h GLU 80 N 0.52 0.00 -0.39 0.86 9.09 -1.91 -1.13 114.58 121.61 1oxu h GLU 80 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.83 1oxu h GLU 80 Cb 0.61 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.71 1oxu h GLU 80 CO -0.38 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.43 1oxu n ASP 81 N -2.69 3.45 -0.07 3.06 8.00 0.08 -4.57 116.55 123.81 1oxu n ASP 81 Ca -0.02 -1.98 0.11 0.00 0.71 0.00 0.00 54.79 53.61 1oxu n ASP 81 Cb 0.10 -0.25 0.06 0.00 -0.02 0.00 0.00 41.12 41.00 1oxu n ASP 81 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1oxu n ARG 82 N 1.46 0.19 -3.07 -1.24 1.74 -0.43 -4.95 116.66 110.36 1oxu n ARG 82 Ca 0.19 -0.14 -0.13 0.00 -0.77 0.00 0.00 57.85 57.00 1oxu n ARG 82 Cb 0.60 -1.50 0.06 0.00 -1.02 0.00 0.00 32.46 30.61 1oxu n ARG 82 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1oxu n LYS 83 N -1.28 -2.72 -4.57 5.56 5.02 -1.26 -4.79 118.16 114.10 1oxu n LYS 83 Ca 0.06 0.75 -0.24 0.00 -2.02 0.00 0.00 58.31 56.86 1oxu n LYS 83 Cb 0.35 -5.31 -0.14 0.00 -0.02 0.00 0.00 35.03 29.91 1oxu n LYS 83 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1oxu s ILE 84 N -3.33 1.48 -0.01 -0.18 1.01 -1.26 -1.11 121.20 117.79 1oxu s ILE 84 Ca 0.32 -1.10 0.06 0.00 0.00 0.00 0.00 60.65 59.93 1oxu s ILE 84 Cb -0.04 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.11 1oxu s ILE 84 CO 0.64 0.16 -0.19 -0.83 0.00 0.00 0.00 174.94 174.73 1oxu s GLY 85 N -1.10 1.48 -0.02 6.18 0.00 0.28 -4.88 107.32 109.26 1oxu s GLY 85 Ca 0.06 -1.08 0.03 0.00 0.00 0.00 0.00 44.72 43.72 1oxu s GLY 85 CO 0.01 -0.91 -0.09 1.06 0.00 0.00 0.00 173.10 173.17 1oxu s MET 86 N -0.92 0.89 -0.25 2.90 -1.94 -1.26 -0.37 119.30 118.34 1oxu s MET 86 Ca 0.12 -0.32 -0.01 0.00 -1.71 0.00 0.00 55.69 53.76 1oxu s MET 86 Cb -0.10 -0.84 0.08 0.00 2.01 0.00 0.00 34.83 35.97 1oxu s MET 86 CO 0.02 0.15 0.05 0.08 -0.01 0.00 0.00 175.02 175.31 1oxu s VAL 87 N 0.01 0.83 0.22 -6.03 1.01 -0.31 -4.68 120.40 111.45 1oxu s VAL 87 Ca -0.00 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 61.00 1oxu s VAL 87 Cb -0.06 -1.43 -0.03 0.00 0.00 0.00 0.00 36.38 34.85 1oxu s VAL 87 CO 0.00 -0.40 0.29 -0.36 0.00 0.00 0.00 175.10 174.63 1oxu s PHE 88 N 1.68 3.35 0.48 5.22 0.08 -1.26 -1.35 117.98 126.18 1oxu s PHE 88 Ca 0.03 -0.01 0.31 0.00 0.12 0.00 0.00 56.93 57.37 1oxu s PHE 88 Cb -0.17 -1.54 1.40 0.00 -0.57 0.00 0.00 43.02 42.13 1oxu s PHE 88 CO -0.15 0.48 1.76 0.37 -0.10 0.00 0.00 175.22 177.58 1oxu h GLN 89 N 1.55 0.14 -0.00 0.44 4.15 -0.93 0.78 115.11 121.24 1oxu h GLN 89 Ca -0.50 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.91 1oxu h GLN 89 Cb 1.22 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1oxu h GLN 89 CO 0.63 0.09 -0.41 0.25 -1.93 0.00 0.00 178.83 177.45 1oxu n THR 90 N -4.37 0.00 -1.02 2.39 -2.24 -1.26 -4.97 114.28 102.81 1oxu n THR 90 Ca 0.28 -0.01 -0.33 0.00 -2.27 0.00 0.00 64.05 61.72 1oxu n THR 90 Cb 1.19 0.15 -0.01 0.00 -2.10 0.00 0.00 70.33 69.56 1oxu n THR 90 CO 0.00 0.00 0.00 -2.67 -0.57 0.00 0.00 175.07 171.83 1oxu n TRP 91 N -1.45 -1.26 -3.63 4.78 4.27 0.27 -4.99 117.44 115.43 1oxu n TRP 91 Ca 0.06 0.55 -0.15 0.00 -3.89 0.00 0.00 57.50 54.08 1oxu n TRP 91 Cb 0.34 -1.40 -0.07 0.00 -1.36 0.00 0.00 31.31 28.81 1oxu n TRP 91 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1oxu s ALA 92 N -1.14 -1.54 0.33 -1.67 0.00 -1.26 -5.01 121.76 111.47 1oxu s ALA 92 Ca 0.46 1.50 -0.19 0.00 0.00 0.00 0.00 51.96 53.73 1oxu s ALA 92 Cb -0.55 -0.62 -0.09 0.00 0.00 0.00 0.00 23.12 21.86 1oxu s ALA 92 CO 0.47 -0.32 0.82 -0.51 0.00 0.00 0.00 175.76 176.22 1oxu s LEU 93 N -0.28 4.13 -0.23 0.00 1.43 -1.26 -4.99 118.68 117.49 1oxu s LEU 93 Ca -0.05 1.49 -0.29 0.00 -1.03 0.00 0.00 54.13 54.26 1oxu s LEU 93 Cb -0.03 -4.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.08 1oxu s LEU 93 CO 0.04 -0.18 1.63 -0.31 0.23 0.00 0.00 176.35 177.77 1oxu s TYR 94 N -1.89 2.07 0.52 0.29 1.51 -1.26 -4.87 117.35 113.72 1oxu s TYR 94 Ca 0.53 0.54 0.28 0.00 -1.01 0.00 0.00 57.07 57.41 1oxu s TYR 94 Cb -0.12 -4.00 1.64 0.00 -0.11 0.00 0.00 41.96 39.37 1oxu s TYR 94 CO 0.18 -2.97 2.18 -1.00 -1.11 0.00 0.00 175.55 172.82 1oxu h PRO 95 N 10.89 0.00 -0.67 -1.71 0.13 -1.99 -2.60 132.00 136.05 1oxu h PRO 95 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1oxu h PRO 95 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1oxu h PRO 95 CO 1.00 0.05 0.00 0.09 -0.23 0.00 0.00 178.00 178.91 1oxu n ASN 96 N -3.80 4.46 -4.48 1.44 3.02 -1.26 -4.46 115.26 110.18 1oxu n ASN 96 Ca -0.03 -2.30 -0.32 0.00 -0.03 0.00 0.00 54.58 51.91 1oxu n ASN 96 Cb 0.15 -0.54 -0.13 0.00 -0.61 0.00 0.00 39.78 38.65 1oxu n ASN 96 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1oxu s LEU 97 N -1.56 2.71 1.19 3.41 1.43 -0.98 -5.12 118.68 119.76 1oxu s LEU 97 Ca 0.50 -0.30 -0.18 0.00 -1.03 0.00 0.00 54.13 53.12 1oxu s LEU 97 Cb 0.30 -1.57 0.28 0.00 0.03 0.00 0.00 46.19 45.23 1oxu s LEU 97 CO 0.27 0.29 1.08 0.42 0.23 0.00 0.00 176.35 178.64 1oxu s THR 98 N -0.85 1.67 0.13 5.49 -4.23 -1.26 -4.27 115.64 112.32 1oxu s THR 98 Ca 0.14 0.00 -0.19 0.00 -1.18 0.00 0.00 61.69 60.46 1oxu s THR 98 Cb -0.11 -2.41 -0.05 0.00 1.34 0.00 0.00 72.50 71.28 1oxu s THR 98 CO 0.04 0.00 1.78 0.00 -0.54 0.00 0.00 174.62 175.90 1oxu h ALA 99 N -2.55 0.30 -0.12 3.99 0.00 -0.45 -0.54 119.26 119.89 1oxu h ALA 99 Ca -0.48 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.46 1oxu h ALA 99 Cb 1.31 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 1oxu h ALA 99 CO 0.40 -0.22 -0.35 0.35 0.00 0.00 0.00 179.25 179.43 1oxu h PHE 100 N 0.32 -0.97 -0.79 0.00 3.57 -1.19 -1.40 116.94 116.49 1oxu h PHE 100 Ca 0.09 0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.68 1oxu h PHE 100 Cb -0.04 0.44 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 1oxu h PHE 100 CO -0.06 -0.42 0.52 0.93 -2.23 0.00 0.00 178.31 177.05 1oxu h GLU 101 N -0.43 0.88 -0.26 1.11 5.08 -1.78 0.28 114.58 119.46 1oxu h GLU 101 Ca 0.09 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1oxu h GLU 101 Cb 0.57 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1oxu h GLU 101 CO -0.36 0.58 0.03 -0.91 -1.00 0.00 0.00 179.01 177.35 1oxu h ASN 102 N 0.90 0.42 0.05 1.42 2.35 -0.61 -1.77 115.58 118.34 1oxu h ASN 102 Ca 0.33 -0.27 -0.10 0.00 -0.55 0.00 0.00 56.30 55.70 1oxu h ASN 102 Cb 0.16 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 1oxu h ASN 102 CO -0.11 0.59 -0.33 0.40 -1.65 0.00 0.00 177.43 176.33 1oxu h ILE 103 N 0.24 1.28 0.00 2.81 2.04 -0.72 -3.05 117.51 120.11 1oxu h ILE 103 Ca 0.08 -1.39 -0.03 0.00 1.00 0.00 0.00 64.86 64.51 1oxu h ILE 103 Cb 0.35 1.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 1oxu h ILE 103 CO 0.01 0.43 -0.16 0.00 0.00 0.00 0.00 178.15 178.43 1oxu h ALA 104 N 1.30 0.92 -0.62 1.87 0.00 -0.87 -3.37 119.26 118.48 1oxu h ALA 104 Ca 0.04 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 54.92 1oxu h ALA 104 Cb 0.75 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 18.40 1oxu h ALA 104 CO 0.06 0.19 -0.30 0.35 0.00 0.00 0.00 179.25 179.55 1oxu h PHE 105 N 0.00 -0.80 0.00 0.00 3.57 -1.20 0.15 116.94 118.65 1oxu h PHE 105 Ca -0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1oxu h PHE 105 Cb 1.02 0.45 0.00 0.00 2.79 0.00 0.00 35.95 40.21 1oxu h PHE 105 CO 0.00 -0.37 0.13 -1.35 -2.23 0.00 0.00 178.31 174.50 1oxu h PRO 106 N -0.12 0.00 -0.01 6.41 0.11 -1.79 -1.17 132.00 135.42 1oxu h PRO 106 Ca 0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.37 1oxu h PRO 106 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 1oxu h PRO 106 CO -0.70 0.00 -0.03 1.28 -0.21 0.00 0.00 178.00 178.35 1oxu n LEU 107 N -2.79 1.31 -0.23 2.35 4.77 0.52 -4.45 117.00 118.48 1oxu n LEU 107 Ca -0.02 -0.43 -0.00 0.00 -0.03 0.00 0.00 56.01 55.53 1oxu n LEU 107 Cb 0.18 -0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.32 1oxu n LEU 107 CO 0.15 0.22 0.71 0.74 -1.33 0.00 0.00 177.39 177.88 1oxu h THR 108 N 2.02 0.28 -0.59 -5.08 2.02 -1.26 -2.11 112.91 108.19 1oxu h THR 108 Ca 0.00 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.01 1oxu h THR 108 Cb 0.46 0.28 -0.10 0.00 -1.74 0.00 0.00 68.15 67.05 1oxu h THR 108 CO 0.00 0.00 0.17 0.59 0.37 0.00 0.00 175.52 176.65 1oxu n ASN 109 N -5.46 4.31 -1.13 4.18 3.02 -1.26 -4.55 115.26 114.36 1oxu n ASN 109 Ca 0.08 -3.27 0.08 0.00 -0.03 0.00 0.00 54.58 51.45 1oxu n ASN 109 Cb 0.36 -0.69 0.26 0.00 -0.61 0.00 0.00 39.78 39.10 1oxu n ASN 109 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1oxu n MET 110 N -0.37 2.63 -3.63 3.52 2.81 -0.79 -4.93 117.12 116.36 1oxu n MET 110 Ca 0.36 -2.07 -0.24 0.00 -1.81 0.00 0.00 57.70 53.94 1oxu n MET 110 Cb 1.24 -1.57 0.07 0.00 -0.71 0.00 0.00 33.22 32.26 1oxu n MET 110 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1oxu n LYS 111 N 0.98 -7.35 -4.50 0.03 5.02 -1.26 -4.99 118.16 106.08 1oxu n LYS 111 Ca 0.19 0.79 -0.33 0.00 -2.02 0.00 0.00 58.31 56.94 1oxu n LYS 111 Cb 0.57 -5.81 -0.11 0.00 -0.02 0.00 0.00 35.03 29.67 1oxu n LYS 111 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1oxu s MET 112 N -6.22 2.65 0.84 1.97 -1.94 -1.26 -5.11 119.30 110.22 1oxu s MET 112 Ca 0.50 -0.65 -0.12 0.00 -1.71 0.00 0.00 55.69 53.72 1oxu s MET 112 Cb -0.23 -2.55 0.10 0.00 2.01 0.00 0.00 34.83 34.16 1oxu s MET 112 CO 0.75 0.63 1.10 -1.54 -0.01 0.00 0.00 175.02 175.94 1oxu s SER 113 N -1.20 4.03 0.29 3.03 1.04 -1.26 -4.79 113.70 114.84 1oxu s SER 113 Ca 0.16 1.35 0.00 0.00 0.48 0.00 0.00 55.95 57.94 1oxu s SER 113 Cb -0.11 -2.06 0.52 0.00 0.10 0.00 0.00 66.02 64.47 1oxu s SER 113 CO 0.05 -2.27 1.90 0.11 0.98 0.00 0.00 173.24 174.01 1oxu h LYS 114 N -1.29 1.02 -0.27 4.02 1.57 -1.99 -0.91 116.57 118.71 1oxu h LYS 114 Ca -0.48 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.09 1oxu h LYS 114 Cb 1.28 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1oxu h LYS 114 CO 0.58 0.67 -0.43 0.93 -0.57 0.00 0.00 179.45 180.63 1oxu h GLU 115 N 1.05 0.69 -0.33 3.15 4.39 -1.99 -1.73 114.58 119.80 1oxu h GLU 115 Ca 0.41 -0.37 -0.09 0.00 0.34 0.00 0.00 59.36 59.65 1oxu h GLU 115 Cb 0.24 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 1oxu h GLU 115 CO -0.17 0.98 -0.17 0.93 -1.16 0.00 0.00 179.01 179.43 1oxu h GLU 116 N 0.56 0.61 0.04 2.33 5.08 -1.72 -1.74 114.58 119.74 1oxu h GLU 116 Ca 0.04 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.19 1oxu h GLU 116 Cb 0.98 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1oxu h GLU 116 CO 0.09 0.75 -0.02 0.82 -1.00 0.00 0.00 179.01 179.65 1oxu h ILE 117 N 0.55 1.18 -0.40 3.13 2.04 -1.05 -2.29 117.51 120.67 1oxu h ILE 117 Ca 0.09 -0.71 0.06 0.00 1.00 0.00 0.00 64.86 65.29 1oxu h ILE 117 Cb 0.61 1.65 -0.05 0.00 -0.74 0.00 0.00 36.82 38.29 1oxu h ILE 117 CO 0.04 0.18 0.09 -0.09 0.00 0.00 0.00 178.15 178.37 1oxu h ARG 118 N -0.37 0.21 -0.30 2.37 2.43 -1.23 0.04 114.38 117.53 1oxu h ARG 118 Ca -0.01 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1oxu h ARG 118 Cb 0.34 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 1oxu h ARG 118 CO 0.01 0.14 0.14 0.87 -1.51 0.00 0.00 179.97 179.62 1oxu h LYS 119 N 0.22 0.29 -0.31 0.20 1.57 -1.30 -0.15 116.57 117.09 1oxu h LYS 119 Ca 0.19 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.94 1oxu h LYS 119 Cb 0.22 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1oxu h LYS 119 CO -0.24 0.19 0.13 -0.09 -0.57 0.00 0.00 179.45 178.87 1oxu h ARG 120 N 0.30 0.46 -0.42 3.15 9.65 -1.02 -1.29 114.38 125.22 1oxu h ARG 120 Ca 0.13 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 1oxu h ARG 120 Cb 0.05 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 1oxu h ARG 120 CO -0.09 0.47 0.27 0.28 2.80 0.00 0.00 179.97 183.70 1oxu h VAL 121 N 0.36 1.12 -0.51 0.20 2.07 -0.78 -2.30 116.25 116.41 1oxu h VAL 121 Ca 0.10 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.32 1oxu h VAL 121 Cb 0.17 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1oxu h VAL 121 CO -0.01 0.11 0.02 -0.33 0.02 0.00 0.00 177.57 177.39 1oxu h GLU 122 N 0.57 0.83 0.18 1.57 5.08 -0.88 -0.22 114.58 121.71 1oxu h GLU 122 Ca 0.15 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1oxu h GLU 122 Cb -0.05 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.10 1oxu h GLU 122 CO -0.03 0.82 -0.09 0.93 -1.00 0.00 0.00 179.01 179.64 1oxu h GLU 123 N 0.78 -0.23 -0.29 2.33 5.08 -1.03 -0.76 114.58 120.46 1oxu h GLU 123 Ca 0.15 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 1oxu h GLU 123 Cb 0.43 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1oxu h GLU 123 CO 0.02 -0.12 -0.23 -0.24 -1.00 0.00 0.00 179.01 177.45 1oxu h VAL 124 N -0.29 1.26 -0.83 3.13 3.04 -1.32 -2.43 116.25 118.81 1oxu h VAL 124 Ca -0.02 -1.25 0.00 0.00 -1.01 0.00 0.00 66.70 64.42 1oxu h VAL 124 Cb 0.22 1.29 -0.04 0.00 -2.01 0.00 0.00 31.29 30.75 1oxu h VAL 124 CO 0.04 0.40 0.52 0.00 -1.01 0.00 0.00 177.57 177.53 1oxu h ALA 125 N 1.27 1.06 -0.46 3.17 0.00 -0.81 -1.63 119.26 121.85 1oxu h ALA 125 Ca 0.07 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1oxu h ALA 125 Cb 0.66 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1oxu h ALA 125 CO 0.05 0.50 0.20 0.87 0.00 0.00 0.00 179.25 180.87 1oxu h LYS 126 N 1.14 0.68 -0.79 0.00 1.57 -0.92 -0.49 116.57 117.76 1oxu h LYS 126 Ca 0.30 -0.11 0.07 0.00 -1.87 0.00 0.00 60.65 59.04 1oxu h LYS 126 Cb -0.08 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.05 1oxu h LYS 126 CO -0.06 0.59 0.47 0.82 -0.57 0.00 0.00 179.45 180.70 1oxu h ILE 127 N 0.60 0.99 -0.10 1.86 2.04 -0.92 -1.49 117.51 120.49 1oxu h ILE 127 Ca 0.16 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1oxu h ILE 127 Cb 0.15 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.31 1oxu h ILE 127 CO -0.02 0.15 0.00 0.18 0.00 0.00 0.00 178.15 178.47 1oxu n LEU 128 N -4.70 1.11 -3.71 1.44 7.99 -0.67 -4.94 117.00 113.52 1oxu n LEU 128 Ca 0.11 -0.46 -0.25 0.00 -0.01 0.00 0.00 56.01 55.41 1oxu n LEU 128 Cb 0.19 -0.06 0.05 0.00 -0.11 0.00 0.00 43.42 43.49 1oxu n LEU 128 CO 0.30 0.23 0.10 -0.67 -1.51 0.00 0.00 177.39 175.84 1oxu n ASP 129 N -0.05 -3.93 -0.24 -1.43 2.03 -0.45 -4.88 116.55 107.60 1oxu n ASP 129 Ca 0.16 -0.71 0.03 0.00 0.52 0.00 0.00 54.79 54.79 1oxu n ASP 129 Cb 0.25 -4.40 0.04 0.00 -0.72 0.00 0.00 41.12 36.29 1oxu n ASP 129 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 1oxu n ILE 130 N -4.59 0.70 -0.33 5.18 -5.35 -0.32 -4.80 119.36 109.86 1oxu n ILE 130 Ca -0.10 -0.82 0.04 0.00 -0.27 0.00 0.00 62.75 61.60 1oxu n ILE 130 Cb 0.59 0.34 0.23 0.00 -1.74 0.00 0.00 39.64 39.06 1oxu n ILE 130 CO 0.00 0.00 0.00 -0.74 -1.76 0.00 0.00 176.55 174.05 1oxu h HIS 131 N 0.00 1.09 0.00 4.28 2.76 -1.86 -1.99 115.15 119.43 1oxu h HIS 131 Ca 0.00 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1oxu h HIS 131 Cb 1.12 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 29.72 1oxu h HIS 131 CO 0.04 0.54 0.00 -2.39 -1.30 0.00 0.00 177.93 174.83 1oxu n HIS 132 N -4.51 0.00 -1.41 5.26 1.44 -1.26 -2.96 115.22 111.77 1oxu n HIS 132 Ca 0.15 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 55.94 1oxu n HIS 132 Cb 0.23 -0.41 0.17 0.00 0.12 0.00 0.00 29.99 30.10 1oxu n HIS 132 CO 0.00 0.00 0.00 1.33 -2.81 0.00 0.00 176.34 174.86 1oxu n VAL 133 N -1.41 1.98 0.26 0.61 0.24 -0.75 -4.78 118.33 114.48 1oxu n VAL 133 Ca 0.07 -2.73 0.09 0.00 -2.04 0.00 0.00 64.34 59.73 1oxu n VAL 133 Cb 0.19 -0.20 0.66 0.00 -1.47 0.00 0.00 33.84 33.03 1oxu n VAL 133 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1oxu h LEU 134 N 0.57 0.00 -0.27 1.34 3.38 -1.49 -1.85 115.31 116.99 1oxu h LEU 134 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1oxu h LEU 134 Cb 1.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1oxu h LEU 134 CO 0.00 0.07 -0.07 -0.46 0.09 0.00 0.00 178.44 178.08 1oxu n ASN 135 N -4.23 0.49 -4.80 -0.43 6.94 -1.26 -0.69 115.26 111.28 1oxu n ASN 135 Ca -0.03 -0.74 -0.35 0.00 -0.02 0.00 0.00 54.58 53.45 1oxu n ASN 135 Cb 0.16 -0.06 -0.06 0.00 -2.36 0.00 0.00 39.78 37.45 1oxu n ASN 135 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1oxu s HIS 136 N -2.34 3.42 0.46 -2.53 3.76 -0.70 -4.75 115.29 112.62 1oxu s HIS 136 Ca 0.33 1.67 -0.10 0.00 -0.15 0.00 0.00 55.06 56.81 1oxu s HIS 136 Cb 0.20 -2.90 -0.06 0.00 1.11 0.00 0.00 32.58 30.94 1oxu s HIS 136 CO 0.44 -0.07 0.84 -0.06 -0.85 0.00 0.00 174.74 175.04 1oxu s PHE 137 N -1.95 3.51 0.38 1.40 0.40 -1.26 -0.24 117.98 120.21 1oxu s PHE 137 Ca 0.58 1.08 0.12 0.00 -0.60 0.00 0.00 56.93 58.12 1oxu s PHE 137 Cb -0.13 -2.49 0.93 0.00 0.51 0.00 0.00 43.02 41.83 1oxu s PHE 137 CO 0.18 -0.26 1.86 -1.35 0.70 0.00 0.00 175.22 176.35 1oxu h PRO 138 N 0.78 0.55 0.00 0.24 0.11 -1.78 0.11 132.00 132.01 1oxu h PRO 138 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1oxu h PRO 138 Cb 1.19 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1oxu h PRO 138 CO 0.63 0.36 0.00 0.07 -0.21 0.00 0.00 178.00 178.85 1oxu h ARG 139 N 0.57 0.00 -0.13 1.05 0.11 -1.93 -1.48 114.38 112.56 1oxu h ARG 139 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 1oxu h ARG 139 Cb 0.92 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.00 1oxu h ARG 139 CO -0.21 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.25 1oxu n GLU 140 N -3.08 1.71 -4.10 0.08 1.02 0.39 -4.91 120.64 111.75 1oxu n GLU 140 Ca -0.01 -1.05 -0.29 0.00 -0.02 0.00 0.00 57.16 55.79 1oxu n GLU 140 Cb 0.22 -1.41 -0.07 0.00 -0.02 0.00 0.00 31.44 30.16 1oxu n GLU 140 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1oxu s LEU 141 N -1.66 3.66 0.82 -4.62 1.43 -0.56 -4.95 118.68 112.80 1oxu s LEU 141 Ca 0.34 -0.13 -0.11 0.00 -1.03 0.00 0.00 54.13 53.19 1oxu s LEU 141 Cb 0.18 -2.33 0.08 0.00 0.03 0.00 0.00 46.19 44.15 1oxu s LEU 141 CO 0.28 0.13 1.09 -0.94 0.23 0.00 0.00 176.35 177.14 1oxu s SER 142 N -2.66 4.26 0.26 2.29 1.04 -1.26 -4.80 113.70 112.83 1oxu s SER 142 Ca 0.29 1.38 -0.02 0.00 0.48 0.00 0.00 55.95 58.07 1oxu s SER 142 Cb -0.11 -2.10 0.43 0.00 0.10 0.00 0.00 66.02 64.34 1oxu s SER 142 CO 0.21 -2.13 1.86 1.23 0.98 0.00 0.00 173.24 175.39 1oxu h GLY 143 N -1.20 1.49 1.02 7.32 0.00 -1.99 0.10 103.07 109.81 1oxu h GLY 143 Ca -0.47 -0.43 -0.05 0.00 0.00 0.00 0.00 47.33 46.37 1oxu h GLY 143 CO 0.58 0.26 0.20 -1.33 0.00 0.00 0.00 176.54 176.24 1oxu h GLY 144 N 1.06 1.07 1.42 4.60 0.00 -1.98 -2.51 103.07 106.72 1oxu h GLY 144 Ca 0.43 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 47.02 1oxu h GLY 144 CO -0.20 0.60 -0.22 1.46 0.00 0.00 0.00 176.54 178.18 1oxu h GLN 145 N 0.92 0.67 -0.24 4.80 4.20 -1.68 -2.30 115.11 121.49 1oxu h GLN 145 Ca 0.21 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.67 1oxu h GLN 145 Cb 0.30 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.02 1oxu h GLN 145 CO -0.01 0.84 0.13 1.96 -0.67 0.00 0.00 178.83 181.08 1oxu h GLN 146 N 0.59 0.27 -0.95 1.46 4.20 -0.72 -0.44 115.11 119.53 1oxu h GLN 146 Ca 0.09 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1oxu h GLN 146 Cb 0.69 -0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.36 1oxu h GLN 146 CO 0.05 0.18 0.59 1.96 -0.67 0.00 0.00 178.83 180.94 1oxu h GLN 147 N 0.28 1.27 -0.70 1.46 1.08 -1.33 -0.71 115.11 116.46 1oxu h GLN 147 Ca 0.09 -0.10 -0.03 0.00 -1.45 0.00 0.00 58.65 57.16 1oxu h GLN 147 Cb 0.00 -0.27 -0.03 0.00 -0.05 0.00 0.00 27.48 27.13 1oxu h GLN 147 CO -0.05 0.87 0.32 0.00 -0.95 0.00 0.00 178.83 179.02 1oxu h ARG 148 N 1.30 1.00 -0.42 1.46 3.08 -0.88 0.00 114.38 119.92 1oxu h ARG 148 Ca 0.34 -0.14 -0.10 0.00 0.07 0.00 0.00 59.98 60.15 1oxu h ARG 148 Cb -0.09 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.76 1oxu h ARG 148 CO -0.07 0.78 -0.14 0.28 -1.07 0.00 0.00 179.97 179.76 1oxu h VAL 149 N 0.99 1.28 -0.63 2.04 2.07 -0.36 -0.58 116.25 121.06 1oxu h VAL 149 Ca 0.24 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 1oxu h VAL 149 Cb 0.13 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 1oxu h VAL 149 CO -0.03 0.42 0.22 0.00 0.02 0.00 0.00 177.57 178.21 1oxu h ALA 150 N 0.84 1.21 -0.24 1.67 0.00 -0.68 -0.67 119.26 121.39 1oxu h ALA 150 Ca 0.10 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1oxu h ALA 150 Cb 0.68 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1oxu h ALA 150 CO 0.05 0.56 -0.11 -0.07 0.00 0.00 0.00 179.25 179.68 1oxu h LEU 151 N 0.91 0.52 -0.81 0.00 3.38 -0.81 -1.61 115.31 116.89 1oxu h LEU 151 Ca 0.21 -0.41 0.06 0.00 0.09 0.00 0.00 57.88 57.84 1oxu h LEU 151 Cb 0.22 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.76 1oxu h LEU 151 CO -0.01 0.81 0.49 0.00 0.09 0.00 0.00 178.44 179.82 1oxu h ALA 152 N 0.72 1.11 -0.70 1.53 0.00 -0.89 -1.17 119.26 119.87 1oxu h ALA 152 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1oxu h ALA 152 Cb 0.62 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1oxu h ALA 152 CO 0.04 0.20 0.37 -0.09 0.00 0.00 0.00 179.25 179.76 1oxu h ARG 153 N 0.88 0.99 0.00 0.00 2.43 -0.93 -1.44 114.38 116.31 1oxu h ARG 153 Ca 0.36 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1oxu h ARG 153 Cb 0.20 -0.19 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 1oxu h ARG 153 CO -0.18 0.76 -0.03 0.00 -1.51 0.00 0.00 179.97 179.00 1oxu h ALA 154 N 1.18 1.01 -0.14 2.80 0.00 -0.38 -3.13 119.26 120.59 1oxu h ALA 154 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1oxu h ALA 154 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1oxu h ALA 154 CO -0.04 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1oxu n LEU 155 N -3.15 2.63 0.23 0.00 4.77 -0.53 -4.11 117.00 116.85 1oxu n LEU 155 Ca 0.00 -1.24 0.08 0.00 -0.03 0.00 0.00 56.01 54.82 1oxu n LEU 155 Cb 0.31 -0.08 0.56 0.00 -2.33 0.00 0.00 43.42 41.87 1oxu n LEU 155 CO 0.28 0.53 0.88 1.62 -1.33 0.00 0.00 177.39 179.37 1oxu h VAL 156 N 3.22 0.91 -0.41 4.08 3.04 -1.23 -1.97 116.25 123.88 1oxu h VAL 156 Ca 0.00 -0.78 -0.00 0.00 -1.01 0.00 0.00 66.70 64.91 1oxu h VAL 156 Cb 0.73 1.45 -0.00 0.00 -2.01 0.00 0.00 31.29 31.46 1oxu h VAL 156 CO 0.00 0.20 0.00 0.29 -1.01 0.00 0.00 177.57 177.05 1oxu n LYS 157 N -3.94 3.78 -3.57 4.17 5.02 -1.26 -4.94 118.16 117.41 1oxu n LYS 157 Ca -0.02 -2.24 -0.23 0.00 -2.02 0.00 0.00 58.31 53.80 1oxu n LYS 157 Cb 0.29 -2.05 0.05 0.00 -0.02 0.00 0.00 35.03 33.30 1oxu n LYS 157 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1oxu n ASP 158 N 0.44 -4.13 -4.78 4.39 2.03 -0.74 -4.96 116.55 108.80 1oxu n ASP 158 Ca 0.20 -0.86 -0.30 0.00 0.52 0.00 0.00 54.79 54.35 1oxu n ASP 158 Cb 0.93 -4.13 0.10 0.00 -0.72 0.00 0.00 41.12 37.30 1oxu n ASP 158 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1oxu s PRO 159 N -5.55 1.98 0.04 -0.67 0.04 -1.26 -4.98 135.00 124.59 1oxu s PRO 159 Ca 0.30 0.75 0.22 0.00 0.04 0.00 0.00 61.00 62.30 1oxu s PRO 159 Cb -0.08 -1.90 -0.20 0.00 0.04 0.00 0.00 34.50 32.36 1oxu s PRO 159 CO 0.81 -1.72 0.71 0.43 0.04 0.00 0.00 177.00 177.28 1oxu n SER 160 N -3.52 0.35 -3.99 6.66 7.64 -0.27 -4.88 113.62 115.62 1oxu n SER 160 Ca 0.07 -0.03 -0.22 0.00 1.01 0.00 0.00 58.87 59.71 1oxu n SER 160 Cb 0.56 1.41 -0.16 0.00 -1.01 0.00 0.00 64.21 65.00 1oxu n SER 160 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1oxu s LEU 161 N -4.52 1.65 -0.14 -3.43 2.96 -1.10 -1.02 118.68 113.07 1oxu s LEU 161 Ca -0.04 -0.22 0.00 0.00 -0.22 0.00 0.00 54.13 53.66 1oxu s LEU 161 Cb 0.13 -0.64 -0.01 0.00 0.50 0.00 0.00 46.19 46.17 1oxu s LEU 161 CO 0.86 0.04 -0.15 -0.22 -1.32 0.00 0.00 176.35 175.56 1oxu s LEU 162 N 0.49 2.51 -0.17 -0.68 2.96 -0.38 -0.56 118.68 122.85 1oxu s LEU 162 Ca -0.09 -0.44 -0.02 0.00 -0.22 0.00 0.00 54.13 53.36 1oxu s LEU 162 Cb -0.12 -1.56 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 1oxu s LEU 162 CO 0.02 0.12 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.33 1oxu s LEU 163 N 0.64 2.90 -0.19 -0.68 1.43 0.50 -1.78 118.68 121.50 1oxu s LEU 163 Ca -0.08 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1oxu s LEU 163 Cb -0.16 -1.70 0.03 0.00 0.03 0.00 0.00 46.19 44.39 1oxu s LEU 163 CO 0.03 0.09 -0.18 -0.76 0.23 0.00 0.00 176.35 175.76 1oxu s LEU 164 N 0.79 2.35 -0.50 1.79 1.02 -0.03 -1.16 118.68 122.94 1oxu s LEU 164 Ca -0.03 -0.78 -0.07 0.00 0.02 0.00 0.00 54.13 53.27 1oxu s LEU 164 Cb -0.15 -1.47 0.13 0.00 0.02 0.00 0.00 46.19 44.72 1oxu s LEU 164 CO 0.01 -0.04 0.36 -0.62 0.02 0.00 0.00 176.35 176.08 1oxu s ASP 165 N 1.27 5.61 -1.27 2.29 -1.08 -0.46 -0.79 116.67 122.23 1oxu s ASP 165 Ca 0.02 -2.13 -0.16 0.00 -0.52 0.00 0.00 52.55 49.76 1oxu s ASP 165 Cb -0.14 -1.96 0.01 0.00 -1.46 0.00 0.00 42.92 39.36 1oxu s ASP 165 CO -0.11 -0.61 0.58 -0.62 0.52 0.00 0.00 175.17 174.93 1oxu n GLU 166 N 4.57 -1.61 0.06 4.34 1.02 0.10 -0.38 120.64 128.74 1oxu n GLU 166 Ca -0.03 0.32 -0.09 0.00 -0.02 0.00 0.00 57.16 57.34 1oxu n GLU 166 Cb 0.41 -3.84 0.03 0.00 -0.02 0.00 0.00 31.44 28.02 1oxu n GLU 166 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1oxu h PRO 167 N -2.04 0.33 -2.00 3.49 0.13 -1.84 -3.35 132.00 126.73 1oxu h PRO 167 Ca -0.67 -0.29 -0.10 0.00 -0.87 0.00 0.00 66.00 64.07 1oxu h PRO 167 Cb 1.38 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.53 1oxu h PRO 167 CO 0.55 0.94 -0.19 1.19 -0.23 0.00 0.00 178.00 180.26 1oxu n PHE 168 N -3.80 0.03 -0.03 1.56 0.99 -1.26 -4.25 117.46 110.69 1oxu n PHE 168 Ca -0.04 -1.27 -0.17 0.00 -0.00 0.00 0.00 57.45 55.97 1oxu n PHE 168 Cb 0.72 -1.06 -0.14 0.00 -1.00 0.00 0.00 39.48 38.00 1oxu n PHE 168 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1oxu n SER 169 N 1.99 1.70 0.07 4.37 3.41 -1.26 -4.04 113.62 119.87 1oxu n SER 169 Ca 0.22 0.18 0.11 0.00 -0.26 0.00 0.00 58.87 59.12 1oxu n SER 169 Cb 0.71 -0.50 0.44 0.00 -0.26 0.00 0.00 64.21 64.60 1oxu n SER 169 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1oxu n ASN 170 N -3.31 0.42 -4.93 4.04 3.02 -1.26 -4.78 115.26 108.46 1oxu n ASN 170 Ca -0.31 0.59 -0.25 0.00 -0.03 0.00 0.00 54.58 54.58 1oxu n ASN 170 Cb 1.05 -0.68 -0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1oxu n ASN 170 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1oxu s LEU 171 N -3.89 4.03 0.00 3.41 1.02 -1.26 -5.11 118.68 116.88 1oxu s LEU 171 Ca 0.07 0.50 0.00 0.00 0.02 0.00 0.00 54.13 54.72 1oxu s LEU 171 Cb 0.11 -3.35 0.00 0.00 0.02 0.00 0.00 46.19 42.96 1oxu s LEU 171 CO 0.39 -0.26 0.00 0.47 0.02 0.00 0.00 176.35 176.97 1oxu n ASP 172 N -1.55 0.00 -0.08 2.29 8.00 -1.26 -4.87 116.55 119.08 1oxu n ASP 172 Ca -0.04 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.37 1oxu n ASP 172 Cb 0.55 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.56 1oxu n ASP 172 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1oxu n ALA 173 N -3.00 1.64 -0.13 2.24 0.00 -1.26 -2.72 120.51 117.29 1oxu n ALA 173 Ca 0.00 -0.82 -0.13 0.00 0.00 0.00 0.00 53.44 52.49 1oxu n ALA 173 Cb 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 19.45 19.46 1oxu n ALA 173 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 1oxu h ARG 174 N 0.00 0.94 0.00 0.00 -0.00 -2.01 -2.73 114.38 110.59 1oxu h ARG 174 Ca -0.38 -0.46 -0.10 0.00 -0.00 0.00 0.00 59.98 59.04 1oxu h ARG 174 Cb 1.72 -0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 31.68 1oxu h ARG 174 CO -0.02 1.12 -0.46 0.52 -0.00 0.00 0.00 179.97 181.13 1oxu h MET 175 N 0.77 0.00 -0.34 0.08 2.07 -1.96 -3.10 114.93 112.44 1oxu h MET 175 Ca 0.08 0.00 -0.15 0.00 -2.07 0.00 0.00 59.70 57.56 1oxu h MET 175 Cb 0.90 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.63 1oxu h MET 175 CO 0.08 0.46 -0.36 0.00 1.07 0.00 0.00 176.91 178.16 1oxu h ARG 176 N 0.00 0.85 -0.20 1.72 3.08 -1.29 0.53 114.38 119.07 1oxu h ARG 176 Ca -0.00 -0.46 0.00 0.00 0.07 0.00 0.00 59.98 59.59 1oxu h ARG 176 Cb 0.96 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1oxu h ARG 176 CO 0.06 1.10 0.13 -0.44 -1.07 0.00 0.00 179.97 179.74 1oxu h ASP 177 N 0.64 0.23 -0.32 7.04 3.45 -1.49 -1.23 116.42 124.75 1oxu h ASP 177 Ca 0.05 -0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.48 1oxu h ASP 177 Cb 0.95 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 39.65 1oxu h ASP 177 CO 0.09 0.18 0.15 0.28 -1.57 0.00 0.00 179.24 178.37 1oxu h SER 178 N 0.26 0.42 -0.88 6.45 0.02 -1.46 -0.55 113.55 117.82 1oxu h SER 178 Ca 0.07 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1oxu h SER 178 Cb -0.01 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1oxu h SER 178 CO -0.01 0.43 0.46 0.00 -1.14 0.00 0.00 176.83 176.57 1oxu h ALA 179 N 1.01 1.13 -0.22 3.77 0.00 -0.80 0.63 119.26 124.78 1oxu h ALA 179 Ca 0.11 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1oxu h ALA 179 Cb 0.12 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 1oxu h ALA 179 CO -0.01 0.66 -0.01 0.00 0.00 0.00 0.00 179.25 179.88 1oxu h ARG 180 N 1.24 0.40 -0.86 0.00 3.08 -1.00 -1.92 114.38 115.32 1oxu h ARG 180 Ca 0.31 -0.13 0.06 0.00 0.07 0.00 0.00 59.98 60.28 1oxu h ARG 180 Cb 0.06 -0.03 -0.06 0.00 0.08 0.00 0.00 29.97 30.01 1oxu h ARG 180 CO -0.05 0.60 0.54 0.00 -1.07 0.00 0.00 179.97 179.99 1oxu h ALA 181 N 0.79 1.18 -0.72 0.04 0.00 -0.80 -2.25 119.26 117.51 1oxu h ALA 181 Ca 0.06 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1oxu h ALA 181 Cb 0.43 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1oxu h ALA 181 CO 0.01 0.29 0.32 1.25 0.00 0.00 0.00 179.25 181.12 1oxu h LEU 182 N 0.99 0.96 -0.64 0.00 5.85 -0.68 -1.99 115.31 119.81 1oxu h LEU 182 Ca 0.37 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.98 1oxu h LEU 182 Cb 0.16 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 1oxu h LEU 182 CO -0.17 0.85 0.38 0.58 -0.34 0.00 0.00 178.44 179.73 1oxu h VAL 183 N 1.01 1.03 -0.49 1.05 2.07 -0.77 -1.22 116.25 118.94 1oxu h VAL 183 Ca 0.24 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.45 1oxu h VAL 183 Cb 0.16 0.25 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 1oxu h VAL 183 CO -0.03 0.13 0.06 0.11 0.02 0.00 0.00 177.57 177.87 1oxu h LYS 184 N 0.72 0.82 -0.21 1.57 1.57 -1.26 -1.58 116.57 118.21 1oxu h LYS 184 Ca 0.27 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1oxu h LYS 184 Cb 0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1oxu h LYS 184 CO -0.13 0.83 0.13 0.93 -0.57 0.00 0.00 179.45 180.64 1oxu h GLU 185 N 0.69 0.28 -0.81 3.15 5.08 -1.02 -1.88 114.58 120.06 1oxu h GLU 185 Ca 0.15 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1oxu h GLU 185 Cb 0.42 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.58 1oxu h GLU 185 CO 0.01 0.21 0.36 0.28 -1.00 0.00 0.00 179.01 178.87 1oxu h VAL 186 N 0.27 1.26 -0.75 3.13 2.07 -1.17 -0.16 116.25 120.89 1oxu h VAL 186 Ca 0.08 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 1oxu h VAL 186 Cb -0.00 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 1oxu h VAL 186 CO -0.02 0.32 0.43 -0.61 0.02 0.00 0.00 177.57 177.72 1oxu h GLN 187 N 1.17 1.03 -0.23 1.57 -0.00 -1.05 -2.22 115.11 115.37 1oxu h GLN 187 Ca 0.27 -0.10 -0.16 0.00 -0.00 0.00 0.00 58.65 58.66 1oxu h GLN 187 Cb 0.17 -0.21 0.00 0.00 0.00 0.00 0.00 27.48 27.44 1oxu h GLN 187 CO -0.03 0.74 -0.50 0.77 0.00 0.00 0.00 178.83 179.81 1oxu h SER 188 N 1.04 0.83 -0.15 -0.69 0.02 -0.79 0.12 113.55 113.93 1oxu h SER 188 Ca 0.27 -0.55 -0.01 0.00 -0.84 0.00 0.00 61.79 60.65 1oxu h SER 188 Cb -0.01 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 1oxu h SER 188 CO -0.05 1.23 0.07 -0.09 -1.14 0.00 0.00 176.83 176.86 1oxu h ARG 189 N 0.47 0.26 0.00 3.45 9.65 -0.72 -3.28 114.38 124.21 1oxu h ARG 189 Ca 0.00 -0.02 -0.03 0.00 -1.10 0.00 0.00 59.98 58.83 1oxu h ARG 189 Cb 1.11 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 29.63 1oxu h ARG 189 CO 0.11 0.22 -1.51 1.28 2.80 0.00 0.00 179.97 182.87 1oxu n LEU 190 N -4.45 0.00 -0.11 3.80 4.77 -0.86 -5.02 117.00 115.12 1oxu n LEU 190 Ca -0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.96 1oxu n LEU 190 Cb 0.12 0.04 -0.01 0.00 -2.33 0.00 0.00 43.42 41.24 1oxu n LEU 190 CO 0.35 0.04 -0.01 0.61 -1.33 0.00 0.00 177.39 177.05 1oxu n GLY 191 N 1.99 0.52 3.77 -0.72 0.00 0.41 -5.00 105.19 106.16 1oxu n GLY 191 Ca -0.04 -0.54 -0.35 0.00 0.00 0.00 0.00 46.02 45.09 1oxu n GLY 191 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1oxu s VAL 192 N -2.00 3.15 0.31 1.61 -7.23 -1.23 -2.52 120.40 112.50 1oxu s VAL 192 Ca 0.00 0.67 -0.29 0.00 -1.81 0.00 0.00 61.98 60.55 1oxu s VAL 192 Cb 0.00 -3.23 -0.10 0.00 0.56 0.00 0.00 36.38 33.61 1oxu s VAL 192 CO 0.00 -0.20 1.18 -0.89 -0.31 0.00 0.00 175.10 174.88 1oxu s THR 193 N -1.91 3.16 -0.08 5.32 2.01 -0.19 -4.53 115.64 119.42 1oxu s THR 193 Ca 0.72 1.15 0.02 0.00 0.31 0.00 0.00 61.69 63.89 1oxu s THR 193 Cb -0.23 -3.73 0.01 0.00 0.01 0.00 0.00 72.50 68.56 1oxu s THR 193 CO 0.31 0.26 -0.13 -0.22 -0.69 0.00 0.00 174.62 174.16 1oxu s LEU 194 N -1.67 1.61 -0.16 4.42 2.96 0.18 -1.25 118.68 124.78 1oxu s LEU 194 Ca 0.47 -0.33 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1oxu s LEU 194 Cb -0.35 -0.89 0.02 0.00 0.50 0.00 0.00 46.19 45.47 1oxu s LEU 194 CO 0.45 0.02 -0.16 -0.22 -1.32 0.00 0.00 176.35 175.12 1oxu s LEU 195 N 0.84 1.82 -0.08 -0.68 2.96 -0.73 0.08 118.68 122.89 1oxu s LEU 195 Ca -0.11 -0.54 0.04 0.00 -0.22 0.00 0.00 54.13 53.30 1oxu s LEU 195 Cb -0.15 -1.27 -0.00 0.00 0.50 0.00 0.00 46.19 45.27 1oxu s LEU 195 CO 0.01 -0.04 -0.22 0.54 -1.32 0.00 0.00 176.35 175.32 1oxu s VAL 196 N 1.43 1.88 -0.02 1.68 0.11 -0.57 -0.85 120.40 124.05 1oxu s VAL 196 Ca 0.05 -0.93 0.05 0.00 -2.93 0.00 0.00 61.98 58.22 1oxu s VAL 196 Cb -0.13 -1.62 -0.03 0.00 -1.53 0.00 0.00 36.38 33.08 1oxu s VAL 196 CO -0.11 0.52 -0.17 0.68 -3.33 0.00 0.00 175.10 172.69 1oxu s VAL 197 N 0.23 2.81 0.15 2.04 -7.23 0.03 -1.41 120.40 117.02 1oxu s VAL 197 Ca -0.13 -0.89 -0.24 0.00 -1.81 0.00 0.00 61.98 58.91 1oxu s VAL 197 Cb -0.16 -2.10 0.07 0.00 0.56 0.00 0.00 36.38 34.75 1oxu s VAL 197 CO 0.06 0.54 0.65 -0.55 -0.31 0.00 0.00 175.10 175.49 1oxu s SER 198 N -0.86 -0.51 0.00 4.85 0.15 -0.44 -0.72 113.70 116.17 1oxu s SER 198 Ca 0.12 -0.06 0.25 0.00 0.70 0.00 0.00 55.95 56.97 1oxu s SER 198 Cb -0.10 0.58 0.53 0.00 -1.71 0.00 0.00 66.02 65.32 1oxu s SER 198 CO 0.01 -0.95 1.45 0.00 1.20 0.00 0.00 173.24 174.95 1oxu n HIS 199 N -0.37 0.02 -3.71 3.44 1.44 -1.26 -2.35 115.22 112.44 1oxu n HIS 199 Ca -0.15 -0.01 -0.38 0.00 -2.01 0.00 0.00 57.72 55.17 1oxu n HIS 199 Cb 0.64 0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.63 1oxu n HIS 199 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1oxu s ASP 200 N -1.97 5.32 0.57 4.39 -1.08 -1.26 -4.81 116.67 117.83 1oxu s ASP 200 Ca 0.32 -0.68 0.34 0.00 -0.52 0.00 0.00 52.55 52.01 1oxu s ASP 200 Cb 0.20 -1.93 1.73 0.00 -1.46 0.00 0.00 42.92 41.46 1oxu s ASP 200 CO 0.31 -0.21 2.15 -0.65 0.52 0.00 0.00 175.17 177.29 1oxu h PRO 201 N 8.29 0.00 -0.57 4.34 0.11 -1.90 -1.85 132.00 140.42 1oxu h PRO 201 Ca -0.31 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.70 1oxu h PRO 201 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1oxu h PRO 201 CO 0.61 0.05 -0.03 0.00 -0.21 0.00 0.00 178.00 178.43 1oxu h ALA 202 N 1.95 0.87 -0.08 -0.75 0.00 -1.94 -2.48 119.26 116.82 1oxu h ALA 202 Ca -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1oxu h ALA 202 Cb 0.26 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1oxu h ALA 202 CO 0.01 0.66 -0.00 -0.44 0.00 0.00 0.00 179.25 179.47 1oxu h ASP 203 N 0.92 0.10 0.00 0.00 3.32 -1.76 -2.32 116.42 116.67 1oxu h ASP 203 Ca 0.16 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1oxu h ASP 203 Cb 0.57 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1oxu h ASP 203 CO 0.03 0.13 -0.00 0.40 -1.72 0.00 0.00 179.24 178.08 1oxu h ILE 204 N 0.11 1.73 0.00 0.35 1.08 -1.49 -2.61 117.51 116.68 1oxu h ILE 204 Ca 0.03 -2.24 -0.04 0.00 -0.39 0.00 0.00 64.86 62.22 1oxu h ILE 204 Cb 0.09 3.24 -0.01 0.00 -3.07 0.00 0.00 36.82 37.07 1oxu h ILE 204 CO 0.00 0.58 -0.17 -0.26 -0.69 0.00 0.00 178.15 177.61 1oxu h PHE 205 N -0.97 0.00 -0.04 1.37 -1.00 -1.48 -0.65 116.94 114.18 1oxu h PHE 205 Ca -0.00 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.58 1oxu h PHE 205 Cb 0.94 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.50 1oxu h PHE 205 CO 0.26 0.17 -0.81 0.00 -1.61 0.00 0.00 178.31 176.32 1oxu h ALA 206 N 1.83 0.53 0.00 2.45 0.00 -1.46 -3.42 119.26 119.19 1oxu h ALA 206 Ca -0.00 -0.66 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 1oxu h ALA 206 Cb 0.32 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1oxu h ALA 206 CO 0.02 0.81 -1.04 -0.89 0.00 0.00 0.00 179.25 178.15 1oxu n ILE 207 N -3.77 0.04 -3.02 0.00 5.41 -0.99 -4.97 119.36 112.07 1oxu n ILE 207 Ca -0.05 -0.02 -0.39 0.00 1.00 0.00 0.00 62.75 63.30 1oxu n ILE 207 Cb 0.76 -0.59 -0.06 0.00 -0.71 0.00 0.00 39.64 39.04 1oxu n ILE 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1oxu s ALA 208 N -2.02 3.45 -0.16 -1.39 0.00 -0.27 -4.87 121.76 116.51 1oxu s ALA 208 Ca -0.01 0.31 0.20 0.00 0.00 0.00 0.00 51.96 52.46 1oxu s ALA 208 Cb 0.00 -2.92 -0.13 0.00 0.00 0.00 0.00 23.12 20.08 1oxu s ALA 208 CO 0.02 0.30 0.80 -0.25 0.00 0.00 0.00 175.76 176.63 1oxu n ASP 209 N 1.43 0.62 -3.92 0.00 10.43 0.05 -4.78 116.55 120.38 1oxu n ASP 209 Ca -0.05 0.25 -0.12 0.00 2.57 0.00 0.00 54.79 57.44 1oxu n ASP 209 Cb 0.49 0.72 -0.13 0.00 1.84 0.00 0.00 41.12 44.04 1oxu n ASP 209 CO 0.00 0.00 0.00 -0.60 -1.07 0.00 0.00 177.20 175.53 1oxu s ARG 210 N -3.21 0.16 0.01 -1.24 3.52 -1.18 -4.35 118.95 112.66 1oxu s ARG 210 Ca -0.03 -0.21 0.02 0.00 -0.13 0.00 0.00 55.73 55.37 1oxu s ARG 210 Cb 0.10 -0.04 -0.01 0.00 -1.56 0.00 0.00 34.95 33.44 1oxu s ARG 210 CO 0.82 0.00 -0.07 0.54 -0.81 0.00 0.00 175.30 175.79 1oxu s VAL 211 N -0.45 0.55 -0.07 7.11 0.11 0.19 -1.28 120.40 126.55 1oxu s VAL 211 Ca -0.04 -0.59 0.03 0.00 -2.93 0.00 0.00 61.98 58.45 1oxu s VAL 211 Cb -0.03 -0.52 -0.02 0.00 -1.53 0.00 0.00 36.38 34.28 1oxu s VAL 211 CO -0.00 -0.04 -0.17 -0.83 -3.33 0.00 0.00 175.10 170.72 1oxu s GLY 212 N -0.69 1.46 -0.22 6.54 0.00 0.30 -1.55 107.32 113.16 1oxu s GLY 212 Ca -0.02 -0.98 -0.09 0.00 0.00 0.00 0.00 44.72 43.63 1oxu s GLY 212 CO 0.00 -0.58 0.13 0.14 0.00 0.00 0.00 173.10 172.78 1oxu s VAL 213 N -0.28 5.12 -0.21 1.40 1.01 -0.28 -1.08 120.40 126.09 1oxu s VAL 213 Ca 0.01 0.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.05 1oxu s VAL 213 Cb -0.13 -3.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.87 1oxu s VAL 213 CO 0.03 0.38 -0.04 -0.22 0.00 0.00 0.00 175.10 175.24 1oxu s LEU 214 N 0.89 2.95 -0.15 3.92 2.96 0.53 -1.35 118.68 128.43 1oxu s LEU 214 Ca 0.06 -0.35 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 1oxu s LEU 214 Cb -0.13 -1.74 0.04 0.00 0.50 0.00 0.00 46.19 44.86 1oxu s LEU 214 CO 0.03 0.02 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.37 1oxu s VAL 215 N 1.26 0.78 -1.41 1.68 1.01 0.27 -4.19 120.40 119.80 1oxu s VAL 215 Ca 0.03 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 1oxu s VAL 215 Cb -0.14 -1.06 0.02 0.00 0.00 0.00 0.00 36.38 35.20 1oxu s VAL 215 CO -0.01 0.05 0.62 0.29 0.00 0.00 0.00 175.10 176.05 1oxu n LYS 216 N 4.98 -4.16 0.00 2.72 5.02 -1.26 -1.72 118.16 123.74 1oxu n LYS 216 Ca -0.10 0.51 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 1oxu n LYS 216 Cb 0.48 -4.93 0.00 0.00 -0.02 0.00 0.00 35.03 30.56 1oxu n LYS 216 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oxu n GLY 217 N -1.76 2.41 3.65 0.72 0.00 -0.23 -4.84 105.19 105.15 1oxu n GLY 217 Ca -0.24 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.43 1oxu n GLY 217 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oxu s LYS 218 N -0.22 3.70 -0.82 1.61 1.02 -0.70 -0.54 119.74 123.79 1oxu s LYS 218 Ca 0.00 -0.35 -0.22 0.00 0.02 0.00 0.00 55.97 55.42 1oxu s LYS 218 Cb 0.00 -3.10 0.08 0.00 -0.52 0.00 0.00 37.83 34.30 1oxu s LYS 218 CO 0.00 0.40 1.14 -1.17 -0.92 0.00 0.00 175.35 174.80 1oxu s LEU 219 N -0.02 4.31 0.43 3.17 2.96 -1.26 -0.57 118.68 127.71 1oxu s LEU 219 Ca 0.05 -1.36 0.24 0.00 -0.22 0.00 0.00 54.13 52.85 1oxu s LEU 219 Cb -0.12 -2.45 0.48 0.00 0.50 0.00 0.00 46.19 44.59 1oxu s LEU 219 CO 0.01 -1.37 1.66 -0.37 -1.32 0.00 0.00 176.35 174.96 1oxu h VAL 220 N 6.08 0.00 -1.80 1.68 -1.51 -1.57 -3.46 116.25 115.67 1oxu h VAL 220 Ca -0.06 -0.91 0.01 0.00 -1.23 0.00 0.00 66.70 64.52 1oxu h VAL 220 Cb 1.04 1.91 -0.23 0.00 -2.13 0.00 0.00 31.29 31.87 1oxu h VAL 220 CO 1.21 0.00 0.30 -1.58 -1.23 0.00 0.00 177.57 176.27 1oxu s GLN 221 N -3.24 0.69 -0.02 5.19 0.74 -1.25 -4.96 119.66 116.80 1oxu s GLN 221 Ca 0.07 0.73 0.03 0.00 0.05 0.00 0.00 55.36 56.24 1oxu s GLN 221 Cb 0.06 0.33 -0.00 0.00 1.10 0.00 0.00 33.01 34.50 1oxu s GLN 221 CO 0.65 -0.10 -0.11 0.08 -0.55 0.00 0.00 175.29 175.26 1oxu s VAL 222 N 0.14 0.94 -1.03 1.34 1.01 -1.26 -1.13 120.40 120.43 1oxu s VAL 222 Ca 0.01 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1oxu s VAL 222 Cb -0.04 -0.81 0.00 0.00 0.00 0.00 0.00 36.38 35.53 1oxu s VAL 222 CO -0.02 0.28 0.00 0.61 0.00 0.00 0.00 175.10 175.97 1oxu n GLY 223 N 3.03 -1.44 3.78 4.51 0.00 -0.59 -5.00 105.19 109.48 1oxu n GLY 223 Ca -0.16 -1.05 -0.34 0.00 0.00 0.00 0.00 46.02 44.47 1oxu n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oxu s LYS 224 N -1.77 3.30 0.20 1.61 1.02 -1.26 -0.64 119.74 122.19 1oxu s LYS 224 Ca 0.00 1.46 -0.14 0.00 0.02 0.00 0.00 55.97 57.30 1oxu s LYS 224 Cb 0.00 -2.01 0.20 0.00 -0.52 0.00 0.00 37.83 35.50 1oxu s LYS 224 CO 0.00 -0.86 1.64 -1.35 -0.92 0.00 0.00 175.35 173.86 1oxu h PRO 225 N 0.88 0.01 -0.09 -1.68 0.11 -1.88 0.59 132.00 129.94 1oxu h PRO 225 Ca -0.49 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1oxu h PRO 225 Cb 1.24 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 1oxu h PRO 225 CO 0.57 0.01 0.04 1.05 -0.21 0.00 0.00 178.00 179.46 1oxu h GLU 226 N 0.01 0.12 -0.35 1.05 9.09 -1.95 -0.32 114.58 122.23 1oxu h GLU 226 Ca 0.27 -0.01 -0.11 0.00 0.05 0.00 0.00 59.36 59.56 1oxu h GLU 226 Cb 0.42 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.48 1oxu h GLU 226 CO -0.56 0.09 -0.22 -0.44 0.05 0.00 0.00 179.01 177.93 1oxu h ASP 227 N 0.12 0.80 -0.42 3.06 3.32 -1.25 0.20 116.42 122.24 1oxu h ASP 227 Ca 0.03 -0.43 -0.07 0.00 0.02 0.00 0.00 57.03 56.59 1oxu h ASP 227 Cb 0.01 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1oxu h ASP 227 CO -0.01 1.05 -0.00 -0.07 -1.72 0.00 0.00 179.24 178.49 1oxu h LEU 228 N 0.55 0.73 -0.18 1.55 4.07 -0.92 0.20 115.31 121.30 1oxu h LEU 228 Ca 0.07 -0.31 0.01 0.00 0.08 0.00 0.00 57.88 57.73 1oxu h LEU 228 Cb 0.78 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1oxu h LEU 228 CO 0.06 0.86 0.11 0.22 -1.08 0.00 0.00 178.44 178.61 1oxu h TYR 229 N 0.58 0.20 0.11 1.13 3.20 -0.94 -2.71 116.97 118.53 1oxu h TYR 229 Ca 0.12 0.01 -0.30 0.00 3.14 0.00 0.00 58.73 61.69 1oxu h TYR 229 Cb 0.49 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1oxu h TYR 229 CO 0.04 0.12 -1.51 -0.44 -1.64 0.00 0.00 178.16 174.73 1oxu h ASP 230 N 0.22 0.36 -1.97 -2.11 3.32 -0.95 -3.40 116.42 111.90 1oxu h ASP 230 Ca 0.07 -0.50 -0.57 0.00 0.02 0.00 0.00 57.03 56.05 1oxu h ASP 230 Cb -0.01 -0.12 -0.42 0.00 0.22 0.00 0.00 39.33 39.01 1oxu h ASP 230 CO -0.03 1.41 -0.74 0.59 -1.72 0.00 0.00 179.24 178.75 1oxu n ASN 231 N -3.44 4.11 -4.76 6.45 3.02 0.69 -5.02 115.26 116.30 1oxu n ASN 231 Ca -0.15 -3.59 -0.39 0.00 -0.03 0.00 0.00 54.58 50.41 1oxu n ASN 231 Cb 1.04 -0.53 0.01 0.00 -0.61 0.00 0.00 39.78 39.69 1oxu n ASN 231 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1oxu s PRO 232 N -3.39 3.68 0.39 3.52 0.04 -1.02 -4.72 135.00 133.49 1oxu s PRO 232 Ca 0.47 2.24 0.25 0.00 0.04 0.00 0.00 61.00 64.00 1oxu s PRO 232 Cb 0.33 -2.59 0.64 0.00 0.04 0.00 0.00 34.50 32.92 1oxu s PRO 232 CO -0.14 -0.76 1.71 -0.24 0.04 0.00 0.00 177.00 177.61 1oxu h VAL 233 N 2.15 0.00 -3.76 -0.36 3.04 -1.93 -3.47 116.25 111.93 1oxu h VAL 233 Ca -0.50 -0.76 -0.08 0.00 -1.01 0.00 0.00 66.70 64.35 1oxu h VAL 233 Cb 1.26 1.75 -0.10 0.00 -2.01 0.00 0.00 31.29 32.19 1oxu h VAL 233 CO 0.61 0.00 -0.18 -0.94 -1.01 0.00 0.00 177.57 176.05 1oxu s SER 234 N -5.63 -0.06 0.27 3.17 1.04 -1.26 -5.03 113.70 106.19 1oxu s SER 234 Ca 0.07 -0.98 0.05 0.00 0.48 0.00 0.00 55.95 55.57 1oxu s SER 234 Cb 0.08 0.56 0.35 0.00 0.10 0.00 0.00 66.02 67.11 1oxu s SER 234 CO 0.62 -1.10 1.64 -0.29 0.98 0.00 0.00 173.24 175.08 1oxu h ILE 235 N 2.30 1.33 -0.53 -1.02 6.09 -1.98 -1.94 117.51 121.76 1oxu h ILE 235 Ca -0.27 -1.68 -0.08 0.00 -1.37 0.00 0.00 64.86 61.45 1oxu h ILE 235 Cb 1.25 1.78 -0.02 0.00 0.47 0.00 0.00 36.82 40.30 1oxu h ILE 235 CO 0.37 0.50 0.02 -0.61 -3.07 0.00 0.00 178.15 175.36 1oxu h GLN 236 N 0.23 0.93 -0.65 2.19 4.15 -2.00 -2.32 115.11 117.64 1oxu h GLN 236 Ca 0.01 -0.29 -0.07 0.00 0.77 0.00 0.00 58.65 59.08 1oxu h GLN 236 Cb 0.93 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.50 1oxu h GLN 236 CO 0.08 0.94 0.14 0.28 -1.93 0.00 0.00 178.83 178.33 1oxu h VAL 237 N 0.81 1.26 -0.81 2.39 2.07 -1.94 -1.81 116.25 118.22 1oxu h VAL 237 Ca 0.15 -0.98 0.08 0.00 0.82 0.00 0.00 66.70 66.77 1oxu h VAL 237 Cb 0.51 0.64 -0.07 0.00 -1.52 0.00 0.00 31.29 30.85 1oxu h VAL 237 CO 0.02 0.37 0.47 0.00 0.02 0.00 0.00 177.57 178.46 1oxu h ALA 238 N 1.05 1.12 0.00 1.67 0.00 -1.04 -1.51 119.26 120.56 1oxu h ALA 238 Ca 0.20 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 1oxu h ALA 238 Cb 0.39 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1oxu h ALA 238 CO 0.01 0.15 -0.80 0.66 0.00 0.00 0.00 179.25 179.27 1oxu h SER 239 N 0.84 0.00 -0.56 0.00 4.64 -1.36 -2.97 113.55 114.14 1oxu h SER 239 Ca 0.37 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.60 1oxu h SER 239 Cb 0.26 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 1oxu h SER 239 CO -0.21 0.52 -0.00 -0.07 -0.87 0.00 0.00 176.83 176.20 1oxu h LEU 240 N 0.00 0.97 -0.16 5.97 3.38 -0.81 -3.12 115.31 121.54 1oxu h LEU 240 Ca -0.05 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1oxu h LEU 240 Cb 1.44 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1oxu h LEU 240 CO 0.06 1.04 0.00 -0.29 0.09 0.00 0.00 178.44 179.34 1oxu h ILE 241 N 0.88 0.00 0.00 1.22 6.09 -1.32 -3.43 117.51 120.94 1oxu h ILE 241 Ca 0.16 -0.67 0.00 0.00 -1.37 0.00 0.00 64.86 62.98 1oxu h ILE 241 Cb 0.55 1.65 0.00 0.00 0.47 0.00 0.00 36.82 39.49 1oxu h ILE 241 CO 0.03 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 175.72 1oxu n GLY 242 N 1.04 0.15 3.75 8.18 0.00 -1.12 -4.96 105.19 112.22 1oxu n GLY 242 Ca 0.04 -0.97 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 1oxu n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oxu s GLU 243 N -2.00 4.14 -0.15 1.61 2.02 -1.26 -4.06 118.70 118.99 1oxu s GLU 243 Ca 0.00 2.54 -0.24 0.00 0.02 0.00 0.00 54.97 57.29 1oxu s GLU 243 Cb 0.00 -3.02 0.06 0.00 0.10 0.00 0.00 34.13 31.27 1oxu s GLU 243 CO 0.00 -0.59 0.61 -1.50 0.02 0.00 0.00 175.26 173.80 1oxu s ILE 244 N -0.20 0.01 -0.15 -1.63 2.07 -1.26 -4.46 121.20 115.57 1oxu s ILE 244 Ca 0.61 -0.05 -0.25 0.00 -1.41 0.00 0.00 60.65 59.55 1oxu s ILE 244 Cb -0.47 -0.89 -0.02 0.00 0.13 0.00 0.00 42.46 41.22 1oxu s ILE 244 CO 0.50 -0.03 0.79 0.20 -1.91 0.00 0.00 174.94 174.49 1oxu s ASN 245 N -0.33 6.94 -0.26 4.50 0.01 0.35 -4.92 114.94 121.23 1oxu s ASN 245 Ca -0.05 1.14 -0.06 0.00 -0.71 0.00 0.00 52.86 53.19 1oxu s ASN 245 Cb -0.03 -2.44 -0.00 0.00 0.41 0.00 0.00 41.25 39.19 1oxu s ASN 245 CO 0.04 -0.34 0.03 -1.61 -1.51 0.00 0.00 177.10 173.71 1oxu s GLU 246 N 1.89 3.29 -0.04 -0.60 2.02 -1.26 -1.09 118.70 122.92 1oxu s GLU 246 Ca 0.37 -0.70 0.05 0.00 0.02 0.00 0.00 54.97 54.71 1oxu s GLU 246 Cb -0.17 -3.21 -0.01 0.00 0.10 0.00 0.00 34.13 30.84 1oxu s GLU 246 CO 0.13 -0.30 -0.20 -0.51 0.02 0.00 0.00 175.26 174.41 1oxu s LEU 247 N 1.51 1.98 -0.17 1.80 2.01 0.10 -4.90 118.68 121.00 1oxu s LEU 247 Ca 0.04 -0.40 -0.11 0.00 0.01 0.00 0.00 54.13 53.67 1oxu s LEU 247 Cb -0.16 -1.09 -0.05 0.00 0.01 0.00 0.00 46.19 44.90 1oxu s LEU 247 CO 0.00 0.20 0.21 -1.61 1.01 0.00 0.00 176.35 176.15 1oxu s GLU 248 N -0.11 4.13 0.22 1.70 2.02 -1.26 0.17 118.70 125.56 1oxu s GLU 248 Ca -0.02 -0.06 -0.10 0.00 0.02 0.00 0.00 54.97 54.81 1oxu s GLU 248 Cb -0.11 -3.39 -0.01 0.00 0.10 0.00 0.00 34.13 30.71 1oxu s GLU 248 CO 0.02 0.34 0.37 0.20 0.02 0.00 0.00 175.26 176.21 1oxu s GLY 249 N 0.20 0.68 -0.07 -1.39 0.00 -0.56 -4.84 107.32 101.34 1oxu s GLY 249 Ca 0.13 -1.02 -0.17 0.00 0.00 0.00 0.00 44.72 43.65 1oxu s GLY 249 CO 0.02 -0.81 0.46 0.54 0.00 0.00 0.00 173.10 173.31 1oxu s LYS 250 N -4.03 4.22 -0.09 2.90 1.02 -0.88 -1.15 119.74 121.74 1oxu s LYS 250 Ca 0.24 0.46 -0.27 0.00 0.02 0.00 0.00 55.97 56.42 1oxu s LYS 250 Cb 0.02 -3.37 -0.02 0.00 -0.52 0.00 0.00 37.83 33.94 1oxu s LYS 250 CO 0.07 0.33 0.90 0.08 -0.92 0.00 0.00 175.35 175.82 1oxu s VAL 251 N 0.04 4.88 0.20 3.17 1.01 -0.90 -0.35 120.40 128.45 1oxu s VAL 251 Ca 0.25 1.83 -0.03 0.00 0.00 0.00 0.00 61.98 64.03 1oxu s VAL 251 Cb -0.16 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 31.97 1oxu s VAL 251 CO 0.12 0.09 0.18 0.42 0.00 0.00 0.00 175.10 175.91 1oxu s THR 252 N 1.60 0.01 0.43 3.92 -4.23 -0.54 -4.94 115.64 111.90 1oxu s THR 252 Ca 0.45 -1.88 0.24 0.00 -1.18 0.00 0.00 61.69 59.32 1oxu s THR 252 Cb -0.18 -2.39 0.44 0.00 1.34 0.00 0.00 72.50 71.71 1oxu s THR 252 CO 0.19 -0.05 1.75 -1.13 -0.54 0.00 0.00 174.62 174.83 1oxu h ASN 253 N 2.58 0.32 1.41 3.99 -0.00 -1.99 0.54 115.58 122.43 1oxu h ASN 253 Ca -0.34 0.08 -0.11 0.00 -0.00 0.00 0.00 56.30 55.93 1oxu h ASN 253 Cb 1.24 0.03 -0.02 0.00 -0.00 0.00 0.00 38.32 39.58 1oxu h ASN 253 CO 0.51 0.02 -0.60 -0.08 -0.00 0.00 0.00 177.43 177.27 1oxu h GLU 254 N 0.26 0.00 0.00 6.67 4.81 -1.97 -3.50 114.58 120.84 1oxu h GLU 254 Ca 0.63 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.86 1oxu h GLU 254 Cb 1.87 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.25 1oxu h GLU 254 CO -0.26 0.46 0.00 0.41 -0.73 0.00 0.00 179.01 178.89 1oxu n GLY 255 N 1.24 0.85 3.60 1.92 0.00 0.19 -4.62 105.19 108.38 1oxu n GLY 255 Ca 0.01 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.61 1oxu n GLY 255 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxu s VAL 256 N -1.91 4.15 -0.10 1.61 1.01 -0.49 -1.47 120.40 123.20 1oxu s VAL 256 Ca 0.00 1.14 -0.21 0.00 0.00 0.00 0.00 61.98 62.92 1oxu s VAL 256 Cb 0.00 -4.61 -0.04 0.00 0.00 0.00 0.00 36.38 31.74 1oxu s VAL 256 CO 0.00 -1.06 0.58 -0.69 0.00 0.00 0.00 175.10 173.93 1oxu s VAL 257 N 4.62 5.12 -0.36 2.92 1.01 0.53 -2.05 120.40 132.19 1oxu s VAL 257 Ca 0.48 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.64 1oxu s VAL 257 Cb -0.07 -3.92 0.14 0.00 0.00 0.00 0.00 36.38 32.52 1oxu s VAL 257 CO 0.31 0.28 0.21 -0.63 0.00 0.00 0.00 175.10 175.26 1oxu s ILE 258 N 0.80 0.38 0.00 2.22 1.01 -0.42 -2.07 121.20 123.13 1oxu s ILE 258 Ca 0.31 -1.79 0.00 0.00 0.00 0.00 0.00 60.65 59.17 1oxu s ILE 258 Cb -0.16 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.02 1oxu s ILE 258 CO 0.14 -0.95 0.00 0.61 0.00 0.00 0.00 174.94 174.74 1oxu n GLY 259 N 4.05 3.44 0.00 6.18 0.00 -1.26 -1.56 105.19 116.04 1oxu n GLY 259 Ca 0.10 -0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.15 1oxu n GLY 259 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1oxu n SER 260 N 5.76 0.00 -4.89 1.61 3.41 -0.74 -4.84 113.62 113.93 1oxu n SER 260 Ca 0.00 -0.16 -0.33 0.00 -0.26 0.00 0.00 58.87 58.12 1oxu n SER 260 Cb 0.00 -0.28 -0.05 0.00 -0.26 0.00 0.00 64.21 63.62 1oxu n SER 260 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1oxu s LEU 261 N -2.56 4.33 -0.14 1.04 1.43 -0.60 -4.12 118.68 118.06 1oxu s LEU 261 Ca 0.29 0.58 -0.03 0.00 -1.03 0.00 0.00 54.13 53.93 1oxu s LEU 261 Cb 0.20 -2.95 0.05 0.00 0.03 0.00 0.00 46.19 43.52 1oxu s LEU 261 CO 0.45 0.17 0.05 -0.13 0.23 0.00 0.00 176.35 177.13 1oxu s ARG 262 N -2.13 0.30 -0.25 1.70 3.00 0.34 -1.30 118.95 120.61 1oxu s ARG 262 Ca 0.33 -0.08 -0.13 0.00 0.00 0.00 0.00 55.73 55.86 1oxu s ARG 262 Cb -0.13 -1.56 -0.04 0.00 0.00 0.00 0.00 34.95 33.22 1oxu s ARG 262 CO 0.20 -0.55 0.29 -0.06 0.00 0.00 0.00 175.30 175.18 1oxu s PHE 263 N 2.04 3.28 -0.29 -0.53 0.40 -0.87 -4.64 117.98 117.37 1oxu s PHE 263 Ca 0.02 0.34 -0.04 0.00 -0.60 0.00 0.00 56.93 56.65 1oxu s PHE 263 Cb -0.15 -2.45 -0.13 0.00 0.51 0.00 0.00 43.02 40.80 1oxu s PHE 263 CO -0.07 -0.09 2.32 -0.35 0.70 0.00 0.00 175.22 177.72 1oxu n PRO 264 N 4.83 1.50 -4.33 0.24 -0.04 -1.26 -1.39 135.00 134.55 1oxu n PRO 264 Ca -0.11 -0.87 -0.18 0.00 -0.04 0.00 0.00 63.50 62.29 1oxu n PRO 264 Cb 0.51 -2.00 -0.09 0.00 -0.04 0.00 0.00 33.50 31.88 1oxu n PRO 264 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1oxu s VAL 265 N 2.25 0.32 0.10 0.52 -7.23 -1.26 -5.02 120.40 110.07 1oxu s VAL 265 Ca 0.41 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.38 1oxu s VAL 265 Cb 0.17 -2.52 0.05 0.00 0.56 0.00 0.00 36.38 34.64 1oxu s VAL 265 CO -0.01 0.00 0.49 -0.55 -0.31 0.00 0.00 175.10 174.72 1oxu s SER 266 N -3.36 -0.39 0.19 4.85 0.15 -1.26 -3.57 113.70 110.31 1oxu s SER 266 Ca 0.36 -0.05 0.03 0.00 0.70 0.00 0.00 55.95 56.99 1oxu s SER 266 Cb 0.05 0.51 -0.05 0.00 -1.71 0.00 0.00 66.02 64.82 1oxu s SER 266 CO 0.17 -0.82 -0.02 0.68 1.20 0.00 0.00 173.24 174.45 1oxu s VAL 267 N -3.24 0.89 -0.40 4.45 -7.23 -1.26 -4.99 120.40 108.62 1oxu s VAL 267 Ca -0.01 -2.01 -0.02 0.00 -1.81 0.00 0.00 61.98 58.13 1oxu s VAL 267 Cb 0.00 -2.15 0.15 0.00 0.56 0.00 0.00 36.38 34.95 1oxu s VAL 267 CO -0.08 -0.47 2.38 -1.54 -0.31 0.00 0.00 175.10 175.07 1oxu n SER 268 N -0.29 6.54 -4.19 4.85 3.41 -1.26 -4.88 113.62 117.79 1oxu n SER 268 Ca -0.07 -3.17 -0.11 0.00 -0.26 0.00 0.00 58.87 55.26 1oxu n SER 268 Cb 0.63 -1.14 -0.10 0.00 -0.26 0.00 0.00 64.21 63.34 1oxu n SER 268 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1oxu s SER 269 N 0.16 0.69 0.18 4.04 0.15 -1.26 -5.05 113.70 112.60 1oxu s SER 269 Ca 0.46 -1.21 -0.13 0.00 0.70 0.00 0.00 55.95 55.77 1oxu s SER 269 Cb 0.32 0.22 0.11 0.00 -1.71 0.00 0.00 66.02 64.96 1oxu s SER 269 CO -0.11 -0.67 1.82 -0.78 1.20 0.00 0.00 173.24 174.70 1oxu h ASP 270 N 2.77 0.54 -3.01 5.45 1.82 -1.94 -3.43 116.42 118.63 1oxu h ASP 270 Ca -0.36 0.00 -0.49 0.00 -0.39 0.00 0.00 57.03 55.79 1oxu h ASP 270 Cb 1.20 -0.12 -0.14 0.00 0.68 0.00 0.00 39.33 40.96 1oxu h ASP 270 CO 0.60 0.38 -0.63 -0.13 -1.61 0.00 0.00 179.24 177.86 1oxu s ARG 271 N -6.14 1.65 0.03 0.28 0.52 -1.26 -2.12 118.95 111.90 1oxu s ARG 271 Ca -0.13 -1.89 -0.07 0.00 -0.52 0.00 0.00 55.73 53.12 1oxu s ARG 271 Cb 0.13 -1.02 -0.00 0.00 0.52 0.00 0.00 34.95 34.58 1oxu s ARG 271 CO 0.74 -0.11 0.12 0.00 0.02 0.00 0.00 175.30 176.08 1oxu s ALA 272 N -3.16 -0.19 -0.25 2.13 0.00 -0.30 -2.99 121.76 117.00 1oxu s ALA 272 Ca 0.34 -0.38 -0.11 0.00 0.00 0.00 0.00 51.96 51.81 1oxu s ALA 272 Cb 0.07 0.21 -0.05 0.00 0.00 0.00 0.00 23.12 23.36 1oxu s ALA 272 CO 0.15 -0.29 0.18 0.42 0.00 0.00 0.00 175.76 176.21 1oxu s ILE 273 N -2.22 5.34 -0.18 0.00 -1.09 0.18 -1.50 121.20 121.73 1oxu s ILE 273 Ca -0.08 0.20 -0.11 0.00 -2.23 0.00 0.00 60.65 58.44 1oxu s ILE 273 Cb -0.03 -3.52 -0.05 0.00 -1.58 0.00 0.00 42.46 37.28 1oxu s ILE 273 CO -0.03 0.32 0.17 -0.63 -1.23 0.00 0.00 174.94 173.55 1oxu s ILE 274 N 1.23 5.39 -0.19 2.92 -1.09 0.45 -1.03 121.20 128.88 1oxu s ILE 274 Ca 0.08 0.29 -0.00 0.00 -2.23 0.00 0.00 60.65 58.78 1oxu s ILE 274 Cb -0.14 -3.50 0.01 0.00 -1.58 0.00 0.00 42.46 37.25 1oxu s ILE 274 CO 0.06 0.46 -0.16 -0.83 -1.23 0.00 0.00 174.94 173.23 1oxu s GLY 275 N 0.17 1.45 -0.10 6.18 0.00 0.23 0.02 107.32 115.26 1oxu s GLY 275 Ca 0.11 -1.22 -0.02 0.00 0.00 0.00 0.00 44.72 43.59 1oxu s GLY 275 CO 0.00 0.32 0.01 -1.50 0.00 0.00 0.00 173.10 171.94 1oxu s ILE 276 N 1.33 0.38 0.46 0.90 1.10 -0.25 -0.30 121.20 124.83 1oxu s ILE 276 Ca 0.05 -0.04 -0.22 0.00 -0.51 0.00 0.00 60.65 59.92 1oxu s ILE 276 Cb -0.13 -0.64 -0.08 0.00 0.15 0.00 0.00 42.46 41.75 1oxu s ILE 276 CO -0.11 0.13 1.10 -0.13 -2.11 0.00 0.00 174.94 173.83 1oxu s ARG 277 N 1.96 3.83 0.23 3.50 0.52 -1.26 -0.50 118.95 127.23 1oxu s ARG 277 Ca 0.04 1.60 -0.07 0.00 -0.52 0.00 0.00 55.73 56.78 1oxu s ARG 277 Cb -0.13 -2.34 0.40 0.00 0.52 0.00 0.00 34.95 33.40 1oxu s ARG 277 CO -0.06 -0.45 1.70 -1.35 0.02 0.00 0.00 175.30 175.16 1oxu h PRO 278 N 1.98 0.29 0.00 3.54 0.11 -1.78 0.74 132.00 136.87 1oxu h PRO 278 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1oxu h PRO 278 Cb 1.24 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1oxu h PRO 278 CO 0.60 0.19 0.00 1.05 -0.21 0.00 0.00 178.00 179.63 1oxu h GLU 279 N 0.29 0.00 -0.60 1.05 9.09 -1.92 -2.06 114.58 120.42 1oxu h GLU 279 Ca 0.38 0.00 -0.02 0.00 0.05 0.00 0.00 59.36 59.77 1oxu h GLU 279 Cb 0.61 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.70 1oxu h GLU 279 CO -0.46 0.00 0.02 -0.25 0.05 0.00 0.00 179.01 178.38 1oxu n ASP 280 N -2.48 5.63 -4.18 3.06 8.00 0.25 -4.88 116.55 121.95 1oxu n ASP 280 Ca -0.01 -2.95 -0.26 0.00 0.71 0.00 0.00 54.79 52.28 1oxu n ASP 280 Cb 0.09 -0.69 -0.16 0.00 -0.02 0.00 0.00 41.12 40.34 1oxu n ASP 280 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1oxu s VAL 281 N -2.77 1.49 -0.02 2.53 1.01 -0.78 -2.55 120.40 119.32 1oxu s VAL 281 Ca 0.54 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.73 1oxu s VAL 281 Cb 0.41 -1.25 0.02 0.00 0.00 0.00 0.00 36.38 35.56 1oxu s VAL 281 CO 0.16 0.42 -0.01 -0.75 0.00 0.00 0.00 175.10 174.92 1oxu s LYS 282 N -0.36 0.30 0.06 2.72 2.20 0.28 -4.89 119.74 120.05 1oxu s LYS 282 Ca 0.05 0.00 0.03 0.00 -0.36 0.00 0.00 55.97 55.70 1oxu s LYS 282 Cb -0.08 -0.41 -0.04 0.00 -1.51 0.00 0.00 37.83 35.79 1oxu s LYS 282 CO -0.00 -0.06 0.03 -0.51 -0.36 0.00 0.00 175.35 174.45 1oxu s LEU 283 N 0.62 3.61 -0.11 5.43 1.43 -1.26 -0.20 118.68 128.21 1oxu s LEU 283 Ca -0.06 -0.06 -0.27 0.00 -1.03 0.00 0.00 54.13 52.71 1oxu s LEU 283 Cb -0.09 -2.25 0.06 0.00 0.03 0.00 0.00 46.19 43.94 1oxu s LEU 283 CO -0.01 0.21 0.64 -0.55 0.23 0.00 0.00 176.35 176.87 1oxu s SER 284 N -2.11 -0.63 0.00 2.29 0.15 -0.67 -4.96 113.70 107.77 1oxu s SER 284 Ca 0.25 0.86 0.25 0.00 0.70 0.00 0.00 55.95 58.01 1oxu s SER 284 Cb -0.12 0.78 0.43 0.00 -1.71 0.00 0.00 66.02 65.40 1oxu s SER 284 CO 0.17 -0.48 1.36 0.29 1.20 0.00 0.00 173.24 175.79 1oxu n LYS 285 N 1.51 0.05 -4.31 5.44 5.02 -1.26 0.11 118.16 124.71 1oxu n LYS 285 Ca -0.18 -0.03 -0.17 0.00 -2.02 0.00 0.00 58.31 55.92 1oxu n LYS 285 Cb 0.56 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.97 1oxu n LYS 285 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1oxu s ASP 286 N -2.97 1.93 0.35 4.39 -0.00 -1.26 -4.86 116.67 114.26 1oxu s ASP 286 Ca 0.11 -1.14 -0.28 0.00 -0.00 0.00 0.00 52.55 51.25 1oxu s ASP 286 Cb 0.17 -0.02 -0.10 0.00 -0.00 0.00 0.00 42.92 42.98 1oxu s ASP 286 CO 0.71 -0.42 1.32 0.68 -0.00 0.00 0.00 175.17 177.46 1oxu s VAL 287 N -3.33 2.64 -0.29 -1.27 -7.23 -1.26 -4.89 120.40 104.77 1oxu s VAL 287 Ca 0.24 0.63 -0.13 0.00 -1.81 0.00 0.00 61.98 60.91 1oxu s VAL 287 Cb 0.04 -3.39 -0.03 0.00 0.56 0.00 0.00 36.38 33.55 1oxu s VAL 287 CO 0.06 0.14 0.30 -0.63 -0.31 0.00 0.00 175.10 174.66 1oxu s ILE 288 N -1.17 5.23 -1.33 -0.62 1.01 -1.26 -4.98 121.20 118.07 1oxu s ILE 288 Ca 0.51 0.26 -0.10 0.00 0.00 0.00 0.00 60.65 61.32 1oxu s ILE 288 Cb -0.40 -3.67 0.14 0.00 0.01 0.00 0.00 42.46 38.54 1oxu s ILE 288 CO 0.53 0.12 1.98 0.29 0.00 0.00 0.00 174.94 177.86 1oxu n LYS 289 N 5.23 3.47 -3.52 2.79 5.02 -1.26 -4.84 118.16 125.06 1oxu n LYS 289 Ca -0.11 -3.30 -0.12 0.00 -2.02 0.00 0.00 58.31 52.76 1oxu n LYS 289 Cb 0.51 -3.00 -0.11 0.00 -0.02 0.00 0.00 35.03 32.41 1oxu n LYS 289 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1oxu s ASP 290 N 1.37 0.37 0.65 4.39 3.68 -1.26 -5.04 116.67 120.83 1oxu s ASP 290 Ca 0.42 0.40 0.43 0.00 2.13 0.00 0.00 52.55 55.93 1oxu s ASP 290 Cb 0.11 0.92 2.27 0.00 -1.45 0.00 0.00 42.92 44.77 1oxu s ASP 290 CO -0.02 -0.27 2.31 0.44 0.13 0.00 0.00 175.17 177.76 1oxu h ASP 291 N 8.23 0.00 1.04 -0.34 3.32 -2.04 -2.06 116.42 124.57 1oxu h ASP 291 Ca -0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.88 1oxu h ASP 291 Cb 1.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1oxu h ASP 291 CO 0.21 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.19 1oxu n SER 292 N -3.08 0.33 -4.47 6.45 3.41 -1.26 -4.73 113.62 110.27 1oxu n SER 292 Ca -0.02 0.54 -0.33 0.00 -0.26 0.00 0.00 58.87 58.80 1oxu n SER 292 Cb 0.11 -0.63 -0.13 0.00 -0.26 0.00 0.00 64.21 63.30 1oxu n SER 292 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1oxu s TRP 293 N -3.07 2.68 -0.12 7.33 0.52 -0.78 -4.47 118.94 121.04 1oxu s TRP 293 Ca 0.11 -0.18 0.03 0.00 0.02 0.00 0.00 56.10 56.08 1oxu s TRP 293 Cb 0.14 -1.62 0.00 0.00 -1.15 0.00 0.00 33.47 30.85 1oxu s TRP 293 CO 0.50 0.18 -0.21 0.42 0.02 0.00 0.00 176.95 177.85 1oxu s ILE 294 N -0.73 2.23 -0.01 2.03 -1.09 0.12 -4.82 121.20 118.93 1oxu s ILE 294 Ca 0.12 -0.95 -0.30 0.00 -2.23 0.00 0.00 60.65 57.29 1oxu s ILE 294 Cb -0.11 -1.88 -0.05 0.00 -1.58 0.00 0.00 42.46 38.84 1oxu s ILE 294 CO 0.01 0.55 1.37 -0.22 -1.23 0.00 0.00 174.94 175.41 1oxu s LEU 295 N 0.50 4.31 0.00 2.97 2.96 -1.26 -0.81 118.68 127.35 1oxu s LEU 295 Ca -0.14 2.07 0.11 0.00 -0.22 0.00 0.00 54.13 55.95 1oxu s LEU 295 Cb -0.17 -3.56 -0.12 0.00 0.50 0.00 0.00 46.19 42.85 1oxu s LEU 295 CO 0.05 -0.69 0.50 1.33 -1.32 0.00 0.00 176.35 176.22 1oxu n VAL 296 N 4.64 0.00 0.00 1.68 0.24 -0.20 -4.97 118.33 119.72 1oxu n VAL 296 Ca 0.13 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.19 1oxu n VAL 296 Cb 0.44 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 1oxu n VAL 296 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oxu n GLY 297 N 1.25 0.92 3.85 7.63 0.00 -1.24 -0.51 105.19 117.09 1oxu n GLY 297 Ca 0.02 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.75 1oxu n GLY 297 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oxu s LYS 298 N -1.63 4.02 0.29 1.61 1.02 -1.26 -1.13 119.74 122.66 1oxu s LYS 298 Ca 0.00 0.72 0.04 0.00 0.02 0.00 0.00 55.97 56.76 1oxu s LYS 298 Cb 0.00 -2.39 -0.03 0.00 -0.52 0.00 0.00 37.83 34.88 1oxu s LYS 298 CO 0.00 0.12 0.22 0.20 -0.92 0.00 0.00 175.35 174.97 1oxu s GLY 299 N -2.30 2.05 -0.02 -3.33 0.00 0.53 -3.87 107.32 100.38 1oxu s GLY 299 Ca 0.55 -1.94 -0.00 0.00 0.00 0.00 0.00 44.72 43.33 1oxu s GLY 299 CO 0.17 -1.46 0.03 1.25 0.00 0.00 0.00 173.10 173.09 1oxu s LYS 300 N -3.69 0.03 0.01 2.90 2.20 -0.05 -0.89 119.74 120.25 1oxu s LYS 300 Ca 0.40 0.18 -0.30 0.00 -0.36 0.00 0.00 55.97 55.89 1oxu s LYS 300 Cb 0.04 -0.32 -0.06 0.00 -1.51 0.00 0.00 37.83 35.98 1oxu s LYS 300 CO 0.22 -0.18 1.44 0.08 -0.36 0.00 0.00 175.35 176.55 1oxu s VAL 301 N 1.16 3.60 -0.23 4.02 1.01 0.02 -1.57 120.40 128.41 1oxu s VAL 301 Ca -0.08 1.00 -0.00 0.00 0.00 0.00 0.00 61.98 62.89 1oxu s VAL 301 Cb -0.13 -3.64 -0.19 0.00 0.00 0.00 0.00 36.38 32.42 1oxu s VAL 301 CO -0.03 0.00 -0.09 1.17 0.00 0.00 0.00 175.10 176.15 1oxu n LYS 302 N 5.35 0.67 -3.55 2.72 4.81 0.12 -0.12 118.16 128.17 1oxu n LYS 302 Ca 0.13 0.18 -0.11 0.00 -0.87 0.00 0.00 58.31 57.64 1oxu n LYS 302 Cb 0.43 -1.56 -0.05 0.00 0.02 0.00 0.00 35.03 33.87 1oxu n LYS 302 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1oxu s VAL 303 N -2.53 0.00 0.08 3.15 0.11 -1.09 -4.78 120.40 115.33 1oxu s VAL 303 Ca -0.32 0.00 0.08 0.00 -2.93 0.00 0.00 61.98 58.81 1oxu s VAL 303 Cb 0.09 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.90 1oxu s VAL 303 CO 0.64 0.00 -0.21 -0.51 -3.33 0.00 0.00 175.10 171.69 1oxu s ILE 304 N -1.57 1.67 0.26 7.04 2.07 -1.26 -1.35 121.20 128.06 1oxu s ILE 304 Ca -0.02 -1.38 0.04 0.00 -1.41 0.00 0.00 60.65 57.88 1oxu s ILE 304 Cb -0.00 -1.49 -0.06 0.00 0.13 0.00 0.00 42.46 41.04 1oxu s ILE 304 CO 0.01 0.05 0.01 -0.83 -1.91 0.00 0.00 174.94 172.27 1oxu s GLY 305 N -1.58 1.74 -0.03 1.50 0.00 0.81 -4.96 107.32 104.80 1oxu s GLY 305 Ca 0.07 -1.87 -0.00 0.00 0.00 0.00 0.00 44.72 42.92 1oxu s GLY 305 CO 0.03 -1.73 0.03 -0.47 0.00 0.00 0.00 173.10 170.96 1oxu s TYR 306 N -3.34 0.13 -0.24 1.90 5.04 -1.26 -0.48 117.35 119.09 1oxu s TYR 306 Ca 0.31 0.12 -0.28 0.00 -2.44 0.00 0.00 57.07 54.78 1oxu s TYR 306 Cb 0.06 -0.36 0.15 0.00 0.35 0.00 0.00 41.96 42.16 1oxu s TYR 306 CO 0.11 -0.13 1.16 1.14 -1.34 0.00 0.00 175.55 176.49 1oxu s GLN 307 N 1.36 0.37 -1.73 4.97 0.00 -0.71 -4.96 119.66 118.95 1oxu s GLN 307 Ca -0.05 0.22 0.00 0.00 -0.00 0.00 0.00 55.36 55.53 1oxu s GLN 307 Cb -0.13 0.18 0.00 0.00 0.00 0.00 0.00 33.01 33.06 1oxu s GLN 307 CO -0.03 -0.09 0.00 0.41 0.00 0.00 0.00 175.29 175.58 1oxu n GLY 308 N 1.21 0.14 3.08 2.60 0.00 -1.26 -1.89 105.19 109.08 1oxu n GLY 308 Ca -0.09 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1oxu n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oxu n GLY 309 N -0.92 1.47 3.51 -0.02 0.00 -1.26 -5.01 105.19 102.96 1oxu n GLY 309 Ca -0.22 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.56 1oxu n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oxu s LEU 310 N 0.00 2.73 -0.10 0.99 1.43 -0.79 -4.94 118.68 118.00 1oxu s LEU 310 Ca 0.00 -0.87 -0.16 0.00 -1.03 0.00 0.00 54.13 52.07 1oxu s LEU 310 Cb 0.00 -1.30 -0.05 0.00 0.03 0.00 0.00 46.19 44.87 1oxu s LEU 310 CO 0.00 0.05 0.41 -0.36 0.23 0.00 0.00 176.35 176.68 1oxu s PHE 311 N -2.24 3.56 -0.35 0.29 0.40 -0.23 -1.74 117.98 117.66 1oxu s PHE 311 Ca 0.28 0.83 -0.12 0.00 -0.60 0.00 0.00 56.93 57.32 1oxu s PHE 311 Cb -0.06 -2.42 -0.00 0.00 0.51 0.00 0.00 43.02 41.04 1oxu s PHE 311 CO 0.15 0.32 0.23 0.50 0.70 0.00 0.00 175.22 177.12 1oxu s ARG 312 N 0.12 3.29 -0.21 0.44 3.52 0.36 -1.12 118.95 125.36 1oxu s ARG 312 Ca 0.23 -0.78 -0.06 0.00 -0.13 0.00 0.00 55.73 54.99 1oxu s ARG 312 Cb -0.15 -3.78 -0.03 0.00 -1.56 0.00 0.00 34.95 29.43 1oxu s ARG 312 CO 0.09 -0.52 0.02 0.42 -0.81 0.00 0.00 175.30 174.50 1oxu s ILE 313 N 1.67 4.09 -0.17 4.11 1.01 0.04 -0.14 121.20 131.82 1oxu s ILE 313 Ca 0.05 -0.26 -0.04 0.00 0.00 0.00 0.00 60.65 60.40 1oxu s ILE 313 Cb -0.18 -2.86 -0.02 0.00 0.01 0.00 0.00 42.46 39.41 1oxu s ILE 313 CO 0.09 0.42 -0.03 -0.89 0.00 0.00 0.00 174.94 174.53 1oxu s THR 314 N 1.03 3.85 0.38 2.92 2.01 -0.46 -1.75 115.64 123.62 1oxu s THR 314 Ca 0.02 -0.36 0.05 0.00 0.31 0.00 0.00 61.69 61.71 1oxu s THR 314 Cb -0.14 -2.70 -0.06 0.00 0.01 0.00 0.00 72.50 69.60 1oxu s THR 314 CO 0.02 0.47 0.04 0.27 -0.69 0.00 0.00 174.62 174.73 1oxu s ILE 315 N 0.61 1.41 0.07 1.82 -4.36 -0.07 0.10 121.20 120.80 1oxu s ILE 315 Ca -0.02 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.39 1oxu s ILE 315 Cb -0.14 -2.76 -0.03 0.00 1.25 0.00 0.00 42.46 40.77 1oxu s ILE 315 CO 0.02 0.00 -0.08 0.42 0.24 0.00 0.00 174.94 175.54 1oxu s THR 316 N -3.04 0.69 0.90 8.37 -4.23 -0.61 -1.36 115.64 116.36 1oxu s THR 316 Ca 0.32 -1.51 -0.12 0.00 -1.18 0.00 0.00 61.69 59.20 1oxu s THR 316 Cb 0.08 -1.16 0.13 0.00 1.34 0.00 0.00 72.50 72.89 1oxu s THR 316 CO 0.15 -0.59 1.09 -2.84 -0.54 0.00 0.00 174.62 171.89 1oxu s PRO 317 N -2.65 1.22 0.34 3.99 0.02 -1.26 -0.87 135.00 135.78 1oxu s PRO 317 Ca 0.01 0.80 -0.28 0.00 0.02 0.00 0.00 61.00 61.56 1oxu s PRO 317 Cb -0.03 -1.81 -0.09 0.00 0.02 0.00 0.00 34.50 32.59 1oxu s PRO 317 CO -0.02 -2.27 1.16 -0.51 -0.33 0.00 0.00 177.00 175.04 1oxu s LEU 318 N -6.23 4.39 -1.02 -5.54 1.43 -1.25 -3.40 118.68 107.05 1oxu s LEU 318 Ca 0.63 2.36 -0.07 0.00 -1.03 0.00 0.00 54.13 56.03 1oxu s LEU 318 Cb -0.18 -3.80 0.01 0.00 0.03 0.00 0.00 46.19 42.25 1oxu s LEU 318 CO 0.57 -0.41 0.90 -0.90 0.23 0.00 0.00 176.35 176.73 1oxu n ASP 319 N 0.67 -5.28 -3.48 2.29 5.75 -1.26 -1.80 116.55 113.44 1oxu n ASP 319 Ca 0.01 -0.41 -0.15 0.00 -0.01 0.00 0.00 54.79 54.23 1oxu n ASP 319 Cb 0.45 -3.92 -0.04 0.00 -1.03 0.00 0.00 41.12 36.57 1oxu n ASP 319 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1oxu s SER 320 N -3.25 -0.60 -0.01 -1.12 0.15 -1.22 -4.46 113.70 103.18 1oxu s SER 320 Ca 0.44 0.40 0.18 0.00 0.70 0.00 0.00 55.95 57.67 1oxu s SER 320 Cb -0.19 0.55 -0.23 0.00 -1.71 0.00 0.00 66.02 64.43 1oxu s SER 320 CO 0.55 -0.74 0.59 -0.62 1.20 0.00 0.00 173.24 174.23 1oxu n GLU 321 N 0.36 0.92 -1.67 5.44 -0.58 -1.26 -4.51 120.64 119.33 1oxu n GLU 321 Ca -0.17 -0.07 -0.44 0.00 -0.42 0.00 0.00 57.16 56.06 1oxu n GLU 321 Cb 0.60 -1.37 -0.01 0.00 -0.57 0.00 0.00 31.44 30.09 1oxu n GLU 321 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1oxu n GLU 322 N -1.72 1.99 -4.06 3.49 -0.58 -1.26 -4.98 120.64 113.52 1oxu n GLU 322 Ca 0.00 0.70 -0.32 0.00 -0.42 0.00 0.00 57.16 57.13 1oxu n GLU 322 Cb 0.36 -2.28 -0.06 0.00 -0.57 0.00 0.00 31.44 28.88 1oxu n GLU 322 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 1oxu s GLU 323 N -1.31 3.05 -0.05 3.49 2.02 -1.26 -4.12 118.70 120.52 1oxu s GLU 323 Ca 0.60 -0.54 -0.01 0.00 0.02 0.00 0.00 54.97 55.04 1oxu s GLU 323 Cb -0.62 -2.84 0.03 0.00 0.10 0.00 0.00 34.13 30.80 1oxu s GLU 323 CO 0.57 0.62 0.03 0.42 0.02 0.00 0.00 175.26 176.92 1oxu s ILE 324 N -1.29 0.10 0.20 -1.63 1.01 -0.46 -4.75 121.20 114.38 1oxu s ILE 324 Ca 0.26 0.25 0.10 0.00 0.00 0.00 0.00 60.65 61.26 1oxu s ILE 324 Cb -0.12 -0.28 -0.04 0.00 0.01 0.00 0.00 42.46 42.02 1oxu s ILE 324 CO 0.18 0.19 -0.17 0.72 0.00 0.00 0.00 174.94 175.86 1oxu s PHE 325 N 1.78 2.45 0.19 3.97 -0.12 -1.26 -0.89 117.98 124.09 1oxu s PHE 325 Ca 0.01 -0.30 -0.17 0.00 -0.05 0.00 0.00 56.93 56.42 1oxu s PHE 325 Cb -0.12 -1.18 0.03 0.00 -0.63 0.00 0.00 43.02 41.11 1oxu s PHE 325 CO -0.03 0.54 0.50 -0.08 -0.05 0.00 0.00 175.22 176.09 1oxu s THR 326 N -1.84 0.03 0.03 -4.49 -1.32 -0.72 -4.37 115.64 102.96 1oxu s THR 326 Ca 0.24 -0.79 0.03 0.00 -1.21 0.00 0.00 61.69 59.97 1oxu s THR 326 Cb -0.08 -1.54 -0.04 0.00 -1.51 0.00 0.00 72.50 69.33 1oxu s THR 326 CO 0.13 -0.15 -0.04 -0.31 -2.21 0.00 0.00 174.62 172.04 1oxu s TYR 327 N -3.87 2.94 0.05 9.09 1.51 -1.26 -0.78 117.35 125.03 1oxu s TYR 327 Ca 0.09 -0.02 -0.17 0.00 -1.01 0.00 0.00 57.07 55.96 1oxu s TYR 327 Cb -0.00 -1.59 0.03 0.00 -0.11 0.00 0.00 41.96 40.28 1oxu s TYR 327 CO -0.04 0.42 0.39 0.45 -1.11 0.00 0.00 175.55 175.66 1oxu s SER 328 N -1.69 -0.25 0.51 2.29 0.15 -0.28 -4.98 113.70 109.46 1oxu s SER 328 Ca 0.20 -0.06 0.30 0.00 0.70 0.00 0.00 55.95 57.09 1oxu s SER 328 Cb -0.11 0.41 1.06 0.00 -1.71 0.00 0.00 66.02 65.67 1oxu s SER 328 CO 0.11 -0.67 1.87 0.44 1.20 0.00 0.00 173.24 176.19 1oxu h ASP 329 N 3.01 0.00 -4.28 5.45 3.32 -1.92 -0.59 116.42 121.41 1oxu h ASP 329 Ca -0.31 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.20 1oxu h ASP 329 Cb 1.21 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 40.51 1oxu h ASP 329 CO 0.44 0.02 -0.82 -1.00 -1.72 0.00 0.00 179.24 176.16 1oxu s HIS 330 N -3.54 1.63 0.38 4.55 3.76 -1.26 -4.81 115.29 116.00 1oxu s HIS 330 Ca 0.03 -0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 54.43 1oxu s HIS 330 Cb 0.08 -0.95 -0.07 0.00 1.11 0.00 0.00 32.58 32.75 1oxu s HIS 330 CO 0.58 0.10 0.76 -1.25 -0.85 0.00 0.00 174.74 174.09 1oxu s PRO 331 N -1.38 3.85 -0.09 8.40 0.04 -1.26 -4.90 135.00 139.66 1oxu s PRO 331 Ca 0.05 0.54 0.02 0.00 0.04 0.00 0.00 61.00 61.65 1oxu s PRO 331 Cb -0.09 -2.40 0.01 0.00 0.04 0.00 0.00 34.50 32.06 1oxu s PRO 331 CO 0.02 0.03 -0.13 0.42 0.04 0.00 0.00 177.00 177.38 1oxu s ILE 332 N -2.24 1.29 0.60 0.56 1.01 -1.26 -5.13 121.20 116.04 1oxu s ILE 332 Ca 0.52 -0.54 -0.17 0.00 0.00 0.00 0.00 60.65 60.46 1oxu s ILE 332 Cb -0.10 -1.19 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1oxu s ILE 332 CO 0.27 0.40 1.13 -1.00 0.00 0.00 0.00 174.94 175.74 1oxu s HIS 333 N 0.91 2.58 0.57 3.97 3.76 -1.26 -4.88 115.29 120.94 1oxu s HIS 333 Ca -0.09 1.55 -0.20 0.00 -0.15 0.00 0.00 55.06 56.16 1oxu s HIS 333 Cb -0.15 -3.27 -0.04 0.00 1.11 0.00 0.00 32.58 30.22 1oxu s HIS 333 CO 0.00 -1.75 1.29 -1.54 -0.85 0.00 0.00 174.74 171.89 1oxu s SER 334 N -2.08 5.23 0.00 1.40 1.04 -1.26 -2.83 113.70 115.20 1oxu s SER 334 Ca 0.71 2.59 0.00 0.00 0.48 0.00 0.00 55.95 59.73 1oxu s SER 334 Cb -0.24 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.26 1oxu s SER 334 CO 0.34 -1.58 0.00 0.61 0.98 0.00 0.00 173.24 173.59 1oxu n GLY 335 N 0.68 1.91 3.76 7.32 0.00 0.84 -4.97 105.19 114.72 1oxu n GLY 335 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 1oxu n GLY 335 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oxu s GLU 336 N -0.36 4.79 0.13 1.61 0.41 -1.13 -4.78 118.70 119.37 1oxu s GLU 336 Ca 0.00 1.45 -0.17 0.00 -0.41 0.00 0.00 54.97 55.84 1oxu s GLU 336 Cb 0.00 -3.16 -0.07 0.00 -1.78 0.00 0.00 34.13 29.12 1oxu s GLU 336 CO 0.00 0.46 0.58 -1.21 -0.49 0.00 0.00 175.26 174.60 1oxu s GLU 337 N -1.40 4.10 0.11 1.61 2.02 -1.26 -0.80 118.70 123.08 1oxu s GLU 337 Ca 0.43 0.64 -0.04 0.00 0.02 0.00 0.00 54.97 56.02 1oxu s GLU 337 Cb -0.24 -3.03 -0.03 0.00 0.10 0.00 0.00 34.13 30.93 1oxu s GLU 337 CO 0.30 0.52 0.10 0.14 0.02 0.00 0.00 175.26 176.35 1oxu s VAL 338 N -1.35 0.13 0.04 2.63 -7.23 -0.07 -4.86 120.40 109.70 1oxu s VAL 338 Ca 0.35 -1.65 -0.21 0.00 -1.81 0.00 0.00 61.98 58.66 1oxu s VAL 338 Cb -0.17 -1.75 -0.06 0.00 0.56 0.00 0.00 36.38 34.96 1oxu s VAL 338 CO 0.19 -0.60 0.63 -0.76 -0.31 0.00 0.00 175.10 174.26 1oxu s LEU 339 N -2.97 4.47 -0.23 1.32 1.43 0.30 -0.34 118.68 122.65 1oxu s LEU 339 Ca 0.15 1.28 -0.06 0.00 -1.03 0.00 0.00 54.13 54.47 1oxu s LEU 339 Cb 0.06 -3.00 -0.02 0.00 0.03 0.00 0.00 46.19 43.26 1oxu s LEU 339 CO -0.04 0.15 0.03 -0.69 0.23 0.00 0.00 176.35 176.03 1oxu s VAL 340 N -0.53 4.05 0.12 -1.59 1.01 -0.28 -1.67 120.40 121.51 1oxu s VAL 340 Ca 0.32 -0.27 0.08 0.00 0.00 0.00 0.00 61.98 62.12 1oxu s VAL 340 Cb -0.19 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.27 1oxu s VAL 340 CO 0.19 0.38 -0.15 -0.31 0.00 0.00 0.00 175.10 175.21 1oxu s TYR 341 N 1.45 2.60 0.08 5.22 1.51 0.72 -1.03 117.35 127.89 1oxu s TYR 341 Ca 0.05 -0.23 0.01 0.00 -1.01 0.00 0.00 57.07 55.90 1oxu s TYR 341 Cb -0.15 -1.36 -0.04 0.00 -0.11 0.00 0.00 41.96 40.31 1oxu s TYR 341 CO 0.02 0.42 -0.06 0.14 -1.11 0.00 0.00 175.55 174.95 1oxu s VAL 342 N -1.25 0.59 -0.65 0.71 -7.23 0.01 -0.56 120.40 112.02 1oxu s VAL 342 Ca 0.20 -1.76 -0.28 0.00 -1.81 0.00 0.00 61.98 58.34 1oxu s VAL 342 Cb -0.10 -1.45 0.03 0.00 0.56 0.00 0.00 36.38 35.41 1oxu s VAL 342 CO 0.12 -0.81 1.28 -0.13 -0.31 0.00 0.00 175.10 175.26 1oxu s ARG 343 N -3.43 3.32 0.20 4.82 1.81 -1.06 0.10 118.95 124.71 1oxu s ARG 343 Ca 0.07 0.08 -0.11 0.00 -1.72 0.00 0.00 55.73 54.05 1oxu s ARG 343 Cb 0.03 -4.11 0.25 0.00 -0.45 0.00 0.00 34.95 30.67 1oxu s ARG 343 CO -0.05 -1.95 1.71 -0.22 -0.68 0.00 0.00 175.30 174.11 1oxu h LYS 344 N 10.14 0.23 0.00 3.54 3.64 -1.92 0.21 116.57 132.42 1oxu h LYS 344 Ca -0.27 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 1oxu h LYS 344 Cb 1.06 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1oxu h LYS 344 CO 1.23 0.15 0.00 -0.25 -2.27 0.00 0.00 179.45 178.31 1oxu n ASP 345 N -5.13 0.00 -0.52 4.20 8.00 -1.26 -1.87 116.55 119.97 1oxu n ASP 345 Ca 0.07 -0.33 0.07 0.00 0.71 0.00 0.00 54.79 55.31 1oxu n ASP 345 Cb 0.29 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.44 1oxu n ASP 345 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1oxu n LYS 346 N -1.00 0.99 -2.22 -1.24 4.01 0.75 -4.96 118.16 114.49 1oxu n LYS 346 Ca 0.08 -1.26 -0.42 0.00 -0.51 0.00 0.00 58.31 56.20 1oxu n LYS 346 Cb 0.04 -1.25 -0.03 0.00 -0.51 0.00 0.00 35.03 33.28 1oxu n LYS 346 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1oxu s ILE 347 N -1.18 3.69 -0.14 -0.18 1.01 -0.78 -4.75 121.20 118.86 1oxu s ILE 347 Ca 0.15 1.09 -0.07 0.00 0.00 0.00 0.00 60.65 61.82 1oxu s ILE 347 Cb 0.11 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 1oxu s ILE 347 CO 0.19 0.01 0.12 -0.54 0.00 0.00 0.00 174.94 174.71 1oxu s LYS 348 N 2.26 3.64 -0.01 2.79 1.02 0.59 -4.96 119.74 125.07 1oxu s LYS 348 Ca 0.64 -0.19 0.01 0.00 0.02 0.00 0.00 55.97 56.45 1oxu s LYS 348 Cb -0.32 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 33.78 1oxu s LYS 348 CO 0.27 0.61 -0.04 0.54 -0.92 0.00 0.00 175.35 175.80 1oxu s VAL 349 N -0.54 0.35 0.01 3.17 0.11 -1.26 0.77 120.40 123.01 1oxu s VAL 349 Ca 0.12 -0.15 -0.00 0.00 -2.93 0.00 0.00 61.98 59.02 1oxu s VAL 349 Cb -0.12 -0.33 -0.01 0.00 -1.53 0.00 0.00 36.38 34.39 1oxu s VAL 349 CO 0.02 0.12 -0.02 -0.36 -3.33 0.00 0.00 175.10 171.53 1oxu s PHE 350 N 0.14 0.19 0.49 1.54 0.40 -0.20 -4.97 117.98 115.57 1oxu s PHE 350 Ca -0.01 -0.38 -0.23 0.00 -0.60 0.00 0.00 56.93 55.71 1oxu s PHE 350 Cb -0.05 -0.14 -0.06 0.00 0.51 0.00 0.00 43.02 43.28 1oxu s PHE 350 CO -0.00 -0.14 1.31 -1.21 0.70 0.00 0.00 175.22 175.88 1oxu s GLU 351 N -1.05 3.48 0.31 0.44 2.02 -1.26 0.52 118.70 123.16 1oxu s GLU 351 Ca -0.12 2.14 -0.16 0.00 0.02 0.00 0.00 54.97 56.85 1oxu s GLU 351 Cb -0.07 -2.42 -0.09 0.00 0.10 0.00 0.00 34.13 31.65 1oxu s GLU 351 CO -0.01 -0.89 0.75 0.21 0.02 0.00 0.00 175.26 175.35 1oxu s LYS 352 N -2.70 4.07 0.00 1.61 2.20 -1.16 -4.59 119.74 119.17 1oxu s LYS 352 Ca 0.66 0.75 0.00 0.00 -0.36 0.00 0.00 55.97 57.02 1oxu s LYS 352 Cb -0.38 -2.49 0.00 0.00 -1.51 0.00 0.00 37.83 33.45 1oxu s LYS 352 CO 0.46 0.18 0.00 0.09 -0.36 0.00 0.00 175.35 175.72