#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1urk n VAL 7 N 0.00 -0.41 -1.44 5.09 3.14 -1.26 -5.05 118.33 118.40 1urk n VAL 7 Ca 0.00 -4.30 -0.13 0.00 -2.96 0.00 0.00 64.34 56.95 1urk n VAL 7 Cb 0.00 -1.18 -0.11 0.00 -1.06 0.00 0.00 33.84 31.49 1urk n VAL 7 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1urk n PRO 8 N 0.88 0.20 -2.16 1.45 -0.02 -1.26 -4.06 135.00 130.03 1urk n PRO 8 Ca 0.23 -0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.07 1urk n PRO 8 Cb 0.59 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 1urk n PRO 8 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1urk n SER 9 N 12.70 -9.12 -3.20 2.55 2.88 -1.26 -5.07 113.62 113.11 1urk n SER 9 Ca 0.43 1.54 0.04 0.00 -1.33 0.00 0.00 58.87 59.55 1urk n SER 9 Cb 0.37 -5.08 -0.03 0.00 -0.75 0.00 0.00 64.21 58.72 1urk n SER 9 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 1urk s ASN 10 N -0.54 -0.19 0.18 -3.46 3.84 -1.26 -5.18 114.94 108.33 1urk s ASN 10 Ca 0.00 0.20 -0.23 0.00 0.21 0.00 0.00 52.86 53.04 1urk s ASN 10 Cb 0.00 1.19 0.05 0.00 -0.55 0.00 0.00 41.25 41.95 1urk s ASN 10 CO 0.00 -0.04 0.71 0.00 -2.79 0.00 0.00 177.10 174.98 1urk s ASP 12 N -2.80 4.25 0.00 0.00 1.01 -1.26 -4.99 116.67 112.88 1urk s ASP 12 Ca 0.06 -0.91 0.00 0.00 0.71 0.00 0.00 52.55 52.42 1urk s ASP 12 Cb -0.03 -1.64 0.00 0.00 1.01 0.00 0.00 42.92 42.26 1urk s ASP 12 CO -0.04 -0.13 0.00 0.00 0.21 0.00 0.00 175.17 175.22 1urk n LEU 14 N 0.00 0.00 -2.17 0.00 4.77 0.32 -3.49 117.00 116.42 1urk n LEU 14 Ca 0.00 -0.70 -0.03 0.00 -0.03 0.00 0.00 56.01 55.25 1urk n LEU 14 Cb 0.00 -0.45 -0.00 0.00 -2.33 0.00 0.00 43.42 40.64 1urk n LEU 14 CO 0.00 -0.91 -0.04 0.59 -1.33 0.00 0.00 177.39 175.70 1urk n ASN 15 N -3.34 -1.50 -3.28 -1.43 5.03 -1.26 -0.50 115.26 108.98 1urk n ASN 15 Ca 0.08 0.35 -0.16 0.00 0.87 0.00 0.00 54.58 55.71 1urk n ASN 15 Cb 0.27 -1.46 0.07 0.00 -1.02 0.00 0.00 39.78 37.63 1urk n ASN 15 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1urk n GLY 16 N -0.46 -1.15 3.05 7.41 0.00 -1.25 -4.93 105.19 107.86 1urk n GLY 16 Ca -0.03 0.58 -0.23 0.00 0.00 0.00 0.00 46.02 46.33 1urk n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1urk n GLY 17 N -1.25 -2.42 3.85 -0.02 0.00 0.34 -4.91 105.19 100.77 1urk n GLY 17 Ca -0.07 -0.62 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 1urk n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1urk s THR 18 N -2.09 4.45 -0.29 2.61 2.01 -0.89 -4.88 115.64 116.56 1urk s THR 18 Ca 0.38 0.93 -0.02 0.00 0.31 0.00 0.00 61.69 63.28 1urk s THR 18 Cb -0.04 -3.70 0.04 0.00 0.01 0.00 0.00 72.50 68.81 1urk s THR 18 CO 0.44 -0.91 -0.00 0.00 -0.69 0.00 0.00 174.62 173.46 1urk n VAL 20 N 4.67 0.00 -3.61 0.00 0.24 -0.89 -4.93 118.33 113.82 1urk n VAL 20 Ca -0.14 -1.64 -0.04 0.00 -2.04 0.00 0.00 64.34 60.48 1urk n VAL 20 Cb 0.45 0.43 -0.03 0.00 -1.47 0.00 0.00 33.84 33.23 1urk n VAL 20 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1urk s SER 21 N -2.83 -0.12 0.66 -1.34 1.04 -1.26 -2.93 113.70 106.92 1urk s SER 21 Ca 0.06 0.04 -0.08 0.00 0.48 0.00 0.00 55.95 56.45 1urk s SER 21 Cb 0.00 0.12 0.03 0.00 0.10 0.00 0.00 66.02 66.27 1urk s SER 21 CO 0.04 -0.18 1.00 0.21 0.98 0.00 0.00 173.24 175.29 1urk s ASN 22 N -1.87 5.31 0.00 7.02 2.47 -1.24 -4.98 114.94 121.65 1urk s ASN 22 Ca 0.09 0.78 0.00 0.00 0.42 0.00 0.00 52.86 54.15 1urk s ASN 22 Cb -0.01 -1.62 0.00 0.00 -1.45 0.00 0.00 41.25 38.17 1urk s ASN 22 CO -0.04 -1.31 0.00 1.17 -3.72 0.00 0.00 177.10 173.19 1urk n LYS 23 N -2.83 4.56 -1.73 0.43 3.00 -1.26 -4.74 118.16 115.58 1urk n LYS 23 Ca 0.06 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 58.04 1urk n LYS 23 Cb 0.58 -0.33 0.05 0.00 0.00 0.00 0.00 35.03 35.33 1urk n LYS 23 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1urk n TYR 24 N -0.66 3.09 -1.11 5.64 4.01 -1.26 -4.94 117.16 121.94 1urk n TYR 24 Ca 0.00 -2.71 0.00 0.00 -0.16 0.00 0.00 57.90 55.03 1urk n TYR 24 Cb 0.00 -1.01 0.00 0.00 -0.31 0.00 0.00 39.34 38.02 1urk n TYR 24 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1urk n PHE 25 N -0.74 0.00 -2.01 -0.72 7.35 -1.26 -5.08 117.46 114.99 1urk n PHE 25 Ca 0.54 0.00 -0.02 0.00 -0.76 0.00 0.00 57.45 57.21 1urk n PHE 25 Cb 0.63 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.44 1urk n PHE 25 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 1urk n SER 26 N 0.00 -0.33 0.00 -2.13 2.88 -1.26 -4.97 113.62 107.81 1urk n SER 26 Ca 0.00 -1.41 0.00 0.00 -1.33 0.00 0.00 58.87 56.13 1urk n SER 26 Cb 0.00 0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1urk n SER 26 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1urk n ASN 27 N 0.01 0.00 -4.11 -3.46 4.13 -1.26 -5.17 115.26 105.40 1urk n ASN 27 Ca -0.10 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 55.94 1urk n ASN 27 Cb 0.59 0.00 -0.15 0.00 -1.54 0.00 0.00 39.78 38.68 1urk n ASN 27 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 1urk s ILE 28 N 0.00 1.12 -0.25 2.41 1.10 -1.26 -5.12 121.20 119.19 1urk s ILE 28 Ca 0.00 -0.64 -0.27 0.00 -0.51 0.00 0.00 60.65 59.23 1urk s ILE 28 Cb 0.00 -0.94 0.14 0.00 0.15 0.00 0.00 42.46 41.81 1urk s ILE 28 CO 0.00 0.29 1.10 -1.38 -2.11 0.00 0.00 174.94 172.84 1urk s HIS 29 N -0.38 -0.36 0.14 3.50 -3.43 -1.26 -3.68 115.29 109.83 1urk s HIS 29 Ca 0.05 0.81 -0.23 0.00 -0.80 0.00 0.00 55.06 54.89 1urk s HIS 29 Cb -0.06 0.41 0.07 0.00 -1.43 0.00 0.00 32.58 31.57 1urk s HIS 29 CO -0.00 -0.22 0.58 1.67 -2.00 0.00 0.00 174.74 174.77 1urk s TRP 30 N -0.23 -0.51 0.11 0.38 -2.14 -1.15 -4.99 118.94 110.41 1urk s TRP 30 Ca 0.03 0.32 -0.05 0.00 2.66 0.00 0.00 56.10 59.06 1urk s TRP 30 Cb -0.04 0.52 -0.05 0.00 -3.10 0.00 0.00 33.47 30.80 1urk s TRP 30 CO -0.06 -0.82 0.36 0.00 -2.66 0.00 0.00 176.95 173.77 1urk s ASN 32 N -2.26 5.12 0.17 0.00 -0.87 -0.49 -4.88 114.94 111.72 1urk s ASN 32 Ca 0.38 -1.75 -0.04 0.00 -1.57 0.00 0.00 52.86 49.88 1urk s ASN 32 Cb -0.13 -1.78 -0.05 0.00 -0.02 0.00 0.00 41.25 39.27 1urk s ASN 32 CO 0.23 -0.43 0.39 0.00 -2.57 0.00 0.00 177.10 174.72 1urk n PRO 34 N -0.16 0.57 0.11 0.00 -0.02 -1.26 -4.75 135.00 129.48 1urk n PRO 34 Ca -0.03 0.22 0.20 0.00 -2.02 0.00 0.00 63.50 61.87 1urk n PRO 34 Cb 0.52 -1.70 0.73 0.00 -0.02 0.00 0.00 33.50 33.04 1urk n PRO 34 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1urk h LYS 35 N 0.38 0.00 -1.01 -0.52 1.63 -2.02 0.23 116.57 115.27 1urk h LYS 35 Ca -0.45 0.00 -0.23 0.00 -0.85 0.00 0.00 60.65 59.13 1urk h LYS 35 Cb 1.40 0.00 -0.13 0.00 -0.60 0.00 0.00 32.23 32.89 1urk h LYS 35 CO 0.48 0.00 0.29 0.36 -3.45 0.00 0.00 179.45 177.13 1urk n LYS 36 N -3.57 1.54 -4.02 1.90 -0.00 -1.26 -4.84 118.16 107.92 1urk n LYS 36 Ca 0.07 -1.31 -0.13 0.00 -0.00 0.00 0.00 58.31 56.94 1urk n LYS 36 Cb 0.63 -1.51 -0.14 0.00 -0.00 0.00 0.00 35.03 34.02 1urk n LYS 36 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 1urk s PHE 37 N -1.43 0.28 0.00 5.58 0.08 0.81 -3.94 117.98 119.35 1urk s PHE 37 Ca 0.25 -0.13 0.00 0.00 0.12 0.00 0.00 56.93 57.16 1urk s PHE 37 Cb 0.21 -0.18 0.00 0.00 -0.57 0.00 0.00 43.02 42.48 1urk s PHE 37 CO 0.05 -0.03 0.00 0.41 -0.10 0.00 0.00 175.22 175.55 1urk n GLY 38 N 2.73 1.69 1.09 4.36 0.00 -0.92 -4.82 105.19 109.33 1urk n GLY 38 Ca -0.15 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 44.99 1urk n GLY 38 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1urk n GLY 39 N 0.00 -2.09 4.47 -0.02 0.00 -1.26 0.12 105.19 106.40 1urk n GLY 39 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 1urk n GLY 39 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1urk n GLN 40 N 0.22 0.00 -1.47 1.61 -0.06 -1.26 0.69 117.38 117.10 1urk n GLN 40 Ca 0.00 0.00 -0.30 0.00 -2.00 0.00 0.00 57.00 54.70 1urk n GLN 40 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1urk n GLN 40 CO 0.00 0.00 0.00 0.72 -0.20 0.00 0.00 177.06 177.58 1urk n HIS 41 N 0.00 2.17 -4.20 3.69 8.25 -1.26 -4.79 115.22 119.08 1urk n HIS 41 Ca 0.00 -2.20 -0.29 0.00 -0.26 0.00 0.00 57.72 54.97 1urk n HIS 41 Cb 0.00 -1.27 -0.07 0.00 1.12 0.00 0.00 29.99 29.77 1urk n HIS 41 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1urk n GLU 43 N -4.53 2.89 -4.25 0.00 0.28 0.31 -2.37 120.64 112.97 1urk n GLU 43 Ca -0.32 -3.05 -0.14 0.00 -0.16 0.00 0.00 57.16 53.48 1urk n GLU 43 Cb 0.70 -2.19 -0.10 0.00 1.43 0.00 0.00 31.44 31.27 1urk n GLU 43 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 177.13 177.39 1urk s ILE 44 N -3.17 0.89 -0.59 3.84 -1.09 0.13 -4.92 121.20 116.28 1urk s ILE 44 Ca 0.56 -2.01 0.16 0.00 -2.23 0.00 0.00 60.65 57.13 1urk s ILE 44 Cb 0.46 -2.00 0.58 0.00 -1.58 0.00 0.00 42.46 39.92 1urk s ILE 44 CO 0.12 -0.60 1.49 -0.90 -1.23 0.00 0.00 174.94 173.82 1urk n ASP 45 N -0.23 4.20 0.00 3.58 5.68 -1.26 -2.17 116.55 126.35 1urk n ASP 45 Ca -0.08 -2.65 0.00 0.00 -0.50 0.00 0.00 54.79 51.56 1urk n ASP 45 Cb 0.62 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 1urk n ASP 45 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1urk n LYS 46 N 0.29 0.00 0.00 0.11 5.02 -1.25 -4.40 118.16 117.93 1urk n LYS 46 Ca 0.21 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1urk n LYS 46 Cb 0.84 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.85 1urk n LYS 46 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1urk n SER 47 N 1.68 0.00 -4.52 4.39 2.88 -1.26 -4.99 113.62 111.80 1urk n SER 47 Ca 0.00 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.27 1urk n SER 47 Cb 0.00 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.30 1urk n SER 47 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1urk n LYS 48 N -0.00 0.22 -3.34 -1.46 3.00 -1.26 -2.35 118.16 112.97 1urk n LYS 48 Ca 0.00 -0.15 -0.18 0.00 -0.00 0.00 0.00 58.31 57.98 1urk n LYS 48 Cb 0.00 -1.89 0.01 0.00 0.00 0.00 0.00 35.03 33.15 1urk n LYS 48 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1urk n THR 49 N 6.93 -6.93 -3.73 3.15 -2.24 -1.26 -4.80 114.28 105.41 1urk n THR 49 Ca 0.60 0.13 -0.06 0.00 -2.27 0.00 0.00 64.05 62.46 1urk n THR 49 Cb 0.21 -5.06 -0.02 0.00 -2.10 0.00 0.00 70.33 63.36 1urk n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1urk n TYR 51 N -0.43 -2.21 0.00 0.00 0.18 -1.26 -4.65 117.16 108.78 1urk n TYR 51 Ca -0.07 -2.14 0.00 0.00 1.88 0.00 0.00 57.90 57.57 1urk n TYR 51 Cb 0.61 -0.55 0.00 0.00 -0.38 0.00 0.00 39.34 39.02 1urk n TYR 51 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1urk n GLU 52 N -2.25 0.00 0.00 -3.48 1.02 -1.26 -4.93 120.64 109.74 1urk n GLU 52 Ca 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1urk n GLU 52 Cb 0.60 -0.40 0.00 0.00 -0.02 0.00 0.00 31.44 31.62 1urk n GLU 52 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1urk n GLY 53 N 2.40 4.85 0.21 0.62 0.00 -1.26 -5.00 105.19 107.02 1urk n GLY 53 Ca 0.00 -1.90 -0.02 0.00 0.00 0.00 0.00 46.02 44.10 1urk n GLY 53 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1urk h ASN 54 N 0.00 0.19 -0.53 1.61 -1.07 -1.98 -3.48 115.58 110.32 1urk h ASN 54 Ca 0.00 0.07 0.00 0.00 0.07 0.00 0.00 56.30 56.44 1urk h ASN 54 Cb 0.00 0.05 0.00 0.00 -2.07 0.00 0.00 38.32 36.30 1urk h ASN 54 CO 0.00 0.13 0.00 0.61 0.07 0.00 0.00 177.43 178.24 1urk n GLY 55 N -1.28 0.02 0.30 9.14 0.00 -1.26 -4.17 105.19 107.94 1urk n GLY 55 Ca 0.06 -0.59 -0.22 0.00 0.00 0.00 0.00 46.02 45.28 1urk n GLY 55 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1urk n HIS 56 N -0.05 0.00 -3.53 1.61 -0.00 -1.26 -4.65 115.22 107.34 1urk n HIS 56 Ca 0.00 0.00 -0.27 0.00 0.46 0.00 0.00 57.72 57.91 1urk n HIS 56 Cb 0.00 -0.77 -0.09 0.00 -0.12 0.00 0.00 29.99 29.01 1urk n HIS 56 CO 0.00 0.00 0.00 1.19 0.46 0.00 0.00 176.34 177.99 1urk n PHE 57 N -3.82 3.15 -0.12 1.57 3.72 -1.26 -4.79 117.46 115.91 1urk n PHE 57 Ca -0.41 -4.13 -0.16 0.00 -0.05 0.00 0.00 57.45 52.69 1urk n PHE 57 Cb 0.81 -0.54 -0.11 0.00 -0.94 0.00 0.00 39.48 38.71 1urk n PHE 57 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 176.76 177.69 1urk n TYR 58 N 1.22 0.00 -0.91 1.38 9.36 -1.26 -4.97 117.16 121.98 1urk n TYR 58 Ca 0.27 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.49 1urk n TYR 58 Cb 0.41 -0.88 0.00 0.00 -0.63 0.00 0.00 39.34 38.23 1urk n TYR 58 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1urk n ARG 59 N -3.21 -0.44 0.00 2.98 5.12 -1.26 -4.99 116.66 114.86 1urk n ARG 59 Ca -0.41 0.11 0.00 0.00 -1.93 0.00 0.00 57.85 55.62 1urk n ARG 59 Cb 0.93 -3.58 0.00 0.00 -1.16 0.00 0.00 32.46 28.65 1urk n ARG 59 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1urk n GLY 60 N -1.66 -1.84 0.00 -0.13 0.00 -1.26 -5.08 105.19 95.21 1urk n GLY 60 Ca 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1urk n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1urk n LYS 61 N -0.13 0.00 -4.35 1.61 4.76 -1.26 -4.85 118.16 113.94 1urk n LYS 61 Ca 0.00 0.00 -0.36 0.00 -2.87 0.00 0.00 58.31 55.08 1urk n LYS 61 Cb 0.00 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.12 1urk n LYS 61 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1urk n ALA 62 N -3.00 -1.52 0.96 7.82 0.00 -1.26 -4.64 120.51 118.87 1urk n ALA 62 Ca 0.00 -0.23 0.13 0.00 0.00 0.00 0.00 53.44 53.35 1urk n ALA 62 Cb 0.00 -2.16 0.49 0.00 0.00 0.00 0.00 19.45 17.78 1urk n ALA 62 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1urk n SER 63 N -2.67 0.21 -3.29 0.00 7.64 -1.26 -4.53 113.62 109.72 1urk n SER 63 Ca -0.06 0.29 -0.29 0.00 1.01 0.00 0.00 58.87 59.82 1urk n SER 63 Cb 0.55 -0.29 0.27 0.00 -1.01 0.00 0.00 64.21 63.73 1urk n SER 63 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1urk n THR 64 N -1.57 0.00 -1.75 0.44 -2.24 -1.25 -4.28 114.28 103.63 1urk n THR 64 Ca 0.06 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1urk n THR 64 Cb 0.35 -1.02 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 1urk n THR 64 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1urk n ASP 65 N -5.48 0.10 -0.77 3.42 5.75 -0.03 -4.20 116.55 115.34 1urk n ASP 65 Ca 0.14 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.94 1urk n ASP 65 Cb 0.57 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.77 1urk n ASP 65 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1urk n THR 66 N 0.00 0.64 0.00 2.12 -2.24 -1.24 -1.76 114.28 111.80 1urk n THR 66 Ca 0.00 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 1urk n THR 66 Cb 0.00 -0.32 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 1urk n THR 66 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1urk n MET 67 N 0.15 0.13 0.00 -0.78 2.81 -1.26 -4.82 117.12 113.34 1urk n MET 67 Ca 0.07 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.96 1urk n MET 67 Cb 0.43 -0.86 0.00 0.00 -0.71 0.00 0.00 33.22 32.08 1urk n MET 67 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1urk n GLY 68 N 2.92 1.71 3.42 3.03 0.00 -1.24 -5.12 105.19 109.92 1urk n GLY 68 Ca 0.00 -0.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 1urk n GLY 68 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1urk n ARG 69 N 0.00 0.31 0.00 1.61 1.74 -1.26 -4.44 116.66 114.62 1urk n ARG 69 Ca 0.00 0.14 0.10 0.00 -0.77 0.00 0.00 57.85 57.32 1urk n ARG 69 Cb 0.00 -1.67 0.61 0.00 -1.02 0.00 0.00 32.46 30.38 1urk n ARG 69 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1urk n PRO 70 N -0.16 0.68 -0.89 5.56 -0.04 -1.26 -0.85 135.00 138.05 1urk n PRO 70 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1urk n PRO 70 Cb 0.49 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 1urk n PRO 70 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1urk s LEU 72 N -4.21 4.26 0.22 0.00 1.43 -0.79 -4.89 118.68 114.70 1urk s LEU 72 Ca 0.00 2.15 -0.30 0.00 -1.03 0.00 0.00 54.13 54.96 1urk s LEU 72 Cb 0.00 -4.01 -0.09 0.00 0.03 0.00 0.00 46.19 42.13 1urk s LEU 72 CO 0.00 -0.44 1.17 -2.16 0.23 0.00 0.00 176.35 175.16 1urk s PRO 73 N -2.18 4.53 0.63 1.29 0.04 -1.26 -4.51 135.00 133.55 1urk s PRO 73 Ca 0.54 1.87 0.22 0.00 0.04 0.00 0.00 61.00 63.67 1urk s PRO 73 Cb -0.26 -3.22 1.05 0.00 0.04 0.00 0.00 34.50 32.11 1urk s PRO 73 CO 0.33 0.00 1.55 -1.49 0.04 0.00 0.00 177.00 177.43 1urk h TRP 74 N 4.69 0.00 -0.05 0.56 4.06 -0.87 0.41 115.95 124.75 1urk h TRP 74 Ca -0.45 0.00 -0.24 0.00 2.06 0.00 0.00 58.89 60.26 1urk h TRP 74 Cb 1.21 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 29.39 1urk h TRP 74 CO 0.61 0.00 -0.89 -2.95 -3.56 0.00 0.00 178.44 171.65 1urk h ASN 75 N 0.00 0.87 0.00 -3.49 -1.07 -1.69 -3.23 115.58 106.96 1urk h ASN 75 Ca 0.19 -0.71 -0.44 0.00 0.07 0.00 0.00 56.30 55.41 1urk h ASN 75 Cb 1.69 -0.26 -0.05 0.00 -2.07 0.00 0.00 38.32 37.63 1urk h ASN 75 CO -0.00 1.45 1.17 -0.24 0.07 0.00 0.00 177.43 179.88 1urk n SER 76 N -3.94 0.34 -0.35 6.14 2.88 0.14 -4.36 113.62 114.48 1urk n SER 76 Ca -0.10 0.27 0.28 0.00 -1.33 0.00 0.00 58.87 57.99 1urk n SER 76 Cb 0.81 -0.67 0.45 0.00 -0.75 0.00 0.00 64.21 64.05 1urk n SER 76 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1urk n ALA 77 N 6.88 0.96 0.43 -1.46 0.00 -1.26 0.31 120.51 126.38 1urk n ALA 77 Ca 0.45 0.50 -0.19 0.00 0.00 0.00 0.00 53.44 54.21 1urk n ALA 77 Cb 0.00 -0.68 -0.09 0.00 0.00 0.00 0.00 19.45 18.68 1urk n ALA 77 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1urk h THR 78 N 0.00 0.00 -0.65 0.00 2.02 -1.94 -0.95 112.91 111.39 1urk h THR 78 Ca 0.56 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.68 1urk h THR 78 Cb 1.97 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.35 1urk h THR 78 CO -0.19 0.00 0.19 1.62 0.37 0.00 0.00 175.52 177.50 1urk h VAL 79 N -1.17 1.25 -0.61 3.16 3.04 -0.43 -0.06 116.25 121.43 1urk h VAL 79 Ca -0.11 -0.89 0.18 0.00 -1.01 0.00 0.00 66.70 64.87 1urk h VAL 79 Cb 0.92 0.59 -0.02 0.00 -2.01 0.00 0.00 31.29 30.76 1urk h VAL 79 CO 0.14 0.34 0.68 -0.07 -1.01 0.00 0.00 177.57 177.66 1urk h LEU 80 N 0.95 0.00 0.20 3.16 3.38 -1.00 0.84 115.31 122.84 1urk h LEU 80 Ca 0.21 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.88 1urk h LEU 80 Cb 0.32 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.10 1urk h LEU 80 CO -0.00 0.00 -1.37 -0.61 0.09 0.00 0.00 178.44 176.55 1urk h GLN 81 N 0.00 0.43 0.00 1.13 4.15 0.40 -3.46 115.11 117.76 1urk h GLN 81 Ca 0.29 -0.73 0.00 0.00 0.77 0.00 0.00 58.65 58.98 1urk h GLN 81 Cb 1.66 0.27 0.00 0.00 0.21 0.00 0.00 27.48 29.62 1urk h GLN 81 CO -0.00 1.35 0.00 1.04 -1.93 0.00 0.00 178.83 179.29 1urk n GLN 82 N -3.81 2.43 0.00 1.69 1.13 0.29 -5.05 117.38 114.06 1urk n GLN 82 Ca -0.19 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.87 1urk n GLN 82 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.36 1urk n GLN 82 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1urk n THR 83 N 0.00 0.00 -1.52 5.09 -1.04 -1.26 -4.79 114.28 110.76 1urk n THR 83 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 1urk n THR 83 Cb 0.00 0.00 -0.13 0.00 -1.82 0.00 0.00 70.33 68.38 1urk n THR 83 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1urk n TYR 84 N 0.00 0.69 -1.25 -1.42 4.01 -1.26 -4.42 117.16 113.51 1urk n TYR 84 Ca 0.00 0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.91 1urk n TYR 84 Cb 0.00 -1.99 0.00 0.00 -0.31 0.00 0.00 39.34 37.04 1urk n TYR 84 CO 0.00 0.00 0.00 -2.39 -0.46 0.00 0.00 176.86 174.01 1urk n HIS 85 N 11.58 0.00 -1.07 -0.72 1.44 -1.26 -4.85 115.22 120.33 1urk n HIS 85 Ca 0.58 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.29 1urk n HIS 85 Cb 0.23 0.03 0.00 0.00 0.12 0.00 0.00 29.99 30.36 1urk n HIS 85 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1urk n ALA 86 N 0.00 0.00 -1.63 1.59 0.00 -1.26 -3.91 120.51 115.30 1urk n ALA 86 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1urk n ALA 86 Cb 0.38 -0.23 -0.02 0.00 0.00 0.00 0.00 19.45 19.58 1urk n ALA 86 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1urk n HIS 87 N -1.60 0.00 -2.99 0.00 8.25 -1.26 -4.86 115.22 112.76 1urk n HIS 87 Ca 0.00 -0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1urk n HIS 87 Cb 0.23 0.32 0.00 0.00 1.12 0.00 0.00 29.99 31.66 1urk n HIS 87 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1urk n ARG 88 N 0.00 2.84 -0.45 -0.41 1.85 -1.26 -5.02 116.66 114.21 1urk n ARG 88 Ca -0.09 0.00 0.11 0.00 -1.00 0.00 0.00 57.85 56.87 1urk n ARG 88 Cb 0.38 0.00 0.33 0.00 -1.05 0.00 0.00 32.46 32.12 1urk n ARG 88 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1urk n SER 89 N -0.69 4.12 0.00 2.89 7.64 -1.26 -4.14 113.62 122.18 1urk n SER 89 Ca 0.00 -2.16 0.00 0.00 1.01 0.00 0.00 58.87 57.72 1urk n SER 89 Cb 0.00 -0.51 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 1urk n SER 89 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1urk n ASP 90 N 1.40 0.35 0.01 6.43 9.92 -1.26 -4.73 116.55 128.67 1urk n ASP 90 Ca 0.24 -1.05 0.13 0.00 -0.53 0.00 0.00 54.79 53.58 1urk n ASP 90 Cb 0.70 0.00 0.58 0.00 -0.64 0.00 0.00 41.12 41.76 1urk n ASP 90 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1urk n ALA 91 N -0.03 2.26 0.67 2.24 0.00 -1.26 -2.81 120.51 121.58 1urk n ALA 91 Ca 0.00 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.48 1urk n ALA 91 Cb 0.22 -1.45 0.31 0.00 0.00 0.00 0.00 19.45 18.54 1urk n ALA 91 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1urk n LEU 92 N -1.55 0.66 0.05 0.00 -0.00 -1.26 0.61 117.00 115.50 1urk n LEU 92 Ca 0.07 0.37 -0.02 0.00 -0.00 0.00 0.00 56.01 56.43 1urk n LEU 92 Cb 0.33 -0.27 -0.07 0.00 -0.00 0.00 0.00 43.42 43.40 1urk n LEU 92 CO 0.26 -0.08 -0.07 -0.61 -0.00 0.00 0.00 177.39 176.88 1urk h GLN 93 N 0.00 0.00 -0.00 1.47 4.15 -1.87 -3.32 115.11 115.54 1urk h GLN 93 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1urk h GLN 93 Cb 0.70 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.39 1urk h GLN 93 CO 0.00 0.49 -0.41 1.28 -1.93 0.00 0.00 178.83 178.26 1urk n LEU 94 N -3.07 0.81 -3.00 -2.39 7.99 -1.21 -5.07 117.00 111.06 1urk n LEU 94 Ca -0.06 -0.60 -0.01 0.00 -0.01 0.00 0.00 56.01 55.33 1urk n LEU 94 Cb 0.87 0.00 -0.01 0.00 -0.11 0.00 0.00 43.42 44.17 1urk n LEU 94 CO 0.43 0.18 -0.29 0.61 -1.51 0.00 0.00 177.39 176.81 1urk n GLY 95 N 1.14 -1.25 0.00 -0.72 0.00 0.20 -5.00 105.19 99.57 1urk n GLY 95 Ca 0.03 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.39 1urk n GLY 95 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1urk n LEU 96 N 1.90 0.00 0.00 0.99 4.32 -1.22 -5.04 117.00 117.95 1urk n LEU 96 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.92 1urk n LEU 96 Cb 0.25 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.05 1urk n LEU 96 CO 0.11 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.89 1urk n GLY 97 N 4.02 0.69 2.72 -0.72 0.00 -1.26 -4.84 105.19 105.80 1urk n GLY 97 Ca 0.00 -2.08 -0.38 0.00 0.00 0.00 0.00 46.02 43.57 1urk n GLY 97 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1urk n LYS 98 N 0.00 4.71 -1.34 1.61 4.81 -1.26 -3.99 118.16 122.70 1urk n LYS 98 Ca 0.00 -4.58 0.00 0.00 -0.87 0.00 0.00 58.31 52.86 1urk n LYS 98 Cb 0.00 -2.40 0.00 0.00 0.02 0.00 0.00 35.03 32.65 1urk n LYS 98 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1urk n HIS 99 N -0.16 0.00 -2.54 5.64 1.44 -1.26 -4.84 115.22 113.50 1urk n HIS 99 Ca 0.45 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 56.13 1urk n HIS 99 Cb 0.29 0.00 0.05 0.00 0.12 0.00 0.00 29.99 30.45 1urk n HIS 99 CO 0.00 0.00 0.00 0.27 -2.81 0.00 0.00 176.34 173.80 1urk n ASN 100 N -1.73 2.04 -4.78 4.39 0.23 -1.26 -0.27 115.26 113.88 1urk n ASN 100 Ca 0.00 -2.45 -0.32 0.00 -0.53 0.00 0.00 54.58 51.28 1urk n ASN 100 Cb 0.00 -0.42 0.05 0.00 -2.08 0.00 0.00 39.78 37.33 1urk n ASN 100 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 1urk s TYR 101 N -2.92 2.73 -0.61 -2.53 1.51 -1.26 -4.75 117.35 109.51 1urk s TYR 101 Ca 0.33 1.53 -0.23 0.00 -1.01 0.00 0.00 57.07 57.70 1urk s TYR 101 Cb 0.35 -3.09 0.06 0.00 -0.11 0.00 0.00 41.96 39.18 1urk s TYR 101 CO -0.06 -1.55 0.94 0.00 -1.11 0.00 0.00 175.55 173.77 1urk s ARG 103 N 3.95 2.71 -0.46 0.00 1.81 -1.23 -4.63 118.95 121.10 1urk s ARG 103 Ca 0.25 -1.36 0.09 0.00 -1.72 0.00 0.00 55.73 52.98 1urk s ARG 103 Cb -0.15 -2.60 0.32 0.00 -0.45 0.00 0.00 34.95 32.07 1urk s ARG 103 CO 0.13 -0.23 0.77 -1.71 -0.68 0.00 0.00 175.30 173.58 1urk n ASN 104 N -1.72 2.14 0.00 0.23 4.05 -1.26 -1.80 115.26 116.91 1urk n ASN 104 Ca 0.06 -3.22 0.06 0.00 0.45 0.00 0.00 54.58 51.93 1urk n ASN 104 Cb 0.60 -0.61 0.35 0.00 1.23 0.00 0.00 39.78 41.36 1urk n ASN 104 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 177.26 173.40 1urk n PRO 105 N 0.33 0.69 -0.11 1.20 -0.04 -1.26 -2.68 135.00 133.13 1urk n PRO 105 Ca 0.27 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.82 1urk n PRO 105 Cb 0.54 -1.27 0.14 0.00 -0.04 0.00 0.00 33.50 32.87 1urk n PRO 105 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1urk n ASP 106 N -0.77 2.24 0.00 3.54 2.03 -1.26 -5.03 116.55 117.30 1urk n ASP 106 Ca 0.09 -3.08 0.00 0.00 0.52 0.00 0.00 54.79 52.32 1urk n ASP 106 Cb 0.04 -0.43 0.00 0.00 -0.72 0.00 0.00 41.12 40.02 1urk n ASP 106 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 1urk n ASN 107 N -1.37 0.00 -0.03 1.67 4.05 -1.09 -4.94 115.26 113.54 1urk n ASN 107 Ca 0.16 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.19 1urk n ASN 107 Cb 0.65 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.66 1urk n ASN 107 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1urk n ARG 108 N 0.00 0.00 0.00 1.20 1.74 -1.26 -4.48 116.66 113.85 1urk n ARG 108 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1urk n ARG 108 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1urk n ARG 108 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1urk n ARG 109 N -0.07 5.65 -3.78 5.56 1.74 -1.26 -5.03 116.66 119.47 1urk n ARG 109 Ca 0.00 -0.07 -0.13 0.00 -0.77 0.00 0.00 57.85 56.88 1urk n ARG 109 Cb 0.00 -0.56 -0.11 0.00 -1.02 0.00 0.00 32.46 30.77 1urk n ARG 109 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1urk s ARG 110 N -0.83 0.32 0.34 5.56 3.52 -1.26 -4.63 118.95 121.97 1urk s ARG 110 Ca 0.00 0.35 -0.26 0.00 -0.13 0.00 0.00 55.73 55.68 1urk s ARG 110 Cb 0.00 0.15 -0.13 0.00 -1.56 0.00 0.00 34.95 33.41 1urk s ARG 110 CO 0.00 -0.04 0.95 -2.30 -0.81 0.00 0.00 175.30 173.10 1urk n PRO 111 N 2.89 1.24 -3.88 5.12 -0.02 -1.26 -4.75 135.00 134.34 1urk n PRO 111 Ca -0.13 0.44 -0.10 0.00 -2.02 0.00 0.00 63.50 61.69 1urk n PRO 111 Cb 0.58 -1.85 -0.09 0.00 -0.02 0.00 0.00 33.50 32.12 1urk n PRO 111 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 1urk s TRP 112 N -1.17 0.11 0.02 6.00 1.48 -0.74 0.28 118.94 124.92 1urk s TRP 112 Ca 0.60 -0.34 -0.00 0.00 -1.06 0.00 0.00 56.10 55.30 1urk s TRP 112 Cb -0.65 -0.08 -0.02 0.00 -1.16 0.00 0.00 33.47 31.56 1urk s TRP 112 CO 0.59 -0.38 -0.03 0.00 -4.06 0.00 0.00 176.95 173.07 1urk s TYR 114 N -1.76 1.50 -0.19 0.00 1.51 -1.26 -1.67 117.35 115.48 1urk s TYR 114 Ca -0.13 1.32 -0.12 0.00 -1.01 0.00 0.00 57.07 57.13 1urk s TYR 114 Cb -0.08 -3.73 -0.05 0.00 -0.11 0.00 0.00 41.96 38.00 1urk s TYR 114 CO -0.02 -1.51 0.23 0.54 -1.11 0.00 0.00 175.55 173.67 1urk s VAL 115 N 12.73 5.34 -0.23 0.71 0.11 -0.28 -1.89 120.40 136.89 1urk s VAL 115 Ca 0.80 0.39 -0.40 0.00 -2.93 0.00 0.00 61.98 59.83 1urk s VAL 115 Cb -0.08 -3.56 -0.16 0.00 -1.53 0.00 0.00 36.38 31.04 1urk s VAL 115 CO 0.06 0.39 1.65 0.00 -3.33 0.00 0.00 175.10 173.87 1urk n GLN 116 N 3.68 1.03 -0.79 1.54 6.02 -1.26 -0.94 117.38 126.66 1urk n GLN 116 Ca -0.13 0.38 -0.01 0.00 -0.01 0.00 0.00 57.00 57.22 1urk n GLN 116 Cb 0.52 -2.03 0.28 0.00 1.02 0.00 0.00 30.24 30.02 1urk n GLN 116 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 1urk n VAL 117 N 4.13 2.37 0.00 5.09 3.14 -0.61 -4.79 118.33 127.66 1urk n VAL 117 Ca 0.25 -1.23 0.00 0.00 -2.96 0.00 0.00 64.34 60.40 1urk n VAL 117 Cb 0.12 -0.39 0.00 0.00 -1.06 0.00 0.00 33.84 32.51 1urk n VAL 117 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1urk n GLY 118 N 0.14 2.05 0.00 7.55 0.00 -1.26 -4.68 105.19 108.99 1urk n GLY 118 Ca 0.29 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1urk n GLY 118 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1urk n LEU 119 N 0.00 0.00 -3.76 0.99 -0.00 -1.26 -5.10 117.00 107.87 1urk n LEU 119 Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.89 1urk n LEU 119 Cb 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 43.42 43.30 1urk n LEU 119 CO 0.00 0.00 -0.10 -1.59 -0.00 0.00 0.00 177.39 175.70 1urk s LYS 120 N -0.28 0.25 -0.71 1.47 -2.85 -1.26 -5.07 119.74 111.29 1urk s LYS 120 Ca 0.00 0.44 -0.25 0.00 -1.00 0.00 0.00 55.97 55.16 1urk s LYS 120 Cb 0.00 0.01 -0.14 0.00 -2.06 0.00 0.00 37.83 35.65 1urk s LYS 120 CO 0.00 -0.10 2.43 -2.30 0.10 0.00 0.00 175.35 175.49 1urk n PRO 121 N 3.57 0.64 -3.47 1.78 -0.02 -1.26 -1.57 135.00 134.67 1urk n PRO 121 Ca -0.19 -0.27 -0.37 0.00 -2.02 0.00 0.00 63.50 60.65 1urk n PRO 121 Cb 0.56 -3.02 -0.07 0.00 -0.02 0.00 0.00 33.50 30.95 1urk n PRO 121 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1urk s LEU 122 N 11.44 4.27 -0.04 2.45 1.98 -0.11 -4.56 118.68 134.11 1urk s LEU 122 Ca 1.05 0.64 -0.30 0.00 -2.89 0.00 0.00 54.13 52.63 1urk s LEU 122 Cb -0.38 -2.49 -0.06 0.00 0.66 0.00 0.00 46.19 43.93 1urk s LEU 122 CO 0.27 0.09 1.60 0.68 -1.89 0.00 0.00 176.35 177.10 1urk s VAL 123 N 0.37 3.58 -0.09 1.68 -7.23 -1.25 -1.13 120.40 116.34 1urk s VAL 123 Ca 0.20 0.77 0.03 0.00 -1.81 0.00 0.00 61.98 61.17 1urk s VAL 123 Cb -0.14 -3.50 -0.02 0.00 0.56 0.00 0.00 36.38 33.28 1urk s VAL 123 CO 0.07 -0.06 -0.16 -1.10 -0.31 0.00 0.00 175.10 173.54 1urk s GLN 124 N 3.70 2.90 -0.78 4.82 1.11 -0.67 -4.79 119.66 125.95 1urk s GLN 124 Ca 0.71 -0.74 -0.26 0.00 0.01 0.00 0.00 55.36 55.09 1urk s GLN 124 Cb -0.33 -2.44 -0.09 0.00 -1.01 0.00 0.00 33.01 29.14 1urk s GLN 124 CO 0.29 0.39 2.23 -1.21 0.01 0.00 0.00 175.29 176.99 1urk s GLU 125 N -0.13 2.01 -0.10 2.91 2.02 -1.26 -2.30 118.70 121.86 1urk s GLU 125 Ca -0.02 0.37 -0.41 0.00 0.02 0.00 0.00 54.97 54.92 1urk s GLU 125 Cb -0.14 -4.82 -0.20 0.00 0.10 0.00 0.00 34.13 29.08 1urk s GLU 125 CO 0.04 -3.88 1.20 0.00 0.02 0.00 0.00 175.26 172.63 1urk s MET 127 N 0.67 4.38 -0.28 0.00 0.23 -0.73 -4.69 119.30 118.89 1urk s MET 127 Ca 0.94 0.86 0.21 0.00 -1.03 0.00 0.00 55.69 56.67 1urk s MET 127 Cb -1.30 -3.49 0.49 0.00 -1.53 0.00 0.00 34.83 29.00 1urk s MET 127 CO 0.62 -0.06 1.17 0.28 -2.03 0.00 0.00 175.02 175.00 1urk n VAL 128 N 4.10 1.05 -3.31 5.16 0.31 -1.26 -4.91 118.33 119.46 1urk n VAL 128 Ca -0.00 -2.63 -0.09 0.00 -0.01 0.00 0.00 64.34 61.60 1urk n VAL 128 Cb 0.51 1.22 0.02 0.00 -0.91 0.00 0.00 33.84 34.67 1urk n VAL 128 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1urk n HIS 129 N -0.70 -1.97 -3.86 3.52 -0.00 -1.26 -4.63 115.22 106.32 1urk n HIS 129 Ca 0.03 -0.92 -0.35 0.00 -0.00 0.00 0.00 57.72 56.49 1urk n HIS 129 Cb 0.81 -0.21 0.02 0.00 -0.00 0.00 0.00 29.99 30.61 1urk n HIS 129 CO 0.00 0.00 0.00 -0.25 -0.00 0.00 0.00 176.34 176.09 1urk n ASP 130 N -2.36 -4.79 -4.23 0.26 9.92 -1.26 -4.83 116.55 109.26 1urk n ASP 130 Ca 0.03 -1.08 -0.34 0.00 -0.53 0.00 0.00 54.79 52.87 1urk n ASP 130 Cb 0.25 -2.19 0.11 0.00 -0.64 0.00 0.00 41.12 38.66 1urk n ASP 130 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1urk n ALA 132 N -3.73 1.91 -3.79 0.00 0.00 -1.26 -4.95 120.51 108.68 1urk n ALA 132 Ca 0.01 -2.23 -0.28 0.00 0.00 0.00 0.00 53.44 50.95 1urk n ALA 132 Cb 0.61 -0.99 0.05 0.00 0.00 0.00 0.00 19.45 19.12 1urk n ALA 132 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1urk n ASP 133 N -0.19 -5.13 0.00 0.00 9.92 -1.26 -3.34 116.55 116.54 1urk n ASP 133 Ca 0.06 -0.70 0.00 0.00 -0.53 0.00 0.00 54.79 53.62 1urk n ASP 133 Cb 0.80 -4.30 0.00 0.00 -0.64 0.00 0.00 41.12 36.98 1urk n ASP 133 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1urk n GLY 134 N -1.79 1.79 0.45 0.44 0.00 -1.26 -5.13 105.19 99.69 1urk n GLY 134 Ca 0.01 -0.48 0.06 0.00 0.00 0.00 0.00 46.02 45.61 1urk n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60