#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ukh n PHE 10 N 0.00 0.02 -3.55 1.20 3.01 -1.26 -3.17 117.46 113.71 1ukh n PHE 10 Ca 0.00 -2.31 -0.11 0.00 1.01 0.00 0.00 57.45 56.04 1ukh n PHE 10 Cb 0.00 -0.39 -0.02 0.00 -0.01 0.00 0.00 39.48 39.05 1ukh n PHE 10 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 1ukh s TYR 11 N -2.68 -0.42 -0.06 1.38 1.13 -0.73 -4.78 117.35 111.19 1ukh s TYR 11 Ca 0.19 0.14 0.06 0.00 -1.41 0.00 0.00 57.07 56.05 1ukh s TYR 11 Cb -0.02 0.59 -0.01 0.00 -1.10 0.00 0.00 41.96 41.42 1ukh s TYR 11 CO 0.12 -0.96 -0.25 -1.12 -2.51 0.00 0.00 175.55 170.84 1ukh s SER 12 N -2.80 3.07 -0.02 -0.18 0.01 -1.26 -1.60 113.70 110.91 1ukh s SER 12 Ca 0.04 -0.51 0.07 0.00 1.31 0.00 0.00 55.95 56.86 1ukh s SER 12 Cb -0.02 -0.87 -0.02 0.00 0.21 0.00 0.00 66.02 65.31 1ukh s SER 12 CO -0.07 0.24 -0.25 -0.69 0.41 0.00 0.00 173.24 172.88 1ukh s VAL 13 N -0.14 1.96 -0.35 3.43 1.01 -0.53 -5.00 120.40 120.79 1ukh s VAL 13 Ca -0.04 -1.06 -0.16 0.00 0.00 0.00 0.00 61.98 60.72 1ukh s VAL 13 Cb -0.14 -1.63 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1ukh s VAL 13 CO 0.04 0.55 0.38 -1.61 0.00 0.00 0.00 175.10 174.47 1ukh s GLU 14 N -0.52 3.54 -0.20 2.72 0.41 -1.26 -1.06 118.70 122.32 1ukh s GLU 14 Ca 0.08 -0.41 0.01 0.00 -0.41 0.00 0.00 54.97 54.24 1ukh s GLU 14 Cb -0.10 -3.81 0.03 0.00 -1.78 0.00 0.00 34.13 28.46 1ukh s GLU 14 CO -0.00 -0.56 -0.18 0.96 -0.49 0.00 0.00 175.26 174.99 1ukh s ILE 15 N 2.06 2.12 0.00 -1.63 -5.25 -0.81 -4.98 121.20 112.71 1ukh s ILE 15 Ca 0.12 -1.07 0.00 0.00 -0.99 0.00 0.00 60.65 58.72 1ukh s ILE 15 Cb -0.16 -1.96 0.00 0.00 2.95 0.00 0.00 42.46 43.28 1ukh s ILE 15 CO 0.12 0.42 0.00 0.61 -1.79 0.00 0.00 174.94 174.30 1ukh n GLY 16 N 4.59 3.20 0.89 6.27 0.00 -1.26 -1.57 105.19 117.30 1ukh n GLY 16 Ca -0.20 -0.26 0.10 0.00 0.00 0.00 0.00 46.02 45.67 1ukh n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ukh n ASP 17 N 2.43 2.61 -4.61 1.61 8.00 -1.26 -4.91 116.55 120.42 1ukh n ASP 17 Ca 0.00 -1.91 -0.25 0.00 0.71 0.00 0.00 54.79 53.34 1ukh n ASP 17 Cb 0.00 -0.25 -0.08 0.00 -0.02 0.00 0.00 41.12 40.77 1ukh n ASP 17 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1ukh s SER 18 N -1.29 4.38 -0.26 -2.24 1.04 -0.61 -5.11 113.70 109.61 1ukh s SER 18 Ca 0.35 -0.64 -0.06 0.00 0.48 0.00 0.00 55.95 56.08 1ukh s SER 18 Cb 0.19 -0.77 -0.01 0.00 0.10 0.00 0.00 66.02 65.53 1ukh s SER 18 CO 0.26 0.04 0.05 -0.89 0.98 0.00 0.00 173.24 173.69 1ukh s THR 19 N -2.09 3.94 -0.46 2.02 2.01 -1.26 -1.93 115.64 117.87 1ukh s THR 19 Ca 0.29 -0.48 -0.20 0.00 0.31 0.00 0.00 61.69 61.60 1ukh s THR 19 Cb -0.07 -2.92 0.03 0.00 0.01 0.00 0.00 72.50 69.55 1ukh s THR 19 CO 0.18 0.24 0.65 -0.36 -0.69 0.00 0.00 174.62 174.64 1ukh s PHE 20 N 1.53 3.05 -0.45 4.92 0.40 -0.23 -4.96 117.98 122.25 1ukh s PHE 20 Ca 0.04 -0.18 -0.13 0.00 -0.60 0.00 0.00 56.93 56.06 1ukh s PHE 20 Cb -0.16 -3.42 0.07 0.00 0.51 0.00 0.00 43.02 40.02 1ukh s PHE 20 CO 0.02 -0.94 0.33 0.99 0.70 0.00 0.00 175.22 176.32 1ukh s THR 21 N 2.83 4.81 0.25 0.64 2.01 -1.26 -1.45 115.64 123.47 1ukh s THR 21 Ca 0.21 -1.19 0.03 0.00 0.31 0.00 0.00 61.69 61.05 1ukh s THR 21 Cb -0.15 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 1ukh s THR 21 CO 0.17 -0.54 0.04 0.68 -0.69 0.00 0.00 174.62 174.29 1ukh s VAL 22 N 1.55 0.85 0.38 3.82 -7.23 -0.63 -4.58 120.40 114.56 1ukh s VAL 22 Ca 0.04 -2.01 -0.26 0.00 -1.81 0.00 0.00 61.98 57.93 1ukh s VAL 22 Cb -0.24 -2.50 -0.11 0.00 0.56 0.00 0.00 36.38 34.09 1ukh s VAL 22 CO 0.05 -0.17 1.20 0.18 -0.31 0.00 0.00 175.10 176.05 1ukh n LEU 23 N -0.46 3.36 0.20 1.32 4.77 -1.26 -1.77 117.00 123.16 1ukh n LEU 23 Ca -0.03 1.14 0.14 0.00 -0.03 0.00 0.00 56.01 57.23 1ukh n LEU 23 Cb 0.65 -1.44 0.72 0.00 -2.33 0.00 0.00 43.42 41.02 1ukh n LEU 23 CO 0.38 -0.83 0.92 0.11 -1.33 0.00 0.00 177.39 176.64 1ukh h LYS 24 N 2.13 0.00 0.00 3.23 1.57 -1.85 -2.14 116.57 119.51 1ukh h LYS 24 Ca -0.46 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.30 1ukh h LYS 24 Cb 1.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.61 1ukh h LYS 24 CO 0.60 0.00 -0.10 0.07 -0.57 0.00 0.00 179.45 179.45 1ukh h ARG 25 N 0.00 0.00 -5.37 3.15 0.11 -1.88 -3.42 114.38 106.97 1ukh h ARG 25 Ca 0.00 0.00 -0.60 0.00 0.10 0.00 0.00 59.98 59.48 1ukh h ARG 25 Cb 0.07 0.00 -0.11 0.00 1.11 0.00 0.00 29.97 31.03 1ukh h ARG 25 CO 0.00 0.10 -0.34 0.71 0.10 0.00 0.00 179.97 180.53 1ukh s TYR 26 N -4.01 3.40 0.35 4.08 2.02 -0.81 -0.62 117.35 121.77 1ukh s TYR 26 Ca -0.02 0.50 0.07 0.00 -0.37 0.00 0.00 57.07 57.26 1ukh s TYR 26 Cb 0.12 -2.36 -0.03 0.00 -0.40 0.00 0.00 41.96 39.29 1ukh s TYR 26 CO 0.56 0.14 0.27 1.04 -1.57 0.00 0.00 175.55 175.99 1ukh n GLN 27 N 3.94 0.44 -3.81 -0.62 3.00 -0.59 -4.89 117.38 114.86 1ukh n GLN 27 Ca -0.12 -3.43 -0.26 0.00 -0.01 0.00 0.00 57.00 53.18 1ukh n GLN 27 Cb 0.52 2.66 0.03 0.00 0.00 0.00 0.00 30.24 33.45 1ukh n GLN 27 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 1ukh n ASN 28 N -1.64 -3.66 -4.77 1.08 3.02 -1.26 0.54 115.26 108.57 1ukh n ASN 28 Ca 0.06 -0.77 -0.38 0.00 -0.03 0.00 0.00 54.58 53.46 1ukh n ASN 28 Cb 0.62 -4.06 -0.01 0.00 -0.61 0.00 0.00 39.78 35.71 1ukh n ASN 28 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1ukh s LEU 29 N -7.07 4.16 -0.17 3.41 1.02 -1.25 -4.31 118.68 114.48 1ukh s LEU 29 Ca 0.42 2.41 -0.09 0.00 0.02 0.00 0.00 54.13 56.89 1ukh s LEU 29 Cb -0.21 -4.04 0.06 0.00 0.02 0.00 0.00 46.19 42.03 1ukh s LEU 29 CO 0.81 -0.76 0.42 -0.75 0.02 0.00 0.00 176.35 176.09 1ukh s LYS 30 N -2.36 0.39 0.14 1.70 2.20 0.13 -4.92 119.74 117.02 1ukh s LYS 30 Ca 0.58 0.82 -0.31 0.00 -0.36 0.00 0.00 55.97 56.70 1ukh s LYS 30 Cb -0.32 0.01 -0.08 0.00 -1.51 0.00 0.00 37.83 35.93 1ukh s LYS 30 CO 0.40 -0.17 1.41 -1.25 -0.36 0.00 0.00 175.35 175.38 1ukh s PRO 31 N 1.53 4.31 0.00 4.03 0.04 -1.26 0.15 135.00 143.80 1ukh s PRO 31 Ca -0.09 2.13 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1ukh s PRO 31 Cb -0.09 -3.22 0.00 0.00 0.04 0.00 0.00 34.50 31.23 1ukh s PRO 31 CO -0.13 -0.44 0.05 0.44 0.04 0.00 0.00 177.00 176.96 1ukh n ILE 32 N 3.72 0.00 -4.04 0.56 -5.35 0.30 -4.85 119.36 109.69 1ukh n ILE 32 Ca 0.11 -0.36 -0.10 0.00 -0.27 0.00 0.00 62.75 62.13 1ukh n ILE 32 Cb 0.42 1.04 -0.07 0.00 -1.74 0.00 0.00 39.64 39.28 1ukh n ILE 32 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ukh s GLY 33 N -0.62 0.76 0.00 3.28 0.00 -0.88 -4.98 107.32 104.88 1ukh s GLY 33 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 44.72 43.62 1ukh s GLY 33 CO 0.00 -0.88 0.00 -1.26 0.00 0.00 0.00 173.10 170.96 1ukh n SER 34 N -0.31 0.00 0.00 1.64 2.88 -1.25 -3.01 113.62 113.57 1ukh n SER 34 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 1ukh n SER 34 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 1ukh n SER 34 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ukh n GLY 35 N 0.00 5.29 0.13 0.46 0.00 -0.90 -5.01 105.19 105.16 1ukh n GLY 35 Ca 0.00 -1.48 -0.20 0.00 0.00 0.00 0.00 46.02 44.34 1ukh n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ukh h ALA 36 N 1.00 -0.06 0.03 4.61 0.00 -2.02 -3.33 119.26 119.49 1ukh h ALA 36 Ca 0.00 -0.70 0.03 0.00 0.00 0.00 0.00 54.91 54.24 1ukh h ALA 36 Cb 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1ukh h ALA 36 CO 0.00 0.44 -0.42 1.96 0.00 0.00 0.00 179.25 181.23 1ukh h GLN 37 N -0.20 -0.57 0.00 0.00 1.08 -1.96 -3.44 115.11 110.03 1ukh h GLN 37 Ca -0.15 0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1ukh h GLN 37 Cb 1.67 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 29.23 1ukh h GLN 37 CO 0.17 -0.38 0.00 0.41 -0.95 0.00 0.00 178.83 178.08 1ukh n GLY 38 N -1.45 -0.50 3.74 3.46 0.00 -1.25 -2.74 105.19 106.44 1ukh n GLY 38 Ca -0.06 -1.01 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 1ukh n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ukh s ILE 39 N -3.07 5.41 -0.12 -0.61 1.01 -1.13 -2.11 121.20 120.58 1ukh s ILE 39 Ca 0.00 0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.83 1ukh s ILE 39 Cb 0.00 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 1ukh s ILE 39 CO 0.00 0.45 -0.10 -0.69 0.00 0.00 0.00 174.94 174.60 1ukh s VAL 40 N 0.29 3.39 0.06 2.92 1.01 -1.16 -1.32 120.40 125.58 1ukh s VAL 40 Ca 0.08 -0.55 0.08 0.00 0.00 0.00 0.00 61.98 61.59 1ukh s VAL 40 Cb -0.11 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.80 1ukh s VAL 40 CO -0.02 0.53 -0.19 0.00 0.00 0.00 0.00 175.10 175.43 1ukh s ALA 42 N -0.97 3.61 0.02 0.00 0.00 0.40 -0.84 121.76 123.99 1ukh s ALA 42 Ca 0.15 -0.05 -0.18 0.00 0.00 0.00 0.00 51.96 51.89 1ukh s ALA 42 Cb -0.10 -2.57 0.03 0.00 0.00 0.00 0.00 23.12 20.48 1ukh s ALA 42 CO 0.06 0.40 0.39 0.00 0.00 0.00 0.00 175.76 176.61 1ukh s ALA 43 N -0.99 -0.97 -0.22 0.00 0.00 -0.99 -0.70 121.76 117.90 1ukh s ALA 43 Ca 0.27 0.34 -0.16 0.00 0.00 0.00 0.00 51.96 52.42 1ukh s ALA 43 Cb -0.18 0.26 -0.04 0.00 0.00 0.00 0.00 23.12 23.16 1ukh s ALA 43 CO 0.17 -0.40 0.41 -0.47 0.00 0.00 0.00 175.76 175.47 1ukh s TYR 44 N -2.14 3.34 -0.61 0.00 5.04 0.19 -1.30 117.35 121.88 1ukh s TYR 44 Ca -0.07 0.59 -0.22 0.00 -2.44 0.00 0.00 57.07 54.92 1ukh s TYR 44 Cb -0.02 -2.56 0.06 0.00 0.35 0.00 0.00 41.96 39.80 1ukh s TYR 44 CO -0.00 -0.07 0.91 0.34 -1.34 0.00 0.00 175.55 175.39 1ukh s ASP 45 N 1.18 6.23 0.19 4.32 3.68 0.13 -1.54 116.67 130.86 1ukh s ASP 45 Ca 0.19 -0.82 0.18 0.00 2.13 0.00 0.00 52.55 54.23 1ukh s ASP 45 Cb -0.15 -2.40 0.84 0.00 -1.45 0.00 0.00 42.92 39.75 1ukh s ASP 45 CO 0.08 -1.31 1.56 0.00 0.13 0.00 0.00 175.17 175.64 1ukh n ALA 46 N 7.41 1.41 -0.11 3.66 0.00 0.21 0.87 120.51 133.96 1ukh n ALA 46 Ca -0.03 0.08 -0.20 0.00 0.00 0.00 0.00 53.44 53.30 1ukh n ALA 46 Cb 0.46 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.54 1ukh n ALA 46 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1ukh n ILE 47 N -2.01 1.51 0.70 0.00 2.08 -1.26 -4.23 119.36 116.15 1ukh n ILE 47 Ca 0.01 -0.09 0.12 0.00 0.56 0.00 0.00 62.75 63.35 1ukh n ILE 47 Cb 0.14 -2.10 0.48 0.00 -0.75 0.00 0.00 39.64 37.41 1ukh n ILE 47 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1ukh n LEU 48 N -4.40 0.35 -3.57 1.39 4.77 -1.22 -4.92 117.00 109.39 1ukh n LEU 48 Ca -0.33 0.55 -0.20 0.00 -0.03 0.00 0.00 56.01 56.00 1ukh n LEU 48 Cb 0.66 -0.46 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1ukh n LEU 48 CO 0.12 -0.19 -0.01 -0.62 -1.33 0.00 0.00 177.39 175.36 1ukh n GLU 49 N -1.84 -4.76 -3.68 3.23 1.02 0.25 -4.99 120.64 109.87 1ukh n GLU 49 Ca 0.05 0.70 -0.10 0.00 -0.02 0.00 0.00 57.16 57.79 1ukh n GLU 49 Cb 0.32 -5.36 -0.04 0.00 -0.02 0.00 0.00 31.44 26.34 1ukh n GLU 49 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1ukh s ARG 50 N -5.62 1.31 -0.04 3.49 1.70 -0.70 -4.96 118.95 114.12 1ukh s ARG 50 Ca 0.09 -0.78 -0.28 0.00 -0.47 0.00 0.00 55.73 54.29 1ukh s ARG 50 Cb -0.02 0.52 -0.03 0.00 -0.57 0.00 0.00 34.95 34.85 1ukh s ARG 50 CO 0.79 -0.55 0.91 -0.80 -1.08 0.00 0.00 175.30 174.57 1ukh s ASN 51 N -2.84 7.24 0.45 -2.89 0.01 -1.26 0.19 114.94 115.83 1ukh s ASN 51 Ca 0.07 1.50 0.01 0.00 -0.71 0.00 0.00 52.86 53.73 1ukh s ASN 51 Cb -0.00 -2.53 -0.00 0.00 0.41 0.00 0.00 41.25 39.13 1ukh s ASN 51 CO -0.06 -0.27 0.04 1.33 -1.51 0.00 0.00 177.10 176.63 1ukh n VAL 52 N 4.04 0.00 -3.91 1.60 0.24 -0.42 -3.56 118.33 116.32 1ukh n VAL 52 Ca 0.05 -2.23 -0.28 0.00 -2.04 0.00 0.00 64.34 59.84 1ukh n VAL 52 Cb 0.51 0.56 -0.17 0.00 -1.47 0.00 0.00 33.84 33.27 1ukh n VAL 52 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ukh s ALA 53 N -2.88 1.50 -0.29 2.33 0.00 0.16 -2.35 121.76 120.23 1ukh s ALA 53 Ca 0.06 -0.76 -0.11 0.00 0.00 0.00 0.00 51.96 51.15 1ukh s ALA 53 Cb 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 1ukh s ALA 53 CO 0.04 -0.61 0.18 0.42 0.00 0.00 0.00 175.76 175.79 1ukh s ILE 54 N 1.63 5.16 -0.22 0.00 1.01 -0.02 -0.58 121.20 128.18 1ukh s ILE 54 Ca 0.03 0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.67 1ukh s ILE 54 Cb -0.14 -3.50 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 1ukh s ILE 54 CO -0.08 0.21 -0.02 -0.75 0.00 0.00 0.00 174.94 174.29 1ukh s LYS 55 N 1.73 3.44 -0.33 2.79 2.20 -0.03 0.07 119.74 129.61 1ukh s LYS 55 Ca 0.07 -0.60 -0.11 0.00 -0.36 0.00 0.00 55.97 54.97 1ukh s LYS 55 Cb -0.16 -3.05 -0.01 0.00 -1.51 0.00 0.00 37.83 33.10 1ukh s LYS 55 CO 0.10 -0.17 0.20 0.21 -0.36 0.00 0.00 175.35 175.33 1ukh s LYS 56 N 1.42 3.36 0.32 4.03 2.20 -0.43 -0.54 119.74 130.10 1ukh s LYS 56 Ca 0.05 -0.72 -0.29 0.00 -0.36 0.00 0.00 55.97 54.65 1ukh s LYS 56 Cb -0.14 -3.69 -0.12 0.00 -1.51 0.00 0.00 37.83 32.37 1ukh s LYS 56 CO -0.02 -0.45 1.54 1.28 -0.36 0.00 0.00 175.35 177.34 1ukh n LEU 57 N 5.04 4.39 -4.59 5.43 4.77 0.26 -2.82 117.00 129.48 1ukh n LEU 57 Ca -0.13 1.18 -0.40 0.00 -0.03 0.00 0.00 56.01 56.63 1ukh n LEU 57 Cb 0.49 -1.59 -0.09 0.00 -2.33 0.00 0.00 43.42 39.91 1ukh n LEU 57 CO 0.35 0.09 0.12 -0.94 -1.33 0.00 0.00 177.39 175.69 1ukh s SER 58 N 0.24 6.29 -1.19 -1.43 1.04 -1.11 -4.37 113.70 113.18 1ukh s SER 58 Ca 0.60 0.23 -0.09 0.00 0.48 0.00 0.00 55.95 57.17 1ukh s SER 58 Cb -0.50 -2.23 -0.02 0.00 0.10 0.00 0.00 66.02 63.37 1ukh s SER 58 CO 0.54 -0.27 0.77 0.54 0.98 0.00 0.00 173.24 175.81 1ukh n ARG 59 N 5.45 -2.87 -0.32 4.02 3.00 -1.26 -4.83 116.66 119.84 1ukh n ARG 59 Ca -0.07 0.60 0.13 0.00 -0.01 0.00 0.00 57.85 58.50 1ukh n ARG 59 Cb 0.50 -4.88 0.26 0.00 0.00 0.00 0.00 32.46 28.34 1ukh n ARG 59 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 1ukh n PRO 60 N -4.03 -0.07 -3.34 5.56 -0.02 -1.26 -3.22 135.00 128.62 1ukh n PRO 60 Ca -0.17 1.39 -0.25 0.00 -2.02 0.00 0.00 63.50 62.44 1ukh n PRO 60 Cb 0.63 -2.19 -0.09 0.00 -0.02 0.00 0.00 33.50 31.83 1ukh n PRO 60 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1ukh s PHE 61 N -5.92 0.81 -0.25 6.00 -0.12 -1.26 -1.60 117.98 115.65 1ukh s PHE 61 Ca -0.12 -2.13 0.03 0.00 -0.05 0.00 0.00 56.93 54.66 1ukh s PHE 61 Cb 0.27 -0.80 0.08 0.00 -0.63 0.00 0.00 43.02 41.94 1ukh s PHE 61 CO 0.72 -0.87 1.04 0.94 -0.05 0.00 0.00 175.22 177.00 1ukh n GLN 62 N 2.91 2.79 0.00 1.99 0.00 -1.20 -4.99 117.38 118.88 1ukh n GLN 62 Ca 0.28 -1.60 0.00 0.00 -0.00 0.00 0.00 57.00 55.68 1ukh n GLN 62 Cb 0.48 -1.07 0.00 0.00 0.00 0.00 0.00 30.24 29.65 1ukh n GLN 62 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 1ukh n ASN 63 N -0.21 0.00 0.31 1.69 6.94 -1.26 -5.00 115.26 117.73 1ukh n ASN 63 Ca 0.03 0.00 0.09 0.00 -0.02 0.00 0.00 54.58 54.68 1ukh n ASN 63 Cb 0.29 0.00 0.44 0.00 -2.36 0.00 0.00 39.78 38.14 1ukh n ASN 63 CO 0.00 0.00 0.00 1.56 -1.03 0.00 0.00 177.26 177.79 1ukh h GLN 64 N 0.00 0.00 -0.10 -3.83 4.20 -1.94 -0.10 115.11 113.35 1ukh h GLN 64 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 1ukh h GLN 64 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1ukh h GLN 64 CO 0.00 0.00 -0.17 1.15 -0.67 0.00 0.00 178.83 179.14 1ukh h THR 65 N 0.00 1.39 -0.24 -0.54 2.02 -1.96 -3.25 112.91 110.33 1ukh h THR 65 Ca 0.02 -1.44 -0.05 0.00 0.77 0.00 0.00 66.41 65.71 1ukh h THR 65 Cb 1.35 2.10 -0.01 0.00 -1.74 0.00 0.00 68.15 69.85 1ukh h THR 65 CO -0.00 0.41 -0.06 0.45 0.37 0.00 0.00 175.52 176.69 1ukh h HIS 66 N -0.15 0.52 -0.85 3.16 3.86 -1.28 -3.28 115.15 117.13 1ukh h HIS 66 Ca 0.01 -0.12 0.13 0.00 -1.16 0.00 0.00 60.37 59.23 1ukh h HIS 66 Cb 0.74 -0.13 -0.09 0.00 1.06 0.00 0.00 27.41 29.00 1ukh h HIS 66 CO 0.10 0.70 0.46 0.00 0.86 0.00 0.00 177.93 180.05 1ukh h ALA 67 N 0.75 1.27 -0.22 2.45 0.00 -1.17 -0.26 119.26 122.07 1ukh h ALA 67 Ca 0.06 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1ukh h ALA 67 Cb 0.53 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1ukh h ALA 67 CO 0.02 -0.02 -0.24 -0.22 0.00 0.00 0.00 179.25 178.79 1ukh h LYS 68 N 0.69 0.41 -0.26 0.00 3.11 -1.62 0.52 116.57 119.42 1ukh h LYS 68 Ca 0.45 -0.14 -0.19 0.00 -2.81 0.00 0.00 60.65 57.95 1ukh h LYS 68 Cb 0.57 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.78 1ukh h LYS 68 CO -0.33 0.63 -0.58 -0.09 -2.81 0.00 0.00 179.45 176.27 1ukh h ARG 69 N 0.37 0.85 -0.12 1.90 1.12 -1.38 0.27 114.38 117.38 1ukh h ARG 69 Ca 0.06 -0.57 -0.02 0.00 -1.11 0.00 0.00 59.98 58.34 1ukh h ARG 69 Cb 0.62 0.08 -0.00 0.00 -0.01 0.00 0.00 29.97 30.66 1ukh h ARG 69 CO 0.04 1.20 -0.01 0.00 -3.11 0.00 0.00 179.97 178.09 1ukh h ALA 70 N 0.65 0.17 -0.56 2.80 0.00 -0.66 0.06 119.26 121.73 1ukh h ALA 70 Ca 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1ukh h ALA 70 Cb 1.19 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 1ukh h ALA 70 CO 0.13 -0.12 0.26 -0.92 0.00 0.00 0.00 179.25 178.60 1ukh h TYR 71 N -0.06 0.78 0.44 0.00 3.20 0.07 -2.16 116.97 119.23 1ukh h TYR 71 Ca 0.03 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1ukh h TYR 71 Cb 0.40 -0.25 0.00 0.00 1.54 0.00 0.00 36.73 38.43 1ukh h TYR 71 CO 0.04 0.58 -0.21 -0.09 -1.64 0.00 0.00 178.16 176.84 1ukh h ARG 72 N 0.78 -0.57 -0.70 1.82 2.43 -0.10 -2.41 114.38 115.64 1ukh h ARG 72 Ca 0.19 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1ukh h ARG 72 Cb 0.10 0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.74 1ukh h ARG 72 CO -0.02 -0.36 0.40 1.49 -1.51 0.00 0.00 179.97 179.96 1ukh h GLU 73 N -0.61 0.97 0.63 0.20 4.81 -0.79 -2.33 114.58 117.46 1ukh h GLU 73 Ca -0.06 -0.10 -0.03 0.00 -0.13 0.00 0.00 59.36 59.04 1ukh h GLU 73 Cb 0.47 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 29.66 1ukh h GLU 73 CO 0.10 0.71 -0.30 -0.07 -0.73 0.00 0.00 179.01 178.72 1ukh h LEU 74 N 0.96 -0.72 -0.23 1.64 3.38 -1.40 -0.04 115.31 118.90 1ukh h LEU 74 Ca 0.25 -0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.25 1ukh h LEU 74 Cb 0.01 0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 1ukh h LEU 74 CO -0.04 -0.44 -0.03 0.58 0.09 0.00 0.00 178.44 178.59 1ukh h VAL 75 N -0.95 0.80 0.41 1.22 2.07 -1.43 -1.48 116.25 116.89 1ukh h VAL 75 Ca -0.09 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 1ukh h VAL 75 Cb 0.68 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1ukh h VAL 75 CO 0.14 0.01 -0.20 -0.07 0.02 0.00 0.00 177.57 177.47 1ukh h LEU 76 N 0.03 -0.47 -1.75 2.57 3.38 -1.44 -2.15 115.31 115.48 1ukh h LEU 76 Ca 0.11 -0.01 0.27 0.00 0.09 0.00 0.00 57.88 58.34 1ukh h LEU 76 Cb 0.15 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.97 1ukh h LEU 76 CO -0.21 -0.31 0.69 0.24 0.09 0.00 0.00 178.44 178.94 1ukh h MET 77 N -0.60 0.17 0.12 1.13 2.86 -0.82 -0.60 114.93 117.19 1ukh h MET 77 Ca -0.06 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1ukh h MET 77 Cb 0.45 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.07 1ukh h MET 77 CO 0.09 0.11 -0.06 0.87 1.06 0.00 0.00 176.91 178.99 1ukh h LYS 78 N 0.17 -0.15 -0.25 1.72 1.57 -0.63 -3.37 116.57 115.63 1ukh h LYS 78 Ca 0.51 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 59.30 1ukh h LYS 78 Cb 1.69 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 34.02 1ukh h LYS 78 CO -0.11 -0.10 0.15 0.00 -0.57 0.00 0.00 179.45 178.82 1ukh n VAL 80 N -4.89 0.03 -3.26 0.00 0.31 -0.25 -4.63 118.33 105.66 1ukh n VAL 80 Ca -0.03 -0.01 -0.03 0.00 -0.01 0.00 0.00 64.34 64.26 1ukh n VAL 80 Cb 0.05 -1.45 -0.04 0.00 -0.91 0.00 0.00 33.84 31.49 1ukh n VAL 80 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1ukh s ASN 81 N 1.04 -0.46 0.07 4.52 2.47 -1.26 -4.88 114.94 116.44 1ukh s ASN 81 Ca 0.80 0.30 -0.20 0.00 0.42 0.00 0.00 52.86 54.19 1ukh s ASN 81 Cb -0.72 1.55 0.05 0.00 -1.45 0.00 0.00 41.25 40.67 1ukh s ASN 81 CO 0.40 -0.30 0.48 -2.28 -3.72 0.00 0.00 177.10 171.68 1ukh s HIS 82 N 2.68 -0.35 0.24 0.43 2.46 -1.26 -4.96 115.29 114.53 1ukh s HIS 82 Ca 0.14 0.29 0.14 0.00 0.47 0.00 0.00 55.06 56.11 1ukh s HIS 82 Cb -0.14 0.31 0.54 0.00 -0.13 0.00 0.00 32.58 33.16 1ukh s HIS 82 CO -0.21 -0.65 1.69 1.57 -2.47 0.00 0.00 174.74 174.67 1ukh h LYS 83 N 2.70 0.00 -1.05 2.88 2.10 -1.97 -3.02 116.57 118.20 1ukh h LYS 83 Ca -0.32 0.00 -0.41 0.00 -2.00 0.00 0.00 60.65 57.92 1ukh h LYS 83 Cb 1.23 0.00 -0.23 0.00 -0.90 0.00 0.00 32.23 32.33 1ukh h LYS 83 CO 0.43 0.49 0.52 0.09 -2.00 0.00 0.00 179.45 178.97 1ukh n ASN 84 N -3.72 4.25 -3.75 7.07 5.03 -1.26 -4.70 115.26 118.18 1ukh n ASN 84 Ca -0.01 -3.24 -0.12 0.00 0.87 0.00 0.00 54.58 52.07 1ukh n ASN 84 Cb 0.54 -0.80 -0.12 0.00 -1.02 0.00 0.00 39.78 38.38 1ukh n ASN 84 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1ukh s ILE 85 N -2.67 -0.02 -0.33 2.41 1.01 -1.14 -1.48 121.20 118.97 1ukh s ILE 85 Ca 0.44 0.08 -0.42 0.00 0.00 0.00 0.00 60.65 60.75 1ukh s ILE 85 Cb 0.36 -0.40 -0.16 0.00 0.01 0.00 0.00 42.46 42.26 1ukh s ILE 85 CO 0.06 0.03 1.73 0.00 0.00 0.00 0.00 174.94 176.77 1ukh n ILE 86 N 3.70 0.24 -3.24 2.92 0.13 -0.30 -4.66 119.36 118.15 1ukh n ILE 86 Ca -0.20 -0.05 -0.39 0.00 -1.10 0.00 0.00 62.75 61.02 1ukh n ILE 86 Cb 0.55 -1.08 -0.06 0.00 -0.84 0.00 0.00 39.64 38.22 1ukh n ILE 86 CO 0.00 0.00 0.00 -0.83 2.80 0.00 0.00 176.55 178.52 1ukh s GLY 87 N 3.53 2.55 0.35 4.50 0.00 -1.26 -4.92 107.32 112.08 1ukh s GLY 87 Ca 1.00 -0.03 -0.26 0.00 0.00 0.00 0.00 44.72 45.43 1ukh s GLY 87 CO 0.69 0.74 1.08 -2.27 0.00 0.00 0.00 173.10 173.34 1ukh s LEU 88 N -0.01 4.30 0.00 0.66 2.96 -1.26 -0.97 118.68 124.36 1ukh s LEU 88 Ca 0.30 2.15 0.00 0.00 -0.22 0.00 0.00 54.13 56.36 1ukh s LEU 88 Cb -0.17 -3.95 0.00 0.00 0.50 0.00 0.00 46.19 42.56 1ukh s LEU 88 CO 0.15 -0.37 0.00 0.18 -1.32 0.00 0.00 176.35 174.99 1ukh n LEU 89 N 0.43 0.00 0.00 -0.68 4.77 0.12 -4.88 117.00 116.76 1ukh n LEU 89 Ca 0.03 -0.20 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1ukh n LEU 89 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1ukh n LEU 89 CO 0.49 0.00 0.00 -3.20 -1.33 0.00 0.00 177.39 173.35 1ukh n ASN 90 N -0.90 0.00 -3.70 -1.43 4.05 -1.02 -4.94 115.26 107.32 1ukh n ASN 90 Ca 0.00 0.00 -0.13 0.00 0.45 0.00 0.00 54.58 54.90 1ukh n ASN 90 Cb 0.00 0.00 -0.13 0.00 1.23 0.00 0.00 39.78 40.88 1ukh n ASN 90 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1ukh s VAL 91 N -2.00 -0.18 0.14 3.44 1.01 -1.26 0.76 120.40 122.31 1ukh s VAL 91 Ca 0.00 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.08 1ukh s VAL 91 Cb 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 36.00 1ukh s VAL 91 CO 0.00 0.09 0.31 0.72 0.00 0.00 0.00 175.10 176.22 1ukh s PHE 92 N 1.72 0.16 -0.04 5.22 -0.12 -0.04 -4.86 117.98 120.02 1ukh s PHE 92 Ca -0.05 -0.53 0.02 0.00 -0.05 0.00 0.00 56.93 56.32 1ukh s PHE 92 Cb -0.11 0.06 0.01 0.00 -0.63 0.00 0.00 43.02 42.35 1ukh s PHE 92 CO -0.08 -0.70 -0.08 -0.08 -0.05 0.00 0.00 175.22 174.23 1ukh s THR 93 N -3.90 0.73 -1.30 -4.49 -1.32 -1.26 -1.54 115.64 102.56 1ukh s THR 93 Ca 0.10 -0.28 0.20 0.00 -1.21 0.00 0.00 61.69 60.50 1ukh s THR 93 Cb 0.03 -0.68 0.29 0.00 -1.51 0.00 0.00 72.50 70.62 1ukh s THR 93 CO -0.05 0.25 1.62 -0.81 -2.21 0.00 0.00 174.62 173.41 1ukh n PRO 94 N 3.64 0.19 -2.88 7.08 -0.04 -1.26 -4.78 135.00 136.95 1ukh n PRO 94 Ca -0.22 0.12 -0.40 0.00 -0.04 0.00 0.00 63.50 62.96 1ukh n PRO 94 Cb 0.53 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.44 1ukh n PRO 94 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1ukh s GLN 95 N -2.70 4.61 0.40 0.54 1.11 -1.26 -5.00 119.66 117.36 1ukh s GLN 95 Ca 0.16 1.24 0.25 0.00 0.01 0.00 0.00 55.36 57.02 1ukh s GLN 95 Cb 0.13 -3.34 0.55 0.00 -1.01 0.00 0.00 33.01 29.34 1ukh s GLN 95 CO 0.32 0.33 1.68 0.87 0.01 0.00 0.00 175.29 178.50 1ukh h LYS 96 N 5.26 0.00 -4.09 2.91 1.57 -1.92 -3.47 116.57 116.83 1ukh h LYS 96 Ca -0.44 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.20 1ukh h LYS 96 Cb 1.21 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.38 1ukh h LYS 96 CO 0.70 0.00 -0.43 -1.54 -0.57 0.00 0.00 179.45 177.61 1ukh s SER 97 N -5.78 0.12 0.37 0.86 1.04 -1.26 -5.03 113.70 104.02 1ukh s SER 97 Ca 0.07 -1.02 0.11 0.00 0.48 0.00 0.00 55.95 55.59 1ukh s SER 97 Cb 0.07 0.40 0.71 0.00 0.10 0.00 0.00 66.02 67.30 1ukh s SER 97 CO 0.64 -0.86 1.84 0.25 0.98 0.00 0.00 173.24 176.08 1ukh h LEU 98 N 2.62 0.10 -0.65 2.42 5.85 -1.95 0.29 115.31 123.98 1ukh h LEU 98 Ca -0.33 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.36 1ukh h LEU 98 Cb 1.22 -0.03 -0.03 0.00 0.37 0.00 0.00 40.66 42.19 1ukh h LEU 98 CO 0.51 0.41 0.40 -0.08 -0.34 0.00 0.00 178.44 179.34 1ukh h GLU 99 N 0.09 0.88 -0.00 1.25 4.57 -2.01 -2.87 114.58 116.50 1ukh h GLU 99 Ca 0.01 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1ukh h GLU 99 Cb 0.59 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1ukh h GLU 99 CO 0.04 0.62 -0.65 0.39 -1.18 0.00 0.00 179.01 178.23 1ukh n GLU 100 N -4.59 0.27 -1.70 1.92 1.02 -0.97 -4.96 120.64 111.64 1ukh n GLU 100 Ca 0.05 -0.20 -0.60 0.00 -0.02 0.00 0.00 57.16 56.39 1ukh n GLU 100 Cb 0.05 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 29.89 1ukh n GLU 100 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1ukh n PHE 101 N -1.19 1.82 0.00 -0.32 7.35 0.98 -4.80 117.46 121.29 1ukh n PHE 101 Ca 0.06 0.77 0.00 0.00 -0.76 0.00 0.00 57.45 57.52 1ukh n PHE 101 Cb 0.35 -2.35 0.00 0.00 0.35 0.00 0.00 39.48 37.83 1ukh n PHE 101 CO 0.00 0.00 0.00 0.94 -0.76 0.00 0.00 176.76 176.94 1ukh n GLN 102 N 4.41 0.00 -5.26 -4.13 -0.06 -1.26 -5.03 117.38 106.05 1ukh n GLN 102 Ca 0.27 0.00 -0.31 0.00 -2.00 0.00 0.00 57.00 54.95 1ukh n GLN 102 Cb 0.08 -0.49 -0.16 0.00 -4.06 0.00 0.00 30.24 25.61 1ukh n GLN 102 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1ukh s ASP 103 N -1.98 3.14 -0.17 1.69 -0.00 -1.26 -4.62 116.67 113.47 1ukh s ASP 103 Ca 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 52.55 52.10 1ukh s ASP 103 Cb 0.00 -0.49 0.01 0.00 -0.00 0.00 0.00 42.92 42.44 1ukh s ASP 103 CO 0.00 0.31 -0.17 -0.69 -0.00 0.00 0.00 175.17 174.62 1ukh s VAL 104 N -0.52 2.41 -0.14 -1.27 1.01 -1.26 -4.45 120.40 116.18 1ukh s VAL 104 Ca 0.07 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.22 1ukh s VAL 104 Cb -0.11 -2.02 -0.00 0.00 0.00 0.00 0.00 36.38 34.25 1ukh s VAL 104 CO 0.00 0.52 -0.17 -0.31 0.00 0.00 0.00 175.10 175.14 1ukh s TYR 105 N 1.11 2.74 -0.21 5.22 2.02 -0.59 -0.57 117.35 127.08 1ukh s TYR 105 Ca 0.00 -0.95 -0.01 0.00 -0.37 0.00 0.00 57.07 55.74 1ukh s TYR 105 Cb -0.14 -1.84 0.01 0.00 -0.40 0.00 0.00 41.96 39.59 1ukh s TYR 105 CO -0.06 -0.40 -0.13 0.42 -1.57 0.00 0.00 175.55 173.81 1ukh s ILE 106 N 0.61 2.62 -0.09 2.71 1.01 0.30 -0.86 121.20 127.49 1ukh s ILE 106 Ca -0.09 -0.82 -0.11 0.00 0.00 0.00 0.00 60.65 59.63 1ukh s ILE 106 Cb -0.16 -2.18 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 1ukh s ILE 106 CO 0.03 0.44 0.25 -0.69 0.00 0.00 0.00 174.94 174.96 1ukh s VAL 107 N 1.35 5.32 0.35 2.92 1.01 0.23 -0.85 120.40 130.73 1ukh s VAL 107 Ca 0.04 0.46 0.04 0.00 0.00 0.00 0.00 61.98 62.52 1ukh s VAL 107 Cb -0.14 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.69 1ukh s VAL 107 CO -0.08 0.57 0.37 0.00 0.00 0.00 0.00 175.10 175.96 1ukh s MET 108 N -0.79 1.88 0.57 2.72 0.23 0.25 -0.70 119.30 123.45 1ukh s MET 108 Ca 0.18 -1.95 -0.19 0.00 -1.03 0.00 0.00 55.69 52.70 1ukh s MET 108 Cb -0.14 0.38 -0.05 0.00 -1.53 0.00 0.00 34.83 33.50 1ukh s MET 108 CO 0.07 -0.74 1.17 -1.21 -2.03 0.00 0.00 175.02 172.28 1ukh s GLU 109 N -3.18 3.15 -0.17 3.16 2.02 -0.15 -0.66 118.70 122.86 1ukh s GLU 109 Ca 0.37 1.72 -0.01 0.00 0.02 0.00 0.00 54.97 57.07 1ukh s GLU 109 Cb 0.01 -1.96 -0.00 0.00 0.10 0.00 0.00 34.13 32.27 1ukh s GLU 109 CO 0.26 -1.04 -0.12 -1.17 0.02 0.00 0.00 175.26 173.20 1ukh s LEU 110 N -3.96 2.61 0.48 1.80 2.96 -1.23 -4.30 118.68 117.02 1ukh s LEU 110 Ca 0.75 -0.43 0.08 0.00 -0.22 0.00 0.00 54.13 54.31 1ukh s LEU 110 Cb -0.27 -1.61 0.03 0.00 0.50 0.00 0.00 46.19 44.84 1ukh s LEU 110 CO 0.30 0.07 0.62 -0.04 -1.32 0.00 0.00 176.35 175.98 1ukh s MET 111 N 0.93 2.61 0.03 1.98 -1.94 -1.26 -4.88 119.30 116.77 1ukh s MET 111 Ca -0.02 -1.42 -0.05 0.00 -1.71 0.00 0.00 55.69 52.49 1ukh s MET 111 Cb -0.15 -2.67 -0.29 0.00 2.01 0.00 0.00 34.83 33.73 1ukh s MET 111 CO -0.01 -0.47 0.98 -0.44 -0.01 0.00 0.00 175.02 175.07 1ukh h ASP 112 N 0.52 0.45 -5.35 3.03 3.32 -1.79 -3.49 116.42 113.10 1ukh h ASP 112 Ca -0.37 -0.54 0.26 0.00 0.02 0.00 0.00 57.03 56.40 1ukh h ASP 112 Cb 1.28 -0.15 -0.12 0.00 0.22 0.00 0.00 39.33 40.57 1ukh h ASP 112 CO 0.45 1.44 0.71 0.00 -1.72 0.00 0.00 179.24 180.12 1ukh s ALA 113 N -2.63 -2.03 0.50 3.45 0.00 -1.10 -5.03 121.76 114.92 1ukh s ALA 113 Ca -0.07 0.70 0.01 0.00 0.00 0.00 0.00 51.96 52.61 1ukh s ALA 113 Cb 0.07 0.37 0.07 0.00 0.00 0.00 0.00 23.12 23.63 1ukh s ALA 113 CO 0.87 -0.96 0.52 0.27 0.00 0.00 0.00 175.76 176.47 1ukh n ASN 114 N -0.41 0.88 -0.55 0.00 0.23 -1.26 0.41 115.26 114.56 1ukh n ASN 114 Ca -0.07 -1.70 0.04 0.00 -0.53 0.00 0.00 54.58 52.32 1ukh n ASN 114 Cb 0.62 -0.32 0.12 0.00 -2.08 0.00 0.00 39.78 38.11 1ukh n ASN 114 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1ukh n LEU 115 N 0.00 1.55 0.04 -4.53 4.77 -0.50 -4.26 117.00 114.07 1ukh n LEU 115 Ca 0.09 -0.78 0.03 0.00 -0.03 0.00 0.00 56.01 55.32 1ukh n LEU 115 Cb 0.33 -0.23 0.39 0.00 -2.33 0.00 0.00 43.42 41.58 1ukh n LEU 115 CO 0.22 0.34 1.02 0.00 -1.33 0.00 0.00 177.39 177.64 1ukh n GLN 117 N -4.37 0.45 0.25 0.00 -0.06 -1.26 -4.41 117.38 107.98 1ukh n GLN 117 Ca 0.01 0.12 0.17 0.00 -2.00 0.00 0.00 57.00 55.30 1ukh n GLN 117 Cb 0.17 -1.34 0.90 0.00 -4.06 0.00 0.00 30.24 25.91 1ukh n GLN 117 CO 0.00 0.00 0.00 0.28 -0.20 0.00 0.00 177.06 177.14 1ukh h VAL 118 N -0.11 0.38 -0.10 1.69 2.07 -1.76 0.18 116.25 118.59 1ukh h VAL 118 Ca -0.42 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 66.96 1ukh h VAL 118 Cb 1.61 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1ukh h VAL 118 CO -0.10 0.00 -0.55 -0.29 0.02 0.00 0.00 177.57 176.65 1ukh h ILE 119 N 0.00 1.36 -0.37 4.57 2.10 -1.61 -2.58 117.51 120.98 1ukh h ILE 119 Ca 0.05 -1.84 0.00 0.00 1.08 0.00 0.00 64.86 64.15 1ukh h ILE 119 Cb 0.34 1.88 0.00 0.00 -1.09 0.00 0.00 36.82 37.95 1ukh h ILE 119 CO -0.00 0.55 0.00 0.00 -1.08 0.00 0.00 178.15 177.62 1ukh n GLN 120 N -3.92 2.92 -0.42 2.19 6.02 0.59 -4.38 117.38 120.37 1ukh n GLN 120 Ca -0.02 -1.76 0.00 0.00 -0.01 0.00 0.00 57.00 55.20 1ukh n GLN 120 Cb 0.58 -1.77 0.00 0.00 1.02 0.00 0.00 30.24 30.07 1ukh n GLN 120 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1ukh n MET 121 N 0.48 2.12 -3.94 -1.09 2.81 -0.97 -5.07 117.12 111.47 1ukh n MET 121 Ca 0.16 0.00 -0.34 0.00 -1.81 0.00 0.00 57.70 55.71 1ukh n MET 121 Cb 0.68 0.00 -0.14 0.00 -0.71 0.00 0.00 33.22 33.05 1ukh n MET 121 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1ukh s GLU 122 N 0.84 2.01 -0.10 0.03 2.02 -1.26 -5.04 118.70 117.19 1ukh s GLU 122 Ca 0.00 -1.60 -0.02 0.00 0.02 0.00 0.00 54.97 53.37 1ukh s GLU 122 Cb 0.00 -3.24 -0.03 0.00 0.10 0.00 0.00 34.13 30.96 1ukh s GLU 122 CO 0.00 -0.82 -0.02 -0.51 0.02 0.00 0.00 175.26 173.93 1ukh s LEU 123 N 1.09 3.44 0.60 1.80 1.43 -1.26 -5.09 118.68 120.70 1ukh s LEU 123 Ca 0.02 0.05 -0.08 0.00 -1.03 0.00 0.00 54.13 53.09 1ukh s LEU 123 Cb -0.20 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 1ukh s LEU 123 CO -0.05 0.31 0.95 1.51 0.23 0.00 0.00 176.35 179.30 1ukh s ASP 124 N -0.50 5.86 0.49 2.29 -4.77 -1.26 -4.66 116.67 114.12 1ukh s ASP 124 Ca 0.08 1.02 0.30 0.00 -3.30 0.00 0.00 52.55 50.65 1ukh s ASP 124 Cb -0.12 -2.05 1.39 0.00 -1.09 0.00 0.00 42.92 41.05 1ukh s ASP 124 CO 0.02 -0.97 1.78 0.45 0.70 0.00 0.00 175.17 177.16 1ukh h HIS 125 N -0.22 0.26 0.71 2.11 3.86 -1.99 0.77 115.15 120.65 1ukh h HIS 125 Ca -0.45 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 58.73 1ukh h HIS 125 Cb 1.23 -0.07 0.01 0.00 1.06 0.00 0.00 27.41 29.63 1ukh h HIS 125 CO 0.55 0.01 -0.34 0.93 0.86 0.00 0.00 177.93 179.94 1ukh h GLU 126 N 0.14 -0.92 -0.58 2.45 3.07 -1.98 0.35 114.58 117.12 1ukh h GLU 126 Ca 0.59 0.06 -0.09 0.00 -0.50 0.00 0.00 59.36 59.42 1ukh h GLU 126 Cb 2.02 0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 30.12 1ukh h GLU 126 CO -0.13 -0.60 -0.01 0.00 -1.40 0.00 0.00 179.01 176.87 1ukh h ARG 127 N -1.01 1.01 0.46 2.33 3.08 -1.33 -0.37 114.38 118.55 1ukh h ARG 127 Ca -0.10 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 59.61 1ukh h ARG 127 Cb 0.74 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.70 1ukh h ARG 127 CO 0.16 1.00 -0.25 0.52 -1.07 0.00 0.00 179.97 180.33 1ukh h MET 128 N 0.93 -0.63 0.00 0.04 2.86 0.60 -1.47 114.93 117.25 1ukh h MET 128 Ca 0.16 0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 1ukh h MET 128 Cb 0.55 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 1ukh h MET 128 CO 0.03 -0.42 -0.18 0.66 1.06 0.00 0.00 176.91 178.06 1ukh h SER 129 N -0.65 0.00 -0.03 1.22 4.64 -0.36 -2.61 113.55 115.75 1ukh h SER 129 Ca -0.06 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 1ukh h SER 129 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1ukh h SER 129 CO 0.08 0.18 -0.10 0.22 -0.87 0.00 0.00 176.83 176.34 1ukh h TYR 130 N 0.00 0.16 -0.53 4.77 3.20 -1.01 0.25 116.97 123.80 1ukh h TYR 130 Ca -0.00 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.84 1ukh h TYR 130 Cb 0.43 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.63 1ukh h TYR 130 CO 0.00 0.71 0.29 -0.07 -1.64 0.00 0.00 178.16 177.45 1ukh h LEU 131 N -0.43 0.44 -0.86 2.82 3.38 -1.20 -0.86 115.31 118.59 1ukh h LEU 131 Ca -0.00 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1ukh h LEU 131 Cb 0.71 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 1ukh h LEU 131 CO 0.02 0.30 0.30 -0.07 0.09 0.00 0.00 178.44 179.08 1ukh h LEU 132 N 0.56 1.05 -0.34 1.67 3.38 -1.43 -1.09 115.31 119.11 1ukh h LEU 132 Ca 0.23 -0.16 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1ukh h LEU 132 Cb 0.10 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.53 1ukh h LEU 132 CO -0.14 0.93 -0.01 0.22 0.09 0.00 0.00 178.44 179.53 1ukh h TYR 133 N 1.11 -0.04 0.00 1.13 3.20 0.53 -0.04 116.97 122.85 1ukh h TYR 133 Ca 0.25 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 1ukh h TYR 133 Cb 0.21 0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 1ukh h TYR 133 CO 0.02 -0.07 -0.13 1.96 -1.64 0.00 0.00 178.16 178.29 1ukh h GLN 134 N 0.08 0.00 0.02 1.82 4.20 -0.59 -1.17 115.11 119.48 1ukh h GLN 134 Ca 0.16 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 1ukh h GLN 134 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1ukh h GLN 134 CO -0.28 0.13 -0.01 0.52 -0.67 0.00 0.00 178.83 178.52 1ukh h MET 135 N 0.00 -0.03 -1.00 1.46 2.86 0.01 -2.79 114.93 115.44 1ukh h MET 135 Ca -0.00 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.75 1ukh h MET 135 Cb 0.35 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.93 1ukh h MET 135 CO 0.02 0.61 0.63 -0.07 1.06 0.00 0.00 176.91 179.16 1ukh h LEU 136 N -0.71 0.93 -0.35 1.22 3.38 -0.48 0.25 115.31 119.55 1ukh h LEU 136 Ca -0.00 0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1ukh h LEU 136 Cb 0.66 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1ukh h LEU 136 CO 0.01 0.51 0.06 0.00 0.09 0.00 0.00 178.44 179.11 1ukh h GLY 138 N 0.42 0.58 1.03 0.00 0.00 -1.08 -1.63 103.07 102.38 1ukh h GLY 138 Ca 0.11 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 1ukh h GLY 138 CO 0.01 0.36 0.42 -2.22 0.00 0.00 0.00 176.54 175.10 1ukh h ILE 139 N 0.37 1.25 -0.51 2.60 2.04 -0.95 -0.22 117.51 122.09 1ukh h ILE 139 Ca 0.10 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.26 1ukh h ILE 139 Cb 0.35 0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1ukh h ILE 139 CO 0.01 0.29 0.22 0.50 0.00 0.00 0.00 178.15 179.18 1ukh h LYS 140 N 1.16 0.75 -0.68 2.37 3.64 -0.86 0.11 116.57 123.07 1ukh h LYS 140 Ca 0.29 -0.12 -0.05 0.00 -1.27 0.00 0.00 60.65 59.49 1ukh h LYS 140 Cb 0.09 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.75 1ukh h LYS 140 CO -0.04 0.64 0.21 1.25 -2.27 0.00 0.00 179.45 179.24 1ukh h HIS 141 N 0.68 1.09 0.15 1.91 2.76 -0.92 0.40 115.15 121.22 1ukh h HIS 141 Ca 0.17 -0.11 0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1ukh h HIS 141 Cb 0.16 -0.31 -0.03 0.00 1.55 0.00 0.00 27.41 28.78 1ukh h HIS 141 CO -0.00 0.88 -0.22 -0.07 -1.30 0.00 0.00 177.93 177.22 1ukh h LEU 142 N 0.99 -0.61 -0.16 0.26 4.07 -0.69 -2.44 115.31 116.73 1ukh h LEU 142 Ca 0.22 0.07 0.04 0.00 0.08 0.00 0.00 57.88 58.28 1ukh h LEU 142 Cb 0.30 0.22 -0.04 0.00 1.08 0.00 0.00 40.66 42.22 1ukh h LEU 142 CO -0.01 -0.31 -0.09 0.45 -1.08 0.00 0.00 178.44 177.40 1ukh h HIS 143 N -0.43 -0.21 0.00 1.13 3.86 -0.16 -0.35 115.15 118.99 1ukh h HIS 143 Ca 0.02 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 1ukh h HIS 143 Cb 0.44 0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.02 1ukh h HIS 143 CO -0.19 -0.14 0.00 -1.13 0.86 0.00 0.00 177.93 177.33 1ukh n SER 144 N -5.23 0.00 -0.52 2.45 3.41 0.14 0.46 113.62 114.32 1ukh n SER 144 Ca -0.03 0.01 0.05 0.00 -0.26 0.00 0.00 58.87 58.64 1ukh n SER 144 Cb 0.16 -0.06 0.14 0.00 -0.26 0.00 0.00 64.21 64.18 1ukh n SER 144 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ukh n ALA 145 N -1.06 2.30 -0.97 7.33 0.00 -0.21 -4.77 120.51 123.12 1ukh n ALA 145 Ca 0.01 -1.43 0.00 0.00 0.00 0.00 0.00 53.44 52.03 1ukh n ALA 145 Cb 0.01 -0.39 0.00 0.00 0.00 0.00 0.00 19.45 19.07 1ukh n ALA 145 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ukh n GLY 146 N -0.01 0.38 3.52 0.00 0.00 0.17 -4.99 105.19 104.25 1ukh n GLY 146 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1ukh n GLY 146 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ukh s ILE 147 N -1.85 5.09 -0.61 -0.61 1.01 -0.81 -4.99 121.20 118.42 1ukh s ILE 147 Ca 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 60.65 60.45 1ukh s ILE 147 Cb 0.00 -3.56 0.16 0.00 0.01 0.00 0.00 42.46 39.07 1ukh s ILE 147 CO 0.00 0.08 0.42 -0.63 0.00 0.00 0.00 174.94 174.82 1ukh s ILE 148 N 1.70 3.66 0.04 2.92 1.01 -1.26 -2.55 121.20 126.71 1ukh s ILE 148 Ca 0.06 -2.94 -0.07 0.00 0.00 0.00 0.00 60.65 57.70 1ukh s ILE 148 Cb -0.17 -3.39 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 1ukh s ILE 148 CO 0.09 -0.87 0.74 1.57 0.00 0.00 0.00 174.94 176.47 1ukh n HIS 149 N 3.51 -0.10 0.00 3.97 -0.00 -1.26 -4.75 115.22 116.59 1ukh n HIS 149 Ca 0.07 0.28 0.00 0.00 0.46 0.00 0.00 57.72 58.53 1ukh n HIS 149 Cb 0.38 -0.40 0.00 0.00 -0.12 0.00 0.00 29.99 29.85 1ukh n HIS 149 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 1ukh n ARG 150 N -3.40 0.00 -2.46 1.57 1.74 -1.26 -2.80 116.66 110.05 1ukh n ARG 150 Ca 0.00 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.96 1ukh n ARG 150 Cb 0.06 -2.06 0.03 0.00 -1.02 0.00 0.00 32.46 29.47 1ukh n ARG 150 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1ukh n ASP 151 N 0.00 3.19 -4.77 0.55 2.03 -1.26 -4.79 116.55 111.49 1ukh n ASP 151 Ca 0.00 -2.92 -0.38 0.00 0.52 0.00 0.00 54.79 52.01 1ukh n ASP 151 Cb 0.00 -0.43 -0.05 0.00 -0.72 0.00 0.00 41.12 39.92 1ukh n ASP 151 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1ukh s LEU 152 N -3.64 4.36 0.21 -2.67 1.43 -1.26 -4.92 118.68 112.19 1ukh s LEU 152 Ca 0.39 2.01 -0.22 0.00 -1.03 0.00 0.00 54.13 55.27 1ukh s LEU 152 Cb 0.38 -3.94 0.07 0.00 0.03 0.00 0.00 46.19 42.72 1ukh s LEU 152 CO -0.01 -0.19 0.96 -1.59 0.23 0.00 0.00 176.35 175.75 1ukh s LYS 153 N -1.96 1.45 0.26 1.70 -2.85 -1.26 -4.79 119.74 112.29 1ukh s LYS 153 Ca 0.50 -0.90 -0.02 0.00 -1.00 0.00 0.00 55.97 54.55 1ukh s LYS 153 Cb -0.23 0.43 0.46 0.00 -2.06 0.00 0.00 37.83 36.43 1ukh s LYS 153 CO 0.30 -0.68 1.81 -1.35 0.10 0.00 0.00 175.35 175.53 1ukh h PRO 154 N 2.00 0.82 -0.01 1.78 0.11 -1.91 0.11 132.00 134.89 1ukh h PRO 154 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1ukh h PRO 154 Cb 1.23 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1ukh h PRO 154 CO 0.33 0.54 0.00 -1.13 -0.21 0.00 0.00 178.00 177.53 1ukh n SER 155 N -4.71 0.18 -0.04 -2.05 3.41 -1.26 -1.51 113.62 107.63 1ukh n SER 155 Ca 0.16 -1.36 0.01 0.00 -0.26 0.00 0.00 58.87 57.42 1ukh n SER 155 Cb 0.32 -0.01 -0.14 0.00 -0.26 0.00 0.00 64.21 64.12 1ukh n SER 155 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ukh n ASN 156 N -0.71 0.88 -4.63 4.04 2.85 0.31 -4.91 115.26 113.09 1ukh n ASN 156 Ca 0.16 0.00 -0.37 0.00 -0.11 0.00 0.00 54.58 54.26 1ukh n ASN 156 Cb 0.10 1.41 -0.10 0.00 1.24 0.00 0.00 39.78 42.44 1ukh n ASN 156 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1ukh s ILE 157 N -2.87 5.33 0.06 -1.44 -1.09 -0.85 -1.84 121.20 118.50 1ukh s ILE 157 Ca -0.07 0.20 0.04 0.00 -2.23 0.00 0.00 60.65 58.60 1ukh s ILE 157 Cb 0.09 -3.53 -0.04 0.00 -1.58 0.00 0.00 42.46 37.40 1ukh s ILE 157 CO 0.72 0.29 -0.03 0.68 -1.23 0.00 0.00 174.94 175.38 1ukh s VAL 158 N 1.41 3.87 0.26 2.92 -7.23 -0.78 -1.41 120.40 119.44 1ukh s VAL 158 Ca 0.08 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.32 1ukh s VAL 158 Cb -0.15 -2.79 -0.05 0.00 0.56 0.00 0.00 36.38 33.95 1ukh s VAL 158 CO 0.08 0.21 0.10 0.68 -0.31 0.00 0.00 175.10 175.86 1ukh s VAL 159 N -1.21 0.53 0.22 1.32 -7.23 0.17 -1.21 120.40 112.99 1ukh s VAL 159 Ca 0.23 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.48 1ukh s VAL 159 Cb -0.11 -2.62 -0.05 0.00 0.56 0.00 0.00 36.38 34.16 1ukh s VAL 159 CO 0.14 0.00 -0.15 -0.54 -0.31 0.00 0.00 175.10 174.25 1ukh s LYS 160 N -4.01 1.41 0.23 4.82 1.02 -0.43 -1.99 119.74 120.79 1ukh s LYS 160 Ca 0.37 -1.64 0.16 0.00 0.02 0.00 0.00 55.97 54.88 1ukh s LYS 160 Cb 0.07 -1.24 0.84 0.00 -0.52 0.00 0.00 37.83 36.99 1ukh s LYS 160 CO 0.14 0.20 1.48 -1.13 -0.92 0.00 0.00 175.35 175.12 1ukh n SER 161 N -0.44 0.40 -1.30 2.83 3.41 -1.26 -0.89 113.62 116.37 1ukh n SER 161 Ca -0.07 0.69 0.07 0.00 -0.26 0.00 0.00 58.87 59.29 1ukh n SER 161 Cb 0.61 -0.74 0.27 0.00 -0.26 0.00 0.00 64.21 64.09 1ukh n SER 161 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1ukh n ASP 162 N -2.04 3.81 -1.31 4.04 5.75 -1.26 -4.92 116.55 120.62 1ukh n ASP 162 Ca -0.01 -2.40 -0.14 0.00 -0.01 0.00 0.00 54.79 52.23 1ukh n ASP 162 Cb 0.03 -0.52 -0.04 0.00 -1.03 0.00 0.00 41.12 39.55 1ukh n ASP 162 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ukh s THR 164 N -2.61 5.11 0.04 0.00 -4.23 -1.25 -4.82 115.64 107.89 1ukh s THR 164 Ca 0.00 -0.09 0.02 0.00 -1.18 0.00 0.00 61.69 60.44 1ukh s THR 164 Cb 0.00 -3.71 -0.02 0.00 1.34 0.00 0.00 72.50 70.11 1ukh s THR 164 CO 0.00 -0.19 -0.08 -0.22 -0.54 0.00 0.00 174.62 173.59 1ukh s LEU 165 N -3.28 2.24 0.05 4.79 0.20 -1.26 -1.31 118.68 120.12 1ukh s LEU 165 Ca 0.41 -0.53 -0.05 0.00 0.69 0.00 0.00 54.13 54.66 1ukh s LEU 165 Cb -0.11 -0.17 -0.02 0.00 -0.43 0.00 0.00 46.19 45.47 1ukh s LEU 165 CO 0.28 -0.19 0.08 -0.54 -0.29 0.00 0.00 176.35 175.69 1ukh s LYS 166 N -1.51 0.65 -0.11 1.98 1.02 -0.35 -4.30 119.74 117.12 1ukh s LYS 166 Ca -0.10 -0.94 -0.19 0.00 0.02 0.00 0.00 55.97 54.76 1ukh s LYS 166 Cb -0.10 0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 37.42 1ukh s LYS 166 CO 0.00 -0.17 0.52 0.42 -0.92 0.00 0.00 175.35 175.21 1ukh s ILE 167 N -3.29 5.16 -0.04 2.17 -1.09 -0.55 -1.86 121.20 121.71 1ukh s ILE 167 Ca 0.01 1.05 -0.26 0.00 -2.23 0.00 0.00 60.65 59.22 1ukh s ILE 167 Cb 0.03 -3.86 -0.20 0.00 -1.58 0.00 0.00 42.46 36.84 1ukh s ILE 167 CO -0.08 0.31 1.18 0.25 -1.23 0.00 0.00 174.94 175.36 1ukh h LEU 168 N 6.78 -0.03 -8.90 2.97 6.46 -1.73 -0.77 115.31 120.09 1ukh h LEU 168 Ca -0.41 -0.52 -0.35 0.00 -0.12 0.00 0.00 57.88 56.48 1ukh h LEU 168 Cb 1.18 0.01 -0.14 0.00 -0.73 0.00 0.00 40.66 40.97 1ukh h LEU 168 CO 0.76 0.52 -0.61 1.51 -0.62 0.00 0.00 178.44 179.99 1ukh s ASP 169 N -5.71 1.22 -0.09 1.25 1.47 -1.26 -4.63 116.67 108.91 1ukh s ASP 169 Ca -0.16 -1.40 0.06 0.00 1.18 0.00 0.00 52.55 52.23 1ukh s ASP 169 Cb 0.01 0.19 0.33 0.00 -0.34 0.00 0.00 42.92 43.11 1ukh s ASP 169 CO 0.65 -0.75 1.01 0.49 0.68 0.00 0.00 175.17 177.26 1ukh n PHE 170 N -0.48 0.84 0.00 2.11 3.01 -1.26 -4.99 117.46 116.69 1ukh n PHE 170 Ca 0.00 -0.29 0.00 0.00 1.01 0.00 0.00 57.45 58.17 1ukh n PHE 170 Cb 0.66 -0.26 0.00 0.00 -0.01 0.00 0.00 39.48 39.87 1ukh n PHE 170 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ukh n GLY 171 N 0.27 3.63 0.53 1.37 0.00 -1.26 -4.49 105.19 105.23 1ukh n GLY 171 Ca 0.11 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.36 1ukh n GLY 171 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ukh n LEU 172 N 0.00 0.00 0.04 0.99 -0.00 -1.12 -5.05 117.00 111.86 1ukh n LEU 172 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 56.01 56.05 1ukh n LEU 172 Cb 0.00 -0.07 0.06 0.00 -0.00 0.00 0.00 43.42 43.40 1ukh n LEU 172 CO 0.00 -0.34 0.38 -1.22 -0.00 0.00 0.00 177.39 176.21 1ukh n TYR 190 N -2.05 0.00 1.83 1.47 4.01 -1.26 -5.05 117.16 116.11 1ukh n TYR 190 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 1ukh n TYR 190 Cb 0.00 -0.03 0.61 0.00 -0.31 0.00 0.00 39.34 39.60 1ukh n TYR 190 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ukh n TYR 191 N -1.47 0.04 -2.35 -0.72 4.02 -1.26 -4.83 117.16 110.57 1ukh n TYR 191 Ca 0.03 -0.02 -0.33 0.00 -0.01 0.00 0.00 57.90 57.57 1ukh n TYR 191 Cb 0.41 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.71 1ukh n TYR 191 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 1ukh s ARG 192 N -1.96 3.71 0.40 -0.72 1.81 -1.26 -4.11 118.95 116.81 1ukh s ARG 192 Ca 0.34 1.17 -0.11 0.00 -1.72 0.00 0.00 55.73 55.41 1ukh s ARG 192 Cb 0.16 -2.09 -0.07 0.00 -0.45 0.00 0.00 34.95 32.50 1ukh s ARG 192 CO 0.27 -0.48 0.78 0.00 -0.68 0.00 0.00 175.30 175.18 1ukh s ALA 193 N -2.34 3.33 0.24 2.13 0.00 -1.26 -4.84 121.76 119.01 1ukh s ALA 193 Ca 0.63 -0.15 -0.06 0.00 0.00 0.00 0.00 51.96 52.38 1ukh s ALA 193 Cb -0.14 -2.74 0.43 0.00 0.00 0.00 0.00 23.12 20.68 1ukh s ALA 193 CO 0.28 0.02 1.67 -1.35 0.00 0.00 0.00 175.76 176.38 1ukh h PRO 194 N 1.36 0.21 -0.92 0.00 0.11 -1.95 0.32 132.00 131.13 1ukh h PRO 194 Ca -0.47 -0.01 0.24 0.00 0.11 0.00 0.00 66.00 65.86 1ukh h PRO 194 Cb 1.19 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.19 1ukh h PRO 194 CO 0.64 0.14 0.63 0.93 -0.21 0.00 0.00 178.00 180.12 1ukh h GLU 195 N 0.21 0.23 0.12 1.05 3.07 -1.88 0.35 114.58 117.75 1ukh h GLU 195 Ca 0.40 -0.01 -0.26 0.00 -0.50 0.00 0.00 59.36 58.98 1ukh h GLU 195 Cb 0.69 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.55 1ukh h GLU 195 CO -0.54 0.16 -1.32 0.28 -1.40 0.00 0.00 179.01 176.18 1ukh h VAL 196 N 0.24 1.11 -0.77 3.13 2.07 -0.71 -2.75 116.25 118.57 1ukh h VAL 196 Ca 0.47 -2.43 0.08 0.00 0.82 0.00 0.00 66.70 65.64 1ukh h VAL 196 Cb 1.44 2.80 -0.05 0.00 -1.52 0.00 0.00 31.29 33.96 1ukh h VAL 196 CO -0.13 0.71 0.51 0.40 0.02 0.00 0.00 177.57 179.08 1ukh h ILE 197 N -0.30 0.99 -2.11 4.57 2.04 -0.15 -3.42 117.51 119.14 1ukh h ILE 197 Ca -0.28 -0.26 -0.45 0.00 1.00 0.00 0.00 64.86 64.87 1ukh h ILE 197 Cb 1.75 0.16 0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1ukh h ILE 197 CO 0.08 0.14 -0.33 -0.76 0.00 0.00 0.00 178.15 177.28 1ukh s LEU 198 N -9.74 4.04 -0.04 1.44 1.02 0.03 -4.98 118.68 110.44 1ukh s LEU 198 Ca -0.10 -0.00 -0.05 0.00 0.02 0.00 0.00 54.13 53.99 1ukh s LEU 198 Cb 0.20 -2.88 -0.22 0.00 0.02 0.00 0.00 46.19 43.31 1ukh s LEU 198 CO 0.78 -0.34 3.43 0.61 0.02 0.00 0.00 176.35 180.85 1ukh n GLY 199 N -1.63 3.09 3.90 -3.19 0.00 -1.26 -4.76 105.19 101.33 1ukh n GLY 199 Ca -0.03 -1.18 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 1ukh n GLY 199 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ukh s MET 200 N 0.68 2.79 0.50 1.61 -1.94 -1.04 -5.02 119.30 116.88 1ukh s MET 200 Ca 0.61 -1.26 -0.18 0.00 -1.71 0.00 0.00 55.69 53.15 1ukh s MET 200 Cb 0.30 -2.56 -0.08 0.00 2.01 0.00 0.00 34.83 34.50 1ukh s MET 200 CO -0.02 0.02 0.98 0.20 -0.01 0.00 0.00 175.02 176.19 1ukh s GLY 201 N -4.08 2.16 0.31 -0.03 0.00 -1.26 -4.67 107.32 99.74 1ukh s GLY 201 Ca 0.44 0.26 0.03 0.00 0.00 0.00 0.00 44.72 45.44 1ukh s GLY 201 CO 0.28 0.53 0.08 -2.52 0.00 0.00 0.00 173.10 171.48 1ukh s TYR 202 N -2.49 1.77 0.00 1.90 -0.85 -1.26 -4.88 117.35 111.53 1ukh s TYR 202 Ca 0.60 -1.09 0.00 0.00 -0.52 0.00 0.00 57.07 56.06 1ukh s TYR 202 Cb -0.10 -1.11 0.00 0.00 0.38 0.00 0.00 41.96 41.13 1ukh s TYR 202 CO 0.27 -0.18 0.00 1.63 -1.52 0.00 0.00 175.55 175.75 1ukh n LYS 203 N -0.61 1.31 0.19 -3.49 4.76 -1.26 -5.05 118.16 114.00 1ukh n LYS 203 Ca -0.02 0.00 0.04 0.00 -2.87 0.00 0.00 58.31 55.47 1ukh n LYS 203 Cb 0.66 0.00 0.38 0.00 -1.84 0.00 0.00 35.03 34.23 1ukh n LYS 203 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 1ukh h GLU 204 N 0.00 0.00 0.00 1.97 9.09 -2.00 -2.89 114.58 120.74 1ukh h GLU 204 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1ukh h GLU 204 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 1ukh h GLU 204 CO 0.00 0.37 0.00 0.27 0.05 0.00 0.00 179.01 179.70 1ukh n ASN 205 N -3.82 0.00 -0.04 3.06 6.94 -1.26 -2.75 115.26 117.38 1ukh n ASN 205 Ca -0.01 -1.34 -0.04 0.00 -0.02 0.00 0.00 54.58 53.17 1ukh n ASN 205 Cb 0.44 0.00 0.19 0.00 -2.36 0.00 0.00 39.78 38.05 1ukh n ASN 205 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 1ukh h VAL 206 N 0.00 1.25 0.00 3.53 3.04 -1.90 -2.27 116.25 119.90 1ukh h VAL 206 Ca 0.00 -1.11 0.00 0.00 -1.01 0.00 0.00 66.70 64.58 1ukh h VAL 206 Cb 0.00 1.11 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 1ukh h VAL 206 CO 0.00 0.37 0.00 0.47 -1.01 0.00 0.00 177.57 177.40 1ukh n ASP 207 N -4.18 0.19 0.12 3.17 8.00 -1.11 -2.87 116.55 119.87 1ukh n ASP 207 Ca 0.01 0.53 -0.03 0.00 0.71 0.00 0.00 54.79 56.01 1ukh n ASP 207 Cb 0.35 -0.58 0.09 0.00 -0.02 0.00 0.00 41.12 40.97 1ukh n ASP 207 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 1ukh h ILE 208 N 0.00 1.51 -0.18 0.53 1.08 -1.62 -2.40 117.51 116.42 1ukh h ILE 208 Ca 0.00 -2.46 -0.00 0.00 -0.39 0.00 0.00 64.86 62.01 1ukh h ILE 208 Cb 0.46 2.33 -0.01 0.00 -3.07 0.00 0.00 36.82 36.54 1ukh h ILE 208 CO 0.00 0.70 0.11 -0.25 -0.69 0.00 0.00 178.15 178.02 1ukh h TRP 209 N 0.00 0.25 -0.65 1.37 2.91 -1.58 0.43 115.95 118.68 1ukh h TRP 209 Ca -0.01 -0.00 0.02 0.00 1.13 0.00 0.00 58.89 60.03 1ukh h TRP 209 Cb 1.27 -0.08 -0.04 0.00 -0.51 0.00 0.00 29.16 29.80 1ukh h TRP 209 CO 0.00 0.22 0.41 0.77 -1.03 0.00 0.00 178.44 178.81 1ukh h SER 210 N 0.20 0.69 -0.60 2.65 0.02 -1.65 0.33 113.55 115.19 1ukh h SER 210 Ca 0.06 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1ukh h SER 210 Cb 0.05 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.40 1ukh h SER 210 CO -0.01 0.48 0.30 0.58 -1.14 0.00 0.00 176.83 177.05 1ukh h VAL 211 N 0.82 1.21 -0.87 2.27 2.07 -0.96 0.32 116.25 121.12 1ukh h VAL 211 Ca 0.25 -0.56 0.05 0.00 0.82 0.00 0.00 66.70 67.26 1ukh h VAL 211 Cb -0.02 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 30.17 1ukh h VAL 211 CO -0.09 0.23 0.57 1.23 0.02 0.00 0.00 177.57 179.53 1ukh h GLY 212 N 0.82 1.24 0.57 2.17 0.00 0.12 0.34 103.07 108.33 1ukh h GLY 212 Ca 0.21 -0.41 -0.02 0.00 0.00 0.00 0.00 47.33 47.10 1ukh h GLY 212 CO -0.03 0.33 -0.06 0.00 0.00 0.00 0.00 176.54 176.78 1ukh h ILE 214 N -0.35 1.22 -0.08 0.00 2.04 -0.08 -0.40 117.51 119.87 1ukh h ILE 214 Ca 0.01 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1ukh h ILE 214 Cb 0.60 0.73 -0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1ukh h ILE 214 CO 0.01 0.27 0.05 -0.03 0.00 0.00 0.00 178.15 178.45 1ukh h MET 215 N 0.69 0.10 -0.55 2.37 4.05 -0.37 -2.56 114.93 118.67 1ukh h MET 215 Ca 0.17 -0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.58 1ukh h MET 215 Cb 0.23 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.98 1ukh h MET 215 CO -0.01 0.08 0.33 0.78 0.23 0.00 0.00 176.91 178.32 1ukh h GLY 216 N 0.10 0.78 2.00 1.39 0.00 -1.10 -2.25 103.07 103.99 1ukh h GLY 216 Ca 0.03 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 1ukh h GLY 216 CO -0.01 0.30 -0.28 -2.09 0.00 0.00 0.00 176.54 174.46 1ukh h GLU 217 N 0.75 0.00 -0.50 4.80 4.81 -0.76 -0.22 114.58 123.45 1ukh h GLU 217 Ca 0.20 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.32 1ukh h GLU 217 Cb -0.04 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 1ukh h GLU 217 CO -0.04 0.28 -0.12 0.52 -0.73 0.00 0.00 179.01 178.93 1ukh h MET 218 N 0.00 0.96 -0.07 1.92 2.86 -1.01 0.84 114.93 120.42 1ukh h MET 218 Ca -0.00 -0.37 -0.23 0.00 -2.06 0.00 0.00 59.70 57.04 1ukh h MET 218 Cb 0.69 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.31 1ukh h MET 218 CO 0.04 1.04 -0.88 0.82 1.06 0.00 0.00 176.91 178.98 1ukh h ILE 219 N 0.82 1.30 0.05 -1.22 2.04 -1.38 -3.37 117.51 115.75 1ukh h ILE 219 Ca 0.13 -2.14 -0.00 0.00 1.00 0.00 0.00 64.86 63.84 1ukh h ILE 219 Cb 0.68 2.18 0.00 0.00 -0.74 0.00 0.00 36.82 38.94 1ukh h ILE 219 CO 0.05 0.66 -0.02 0.11 0.00 0.00 0.00 178.15 178.95 1ukh h LYS 220 N 0.42 -0.06 0.00 2.37 1.79 -1.01 -3.47 116.57 116.61 1ukh h LYS 220 Ca -0.08 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.39 1ukh h LYS 220 Cb 1.52 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.18 1ukh h LYS 220 CO 0.17 -0.04 0.00 0.41 -1.08 0.00 0.00 179.45 178.91 1ukh n GLY 221 N 0.71 0.84 3.28 3.86 0.00 0.28 -5.08 105.19 109.10 1ukh n GLY 221 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 1ukh n GLY 221 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ukh s GLY 222 N -0.50 -0.18 0.09 -0.02 0.00 -1.24 -4.87 107.32 100.59 1ukh s GLY 222 Ca 0.00 -0.00 -0.37 0.00 0.00 0.00 0.00 44.72 44.35 1ukh s GLY 222 CO 0.00 -0.24 1.33 -0.62 0.00 0.00 0.00 173.10 173.57 1ukh n VAL 223 N 0.25 0.03 0.28 1.40 0.31 -1.26 -4.61 118.33 114.73 1ukh n VAL 223 Ca -0.17 -0.01 -0.16 0.00 -0.01 0.00 0.00 64.34 63.98 1ukh n VAL 223 Cb 0.61 -0.80 -0.08 0.00 -0.91 0.00 0.00 33.84 32.66 1ukh n VAL 223 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1ukh h LEU 224 N 4.48 -0.85 -7.45 7.52 3.38 -1.91 -3.38 115.31 117.09 1ukh h LEU 224 Ca -0.48 0.06 -0.64 0.00 0.09 0.00 0.00 57.88 56.91 1ukh h LEU 224 Cb 1.34 0.26 -0.41 0.00 0.09 0.00 0.00 40.66 41.94 1ukh h LEU 224 CO 0.77 -0.50 -0.66 -0.36 0.09 0.00 0.00 178.44 177.78 1ukh s PHE 225 N -6.03 3.27 -0.33 1.13 0.08 -1.26 -5.02 117.98 109.82 1ukh s PHE 225 Ca -0.17 -3.08 -0.25 0.00 0.12 0.00 0.00 56.93 53.55 1ukh s PHE 225 Cb 0.05 -2.80 0.01 0.00 -0.57 0.00 0.00 43.02 39.71 1ukh s PHE 225 CO 0.63 -0.80 0.88 -1.25 -0.10 0.00 0.00 175.22 174.58 1ukh s PRO 226 N 0.10 3.93 -0.12 0.24 0.04 -1.26 -4.79 135.00 133.15 1ukh s PRO 226 Ca 0.15 0.66 0.03 0.00 0.04 0.00 0.00 61.00 61.89 1ukh s PRO 226 Cb -0.24 -3.76 0.00 0.00 0.04 0.00 0.00 34.50 30.55 1ukh s PRO 226 CO -0.03 -0.81 -0.23 0.20 0.04 0.00 0.00 177.00 176.17 1ukh s GLY 227 N 1.71 1.34 0.28 0.56 0.00 -1.26 -4.68 107.32 105.27 1ukh s GLY 227 Ca 0.37 -1.02 0.25 0.00 0.00 0.00 0.00 44.72 44.31 1ukh s GLY 227 CO 0.15 -0.20 1.74 -0.91 0.00 0.00 0.00 173.10 173.88 1ukh h THR 228 N 5.76 0.00 -1.48 0.90 1.35 -1.96 -3.44 112.91 114.03 1ukh h THR 228 Ca -0.25 -0.27 0.16 0.00 -0.55 0.00 0.00 66.41 65.51 1ukh h THR 228 Cb 1.22 1.04 -0.22 0.00 -1.73 0.00 0.00 68.15 68.45 1ukh h THR 228 CO 0.51 0.00 0.71 -0.62 -0.25 0.00 0.00 175.52 175.86 1ukh s ASP 229 N -4.39 -0.23 0.61 5.36 -1.08 -1.26 -5.01 116.67 110.66 1ukh s ASP 229 Ca 0.04 0.18 0.26 0.00 -0.52 0.00 0.00 52.55 52.51 1ukh s ASP 229 Cb 0.09 0.20 0.94 0.00 -1.46 0.00 0.00 42.92 42.70 1ukh s ASP 229 CO 0.42 -0.27 1.34 1.12 0.52 0.00 0.00 175.17 178.30 1ukh h HIS 230 N 2.25 0.00 0.03 -5.34 2.07 -1.97 0.22 115.15 112.40 1ukh h HIS 230 Ca -0.14 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.28 1ukh h HIS 230 Cb 1.18 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.15 1ukh h HIS 230 CO 0.26 0.00 -0.53 0.82 -3.07 0.00 0.00 177.93 175.41 1ukh h ILE 231 N 0.00 1.48 -0.41 6.12 2.04 -1.96 -2.80 117.51 121.98 1ukh h ILE 231 Ca 0.46 -2.34 0.00 0.00 1.00 0.00 0.00 64.86 63.98 1ukh h ILE 231 Cb 2.76 3.03 -0.02 0.00 -0.74 0.00 0.00 36.82 41.86 1ukh h ILE 231 CO -0.00 0.56 0.26 -0.78 0.00 0.00 0.00 178.15 178.19 1ukh h ASP 232 N -0.86 0.48 -0.48 1.72 3.58 -1.06 -0.97 116.42 118.83 1ukh h ASP 232 Ca -0.13 -0.03 0.10 0.00 0.42 0.00 0.00 57.03 57.39 1ukh h ASP 232 Cb 1.22 -0.12 -0.10 0.00 1.72 0.00 0.00 39.33 42.05 1ukh h ASP 232 CO -0.03 0.37 -0.22 -0.61 -2.88 0.00 0.00 179.24 175.87 1ukh h GLN 233 N 0.55 -0.11 -0.93 0.28 5.75 -1.06 0.26 115.11 119.85 1ukh h GLN 233 Ca 0.15 0.01 0.05 0.00 -0.15 0.00 0.00 58.65 58.70 1ukh h GLN 233 Cb -0.04 0.03 -0.06 0.00 1.07 0.00 0.00 27.48 28.48 1ukh h GLN 233 CO -0.03 -0.07 0.60 2.35 -2.65 0.00 0.00 178.83 179.02 1ukh h TRP 234 N -0.12 1.11 -0.41 3.99 2.91 -1.10 -2.47 115.95 119.87 1ukh h TRP 234 Ca 0.23 0.03 -0.07 0.00 1.13 0.00 0.00 58.89 60.20 1ukh h TRP 234 Cb 0.47 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 28.74 1ukh h TRP 234 CO -0.50 0.61 -0.02 -0.91 -1.03 0.00 0.00 178.44 176.59 1ukh h ASN 235 N 1.13 0.73 -0.26 2.65 4.21 0.49 -2.28 115.58 122.26 1ukh h ASN 235 Ca 0.38 -0.32 0.05 0.00 1.21 0.00 0.00 56.30 57.62 1ukh h ASN 235 Cb 0.07 -0.20 -0.05 0.00 -1.12 0.00 0.00 38.32 37.02 1ukh h ASN 235 CO -0.14 0.88 -0.06 0.11 -1.29 0.00 0.00 177.43 176.93 1ukh h LYS 236 N 0.57 0.00 0.20 0.81 6.56 -0.19 -1.28 116.57 123.25 1ukh h LYS 236 Ca 0.11 -0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.70 1ukh h LYS 236 Cb 0.52 -0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.17 1ukh h LYS 236 CO 0.03 0.00 -0.16 0.28 -2.06 0.00 0.00 179.45 177.54 1ukh h VAL 237 N 0.00 0.66 0.57 0.50 2.07 -1.39 -1.17 116.25 117.49 1ukh h VAL 237 Ca 0.12 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.62 1ukh h VAL 237 Cb 0.19 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1ukh h VAL 237 CO -0.26 0.00 -0.50 0.40 0.02 0.00 0.00 177.57 177.23 1ukh h ILE 238 N -0.37 0.02 -1.08 4.57 1.08 -1.24 0.27 117.51 120.76 1ukh h ILE 238 Ca -0.01 0.00 0.31 0.00 -0.39 0.00 0.00 64.86 64.78 1ukh h ILE 238 Cb 0.33 0.02 -0.12 0.00 -3.07 0.00 0.00 36.82 33.97 1ukh h ILE 238 CO -0.01 0.00 0.67 -0.08 -0.69 0.00 0.00 178.15 178.03 1ukh h GLU 239 N -1.06 0.33 0.10 2.37 4.22 -1.21 1.44 114.58 120.77 1ukh h GLU 239 Ca -0.07 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 59.34 1ukh h GLU 239 Cb 0.90 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.07 1ukh h GLU 239 CO -0.02 0.22 -0.05 0.37 -2.18 0.00 0.00 179.01 177.35 1ukh h GLN 240 N 0.34 -0.12 0.00 1.92 5.75 -0.53 -3.27 115.11 119.19 1ukh h GLN 240 Ca 0.69 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 59.20 1ukh h GLN 240 Cb 1.73 0.03 0.00 0.00 1.07 0.00 0.00 27.48 30.31 1ukh h GLN 240 CO -0.44 0.13 -0.40 -0.07 -2.65 0.00 0.00 178.83 175.40 1ukh h LEU 241 N -1.00 0.00 0.00 -2.39 3.38 -0.13 -1.07 115.31 114.09 1ukh h LEU 241 Ca -0.01 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1ukh h LEU 241 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1ukh h LEU 241 CO 0.02 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.18 1ukh n GLY 242 N 1.18 2.39 3.75 0.83 0.00 0.49 -4.30 105.19 109.54 1ukh n GLY 242 Ca 0.03 -1.78 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 1ukh n GLY 242 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ukh s THR 243 N -2.20 3.00 0.92 2.61 2.01 0.16 -4.73 115.64 117.41 1ukh s THR 243 Ca 0.00 0.92 -0.11 0.00 0.31 0.00 0.00 61.69 62.81 1ukh s THR 243 Cb 0.00 -3.59 0.15 0.00 0.01 0.00 0.00 72.50 69.07 1ukh s THR 243 CO 0.00 0.18 1.09 -2.16 -0.69 0.00 0.00 174.62 173.05 1ukh s PRO 244 N -0.98 1.02 0.63 4.92 0.04 -1.26 -5.00 135.00 134.36 1ukh s PRO 244 Ca 0.52 1.03 -0.16 0.00 0.04 0.00 0.00 61.00 62.43 1ukh s PRO 244 Cb -0.38 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 32.38 1ukh s PRO 244 CO 0.45 -2.46 1.12 0.00 0.04 0.00 0.00 177.00 176.15 1ukh h PRO 246 N 0.36 0.00 -0.14 0.00 0.11 -1.99 -0.94 132.00 129.40 1ukh h PRO 246 Ca -0.48 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 1ukh h PRO 246 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1ukh h PRO 246 CO 0.55 0.00 -0.25 1.05 -0.21 0.00 0.00 178.00 179.14 1ukh h GLU 247 N 0.00 0.25 0.01 1.05 9.09 -2.00 -1.96 114.58 121.01 1ukh h GLU 247 Ca 0.20 -0.08 -0.14 0.00 0.05 0.00 0.00 59.36 59.38 1ukh h GLU 247 Cb 1.06 -0.02 0.01 0.00 -1.65 0.00 0.00 28.75 28.15 1ukh h GLU 247 CO -0.00 0.49 -0.55 0.35 0.05 0.00 0.00 179.01 179.34 1ukh h PHE 248 N 0.23 0.54 -0.95 2.06 3.57 -1.54 -3.21 116.94 117.63 1ukh h PHE 248 Ca 0.04 -0.30 0.14 0.00 3.53 0.00 0.00 57.97 61.38 1ukh h PHE 248 Cb 0.56 -0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.16 1ukh h PHE 248 CO 0.01 1.12 0.60 0.52 -2.23 0.00 0.00 178.31 178.34 1ukh h MET 249 N -0.20 0.79 -0.39 1.11 2.86 -1.31 0.18 114.93 117.98 1ukh h MET 249 Ca -0.07 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.48 1ukh h MET 249 Cb 1.28 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.75 1ukh h MET 249 CO 0.11 0.52 0.05 0.87 1.06 0.00 0.00 176.91 179.52 1ukh h LYS 250 N 0.82 0.59 0.00 1.72 1.57 -1.40 -0.18 116.57 119.69 1ukh h LYS 250 Ca 0.49 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 59.15 1ukh h LYS 250 Cb 0.67 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.89 1ukh h LYS 250 CO -0.25 0.58 0.00 1.63 -0.57 0.00 0.00 179.45 180.83 1ukh n LYS 251 N -4.29 0.69 -3.45 3.15 4.76 0.62 -4.78 118.16 114.86 1ukh n LYS 251 Ca 0.02 0.00 -0.34 0.00 -2.87 0.00 0.00 58.31 55.12 1ukh n LYS 251 Cb 0.22 -1.48 -0.06 0.00 -1.84 0.00 0.00 35.03 31.88 1ukh n LYS 251 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ukh s LEU 252 N -1.95 4.30 0.59 -0.35 1.43 -0.08 -5.05 118.68 117.57 1ukh s LEU 252 Ca 0.31 0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 54.17 1ukh s LEU 252 Cb 0.14 -3.27 -0.06 0.00 0.03 0.00 0.00 46.19 43.04 1ukh s LEU 252 CO 0.24 0.09 0.82 0.00 0.23 0.00 0.00 176.35 177.73 1ukh n GLN 253 N 0.62 0.76 0.03 1.70 1.13 -1.26 -4.72 117.38 115.64 1ukh n GLN 253 Ca -0.05 0.30 -0.11 0.00 -1.94 0.00 0.00 57.00 55.20 1ukh n GLN 253 Cb 0.52 -2.02 -0.04 0.00 0.11 0.00 0.00 30.24 28.81 1ukh n GLN 253 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1ukh h PRO 254 N 0.40 -0.39 -0.03 -1.09 0.13 -1.95 -1.17 132.00 127.89 1ukh h PRO 254 Ca -0.47 0.03 0.02 0.00 -0.87 0.00 0.00 66.00 64.70 1ukh h PRO 254 Cb 1.38 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 32.57 1ukh h PRO 254 CO 0.50 -0.26 -0.07 0.00 -0.23 0.00 0.00 178.00 177.94 1ukh h THR 255 N -0.40 0.80 0.00 1.56 1.03 -2.01 -2.58 112.91 111.31 1ukh h THR 255 Ca 0.08 0.00 -0.08 0.00 -0.01 0.00 0.00 66.41 66.40 1ukh h THR 255 Cb 0.52 0.80 -0.01 0.00 -1.07 0.00 0.00 68.15 68.39 1ukh h THR 255 CO -0.30 0.00 -0.39 1.62 -0.01 0.00 0.00 175.52 176.44 1ukh h VAL 256 N -0.11 1.22 -0.47 0.00 3.04 -1.92 -2.76 116.25 115.25 1ukh h VAL 256 Ca 0.04 -1.36 -0.11 0.00 -1.01 0.00 0.00 66.70 64.27 1ukh h VAL 256 Cb 0.17 1.74 -0.02 0.00 -2.01 0.00 0.00 31.29 31.17 1ukh h VAL 256 CO -0.10 0.38 -0.13 -0.09 -1.01 0.00 0.00 177.57 176.62 1ukh h ARG 257 N 0.00 0.88 -0.39 4.17 1.12 -1.02 -2.24 114.38 116.90 1ukh h ARG 257 Ca -0.00 -0.32 -0.01 0.00 -1.11 0.00 0.00 59.98 58.54 1ukh h ARG 257 Cb 0.71 -0.06 -0.02 0.00 -0.01 0.00 0.00 29.97 30.60 1ukh h ARG 257 CO 0.05 0.96 0.20 1.15 -3.11 0.00 0.00 179.97 179.22 1ukh h THR 258 N 0.78 1.16 -0.17 0.20 2.02 -1.20 -1.52 112.91 114.19 1ukh h THR 258 Ca 0.12 -0.45 0.05 0.00 0.77 0.00 0.00 66.41 66.90 1ukh h THR 258 Cb 0.66 0.74 -0.05 0.00 -1.74 0.00 0.00 68.15 67.76 1ukh h THR 258 CO 0.05 0.17 -0.14 0.22 0.37 0.00 0.00 175.52 176.19 1ukh h TYR 259 N 0.50 -0.35 -0.53 3.16 3.20 -1.22 -2.49 116.97 119.24 1ukh h TYR 259 Ca 0.14 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 61.93 1ukh h TYR 259 Cb 0.10 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.53 1ukh h TYR 259 CO -0.02 -0.21 -0.06 0.28 -1.64 0.00 0.00 178.16 176.51 1ukh h VAL 260 N -0.15 1.26 0.00 1.81 2.07 -1.27 -2.56 116.25 117.42 1ukh h VAL 260 Ca 0.11 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1ukh h VAL 260 Cb 0.31 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1ukh h VAL 260 CO -0.26 0.42 0.00 -0.62 0.02 0.00 0.00 177.57 177.13 1ukh n GLU 261 N -4.16 0.45 -0.19 1.57 1.02 -0.58 -2.39 120.64 116.35 1ukh n GLU 261 Ca 0.02 0.04 0.09 0.00 -0.02 0.00 0.00 57.16 57.29 1ukh n GLU 261 Cb 0.37 -1.50 0.19 0.00 -0.02 0.00 0.00 31.44 30.48 1ukh n GLU 261 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1ukh n ASN 262 N -1.09 3.18 -4.80 1.62 5.15 -0.96 -4.99 115.26 113.36 1ukh n ASN 262 Ca 0.11 -1.92 -0.22 0.00 -0.60 0.00 0.00 54.58 51.96 1ukh n ASN 262 Cb 0.08 -0.24 -0.05 0.00 -0.53 0.00 0.00 39.78 39.04 1ukh n ASN 262 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1ukh s ARG 263 N -1.20 2.62 0.88 1.20 0.52 -1.01 -5.10 118.95 116.86 1ukh s ARG 263 Ca 0.32 -1.36 -0.10 0.00 -0.52 0.00 0.00 55.73 54.07 1ukh s ARG 263 Cb 0.18 -2.38 0.13 0.00 0.52 0.00 0.00 34.95 33.40 1ukh s ARG 263 CO 0.25 0.14 1.14 -2.14 0.02 0.00 0.00 175.30 174.71 1ukh s PRO 264 N -3.92 1.25 -0.26 3.54 0.02 -1.26 -4.88 135.00 129.48 1ukh s PRO 264 Ca 0.39 1.50 -0.28 0.00 0.02 0.00 0.00 61.00 62.63 1ukh s PRO 264 Cb -0.05 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.68 1ukh s PRO 264 CO 0.25 -2.45 1.92 0.15 -0.33 0.00 0.00 177.00 176.54 1ukh s LYS 265 N -4.66 3.36 -0.41 5.54 -0.14 -1.26 -4.96 119.74 117.21 1ukh s LYS 265 Ca 0.66 1.70 -0.15 0.00 -1.36 0.00 0.00 55.97 56.83 1ukh s LYS 265 Cb -0.22 -4.23 0.02 0.00 -1.68 0.00 0.00 37.83 31.72 1ukh s LYS 265 CO 0.57 -1.83 0.30 0.71 -0.76 0.00 0.00 175.35 174.34 1ukh s TYR 266 N 7.03 3.24 -1.83 3.18 2.02 -1.26 -4.95 117.35 124.78 1ukh s TYR 266 Ca 0.86 -0.60 0.26 0.00 -0.37 0.00 0.00 57.07 57.22 1ukh s TYR 266 Cb -0.27 -2.60 0.64 0.00 -0.40 0.00 0.00 41.96 39.33 1ukh s TYR 266 CO 0.34 -0.60 1.50 0.00 -1.57 0.00 0.00 175.55 175.22 1ukh n ALA 267 N 5.16 3.14 -0.62 3.71 0.00 -1.26 0.37 120.51 131.00 1ukh n ALA 267 Ca -0.11 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 52.89 1ukh n ALA 267 Cb 0.47 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1ukh n ALA 267 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ukh n GLY 268 N 1.35 -1.23 3.36 0.00 0.00 -1.23 -4.34 105.19 103.09 1ukh n GLY 268 Ca 0.12 -1.14 -0.18 0.00 0.00 0.00 0.00 46.02 44.82 1ukh n GLY 268 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ukh s TYR 269 N 0.00 1.66 0.42 1.61 1.51 -0.41 -4.82 117.35 117.33 1ukh s TYR 269 Ca 0.00 -1.10 -0.18 0.00 -1.01 0.00 0.00 57.07 54.78 1ukh s TYR 269 Cb 0.00 -1.01 -0.10 0.00 -0.11 0.00 0.00 41.96 40.74 1ukh s TYR 269 CO 0.00 -0.22 0.90 -1.54 -1.11 0.00 0.00 175.55 173.58 1ukh s SER 270 N -3.36 6.81 0.04 2.29 1.04 -1.26 -4.86 113.70 114.39 1ukh s SER 270 Ca 0.37 1.54 0.09 0.00 0.48 0.00 0.00 55.95 58.42 1ukh s SER 270 Cb 0.08 -2.48 0.39 0.00 0.10 0.00 0.00 66.02 64.10 1ukh s SER 270 CO 0.14 -0.38 1.27 0.49 0.98 0.00 0.00 173.24 175.74 1ukh n PHE 271 N -0.83 0.10 0.08 5.02 3.01 -1.26 -0.42 117.46 123.15 1ukh n PHE 271 Ca 0.06 0.04 -0.10 0.00 1.01 0.00 0.00 57.45 58.47 1ukh n PHE 271 Cb 0.54 -0.57 -0.11 0.00 -0.01 0.00 0.00 39.48 39.33 1ukh n PHE 271 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1ukh h GLU 272 N 0.00 0.10 0.19 -1.08 3.07 -1.92 0.26 114.58 115.20 1ukh h GLU 272 Ca 0.00 -0.16 -0.30 0.00 -0.50 0.00 0.00 59.36 58.39 1ukh h GLU 272 Cb 0.12 0.06 0.02 0.00 -0.84 0.00 0.00 28.75 28.11 1ukh h GLU 272 CO 0.00 1.05 -1.44 0.87 -1.40 0.00 0.00 179.01 178.09 1ukh h LYS 273 N 0.03 0.40 -0.33 2.33 1.57 -1.11 -2.36 116.57 117.11 1ukh h LYS 273 Ca -0.05 -0.69 -0.13 0.00 -1.87 0.00 0.00 60.65 57.91 1ukh h LYS 273 Cb 1.78 0.26 -0.01 0.00 0.08 0.00 0.00 32.23 34.34 1ukh h LYS 273 CO 0.15 1.33 -0.30 -0.07 -0.57 0.00 0.00 179.45 179.99 1ukh h LEU 274 N -0.04 0.83 -6.85 2.94 3.38 -1.09 -3.36 115.31 111.12 1ukh h LEU 274 Ca -0.27 -0.46 -0.61 0.00 0.09 0.00 0.00 57.88 56.62 1ukh h LEU 274 Cb 1.98 -0.23 -0.41 0.00 0.09 0.00 0.00 40.66 42.09 1ukh h LEU 274 CO 0.19 1.12 -0.64 0.49 0.09 0.00 0.00 178.44 179.68 1ukh n PHE 275 N -4.21 2.66 -2.09 1.13 3.72 0.90 -5.05 117.46 114.52 1ukh n PHE 275 Ca -0.03 -4.14 -0.34 0.00 -0.05 0.00 0.00 57.45 52.88 1ukh n PHE 275 Cb 0.48 -0.49 0.02 0.00 -0.94 0.00 0.00 39.48 38.55 1ukh n PHE 275 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1ukh s PRO 276 N -1.38 3.17 0.36 -1.08 0.04 -0.89 -4.35 135.00 130.86 1ukh s PRO 276 Ca 0.28 1.54 0.23 0.00 0.04 0.00 0.00 61.00 63.09 1ukh s PRO 276 Cb -0.00 -1.99 1.24 0.00 0.04 0.00 0.00 34.50 33.79 1ukh s PRO 276 CO -0.15 -0.99 1.69 -0.44 0.04 0.00 0.00 177.00 177.15 1ukh h ASP 277 N 0.81 0.00 0.00 6.66 5.19 -1.94 -1.60 116.42 125.53 1ukh h ASP 277 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1ukh h ASP 277 Cb 1.26 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.77 1ukh h ASP 277 CO 0.56 0.00 0.00 0.52 -3.12 0.00 0.00 179.24 177.20 1ukh n VAL 278 N -2.31 0.00 0.10 -1.35 0.31 -1.26 -1.68 118.33 112.14 1ukh n VAL 278 Ca -0.02 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.34 1ukh n VAL 278 Cb 0.07 -0.82 -0.03 0.00 -0.91 0.00 0.00 33.84 32.15 1ukh n VAL 278 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 1ukh n LEU 279 N -0.96 0.10 -4.83 7.52 4.77 -0.60 -5.05 117.00 117.96 1ukh n LEU 279 Ca 0.06 -0.23 -0.28 0.00 -0.03 0.00 0.00 56.01 55.53 1ukh n LEU 279 Cb 0.03 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.07 1ukh n LEU 279 CO 0.04 0.03 -0.20 -0.36 -1.33 0.00 0.00 177.39 175.57 1ukh s PHE 280 N -1.93 3.25 0.00 -1.77 0.08 -0.68 -5.00 117.98 111.93 1ukh s PHE 280 Ca -0.00 0.05 0.00 0.00 0.12 0.00 0.00 56.93 57.10 1ukh s PHE 280 Cb 0.03 -1.59 0.00 0.00 -0.57 0.00 0.00 43.02 40.90 1ukh s PHE 280 CO 0.20 0.52 0.00 -0.35 -0.10 0.00 0.00 175.22 175.50 1ukh n PRO 281 N -0.13 0.00 0.00 0.24 -0.04 -1.26 -4.99 135.00 128.82 1ukh n PRO 281 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1ukh n PRO 281 Cb 0.53 -0.19 0.00 0.00 -0.04 0.00 0.00 33.50 33.81 1ukh n PRO 281 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ukh n ASN 287 N -0.39 0.00 0.13 3.54 4.13 -1.26 -5.10 115.26 116.31 1ukh n ASN 287 Ca 0.00 0.00 -0.23 0.00 1.68 0.00 0.00 54.58 56.03 1ukh n ASN 287 Cb 0.00 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.09 1ukh n ASN 287 CO 0.00 0.00 0.00 0.11 0.28 0.00 0.00 177.26 177.65 1ukh h LYS 288 N 3.16 0.54 0.49 3.52 1.57 -2.01 -3.19 116.57 120.64 1ukh h LYS 288 Ca 0.00 -0.87 -0.02 0.00 -1.87 0.00 0.00 60.65 57.89 1ukh h LYS 288 Cb 0.00 0.31 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1ukh h LYS 288 CO 0.00 1.41 -0.24 1.25 -0.57 0.00 0.00 179.45 181.30 1ukh h LEU 289 N 0.17 -0.56 -1.18 2.94 5.85 -2.02 -3.11 115.31 117.40 1ukh h LEU 289 Ca -0.23 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.45 1ukh h LEU 289 Cb 2.10 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 43.23 1ukh h LEU 289 CO 0.26 -0.27 0.56 0.11 -0.34 0.00 0.00 178.44 178.76 1ukh h LYS 290 N -0.84 1.07 -0.30 1.25 6.56 -2.00 -1.13 116.57 121.18 1ukh h LYS 290 Ca -0.07 -0.06 -0.06 0.00 -1.06 0.00 0.00 60.65 59.40 1ukh h LYS 290 Cb 0.58 -0.24 -0.02 0.00 -0.57 0.00 0.00 32.23 31.98 1ukh h LYS 290 CO 0.11 0.71 -0.07 0.00 -2.06 0.00 0.00 179.45 178.14 1ukh h ALA 291 N 1.49 1.32 -0.05 3.86 0.00 -1.60 -1.78 119.26 122.50 1ukh h ALA 291 Ca 0.32 -0.24 -0.24 0.00 0.00 0.00 0.00 54.91 54.75 1ukh h ALA 291 Cb -0.07 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.60 1ukh h ALA 291 CO -0.08 0.46 -0.93 0.77 0.00 0.00 0.00 179.25 179.46 1ukh h SER 292 N 0.45 0.82 -0.37 0.00 0.02 -1.34 -3.08 113.55 110.06 1ukh h SER 292 Ca 0.09 -0.62 -0.02 0.00 -0.84 0.00 0.00 61.79 60.40 1ukh h SER 292 Cb 0.41 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.69 1ukh h SER 292 CO 0.02 1.41 0.16 1.56 -1.14 0.00 0.00 176.83 178.84 1ukh h GLN 293 N 0.40 0.54 -0.59 3.45 4.20 -0.99 0.18 115.11 122.29 1ukh h GLN 293 Ca -0.09 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.53 1ukh h GLN 293 Cb 1.57 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 29.23 1ukh h GLN 293 CO 0.18 0.51 0.39 0.00 -0.67 0.00 0.00 178.83 179.24 1ukh h ALA 294 N 1.00 1.58 -0.02 3.87 0.00 -1.41 0.12 119.26 124.41 1ukh h ALA 294 Ca 0.12 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1ukh h ALA 294 Cb 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1ukh h ALA 294 CO -0.01 0.39 -0.11 -0.09 0.00 0.00 0.00 179.25 179.43 1ukh h ARG 295 N 0.80 0.11 -0.99 0.00 2.43 -1.37 -1.51 114.38 113.84 1ukh h ARG 295 Ca 0.22 -0.09 0.14 0.00 -0.81 0.00 0.00 59.98 59.43 1ukh h ARG 295 Cb -0.09 0.02 -0.09 0.00 -0.42 0.00 0.00 29.97 29.39 1ukh h ARG 295 CO -0.05 0.77 0.62 0.22 -1.51 0.00 0.00 179.97 180.03 1ukh h ASP 296 N -0.53 0.87 -0.13 -3.80 1.82 -0.13 0.34 116.42 114.88 1ukh h ASP 296 Ca -0.01 0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.67 1ukh h ASP 296 Cb 0.79 -0.11 -0.00 0.00 0.68 0.00 0.00 39.33 40.69 1ukh h ASP 296 CO 0.02 0.43 -0.00 0.25 -1.61 0.00 0.00 179.24 178.33 1ukh h LEU 297 N 0.92 0.22 -1.46 2.28 5.85 -0.73 -2.61 115.31 119.78 1ukh h LEU 297 Ca 0.51 -0.31 0.09 0.00 0.84 0.00 0.00 57.88 59.01 1ukh h LEU 297 Cb 0.60 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 1ukh h LEU 297 CO -0.28 0.48 0.47 -0.07 -0.34 0.00 0.00 178.44 178.69 1ukh h LEU 298 N -0.04 0.54 -0.62 2.25 3.38 -0.09 0.70 115.31 121.42 1ukh h LEU 298 Ca 0.04 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1ukh h LEU 298 Cb 0.36 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1ukh h LEU 298 CO 0.01 0.33 0.00 -1.54 0.09 0.00 0.00 178.44 177.33 1ukh n SER 299 N -4.49 0.47 -0.04 -0.43 3.41 0.11 -1.86 113.62 110.80 1ukh n SER 299 Ca 0.12 0.64 0.05 0.00 -0.26 0.00 0.00 58.87 59.41 1ukh n SER 299 Cb 0.34 -0.73 -0.05 0.00 -0.26 0.00 0.00 64.21 63.51 1ukh n SER 299 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ukh n LYS 300 N -2.04 3.51 -0.09 4.33 5.02 0.19 -4.58 118.16 124.49 1ukh n LYS 300 Ca 0.02 -0.10 -0.14 0.00 -2.02 0.00 0.00 58.31 56.06 1ukh n LYS 300 Cb 0.17 -0.98 -0.14 0.00 -0.02 0.00 0.00 35.03 34.07 1ukh n LYS 300 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1ukh n MET 301 N -1.06 0.68 -2.48 1.97 2.81 -0.89 -1.22 117.12 116.92 1ukh n MET 301 Ca 0.02 0.12 -0.42 0.00 -1.81 0.00 0.00 57.70 55.61 1ukh n MET 301 Cb 0.16 -1.58 0.01 0.00 -0.71 0.00 0.00 33.22 31.10 1ukh n MET 301 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1ukh n LEU 302 N -3.08 6.78 -4.08 4.03 4.77 -0.77 -4.21 117.00 120.43 1ukh n LEU 302 Ca -0.36 -4.85 -0.32 0.00 -0.03 0.00 0.00 56.01 50.44 1ukh n LEU 302 Cb 1.07 -1.40 -0.16 0.00 -2.33 0.00 0.00 43.42 40.60 1ukh n LEU 302 CO 0.37 1.56 -0.49 -0.69 -1.33 0.00 0.00 177.39 176.81 1ukh s VAL 303 N -0.81 2.02 0.12 4.08 1.01 -1.26 -4.94 120.40 120.61 1ukh s VAL 303 Ca 0.39 -1.17 -0.32 0.00 0.00 0.00 0.00 61.98 60.88 1ukh s VAL 303 Cb 0.10 -1.96 -0.10 0.00 0.00 0.00 0.00 36.38 34.41 1ukh s VAL 303 CO 0.02 0.29 1.57 0.40 0.00 0.00 0.00 175.10 177.38 1ukh h ILE 304 N 6.29 0.10 -2.33 2.22 1.08 -1.95 -3.37 117.51 119.55 1ukh h ILE 304 Ca -0.34 0.00 -0.55 0.00 -0.39 0.00 0.00 64.86 63.58 1ukh h ILE 304 Cb 1.10 0.10 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 1ukh h ILE 304 CO 0.55 0.00 1.35 -0.62 -0.69 0.00 0.00 178.15 178.74 1ukh s ASP 305 N -4.76 5.55 0.66 1.72 -1.08 -1.26 -4.82 116.67 112.69 1ukh s ASP 305 Ca -0.16 1.10 0.34 0.00 -0.52 0.00 0.00 52.55 53.31 1ukh s ASP 305 Cb 0.08 -2.52 1.85 0.00 -1.46 0.00 0.00 42.92 40.86 1ukh s ASP 305 CO 0.63 -2.01 2.05 0.00 0.52 0.00 0.00 175.17 176.36 1ukh h ALA 306 N 14.25 1.30 0.00 3.66 0.00 -1.98 -1.12 119.26 135.37 1ukh h ALA 306 Ca -0.31 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1ukh h ALA 306 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1ukh h ALA 306 CO 1.08 -0.25 0.00 -1.13 0.00 0.00 0.00 179.25 178.95 1ukh n SER 307 N -3.02 0.23 -0.37 0.00 3.41 -1.26 -2.94 113.62 109.67 1ukh n SER 307 Ca -0.02 0.52 0.06 0.00 -0.26 0.00 0.00 58.87 59.18 1ukh n SER 307 Cb 0.30 -0.59 0.13 0.00 -0.26 0.00 0.00 64.21 63.80 1ukh n SER 307 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ukh n LYS 308 N -1.72 2.51 -3.82 4.33 4.76 -0.43 -5.00 118.16 118.79 1ukh n LYS 308 Ca 0.06 -2.22 -0.37 0.00 -2.87 0.00 0.00 58.31 52.92 1ukh n LYS 308 Cb 0.35 -1.39 -0.06 0.00 -1.84 0.00 0.00 35.03 32.09 1ukh n LYS 308 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1ukh s ARG 309 N -1.91 3.51 0.73 1.97 3.52 -1.15 -4.93 118.95 120.70 1ukh s ARG 309 Ca 0.23 -0.06 -0.16 0.00 -0.13 0.00 0.00 55.73 55.62 1ukh s ARG 309 Cb 0.18 -3.19 0.02 0.00 -1.56 0.00 0.00 34.95 30.40 1ukh s ARG 309 CO 0.06 0.76 1.06 1.51 -0.81 0.00 0.00 175.30 177.89 1ukh n ILE 310 N 1.88 2.96 -3.47 4.11 3.06 -0.36 -5.03 119.36 122.52 1ukh n ILE 310 Ca -0.18 -0.35 -0.19 0.00 -2.50 0.00 0.00 62.75 59.52 1ukh n ILE 310 Cb 0.54 -1.18 -0.01 0.00 0.54 0.00 0.00 39.64 39.53 1ukh n ILE 310 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1ukh s SER 311 N -1.70 5.65 0.09 9.51 1.04 -1.26 -4.88 113.70 122.16 1ukh s SER 311 Ca 0.75 -0.37 -0.22 0.00 0.48 0.00 0.00 55.95 56.59 1ukh s SER 311 Cb -0.34 -0.98 -0.12 0.00 0.10 0.00 0.00 66.02 64.68 1ukh s SER 311 CO 0.49 -0.50 1.72 0.58 0.98 0.00 0.00 173.24 176.50 1ukh h VAL 312 N 0.94 1.05 -0.62 5.02 2.07 -1.96 0.13 116.25 122.89 1ukh h VAL 312 Ca -0.44 -0.14 0.11 0.00 0.82 0.00 0.00 66.70 67.04 1ukh h VAL 312 Cb 1.26 0.99 -0.08 0.00 -1.52 0.00 0.00 31.29 31.95 1ukh h VAL 312 CO 0.53 0.05 0.20 0.44 0.02 0.00 0.00 177.57 178.80 1ukh h ASP 313 N 0.08 0.15 -0.01 0.57 3.32 -1.97 0.34 116.42 118.90 1ukh h ASP 313 Ca 0.03 0.09 -0.10 0.00 0.02 0.00 0.00 57.03 57.08 1ukh h ASP 313 Cb 0.03 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1ukh h ASP 313 CO -0.01 0.08 -0.28 -0.08 -1.72 0.00 0.00 179.24 177.24 1ukh h GLU 314 N 0.35 0.44 -0.41 3.56 4.81 -1.87 -1.67 114.58 119.78 1ukh h GLU 314 Ca 0.32 -0.17 -0.13 0.00 -0.13 0.00 0.00 59.36 59.25 1ukh h GLU 314 Cb 0.44 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1ukh h GLU 314 CO -0.35 0.68 -0.25 0.00 -0.73 0.00 0.00 179.01 178.36 1ukh h ALA 315 N 1.32 0.78 0.00 2.92 0.00 0.12 -0.12 119.26 124.28 1ukh h ALA 315 Ca 0.05 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1ukh h ALA 315 Cb 0.69 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ukh h ALA 315 CO 0.05 0.65 -0.27 -0.07 0.00 0.00 0.00 179.25 179.61 1ukh h LEU 316 N 0.74 0.00 0.00 0.00 3.38 -0.16 -2.71 115.31 116.55 1ukh h LEU 316 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1ukh h LEU 316 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1ukh h LEU 316 CO 0.07 0.27 -0.75 0.00 0.09 0.00 0.00 178.44 178.12 1ukh n GLN 317 N -3.52 0.27 -1.56 1.13 1.13 -0.65 -3.48 117.38 110.69 1ukh n GLN 317 Ca -0.00 0.05 -0.41 0.00 -1.94 0.00 0.00 57.00 54.69 1ukh n GLN 317 Cb 0.43 -1.64 0.01 0.00 0.11 0.00 0.00 30.24 29.15 1ukh n GLN 317 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1ukh n HIS 318 N -2.01 0.65 0.27 1.08 -0.00 -0.10 -4.53 115.22 110.58 1ukh n HIS 318 Ca 0.03 0.56 0.15 0.00 0.46 0.00 0.00 57.72 58.92 1ukh n HIS 318 Cb 0.43 -2.15 0.74 0.00 -0.12 0.00 0.00 29.99 28.89 1ukh n HIS 318 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1ukh h PRO 319 N 1.20 0.00 0.00 1.57 0.13 -1.91 0.35 132.00 133.35 1ukh h PRO 319 Ca -0.44 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.60 1ukh h PRO 319 Cb 1.36 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.47 1ukh h PRO 319 CO 0.55 0.00 -0.83 -0.92 -0.23 0.00 0.00 178.00 176.57 1ukh h TYR 320 N 0.00 0.00 0.00 1.56 3.20 -1.88 -3.38 116.97 116.47 1ukh h TYR 320 Ca 0.00 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.59 1ukh h TYR 320 Cb 0.15 0.00 -0.05 0.00 1.54 0.00 0.00 36.73 38.37 1ukh h TYR 320 CO 0.00 0.37 -2.06 -0.89 -1.64 0.00 0.00 178.16 173.94 1ukh n ILE 321 N -3.00 1.07 0.31 1.81 2.08 -0.91 -4.64 119.36 116.07 1ukh n ILE 321 Ca -0.02 -0.52 0.13 0.00 0.56 0.00 0.00 62.75 62.90 1ukh n ILE 321 Cb 0.71 -0.91 0.71 0.00 -0.75 0.00 0.00 39.64 39.40 1ukh n ILE 321 CO 0.00 0.00 0.00 -1.13 0.56 0.00 0.00 176.55 175.98 1ukh h ASN 322 N 0.00 0.00 -0.04 4.38 -1.24 -0.35 -2.91 115.58 115.43 1ukh h ASN 322 Ca -0.42 0.00 -0.00 0.00 0.71 0.00 0.00 56.30 56.59 1ukh h ASN 322 Cb 1.78 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 40.83 1ukh h ASN 322 CO -0.03 0.00 0.02 -0.37 -1.29 0.00 0.00 177.43 175.76 1ukh h VAL 323 N 0.00 1.03 -0.02 2.57 -1.51 -1.82 -1.97 116.25 114.52 1ukh h VAL 323 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 1ukh h VAL 323 Cb 0.70 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 30.83 1ukh h VAL 323 CO 0.00 0.04 -0.24 0.79 -1.23 0.00 0.00 177.57 176.93 1ukh n TRP 324 N -4.50 0.00 -1.54 5.19 7.02 -1.10 -5.00 117.44 117.50 1ukh n TRP 324 Ca -0.02 0.00 -0.51 0.00 -1.02 0.00 0.00 57.50 55.95 1ukh n TRP 324 Cb 0.10 -0.01 -0.05 0.00 -2.42 0.00 0.00 31.31 28.94 1ukh n TRP 324 CO 0.00 0.00 0.00 0.98 -2.02 0.00 0.00 177.69 176.65 1ukh n TYR 325 N 0.53 0.99 -3.67 -5.99 9.36 -0.74 -4.98 117.16 112.66 1ukh n TYR 325 Ca 0.12 0.78 -0.11 0.00 3.32 0.00 0.00 57.90 62.02 1ukh n TYR 325 Cb 0.51 -2.21 -0.11 0.00 -0.63 0.00 0.00 39.34 36.90 1ukh n TYR 325 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1ukh s ASP 326 N -0.05 -0.15 0.57 2.98 3.68 -1.26 -5.05 116.67 117.39 1ukh s ASP 326 Ca 0.77 0.83 0.26 0.00 2.13 0.00 0.00 52.55 56.53 1ukh s ASP 326 Cb -0.96 0.98 1.65 0.00 -1.45 0.00 0.00 42.92 43.14 1ukh s ASP 326 CO 0.53 -0.22 2.22 1.55 0.13 0.00 0.00 175.17 179.38 1ukh h PRO 327 N 7.91 0.00 0.00 4.34 0.13 -1.95 0.20 132.00 142.63 1ukh h PRO 327 Ca -0.22 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.83 1ukh h PRO 327 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1ukh h PRO 327 CO 0.18 0.00 -0.37 0.66 -0.23 0.00 0.00 178.00 178.24 1ukh h SER 328 N 0.00 0.00 0.00 1.44 4.64 -1.97 -1.89 113.55 115.78 1ukh h SER 328 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1ukh h SER 328 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1ukh h SER 328 CO -0.00 0.37 -0.62 -0.62 -0.87 0.00 0.00 176.83 175.09 1ukh n GLU 329 N -3.54 0.38 0.26 4.77 1.02 -0.69 -3.97 120.64 118.87 1ukh n GLU 329 Ca -0.00 0.28 0.17 0.00 -0.02 0.00 0.00 57.16 57.58 1ukh n GLU 329 Cb 0.51 -1.31 0.90 0.00 -0.02 0.00 0.00 31.44 31.51 1ukh n GLU 329 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ukh h ALA 330 N -1.23 1.61 -1.97 0.62 0.00 -0.78 -3.24 119.26 114.26 1ukh h ALA 330 Ca 0.00 -0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 1ukh h ALA 330 Cb 0.62 0.01 -0.40 0.00 0.00 0.00 0.00 17.79 18.02 1ukh h ALA 330 CO 0.00 -0.16 -1.17 0.39 0.00 0.00 0.00 179.25 178.31 1ukh n GLU 331 N -3.71 1.12 -3.12 0.00 -0.58 -0.71 -4.92 120.64 108.72 1ukh n GLU 331 Ca -0.01 -3.47 -0.39 0.00 -0.42 0.00 0.00 57.16 52.88 1ukh n GLU 331 Cb 0.21 -1.72 -0.06 0.00 -0.57 0.00 0.00 31.44 29.31 1ukh n GLU 331 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ukh s ALA 332 N -2.53 3.48 0.19 0.62 0.00 -1.23 -4.73 121.76 117.56 1ukh s ALA 332 Ca 0.40 0.17 -0.32 0.00 0.00 0.00 0.00 51.96 52.21 1ukh s ALA 332 Cb 0.35 -2.82 -0.15 0.00 0.00 0.00 0.00 23.12 20.50 1ukh s ALA 332 CO -0.08 0.24 1.17 -2.30 0.00 0.00 0.00 175.76 174.79 1ukh n PRO 333 N 2.16 1.26 -0.87 0.00 -0.02 -1.26 -4.94 135.00 131.32 1ukh n PRO 333 Ca -0.07 0.45 -0.36 0.00 -2.02 0.00 0.00 63.50 61.50 1ukh n PRO 333 Cb 0.50 -1.94 0.09 0.00 -0.02 0.00 0.00 33.50 32.12 1ukh n PRO 333 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1ukh n PRO 334 N 1.68 -0.54 0.02 0.52 -0.02 -1.26 -4.98 135.00 130.42 1ukh n PRO 334 Ca 0.14 -0.15 -0.19 0.00 -2.02 0.00 0.00 63.50 61.28 1ukh n PRO 334 Cb 0.26 -1.32 -0.14 0.00 -0.02 0.00 0.00 33.50 32.27 1ukh n PRO 334 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1ukh h PRO 335 N -1.41 0.24 0.00 0.52 0.13 -1.86 -3.49 132.00 126.13 1ukh h PRO 335 Ca -0.45 -0.41 0.00 0.00 -0.87 0.00 0.00 66.00 64.27 1ukh h PRO 335 Cb 1.36 0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.64 1ukh h PRO 335 CO 0.28 1.20 0.00 1.17 -0.23 0.00 0.00 178.00 180.42 1ukh n LYS 336 N -4.17 0.00 -0.02 0.86 0.00 -1.26 -4.80 118.16 108.77 1ukh n LYS 336 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.16 1ukh n LYS 336 Cb 0.78 0.00 -0.00 0.00 0.00 0.00 0.00 35.03 35.81 1ukh n LYS 336 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 1ukh n ILE 349 N 0.00 0.00 1.08 3.15 -0.00 -1.26 -5.09 119.36 117.23 1ukh n ILE 349 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 62.75 62.87 1ukh n ILE 349 Cb 0.00 -0.01 0.29 0.00 -0.00 0.00 0.00 39.64 39.92 1ukh n ILE 349 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1ukh n GLU 350 N -0.44 0.26 0.24 0.38 0.00 -1.26 -3.83 120.64 115.99 1ukh n GLU 350 Ca 0.00 -0.15 0.08 0.00 0.00 0.00 0.00 57.16 57.09 1ukh n GLU 350 Cb 0.01 -1.50 0.59 0.00 0.00 0.00 0.00 31.44 30.55 1ukh n GLU 350 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1ukh h GLU 351 N 0.36 0.00 -0.15 5.31 3.07 -2.05 -2.50 114.58 118.62 1ukh h GLU 351 Ca 0.00 0.00 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1ukh h GLU 351 Cb 0.50 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.40 1ukh h GLU 351 CO 0.00 0.16 -0.13 -1.49 -1.40 0.00 0.00 179.01 176.16 1ukh h TRP 352 N 0.00 0.24 -0.76 4.33 4.06 -2.00 -2.16 115.95 119.66 1ukh h TRP 352 Ca -0.00 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.92 1ukh h TRP 352 Cb 0.34 -0.07 -0.04 0.00 -1.00 0.00 0.00 29.16 28.39 1ukh h TRP 352 CO 0.00 0.36 0.48 -0.22 -3.56 0.00 0.00 178.44 175.50 1ukh h LYS 353 N 0.22 1.02 -0.20 0.49 3.64 -1.71 -1.00 116.57 119.02 1ukh h LYS 353 Ca 0.05 -0.08 -0.14 0.00 -1.27 0.00 0.00 60.65 59.21 1ukh h LYS 353 Cb 0.37 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 1ukh h LYS 353 CO 0.02 0.70 -0.43 0.93 -2.27 0.00 0.00 179.45 178.40 1ukh h GLU 354 N 1.04 0.64 -0.29 1.90 5.08 -1.58 -0.73 114.58 120.65 1ukh h GLU 354 Ca 0.28 -0.42 0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1ukh h GLU 354 Cb -0.08 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1ukh h GLU 354 CO -0.06 1.04 0.05 -0.07 -1.00 0.00 0.00 179.01 178.98 1ukh h LEU 355 N 0.33 0.01 0.24 1.33 3.38 -1.11 1.07 115.31 120.56 1ukh h LEU 355 Ca 0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1ukh h LEU 355 Cb 1.03 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1ukh h LEU 355 CO 0.09 0.04 -0.12 0.40 0.09 0.00 0.00 178.44 178.95 1ukh h ILE 356 N 0.16 0.80 -0.21 1.22 2.04 -1.22 0.23 117.51 120.53 1ukh h ILE 356 Ca 0.13 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.80 1ukh h ILE 356 Cb 0.14 0.94 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 1ukh h ILE 356 CO -0.18 0.05 -0.10 0.22 0.00 0.00 0.00 178.15 178.15 1ukh h TYR 357 N -0.45 -0.24 -0.97 1.37 5.03 -0.77 0.26 116.97 121.21 1ukh h TYR 357 Ca -0.03 0.02 0.08 0.00 2.58 0.00 0.00 58.73 61.38 1ukh h TYR 357 Cb 0.34 0.14 -0.07 0.00 1.55 0.00 0.00 36.73 38.69 1ukh h TYR 357 CO -0.03 -0.16 0.61 -0.22 -1.32 0.00 0.00 178.16 177.05 1ukh h LYS 358 N -0.08 1.04 -0.43 1.82 3.64 0.14 0.31 116.57 123.00 1ukh h LYS 358 Ca 0.12 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1ukh h LYS 358 Cb 0.25 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 1ukh h LYS 358 CO -0.26 0.69 0.21 0.93 -2.27 0.00 0.00 179.45 178.75 1ukh h GLU 359 N 1.07 0.61 -0.51 1.90 4.39 0.10 -2.46 114.58 119.68 1ukh h GLU 359 Ca 0.44 -0.09 -0.11 0.00 0.34 0.00 0.00 59.36 59.94 1ukh h GLU 359 Cb 0.27 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1ukh h GLU 359 CO -0.20 0.52 -0.13 0.28 -1.16 0.00 0.00 179.01 178.32 1ukh h VAL 360 N 0.55 1.27 0.00 3.13 2.07 0.47 -2.99 116.25 120.74 1ukh h VAL 360 Ca 0.15 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.40 1ukh h VAL 360 Cb 0.10 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 1ukh h VAL 360 CO -0.02 0.44 0.00 0.24 0.02 0.00 0.00 177.57 178.25 1ukh h MET 361 N 0.86 0.00 -0.01 1.57 2.86 -0.25 -1.54 114.93 118.42 1ukh h MET 361 Ca 0.13 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 1ukh h MET 361 Cb 0.68 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.34 1ukh h MET 361 CO 0.05 0.00 0.00 -0.25 1.06 0.00 0.00 176.91 177.77 1ukh n ASP 362 N -2.93 0.01 0.00 1.22 8.00 -0.94 -5.08 116.55 116.82 1ukh n ASP 362 Ca 0.01 -1.36 0.00 0.00 0.71 0.00 0.00 54.79 54.15 1ukh n ASP 362 Cb 0.28 -0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 1ukh n ASP 362 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99