#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 1.52 0.04 5.09 0.31 -1.26 -4.08 118.33 119.95 1urk n VAL 7 Ca 0.00 -0.13 -0.03 0.00 -0.01 0.00 0.00 64.34 64.17 1urk n VAL 7 Cb 0.00 -2.02 -0.02 0.00 -0.91 0.00 0.00 33.84 30.89 1urk n VAL 7 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1urk h PRO 8 N -1.00 -0.16 -3.57 5.55 0.11 -2.06 -3.32 132.00 127.54 1urk h PRO 8 Ca -0.44 0.01 -0.75 0.00 0.11 0.00 0.00 66.00 64.93 1urk h PRO 8 Cb 1.35 0.04 -0.31 0.00 0.11 0.00 0.00 31.00 32.19 1urk h PRO 8 CO -0.27 -0.11 0.04 -1.12 -0.21 0.00 0.00 178.00 176.34 1urk s SER 9 N -2.74 6.39 0.00 -2.05 0.01 -1.26 -4.90 113.70 109.15 1urk s SER 9 Ca -0.03 -3.23 0.00 0.00 1.31 0.00 0.00 55.95 53.99 1urk s SER 9 Cb 0.01 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.18 1urk s SER 9 CO 0.11 -0.35 0.00 0.59 0.41 0.00 0.00 173.24 174.00 1urk n ASN 10 N 3.11 0.00 0.00 2.44 3.02 -1.25 -4.91 115.26 117.66 1urk n ASN 10 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 1urk n ASN 10 Cb 0.40 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.57 1urk n ASN 10 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1urk n ASP 12 N -0.01 -2.25 -4.18 0.00 2.03 -1.26 -4.63 116.55 106.24 1urk n ASP 12 Ca 0.00 -0.05 -0.35 0.00 0.52 0.00 0.00 54.79 54.91 1urk n ASP 12 Cb 0.00 -1.00 0.07 0.00 -0.72 0.00 0.00 41.12 39.47 1urk n ASP 12 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1urk s LEU 14 N 4.18 2.70 -1.54 0.00 1.43 0.28 -3.39 118.68 122.34 1urk s LEU 14 Ca 0.48 0.47 0.00 0.00 -1.03 0.00 0.00 54.13 54.05 1urk s LEU 14 Cb -0.21 -2.91 0.00 0.00 0.03 0.00 0.00 46.19 43.10 1urk s LEU 14 CO 0.75 -1.97 0.00 0.59 0.23 0.00 0.00 176.35 175.96 1urk n ASN 15 N -3.23 -5.02 -2.40 2.29 4.13 -1.26 -1.73 115.26 108.03 1urk n ASN 15 Ca 0.10 0.09 -0.18 0.00 1.68 0.00 0.00 54.58 56.26 1urk n ASN 15 Cb 0.60 -4.10 0.02 0.00 -1.54 0.00 0.00 39.78 34.77 1urk n ASN 15 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1urk n GLY 16 N -0.99 -0.33 3.02 7.41 0.00 -1.26 -4.95 105.19 108.10 1urk n GLY 16 Ca -0.19 -0.06 -0.20 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.30 -2.36 3.96 -0.02 0.00 -0.71 -4.98 105.19 99.80 1urk n GLY 17 Ca -0.12 -0.63 -0.19 0.00 0.00 0.00 0.00 46.02 45.08 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 -2.08 3.75 -0.03 2.61 2.01 -0.88 -4.76 115.64 116.27 1urk s THR 18 Ca 0.35 -1.08 0.01 0.00 0.31 0.00 0.00 61.69 61.28 1urk s THR 18 Cb -0.04 -3.29 0.01 0.00 0.01 0.00 0.00 72.50 69.19 1urk s THR 18 CO 0.38 -0.13 -0.04 0.00 -0.69 0.00 0.00 174.62 174.14 1urk n VAL 20 N 3.66 0.00 -3.64 0.00 0.24 -1.15 -4.88 118.33 112.56 1urk n VAL 20 Ca -0.21 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.06 1urk n VAL 20 Cb 0.53 -0.30 -0.07 0.00 -1.47 0.00 0.00 33.84 32.54 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 -0.43 -0.55 0.31 -1.34 1.04 -1.26 -4.47 113.70 107.00 1urk s SER 21 Ca 0.00 0.88 -0.25 0.00 0.48 0.00 0.00 55.95 57.05 1urk s SER 21 Cb 0.00 1.24 -0.15 0.00 0.10 0.00 0.00 66.02 67.20 1urk s SER 21 CO 0.00 -0.14 0.54 -3.20 0.98 0.00 0.00 173.24 171.42 1urk n ASN 22 N 3.79 -0.97 0.00 7.02 5.15 -0.01 -4.86 115.26 125.38 1urk n ASN 22 Ca -0.19 1.03 0.00 0.00 -0.60 0.00 0.00 54.58 54.82 1urk n ASN 22 Cb 0.58 -1.04 0.00 0.00 -0.53 0.00 0.00 39.78 38.79 1urk n ASN 22 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 1urk n LYS 23 N 0.91 0.00 0.00 1.20 4.81 -1.26 -4.85 118.16 118.96 1urk n LYS 23 Ca 0.14 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.68 1urk n LYS 23 Cb 0.32 -0.43 0.04 0.00 0.02 0.00 0.00 35.03 34.98 1urk n LYS 23 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1urk n TYR 24 N -1.29 0.00 -0.84 5.64 4.02 -1.26 -4.95 117.16 118.48 1urk n TYR 24 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1urk n TYR 24 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1urk n TYR 24 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1urk n PHE 25 N 0.55 0.00 0.03 -0.72 3.72 -1.26 -5.10 117.46 114.68 1urk n PHE 25 Ca 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.50 1urk n PHE 25 Cb 0.49 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.03 1urk n PHE 25 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1urk n SER 26 N 0.00 0.72 -3.48 4.37 3.41 -1.26 -4.96 113.62 112.41 1urk n SER 26 Ca 0.00 0.09 -0.27 0.00 -0.26 0.00 0.00 58.87 58.43 1urk n SER 26 Cb 0.00 -0.22 -0.10 0.00 -0.26 0.00 0.00 64.21 63.63 1urk n SER 26 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1urk s ASN 27 N -5.64 2.03 -0.38 4.04 3.04 -1.26 -4.99 114.94 111.79 1urk s ASN 27 Ca 0.00 -3.17 0.01 0.00 0.04 0.00 0.00 52.86 49.74 1urk s ASN 27 Cb 0.00 -0.63 0.14 0.00 -1.54 0.00 0.00 41.25 39.22 1urk s ASN 27 CO 0.00 -0.16 0.22 -0.63 -3.04 0.00 0.00 177.10 173.49 1urk s ILE 28 N -0.16 0.49 0.05 -5.21 -1.09 -1.26 -5.05 121.20 108.98 1urk s ILE 28 Ca 0.31 -1.98 0.07 0.00 -2.23 0.00 0.00 60.65 56.83 1urk s ILE 28 Cb 0.01 -1.36 -0.03 0.00 -1.58 0.00 0.00 42.46 39.50 1urk s ILE 28 CO -0.19 -0.97 -0.19 -1.38 -1.23 0.00 0.00 174.94 170.99 1urk s HIS 29 N 0.84 2.54 0.18 3.97 -3.43 -1.26 -0.83 115.29 117.30 1urk s HIS 29 Ca 0.18 -0.27 -0.24 0.00 -0.80 0.00 0.00 55.06 53.94 1urk s HIS 29 Cb -0.22 -1.44 0.06 0.00 -1.43 0.00 0.00 32.58 29.54 1urk s HIS 29 CO -0.00 0.27 0.93 1.67 -2.00 0.00 0.00 174.74 175.60 1urk s TRP 30 N -0.95 -0.12 0.00 0.38 -2.14 -1.26 -4.97 118.94 109.87 1urk s TRP 30 Ca 0.15 -0.22 -0.04 0.00 2.66 0.00 0.00 56.10 58.65 1urk s TRP 30 Cb -0.10 0.66 -0.04 0.00 -3.10 0.00 0.00 33.47 30.88 1urk s TRP 30 CO 0.06 -0.91 0.22 0.00 -2.66 0.00 0.00 176.95 173.65 1urk s ASN 32 N -1.87 5.04 0.26 0.00 2.47 -0.48 -4.91 114.94 115.46 1urk s ASN 32 Ca 0.28 -3.27 0.09 0.00 0.42 0.00 0.00 52.86 50.38 1urk s ASN 32 Cb -0.13 -1.76 -0.04 0.00 -1.45 0.00 0.00 41.25 37.87 1urk s ASN 32 CO 0.18 -0.24 0.06 0.00 -3.72 0.00 0.00 177.10 173.38 1urk n PRO 34 N -0.99 0.34 0.04 0.00 -0.02 -1.26 -4.77 135.00 128.33 1urk n PRO 34 Ca -0.07 0.14 0.05 0.00 -2.02 0.00 0.00 63.50 61.60 1urk n PRO 34 Cb 0.59 -1.69 0.22 0.00 -0.02 0.00 0.00 33.50 32.60 1urk n PRO 34 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1urk n LYS 35 N -0.19 0.04 -0.23 -0.52 4.01 -1.26 -0.95 118.16 119.07 1urk n LYS 35 Ca 0.10 0.47 0.03 0.00 -0.51 0.00 0.00 58.31 58.40 1urk n LYS 35 Cb 0.49 -1.62 0.13 0.00 -0.51 0.00 0.00 35.03 33.52 1urk n LYS 35 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1urk n LYS 36 N -1.71 2.00 -4.11 1.97 4.76 -1.26 -4.48 118.16 115.33 1urk n LYS 36 Ca 0.01 -1.04 -0.13 0.00 -2.87 0.00 0.00 58.31 54.28 1urk n LYS 36 Cb 0.06 -1.49 -0.11 0.00 -1.84 0.00 0.00 35.03 31.65 1urk n LYS 36 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1urk s PHE 37 N -1.64 0.80 0.00 2.13 0.08 -0.13 -0.84 117.98 118.38 1urk s PHE 37 Ca 0.19 -0.61 0.00 0.00 0.12 0.00 0.00 56.93 56.62 1urk s PHE 37 Cb 0.12 -0.47 0.00 0.00 -0.57 0.00 0.00 43.02 42.10 1urk s PHE 37 CO 0.09 -0.08 0.00 0.41 -0.10 0.00 0.00 175.22 175.54 1urk n GLY 38 N 1.00 0.54 0.10 4.36 0.00 -0.60 -4.77 105.19 105.81 1urk n GLY 38 Ca -0.19 -0.84 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 -0.11 0.11 5.87 -0.02 0.00 -1.26 0.68 105.19 110.46 1urk n GLY 39 Ca 0.00 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.19 1urk n GLY 39 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1urk n GLN 40 N 1.28 0.00 -1.10 1.61 6.02 -1.26 0.08 117.38 124.01 1urk n GLN 40 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.74 1urk n GLN 40 Cb 0.00 0.00 0.06 0.00 1.02 0.00 0.00 30.24 31.32 1urk n GLN 40 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1urk n HIS 41 N 0.00 2.35 -4.22 1.08 8.25 -1.26 -4.73 115.22 116.69 1urk n HIS 41 Ca 0.00 -2.44 -0.34 0.00 -0.26 0.00 0.00 57.72 54.68 1urk n HIS 41 Cb 0.00 -1.18 -0.04 0.00 1.12 0.00 0.00 29.99 29.89 1urk n HIS 41 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1urk h GLU 43 N -1.54 0.00 -6.24 0.00 4.11 -0.84 -2.57 114.58 107.50 1urk h GLU 43 Ca -0.61 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 58.19 1urk h GLU 43 Cb 1.38 0.00 0.12 0.00 0.50 0.00 0.00 28.75 30.75 1urk h GLU 43 CO 0.75 0.98 -0.25 -0.89 0.07 0.00 0.00 179.01 179.67 1urk n ILE 44 N -4.56 1.92 -3.51 -1.06 5.41 0.21 -4.61 119.36 113.16 1urk n ILE 44 Ca -0.16 -0.50 -0.41 0.00 1.00 0.00 0.00 62.75 62.68 1urk n ILE 44 Cb 0.53 -0.49 -0.05 0.00 -0.71 0.00 0.00 39.64 38.92 1urk n ILE 44 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 1urk s ASP 45 N -0.81 6.28 1.00 4.38 1.11 -1.26 -1.56 116.67 125.82 1urk s ASP 45 Ca 0.61 -3.17 -0.00 0.00 0.18 0.00 0.00 52.55 50.17 1urk s ASP 45 Cb -0.78 -2.04 0.00 0.00 1.07 0.00 0.00 42.92 41.17 1urk s ASP 45 CO 0.58 -0.37 0.01 0.29 1.18 0.00 0.00 175.17 176.87 1urk n LYS 46 N 3.18 -1.05 -3.20 8.23 5.02 -0.02 -4.89 118.16 125.42 1urk n LYS 46 Ca 0.16 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.44 1urk n LYS 46 Cb 0.41 -0.02 -0.03 0.00 -0.02 0.00 0.00 35.03 35.37 1urk n LYS 46 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1urk s SER 47 N -1.55 -0.98 -0.67 4.39 1.04 -1.26 -4.57 113.70 110.10 1urk s SER 47 Ca 0.01 0.50 -0.23 0.00 0.48 0.00 0.00 55.95 56.71 1urk s SER 47 Cb -0.00 1.85 0.07 0.00 0.10 0.00 0.00 66.02 68.04 1urk s SER 47 CO 0.01 -0.28 1.01 -0.75 0.98 0.00 0.00 173.24 174.20 1urk s LYS 48 N 2.77 3.13 -0.43 4.02 2.36 -1.26 -4.99 119.74 125.33 1urk s LYS 48 Ca 0.16 -0.77 -0.21 0.00 -2.55 0.00 0.00 55.97 52.59 1urk s LYS 48 Cb -0.14 -4.23 0.02 0.00 -1.05 0.00 0.00 37.83 32.43 1urk s LYS 48 CO -0.22 -1.86 0.69 0.99 1.55 0.00 0.00 175.35 176.50 1urk s THR 49 N 4.25 4.78 0.30 3.43 2.01 -1.26 -4.79 115.64 124.36 1urk s THR 49 Ca 0.24 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.53 1urk s THR 49 Cb -0.16 -4.23 0.00 0.00 0.01 0.00 0.00 72.50 68.13 1urk s THR 49 CO 0.10 -0.59 0.00 0.00 -0.69 0.00 0.00 174.62 173.44 1urk n TYR 51 N 0.83 1.87 -2.80 0.00 4.11 -1.26 -4.83 117.16 115.08 1urk n TYR 51 Ca 0.00 0.51 -0.42 0.00 -0.00 0.00 0.00 57.90 57.99 1urk n TYR 51 Cb 0.00 -2.46 0.01 0.00 -0.00 0.00 0.00 39.34 36.89 1urk n TYR 51 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.86 177.25 1urk n GLU 52 N 6.19 4.54 0.00 -3.48 1.02 -1.26 -4.92 120.64 122.73 1urk n GLU 52 Ca 0.33 -4.38 0.00 0.00 -0.02 0.00 0.00 57.16 53.09 1urk n GLU 52 Cb 0.13 -2.57 0.00 0.00 -0.02 0.00 0.00 31.44 28.98 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 1.31 0.60 3.13 0.62 0.00 -1.26 -4.99 105.19 104.59 1urk n GLY 53 Ca 0.33 -1.53 -0.37 0.00 0.00 0.00 0.00 46.02 44.45 1urk n GLY 53 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1urk s ASN 54 N -4.00 5.35 0.25 1.61 2.47 -1.03 -4.50 114.94 115.09 1urk s ASN 54 Ca 0.00 -2.38 -0.03 0.00 0.42 0.00 0.00 52.86 50.87 1urk s ASN 54 Cb 0.00 -1.87 0.31 0.00 -1.45 0.00 0.00 41.25 38.24 1urk s ASN 54 CO 0.00 -0.49 1.79 1.23 -3.72 0.00 0.00 177.10 175.91 1urk h GLY 55 N 7.67 0.99 -0.28 1.21 0.00 -1.94 -3.46 103.07 107.26 1urk h GLY 55 Ca -0.09 -0.59 -0.12 0.00 0.00 0.00 0.00 47.33 46.53 1urk h GLY 55 CO 0.73 0.55 -0.11 1.57 0.00 0.00 0.00 176.54 179.28 1urk n HIS 56 N -4.26 0.00 0.00 5.60 -0.00 -1.26 -4.71 115.22 110.59 1urk n HIS 56 Ca 0.04 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.22 1urk n HIS 56 Cb 0.24 -1.99 0.00 0.00 -0.12 0.00 0.00 29.99 28.12 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 -2.35 0.00 0.00 1.57 3.72 -1.26 -4.83 117.46 114.31 1urk n PHE 57 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1urk n PHE 57 Cb 0.43 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.97 1urk n PHE 57 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1urk n TYR 58 N 0.00 0.00 -2.85 1.38 4.02 -1.26 -4.73 117.16 113.72 1urk n TYR 58 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.78 1urk n TYR 58 Cb 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.38 1urk n TYR 58 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1urk n ARG 59 N 0.00 -2.85 0.00 -0.72 3.00 -1.26 -4.98 116.66 109.86 1urk n ARG 59 Ca 0.00 0.61 0.00 0.00 -0.01 0.00 0.00 57.85 58.45 1urk n ARG 59 Cb 0.00 -4.70 0.00 0.00 0.00 0.00 0.00 32.46 27.76 1urk n ARG 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1urk n GLY 60 N -1.22 0.03 0.00 -0.13 0.00 -1.26 -5.17 105.19 97.44 1urk n GLY 60 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1urk n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1urk n LYS 61 N -1.84 0.00 -3.34 1.61 4.81 -1.26 -5.03 118.16 113.10 1urk n LYS 61 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 1urk n LYS 61 Cb 0.00 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.08 1urk n LYS 61 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1urk n ALA 62 N -3.00 -2.48 -0.92 3.14 0.00 -1.26 -4.91 120.51 111.08 1urk n ALA 62 Ca 0.00 0.55 0.03 0.00 0.00 0.00 0.00 53.44 54.02 1urk n ALA 62 Cb 0.00 -2.64 0.04 0.00 0.00 0.00 0.00 19.45 16.84 1urk n ALA 62 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1urk n SER 63 N -0.22 1.21 -2.46 0.00 3.41 -1.26 -4.87 113.62 109.43 1urk n SER 63 Ca -0.04 -2.05 -0.05 0.00 -0.26 0.00 0.00 58.87 56.47 1urk n SER 63 Cb 0.63 -0.15 0.04 0.00 -0.26 0.00 0.00 64.21 64.47 1urk n SER 63 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1urk n THR 64 N -0.52 0.00 -1.65 6.66 -2.24 -1.26 -3.98 114.28 111.29 1urk n THR 64 Ca 0.04 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1urk n THR 64 Cb 0.50 -1.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.12 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 -3.22 0.00 -0.80 3.42 5.75 0.09 -4.02 116.55 117.77 1urk n ASP 65 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.83 1urk n ASP 65 Cb 0.10 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.30 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 0.67 0.00 2.12 -2.24 -1.26 -2.29 114.28 111.29 1urk n THR 66 Ca 0.00 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1urk n THR 66 Cb 0.00 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 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 0.16 0.42 0.00 -0.78 2.00 -1.26 -4.89 117.12 112.77 1urk n MET 67 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.77 1urk n MET 67 Cb 0.46 -0.91 0.00 0.00 0.00 0.00 0.00 33.22 32.77 1urk n MET 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1urk n GLY 68 N 3.05 0.80 3.78 3.03 0.00 -1.24 -5.13 105.19 109.49 1urk n GLY 68 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1urk n GLY 68 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1urk s ARG 69 N 0.00 2.96 0.00 1.61 0.52 -1.26 -4.65 118.95 118.13 1urk s ARG 69 Ca 0.00 1.39 0.13 0.00 -0.52 0.00 0.00 55.73 56.73 1urk s ARG 69 Cb 0.00 -1.97 0.80 0.00 0.52 0.00 0.00 34.95 34.30 1urk s ARG 69 CO 0.00 -1.12 1.31 -0.35 0.02 0.00 0.00 175.30 175.16 1urk n PRO 70 N -2.20 0.71 -0.64 3.54 -0.04 -1.26 -0.73 135.00 134.37 1urk n PRO 70 Ca 0.10 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.65 1urk n PRO 70 Cb 0.52 -1.30 -0.03 0.00 -0.04 0.00 0.00 33.50 32.66 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 -5.82 4.16 0.47 0.00 1.43 -0.94 -4.89 118.68 113.09 1urk s LEU 72 Ca 0.00 1.24 -0.22 0.00 -1.03 0.00 0.00 54.13 54.12 1urk s LEU 72 Cb 0.00 -3.85 -0.08 0.00 0.03 0.00 0.00 46.19 42.29 1urk s LEU 72 CO 0.00 -0.11 1.11 -2.16 0.23 0.00 0.00 176.35 175.42 1urk s PRO 73 N -2.66 3.76 0.00 1.29 0.04 -1.26 -4.72 135.00 131.45 1urk s PRO 73 Ca 0.49 1.62 0.15 0.00 0.04 0.00 0.00 61.00 63.31 1urk s PRO 73 Cb -0.12 -2.30 0.82 0.00 0.04 0.00 0.00 34.50 32.93 1urk s PRO 73 CO 0.19 -0.51 1.40 0.91 0.04 0.00 0.00 177.00 179.02 1urk n TRP 74 N -0.64 0.00 0.01 0.56 7.02 -0.77 -1.56 117.44 122.06 1urk n TRP 74 Ca 0.08 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.67 1urk n TRP 74 Cb 0.50 -0.20 0.23 0.00 -2.42 0.00 0.00 31.31 29.42 1urk n TRP 74 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1urk n ASN 75 N -1.20 3.48 -4.57 -0.99 2.85 -1.26 -1.28 115.26 112.30 1urk n ASN 75 Ca 0.09 -1.97 -0.43 0.00 -0.11 0.00 0.00 54.58 52.16 1urk n ASN 75 Cb 0.10 -0.32 -0.04 0.00 1.24 0.00 0.00 39.78 40.76 1urk n ASN 75 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1urk s SER 76 N -1.21 6.51 0.32 1.20 0.15 -0.60 -4.88 113.70 115.18 1urk s SER 76 Ca 0.39 0.16 0.27 0.00 0.70 0.00 0.00 55.95 57.46 1urk s SER 76 Cb 0.21 -2.44 1.04 0.00 -1.71 0.00 0.00 66.02 63.13 1urk s SER 76 CO 0.29 -0.99 1.00 0.00 1.20 0.00 0.00 173.24 174.75 1urk n ALA 77 N 7.01 1.06 0.34 5.45 0.00 -1.26 0.13 120.51 133.24 1urk n ALA 77 Ca 0.06 0.49 -0.16 0.00 0.00 0.00 0.00 53.44 53.82 1urk n ALA 77 Cb 0.48 -0.71 -0.08 0.00 0.00 0.00 0.00 19.45 19.14 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 -0.39 0.00 2.02 -1.93 0.56 112.91 113.17 1urk h THR 78 Ca 0.59 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.72 1urk h THR 78 Cb 2.15 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.54 1urk h THR 78 CO -0.15 0.00 0.04 1.62 0.37 0.00 0.00 175.52 177.41 1urk h VAL 79 N -0.96 1.20 -0.67 3.16 3.04 -0.59 0.52 116.25 121.94 1urk h VAL 79 Ca -0.08 -0.76 0.18 0.00 -1.01 0.00 0.00 66.70 65.03 1urk h VAL 79 Cb 0.78 0.85 -0.03 0.00 -2.01 0.00 0.00 31.29 30.88 1urk h VAL 79 CO 0.07 0.27 0.48 -0.07 -1.01 0.00 0.00 177.57 177.31 1urk h LEU 80 N 0.58 0.07 -0.11 3.16 3.38 -0.78 0.62 115.31 122.22 1urk h LEU 80 Ca 0.13 0.01 -0.24 0.00 0.09 0.00 0.00 57.88 57.86 1urk h LEU 80 Cb 0.30 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 41.05 1urk h LEU 80 CO 0.01 0.03 -1.00 -0.61 0.09 0.00 0.00 178.44 176.96 1urk h GLN 81 N 0.07 0.44 0.00 1.13 4.15 0.14 -3.44 115.11 117.60 1urk h GLN 81 Ca 0.32 -0.50 0.00 0.00 0.77 0.00 0.00 58.65 59.24 1urk h GLN 81 Cb 1.18 0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.02 1urk h GLN 81 CO -0.03 1.16 0.00 1.04 -1.93 0.00 0.00 178.83 179.07 1urk n GLN 82 N -3.74 2.57 0.00 1.69 1.13 0.22 -5.04 117.38 114.21 1urk n GLN 82 Ca -0.08 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.98 1urk n GLN 82 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.21 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 -2.27 5.09 -1.04 -1.26 -4.93 114.28 109.87 1urk n THR 83 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.05 61.58 1urk n THR 83 Cb 0.00 -0.88 -0.02 0.00 -1.82 0.00 0.00 70.33 67.61 1urk n THR 83 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1urk s TYR 84 N 0.00 2.44 0.00 -1.42 2.02 -1.26 -4.90 117.35 114.23 1urk s TYR 84 Ca 0.00 0.71 0.00 0.00 -0.37 0.00 0.00 57.07 57.41 1urk s TYR 84 Cb 0.00 -3.84 0.00 0.00 -0.40 0.00 0.00 41.96 37.72 1urk s TYR 84 CO 0.00 -2.37 0.00 -2.39 -1.57 0.00 0.00 175.55 169.22 1urk n HIS 85 N 7.62 0.00 -2.94 2.71 1.44 -1.26 -4.88 115.22 117.92 1urk n HIS 85 Ca 0.16 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.56 1urk n HIS 85 Cb 0.45 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.53 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 -3.00 4.96 0.00 1.59 0.00 -0.41 -4.31 120.51 119.34 1urk n ALA 86 Ca 0.00 -4.70 0.00 0.00 0.00 0.00 0.00 53.44 48.74 1urk n ALA 86 Cb 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.27 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 0.02 0.00 0.02 0.00 8.25 -1.26 -4.89 115.22 117.36 1urk n HIS 87 Ca 0.34 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.80 1urk n HIS 87 Cb 0.36 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 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 0.00 0.00 -0.41 1.85 -1.26 -5.06 116.66 111.78 1urk n ARG 88 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1urk n ARG 88 Cb 0.00 -0.16 0.00 0.00 -1.05 0.00 0.00 32.46 31.25 1urk n ARG 88 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1urk n SER 89 N -2.86 0.00 0.00 2.89 2.88 -1.26 -4.94 113.62 110.33 1urk n SER 89 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1urk n SER 89 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1urk n SER 89 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1urk n ASP 90 N 0.00 1.07 0.17 -3.46 9.92 -1.26 -4.64 116.55 118.35 1urk n ASP 90 Ca 0.00 -1.31 0.13 0.00 -0.53 0.00 0.00 54.79 53.08 1urk n ASP 90 Cb 0.00 0.00 0.54 0.00 -0.64 0.00 0.00 41.12 41.02 1urk n ASP 90 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1urk h ALA 91 N 0.00 1.00 0.00 2.24 0.00 -1.92 -2.27 119.26 118.31 1urk h ALA 91 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1urk h ALA 91 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1urk h ALA 91 CO 0.00 0.00 -0.38 1.47 0.00 0.00 0.00 179.25 180.34 1urk n LEU 92 N -2.49 0.61 0.06 0.00 -0.00 -1.26 -1.22 117.00 112.70 1urk n LEU 92 Ca 0.02 0.31 0.12 0.00 -0.00 0.00 0.00 56.01 56.46 1urk n LEU 92 Cb 0.27 -0.26 0.27 0.00 -0.00 0.00 0.00 43.42 43.69 1urk n LEU 92 CO 0.23 -0.05 0.54 1.67 -0.00 0.00 0.00 177.39 179.77 1urk n GLN 93 N -1.98 0.23 -0.00 1.47 0.00 -0.85 -3.60 117.38 112.64 1urk n GLN 93 Ca 0.05 0.10 0.09 0.00 -0.00 0.00 0.00 57.00 57.24 1urk n GLN 93 Cb 0.41 -1.68 -0.11 0.00 0.00 0.00 0.00 30.24 28.86 1urk n GLN 93 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1urk n LEU 94 N -2.03 0.81 -0.01 1.69 7.99 -1.22 -4.97 117.00 119.27 1urk n LEU 94 Ca 0.04 -0.46 0.00 0.00 -0.01 0.00 0.00 56.01 55.58 1urk n LEU 94 Cb 0.42 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.73 1urk n LEU 94 CO 0.34 0.20 0.00 0.61 -1.51 0.00 0.00 177.39 177.03 1urk n GLY 95 N 1.44 1.69 0.00 -0.72 0.00 -1.21 -4.68 105.19 101.71 1urk n GLY 95 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.01 0.00 0.00 0.99 4.77 -0.36 -5.00 117.00 117.40 1urk n LEU 96 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1urk n LEU 96 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1urk n LEU 96 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1urk n GLY 97 N 5.00 0.46 3.06 -0.72 0.00 -1.26 -4.83 105.19 106.89 1urk n GLY 97 Ca 0.00 -1.28 -0.35 0.00 0.00 0.00 0.00 46.02 44.39 1urk n GLY 97 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1urk s LYS 98 N -1.37 2.38 0.00 1.61 2.20 -1.26 -4.19 119.74 119.11 1urk s LYS 98 Ca 0.00 -2.51 0.00 0.00 -0.36 0.00 0.00 55.97 53.10 1urk s LYS 98 Cb 0.00 -3.62 0.00 0.00 -1.51 0.00 0.00 37.83 32.70 1urk s LYS 98 CO 0.00 -1.15 0.00 -2.39 -0.36 0.00 0.00 175.35 171.45 1urk n HIS 99 N 3.46 -0.26 -2.55 4.03 1.44 -1.26 -4.98 115.22 115.10 1urk n HIS 99 Ca 0.07 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.59 1urk n HIS 99 Cb 0.37 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.49 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 -0.26 3.28 -4.52 4.39 6.94 -1.26 -1.84 115.26 121.99 1urk n ASN 100 Ca 0.00 -3.27 -0.34 0.00 -0.02 0.00 0.00 54.58 50.95 1urk n ASN 100 Cb 0.00 -0.49 -0.12 0.00 -2.36 0.00 0.00 39.78 36.82 1urk n ASN 100 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1urk s TYR 101 N -3.37 3.09 1.17 -2.53 1.51 -1.26 -4.87 117.35 111.08 1urk s TYR 101 Ca 0.39 -0.24 -0.17 0.00 -1.01 0.00 0.00 57.07 56.03 1urk s TYR 101 Cb 0.42 -2.03 0.20 0.00 -0.11 0.00 0.00 41.96 40.44 1urk s TYR 101 CO -0.09 -0.04 0.38 0.00 -1.11 0.00 0.00 175.55 174.69 1urk s ARG 103 N -3.85 0.26 -0.79 0.00 6.06 -0.65 -4.95 118.95 115.03 1urk s ARG 103 Ca 0.57 -0.03 0.02 0.00 -2.50 0.00 0.00 55.73 53.80 1urk s ARG 103 Cb -0.14 0.12 0.22 0.00 0.06 0.00 0.00 34.95 35.21 1urk s ARG 103 CO 0.60 -0.10 0.77 0.09 -2.50 0.00 0.00 175.30 174.16 1urk n ASN 104 N 0.24 3.98 0.18 -2.12 5.03 -1.26 -2.33 115.26 118.97 1urk n ASN 104 Ca -0.01 -3.28 0.06 0.00 0.87 0.00 0.00 54.58 52.21 1urk n ASN 104 Cb 0.58 -0.88 0.20 0.00 -1.02 0.00 0.00 39.78 38.66 1urk n ASN 104 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1urk h PRO 105 N 5.21 0.00 -0.01 3.52 0.13 -1.90 -3.06 132.00 135.89 1urk h PRO 105 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1urk h PRO 105 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1urk h PRO 105 CO 0.86 0.37 -0.38 -3.47 -0.23 0.00 0.00 178.00 175.15 1urk n ASP 106 N -3.30 1.42 -1.51 1.44 2.03 -1.26 -4.94 116.55 110.44 1urk n ASP 106 Ca 0.01 -1.13 -0.03 0.00 0.52 0.00 0.00 54.79 54.16 1urk n ASP 106 Cb 0.60 0.31 0.01 0.00 -0.72 0.00 0.00 41.12 41.33 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 -0.45 -2.18 -4.34 1.67 4.05 -1.16 -5.06 115.26 107.79 1urk n ASN 107 Ca 0.10 -0.11 -0.27 0.00 0.45 0.00 0.00 54.58 54.76 1urk n ASN 107 Cb 0.40 -1.31 0.16 0.00 1.23 0.00 0.00 39.78 40.25 1urk n ASN 107 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 177.26 173.61 1urk s ARG 108 N -4.03 1.02 0.18 1.20 6.06 -1.26 -4.98 118.95 117.14 1urk s ARG 108 Ca 0.02 -0.90 -0.06 0.00 -2.50 0.00 0.00 55.73 52.28 1urk s ARG 108 Cb -0.00 -2.10 0.06 0.00 0.06 0.00 0.00 34.95 32.97 1urk s ARG 108 CO 0.13 -2.01 1.50 -0.09 -2.50 0.00 0.00 175.30 172.33 1urk h ARG 109 N -1.12 0.71 -5.20 5.12 2.43 -1.97 -3.41 114.38 110.95 1urk h ARG 109 Ca -0.39 -0.41 -0.45 0.00 -0.81 0.00 0.00 59.98 57.92 1urk h ARG 109 Cb 1.24 0.03 -0.27 0.00 -0.42 0.00 0.00 29.97 30.55 1urk h ARG 109 CO 0.35 1.03 -0.80 1.03 -1.51 0.00 0.00 179.97 180.07 1urk s ARG 110 N -4.19 0.98 -0.20 0.20 0.52 -1.26 -2.48 118.95 112.53 1urk s ARG 110 Ca -0.09 -0.58 -0.38 0.00 -0.52 0.00 0.00 55.73 54.16 1urk s ARG 110 Cb 0.11 -0.96 -0.14 0.00 0.52 0.00 0.00 34.95 34.48 1urk s ARG 110 CO 0.86 0.25 1.79 -2.30 0.02 0.00 0.00 175.30 175.92 1urk n PRO 111 N 2.39 1.57 -4.57 3.54 -0.02 -1.26 -4.71 135.00 131.94 1urk n PRO 111 Ca -0.16 0.58 -0.31 0.00 -2.02 0.00 0.00 63.50 61.59 1urk n PRO 111 Cb 0.55 -2.32 -0.07 0.00 -0.02 0.00 0.00 33.50 31.64 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 3.70 1.95 0.03 6.00 1.48 -0.99 -0.92 118.94 130.19 1urk s TRP 112 Ca 0.96 -0.88 -0.28 0.00 -1.06 0.00 0.00 56.10 54.84 1urk s TRP 112 Cb -0.92 -1.70 0.07 0.00 -1.16 0.00 0.00 33.47 29.77 1urk s TRP 112 CO 0.60 0.14 0.67 0.00 -4.06 0.00 0.00 176.95 174.30 1urk s TYR 114 N -2.32 1.73 -0.21 0.00 2.02 -1.26 -2.06 117.35 115.25 1urk s TYR 114 Ca -0.05 0.87 -0.13 0.00 -0.37 0.00 0.00 57.07 57.39 1urk s TYR 114 Cb -0.00 -3.90 -0.05 0.00 -0.40 0.00 0.00 41.96 37.61 1urk s TYR 114 CO -0.01 -1.47 0.26 0.54 -1.57 0.00 0.00 175.55 173.31 1urk s VAL 115 N 11.48 5.30 -0.28 0.71 0.11 -0.82 -2.22 120.40 134.69 1urk s VAL 115 Ca 0.73 0.43 -0.41 0.00 -2.93 0.00 0.00 61.98 59.80 1urk s VAL 115 Cb -0.05 -3.60 -0.16 0.00 -1.53 0.00 0.00 36.38 31.04 1urk s VAL 115 CO 0.06 0.33 1.71 0.00 -3.33 0.00 0.00 175.10 173.88 1urk n GLN 116 N 4.12 1.06 -0.31 1.54 1.13 -1.26 -1.74 117.38 121.91 1urk n GLN 116 Ca -0.12 0.39 0.08 0.00 -1.94 0.00 0.00 57.00 55.41 1urk n GLN 116 Cb 0.52 -2.05 0.21 0.00 0.11 0.00 0.00 30.24 29.02 1urk n GLN 116 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1urk n VAL 117 N 4.44 1.96 0.00 5.09 0.31 -1.18 -4.81 118.33 124.15 1urk n VAL 117 Ca 0.26 -1.79 0.00 0.00 -0.01 0.00 0.00 64.34 62.80 1urk n VAL 117 Cb 0.12 -0.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 1urk n VAL 117 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1urk n GLY 118 N -0.56 1.35 0.40 2.92 0.00 -1.26 -4.74 105.19 103.29 1urk n GLY 118 Ca 0.18 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 1urk n GLY 118 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1urk h LEU 119 N 0.00 -1.30 -7.75 0.99 4.07 -2.00 -3.44 115.31 105.87 1urk h LEU 119 Ca 0.00 0.17 -0.09 0.00 0.08 0.00 0.00 57.88 58.04 1urk h LEU 119 Cb 0.00 0.53 -0.15 0.00 1.08 0.00 0.00 40.66 42.12 1urk h LEU 119 CO 0.00 -0.43 -0.35 -1.59 -1.08 0.00 0.00 178.44 174.99 1urk s LYS 120 N -5.89 0.81 -0.44 1.13 -2.85 -1.26 -5.09 119.74 106.16 1urk s LYS 120 Ca -0.15 -0.83 -0.30 0.00 -1.00 0.00 0.00 55.97 53.69 1urk s LYS 120 Cb 0.09 0.33 -0.10 0.00 -2.06 0.00 0.00 37.83 36.10 1urk s LYS 120 CO 0.64 -0.26 2.33 -2.30 0.10 0.00 0.00 175.35 175.87 1urk n PRO 121 N 0.18 1.15 -3.68 1.78 -0.02 -1.26 -3.08 135.00 130.07 1urk n PRO 121 Ca -0.16 0.22 -0.36 0.00 -2.02 0.00 0.00 63.50 61.18 1urk n PRO 121 Cb 0.61 -2.86 -0.07 0.00 -0.02 0.00 0.00 33.50 31.16 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 9.36 4.25 0.37 2.45 1.98 -0.71 -4.68 118.68 131.70 1urk s LEU 122 Ca 1.07 0.38 -0.27 0.00 -2.89 0.00 0.00 54.13 52.42 1urk s LEU 122 Cb -0.56 -2.20 -0.09 0.00 0.66 0.00 0.00 46.19 44.00 1urk s LEU 122 CO 0.38 0.19 1.28 0.68 -1.89 0.00 0.00 176.35 176.99 1urk s VAL 123 N 0.17 2.76 0.03 1.68 -7.23 -1.26 -1.95 120.40 114.60 1urk s VAL 123 Ca 0.12 0.71 -0.02 0.00 -1.81 0.00 0.00 61.98 60.99 1urk s VAL 123 Cb -0.12 -3.44 -0.02 0.00 0.56 0.00 0.00 36.38 33.36 1urk s VAL 123 CO 0.01 0.13 0.01 0.00 -0.31 0.00 0.00 175.10 174.95 1urk s GLN 124 N -2.02 0.48 -0.92 4.82 0.00 -0.88 -4.85 119.66 116.30 1urk s GLN 124 Ca 0.53 -0.82 -0.24 0.00 -0.00 0.00 0.00 55.36 54.82 1urk s GLN 124 Cb -0.38 0.18 -0.00 0.00 0.00 0.00 0.00 33.01 32.81 1urk s GLN 124 CO 0.49 -0.10 1.71 -1.21 0.00 0.00 0.00 175.29 176.18 1urk s GLU 125 N -2.50 3.00 -0.53 9.60 2.02 -1.26 -1.95 118.70 127.07 1urk s GLU 125 Ca -0.06 -0.55 -0.41 0.00 0.02 0.00 0.00 54.97 53.97 1urk s GLU 125 Cb -0.02 -5.08 -0.18 0.00 0.10 0.00 0.00 34.13 28.94 1urk s GLU 125 CO -0.05 -2.80 2.10 0.00 0.02 0.00 0.00 175.26 174.54 1urk s MET 127 N 6.05 3.71 -0.15 0.00 1.75 -0.97 -4.81 119.30 124.88 1urk s MET 127 Ca 1.16 2.03 0.17 0.00 -1.25 0.00 0.00 55.69 57.80 1urk s MET 127 Cb -1.41 -4.16 0.44 0.00 2.84 0.00 0.00 34.83 32.54 1urk s MET 127 CO 0.61 -1.42 1.19 1.55 -0.65 0.00 0.00 175.02 176.30 1urk n VAL 128 N 6.53 1.40 -0.54 10.11 3.14 -1.26 -4.80 118.33 132.90 1urk n VAL 128 Ca 0.22 -2.57 -0.26 0.00 -2.96 0.00 0.00 64.34 58.78 1urk n VAL 128 Cb 0.44 0.23 0.18 0.00 -1.06 0.00 0.00 33.84 33.63 1urk n VAL 128 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 1urk n HIS 129 N -0.46 -2.15 0.00 1.45 -0.00 -1.26 -4.89 115.22 107.91 1urk n HIS 129 Ca 0.16 -0.07 0.00 0.00 0.46 0.00 0.00 57.72 58.27 1urk n HIS 129 Cb 0.89 -1.46 0.00 0.00 -0.12 0.00 0.00 29.99 29.30 1urk n HIS 129 CO 0.00 0.00 0.00 -0.40 0.46 0.00 0.00 176.34 176.40 1urk n ASP 130 N -2.22 0.00 -0.21 0.26 5.68 -1.26 -5.12 116.55 113.68 1urk n ASP 130 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.34 1urk n ASP 130 Cb 0.50 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 1urk n ASP 130 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1urk n ALA 132 N 0.38 -0.78 -3.25 0.00 0.00 -1.26 -4.86 120.51 110.74 1urk n ALA 132 Ca 0.00 0.10 -0.27 0.00 0.00 0.00 0.00 53.44 53.27 1urk n ALA 132 Cb 0.00 -1.52 -0.07 0.00 0.00 0.00 0.00 19.45 17.86 1urk n ALA 132 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1urk n ASP 133 N -1.81 3.83 -0.07 0.00 2.03 -1.26 -4.78 116.55 114.49 1urk n ASP 133 Ca -0.15 -3.49 -0.08 0.00 0.52 0.00 0.00 54.79 51.59 1urk n ASP 133 Cb 0.61 -0.63 -0.10 0.00 -0.72 0.00 0.00 41.12 40.28 1urk n ASP 133 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1urk n GLY 134 N 0.50 -0.53 0.00 0.27 0.00 -1.26 -5.16 105.19 99.01 1urk n GLY 134 Ca 0.30 -0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.19 1urk n GLY 134 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49