#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1urk s VAL 7 N 0.00 1.24 -0.87 1.69 -7.23 -1.26 -5.04 120.40 108.93 1urk s VAL 7 Ca 0.00 -2.08 -0.19 0.00 -1.81 0.00 0.00 61.98 57.90 1urk s VAL 7 Cb 0.00 -1.92 -0.22 0.00 0.56 0.00 0.00 36.38 34.80 1urk s VAL 7 CO 0.00 -0.69 2.32 -2.65 -0.31 0.00 0.00 175.10 173.78 1urk n PRO 8 N -0.24 0.33 -1.23 4.82 -0.02 -1.26 -4.59 135.00 132.80 1urk n PRO 8 Ca -0.09 -0.41 0.17 0.00 -2.02 0.00 0.00 63.50 61.15 1urk n PRO 8 Cb 0.61 -2.46 -0.04 0.00 -0.02 0.00 0.00 33.50 31.59 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 12.71 -7.66 -3.86 2.55 2.88 -1.26 -4.71 113.62 114.27 1urk n SER 9 Ca 0.56 1.33 -0.30 0.00 -1.33 0.00 0.00 58.87 59.12 1urk n SER 9 Cb 0.30 -3.73 -0.15 0.00 -0.75 0.00 0.00 64.21 59.88 1urk n SER 9 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1urk s ASN 10 N -6.52 4.33 0.00 -3.46 0.01 -1.26 -5.11 114.94 102.93 1urk s ASN 10 Ca 0.00 -1.95 0.00 0.00 -0.71 0.00 0.00 52.86 50.20 1urk s ASN 10 Cb 0.00 -1.22 0.00 0.00 0.41 0.00 0.00 41.25 40.44 1urk s ASN 10 CO 0.00 -0.39 0.00 0.00 -1.51 0.00 0.00 177.10 175.20 1urk n ASP 12 N 0.00 1.77 -1.32 0.00 8.00 -1.26 -5.03 116.55 118.71 1urk n ASP 12 Ca 0.00 -0.68 0.15 0.00 0.71 0.00 0.00 54.79 54.97 1urk n ASP 12 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 41.12 41.02 1urk n ASP 12 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1urk n LEU 14 N -4.13 0.00 -0.90 0.00 -0.00 0.87 -4.66 117.00 108.18 1urk n LEU 14 Ca -0.07 0.00 -0.12 0.00 -0.00 0.00 0.00 56.01 55.82 1urk n LEU 14 Cb 0.60 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.97 1urk n LEU 14 CO 0.03 0.00 -0.11 -3.20 -0.00 0.00 0.00 177.39 174.11 1urk n ASN 15 N -0.80 -4.81 0.00 1.45 5.15 -1.26 -1.90 115.26 113.08 1urk n ASN 15 Ca 0.00 0.29 0.00 0.00 -0.60 0.00 0.00 54.58 54.27 1urk n ASN 15 Cb 0.00 -3.35 0.00 0.00 -0.53 0.00 0.00 39.78 35.90 1urk n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1urk n GLY 16 N -1.01 0.79 3.68 8.20 0.00 -1.26 -4.99 105.19 110.60 1urk n GLY 16 Ca -0.12 -0.65 -0.45 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.54 1.58 3.21 -0.02 0.00 -0.80 -4.90 105.19 102.72 1urk n GLY 17 Ca 0.00 0.80 -0.35 0.00 0.00 0.00 0.00 46.02 46.47 1urk n GLY 17 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1urk n THR 18 N 4.97 0.00 -4.90 2.61 -1.04 0.19 -4.57 114.28 111.53 1urk n THR 18 Ca 0.20 -0.29 -0.28 0.00 -2.04 0.00 0.00 64.05 61.64 1urk n THR 18 Cb 0.34 -0.34 -0.17 0.00 -1.82 0.00 0.00 70.33 68.35 1urk n THR 18 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1urk s VAL 20 N 0.35 0.59 -0.28 0.00 -7.23 -1.14 -4.85 120.40 107.83 1urk s VAL 20 Ca -0.13 -2.00 -0.16 0.00 -1.81 0.00 0.00 61.98 57.88 1urk s VAL 20 Cb -0.15 -2.52 0.09 0.00 0.56 0.00 0.00 36.38 34.36 1urk s VAL 20 CO 0.05 0.00 0.73 -0.44 -0.31 0.00 0.00 175.10 175.13 1urk s SER 21 N -3.47 -0.90 1.31 4.85 0.01 -1.26 -2.96 113.70 111.28 1urk s SER 21 Ca 0.32 1.43 -0.19 0.00 1.31 0.00 0.00 55.95 58.82 1urk s SER 21 Cb 0.05 1.39 0.31 0.00 0.21 0.00 0.00 66.02 67.98 1urk s SER 21 CO 0.16 -0.22 0.75 -3.20 0.41 0.00 0.00 173.24 171.13 1urk n ASN 22 N 4.27 -3.29 0.00 2.44 5.15 -1.20 -4.97 115.26 117.66 1urk n ASN 22 Ca -0.20 -0.57 0.00 0.00 -0.60 0.00 0.00 54.58 53.21 1urk n ASN 22 Cb 0.59 -1.02 0.00 0.00 -0.53 0.00 0.00 39.78 38.81 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 -4.68 2.94 -2.45 1.20 4.81 -1.26 -4.79 118.16 113.93 1urk n LYS 23 Ca 0.08 -0.09 -0.27 0.00 -0.87 0.00 0.00 58.31 57.17 1urk n LYS 23 Cb 0.55 -0.45 0.00 0.00 0.02 0.00 0.00 35.03 35.15 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 -0.44 3.35 -1.08 5.64 4.01 -1.26 -5.01 117.16 122.36 1urk n TYR 24 Ca 0.00 -3.05 0.00 0.00 -0.16 0.00 0.00 57.90 54.69 1urk n TYR 24 Cb 0.03 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 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 -0.49 0.00 -1.98 -0.72 7.35 -1.26 -5.08 117.46 115.28 1urk n PHE 25 Ca 0.39 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 57.05 1urk n PHE 25 Cb 0.68 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.48 1urk n PHE 25 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 1urk n SER 26 N 0.00 -0.48 0.00 -2.13 3.41 -1.26 -4.97 113.62 108.19 1urk n SER 26 Ca 0.00 -1.45 0.00 0.00 -0.26 0.00 0.00 58.87 57.16 1urk n SER 26 Cb 0.00 0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 1urk n SER 26 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1urk n ASN 27 N 0.00 0.00 -4.06 4.04 4.13 -1.26 -5.16 115.26 112.96 1urk n ASN 27 Ca -0.13 0.00 -0.27 0.00 1.68 0.00 0.00 54.58 55.86 1urk n ASN 27 Cb 0.58 0.00 -0.17 0.00 -1.54 0.00 0.00 39.78 38.66 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 1.34 -0.30 2.41 1.10 -1.26 -5.09 121.20 119.40 1urk s ILE 28 Ca 0.00 -0.59 -0.05 0.00 -0.51 0.00 0.00 60.65 59.50 1urk s ILE 28 Cb 0.00 -1.22 0.19 0.00 0.15 0.00 0.00 42.46 41.58 1urk s ILE 28 CO 0.00 0.40 0.78 -1.38 -2.11 0.00 0.00 174.94 172.64 1urk s HIS 29 N 0.71 -1.19 -0.12 3.50 -3.43 -1.26 -3.24 115.29 110.25 1urk s HIS 29 Ca -0.13 1.16 0.03 0.00 -0.80 0.00 0.00 55.06 55.31 1urk s HIS 29 Cb -0.16 0.38 0.00 0.00 -1.43 0.00 0.00 32.58 31.37 1urk s HIS 29 CO 0.03 -0.66 -0.21 1.67 -2.00 0.00 0.00 174.74 173.57 1urk s TRP 30 N 2.90 2.65 0.26 0.38 -2.14 -1.16 -4.80 118.94 117.03 1urk s TRP 30 Ca 0.13 -1.12 -0.30 0.00 2.66 0.00 0.00 56.10 57.47 1urk s TRP 30 Cb -0.12 -1.78 -0.09 0.00 -3.10 0.00 0.00 33.47 28.38 1urk s TRP 30 CO -0.18 -0.48 1.14 0.00 -2.66 0.00 0.00 176.95 174.76 1urk s ASN 32 N -0.60 5.47 0.26 0.00 -0.87 0.10 -4.86 114.94 114.44 1urk s ASN 32 Ca 0.47 -0.04 0.08 0.00 -1.57 0.00 0.00 52.86 51.80 1urk s ASN 32 Cb -0.33 -1.96 -0.05 0.00 -0.02 0.00 0.00 41.25 38.89 1urk s ASN 32 CO 0.41 0.07 -0.11 0.00 -2.57 0.00 0.00 177.10 174.90 1urk n PRO 34 N -0.53 0.73 0.05 0.00 -0.02 -1.26 -4.79 135.00 129.17 1urk n PRO 34 Ca -0.06 0.27 0.05 0.00 -2.02 0.00 0.00 63.50 61.74 1urk n PRO 34 Cb 0.62 -1.75 0.24 0.00 -0.02 0.00 0.00 33.50 32.59 1urk n PRO 34 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1urk n LYS 35 N 0.11 0.05 -0.09 -0.52 2.85 -1.26 -1.24 118.16 118.05 1urk n LYS 35 Ca 0.11 0.47 0.03 0.00 -1.05 0.00 0.00 58.31 57.87 1urk n LYS 35 Cb 0.43 -1.63 0.08 0.00 -0.65 0.00 0.00 35.03 33.26 1urk n LYS 35 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 1urk n LYS 36 N -1.73 1.43 -4.35 -1.58 2.85 -1.26 -4.52 118.16 108.99 1urk n LYS 36 Ca 0.01 -0.61 -0.26 0.00 -1.05 0.00 0.00 58.31 56.39 1urk n LYS 36 Cb 0.06 -1.17 -0.10 0.00 -0.65 0.00 0.00 35.03 33.17 1urk n LYS 36 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 1urk s PHE 37 N -1.75 2.50 0.00 5.58 0.08 -0.37 -0.34 117.98 123.68 1urk s PHE 37 Ca 0.11 -0.28 0.00 0.00 0.12 0.00 0.00 56.93 56.89 1urk s PHE 37 Cb 0.06 -1.21 0.00 0.00 -0.57 0.00 0.00 43.02 41.30 1urk s PHE 37 CO 0.07 0.53 0.00 0.41 -0.10 0.00 0.00 175.22 176.14 1urk n GLY 38 N 0.01 2.32 0.00 4.36 0.00 -0.00 -4.85 105.19 107.02 1urk n GLY 38 Ca -0.11 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.45 3.12 5.61 -0.02 0.00 -1.26 -1.13 105.19 111.05 1urk n GLY 39 Ca 0.00 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.46 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 0.54 0.00 -3.14 1.61 3.00 -1.26 -0.33 117.38 117.80 1urk n GLN 40 Ca 0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 57.00 56.77 1urk n GLN 40 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 30.24 30.20 1urk n GLN 40 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.06 177.78 1urk n HIS 41 N 0.00 1.57 -3.35 1.08 8.25 -1.26 -4.93 115.22 116.58 1urk n HIS 41 Ca 0.00 -3.87 -0.16 0.00 -0.26 0.00 0.00 57.72 53.44 1urk n HIS 41 Cb 0.00 -0.44 0.01 0.00 1.12 0.00 0.00 29.99 30.67 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 -1.56 0.00 -1.52 0.00 4.07 -0.96 -2.94 120.64 117.73 1urk n GLU 43 Ca -0.10 0.00 -0.32 0.00 -0.06 0.00 0.00 57.16 56.68 1urk n GLU 43 Cb 0.59 -0.65 0.06 0.00 -0.06 0.00 0.00 31.44 31.38 1urk n GLU 43 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1urk s ILE 44 N -1.59 3.50 0.30 6.31 1.01 -0.29 -4.70 121.20 125.74 1urk s ILE 44 Ca 0.00 0.56 0.01 0.00 0.00 0.00 0.00 60.65 61.22 1urk s ILE 44 Cb 0.00 -3.11 -0.03 0.00 0.01 0.00 0.00 42.46 39.33 1urk s ILE 44 CO 0.00 -0.57 0.48 -1.81 0.00 0.00 0.00 174.94 173.04 1urk s ASP 45 N -3.22 6.32 0.00 3.58 1.11 -1.26 -0.82 116.67 122.37 1urk s ASP 45 Ca 0.62 0.35 0.00 0.00 0.18 0.00 0.00 52.55 53.70 1urk s ASP 45 Cb -0.17 -1.98 0.00 0.00 1.07 0.00 0.00 42.92 41.83 1urk s ASP 45 CO 0.50 -0.20 0.00 0.29 1.18 0.00 0.00 175.17 176.95 1urk n LYS 46 N -1.52 0.00 0.02 8.23 5.02 0.54 -4.83 118.16 125.63 1urk n LYS 46 Ca -0.06 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.22 1urk n LYS 46 Cb 0.56 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.57 1urk n LYS 46 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1urk h SER 47 N 0.00 -0.05 -3.99 4.39 0.02 -1.79 -3.43 113.55 108.69 1urk h SER 47 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1urk h SER 47 Cb 0.00 0.01 0.10 0.00 0.14 0.00 0.00 62.40 62.65 1urk h SER 47 CO 0.00 -0.02 0.60 -0.75 -1.14 0.00 0.00 176.83 175.52 1urk s LYS 48 N -2.39 3.70 0.00 3.45 2.47 -1.26 -4.86 119.74 120.85 1urk s LYS 48 Ca -0.01 2.14 0.00 0.00 -1.56 0.00 0.00 55.97 56.55 1urk s LYS 48 Cb 0.00 -2.57 0.00 0.00 -1.46 0.00 0.00 37.83 33.81 1urk s LYS 48 CO 0.03 -0.71 0.00 2.41 0.16 0.00 0.00 175.35 177.24 1urk n THR 49 N -0.29 0.00 -2.01 3.43 -1.04 -1.26 -4.89 114.28 108.22 1urk n THR 49 Ca 0.06 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.65 1urk n THR 49 Cb 0.44 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.93 1urk n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1urk s TYR 51 N 0.37 2.45 -1.08 0.00 -0.85 -1.26 -4.89 117.35 112.08 1urk s TYR 51 Ca 0.62 1.30 0.25 0.00 -0.52 0.00 0.00 57.07 58.72 1urk s TYR 51 Cb -0.42 -3.87 0.54 0.00 0.38 0.00 0.00 41.96 38.59 1urk s TYR 51 CO 0.39 -2.86 1.44 0.39 -1.52 0.00 0.00 175.55 173.39 1urk n GLU 52 N -0.35 0.09 -2.30 -3.49 1.02 -1.26 -4.95 120.64 109.41 1urk n GLU 52 Ca 0.06 -0.05 -0.05 0.00 -0.02 0.00 0.00 57.16 57.10 1urk n GLU 52 Cb 0.43 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.35 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 1.48 2.23 3.53 0.62 0.00 -1.26 -5.07 105.19 106.72 1urk n GLY 53 Ca 0.06 -1.31 -0.43 0.00 0.00 0.00 0.00 46.02 44.35 1urk n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1urk s ASN 54 N -1.82 6.77 0.00 1.61 2.20 -1.26 -4.84 114.94 117.60 1urk s ASN 54 Ca 0.09 -2.24 0.00 0.00 -0.94 0.00 0.00 52.86 49.77 1urk s ASN 54 Cb -0.01 -2.51 0.00 0.00 -2.00 0.00 0.00 41.25 36.73 1urk s ASN 54 CO 0.06 -1.15 0.42 0.61 -2.94 0.00 0.00 177.10 174.11 1urk n GLY 55 N 5.52 -1.21 0.00 0.45 0.00 -1.26 -4.99 105.19 103.70 1urk n GLY 55 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 -1.50 0.00 -0.03 1.61 -0.00 -1.26 -5.13 115.22 108.90 1urk n HIS 56 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1urk n HIS 56 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1urk n HIS 56 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1urk n PHE 57 N 0.00 0.00 0.00 1.57 -1.74 -1.26 -3.88 117.46 112.15 1urk n PHE 57 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.89 1urk n PHE 57 Cb 0.00 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.00 1urk n PHE 57 CO 0.00 0.00 0.00 0.98 -0.56 0.00 0.00 176.76 177.18 1urk n TYR 58 N 0.00 -0.86 -2.03 2.97 4.19 -1.26 -4.74 117.16 115.42 1urk n TYR 58 Ca 0.00 0.00 -0.19 0.00 3.31 0.00 0.00 57.90 61.02 1urk n TYR 58 Cb 0.00 0.17 -0.04 0.00 0.49 0.00 0.00 39.34 39.96 1urk n TYR 58 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1urk n ARG 59 N -1.75 -1.64 0.00 2.98 0.63 -1.26 -4.87 116.66 110.75 1urk n ARG 59 Ca 0.00 0.99 0.00 0.00 -0.92 0.00 0.00 57.85 57.92 1urk n ARG 59 Cb 0.00 -5.51 0.00 0.00 0.45 0.00 0.00 32.46 27.40 1urk n ARG 59 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1urk n GLY 60 N -0.69 0.93 0.00 5.14 0.00 -1.26 -5.05 105.19 104.26 1urk n GLY 60 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 0.00 0.00 -2.38 1.61 3.00 -1.26 -5.09 118.16 114.04 1urk n LYS 61 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.30 1urk n LYS 61 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 35.03 35.02 1urk n LYS 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1urk n ALA 62 N -3.00 -2.34 -0.01 3.14 0.00 -1.26 -4.90 120.51 112.14 1urk n ALA 62 Ca 0.00 0.84 0.01 0.00 0.00 0.00 0.00 53.44 54.29 1urk n ALA 62 Cb 0.00 -2.06 -0.04 0.00 0.00 0.00 0.00 19.45 17.34 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 1.79 3.75 -4.76 0.00 7.64 -1.26 -4.54 113.62 116.24 1urk n SER 63 Ca -0.08 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.40 1urk n SER 63 Cb 0.12 1.02 -0.03 0.00 -1.01 0.00 0.00 64.21 64.31 1urk n SER 63 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1urk s THR 64 N -2.29 3.28 0.00 0.44 -4.23 -1.26 -4.37 115.64 107.21 1urk s THR 64 Ca -0.02 1.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.71 1urk s THR 64 Cb 0.03 -3.78 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1urk s THR 64 CO 0.22 0.27 0.00 -0.90 -0.54 0.00 0.00 174.62 173.67 1urk n ASP 65 N 1.43 0.00 -1.26 3.99 5.75 -0.45 -3.97 116.55 122.05 1urk n ASP 65 Ca 0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 54.79 54.74 1urk n ASP 65 Cb 0.44 0.00 0.09 0.00 -1.03 0.00 0.00 41.12 40.62 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 -0.22 1.46 0.00 2.12 -2.24 0.11 -2.36 114.28 113.15 1urk n THR 66 Ca 0.00 -0.60 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 1urk n THR 66 Cb 0.00 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 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 0.04 0.00 0.00 -0.78 2.81 -1.26 -4.82 117.12 113.11 1urk n MET 67 Ca 0.17 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.06 1urk n MET 67 Cb 0.79 -0.51 0.00 0.00 -0.71 0.00 0.00 33.22 32.79 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 2.53 0.99 3.77 3.03 0.00 -1.25 -5.12 105.19 109.14 1urk n GLY 68 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1urk n GLY 68 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1urk s ARG 69 N 0.00 4.31 0.00 1.61 1.70 -1.26 -4.72 118.95 120.60 1urk s ARG 69 Ca 0.00 2.06 0.10 0.00 -0.47 0.00 0.00 55.73 57.42 1urk s ARG 69 Cb 0.00 -2.99 0.62 0.00 -0.57 0.00 0.00 34.95 32.01 1urk s ARG 69 CO 0.00 -0.17 1.18 -0.35 -1.08 0.00 0.00 175.30 174.88 1urk n PRO 70 N 0.67 0.71 -1.13 3.89 -0.04 -1.26 -1.34 135.00 136.50 1urk n PRO 70 Ca 0.01 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.61 1urk n PRO 70 Cb 0.43 -1.23 -0.07 0.00 -0.04 0.00 0.00 33.50 32.60 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 -6.63 4.08 0.38 0.00 1.43 -0.59 -4.86 118.68 112.49 1urk s LEU 72 Ca 0.00 1.04 -0.26 0.00 -1.03 0.00 0.00 54.13 53.88 1urk s LEU 72 Cb 0.00 -3.84 -0.09 0.00 0.03 0.00 0.00 46.19 42.29 1urk s LEU 72 CO 0.00 -0.17 1.17 -2.16 0.23 0.00 0.00 176.35 175.41 1urk s PRO 73 N -3.09 4.16 0.19 1.29 0.04 -1.26 -4.69 135.00 131.63 1urk s PRO 73 Ca 0.50 1.85 0.13 0.00 0.04 0.00 0.00 61.00 63.51 1urk s PRO 73 Cb -0.11 -2.76 0.69 0.00 0.04 0.00 0.00 34.50 32.36 1urk s PRO 73 CO 0.22 -0.23 1.39 0.91 0.04 0.00 0.00 177.00 179.33 1urk n TRP 74 N 0.26 0.43 0.01 0.56 7.02 -1.01 -0.59 117.44 124.11 1urk n TRP 74 Ca 0.03 0.22 -0.08 0.00 -1.02 0.00 0.00 57.50 56.65 1urk n TRP 74 Cb 0.46 -0.86 -0.13 0.00 -2.42 0.00 0.00 31.31 28.36 1urk n TRP 74 CO 0.00 0.00 0.00 -0.97 -2.02 0.00 0.00 177.69 174.70 1urk h ASN 75 N 0.00 0.01 -0.11 -0.99 -0.00 -1.74 0.39 115.58 113.15 1urk h ASN 75 Ca 0.00 -0.01 -0.64 0.00 -0.00 0.00 0.00 56.30 55.65 1urk h ASN 75 Cb 0.01 -0.00 -0.06 0.00 -0.00 0.00 0.00 38.32 38.26 1urk h ASN 75 CO 0.00 1.01 1.53 -1.20 -0.00 0.00 0.00 177.43 178.77 1urk n SER 76 N -3.16 0.67 -0.37 1.15 7.64 0.24 -4.41 113.62 115.38 1urk n SER 76 Ca -0.11 0.41 0.29 0.00 1.01 0.00 0.00 58.87 60.48 1urk n SER 76 Cb 1.01 -0.95 0.47 0.00 -1.01 0.00 0.00 64.21 63.73 1urk n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1urk n ALA 77 N 9.18 1.02 0.15 -0.43 0.00 -1.26 -0.03 120.51 129.15 1urk n ALA 77 Ca 0.59 0.47 -0.09 0.00 0.00 0.00 0.00 53.44 54.41 1urk n ALA 77 Cb 0.02 -0.69 -0.05 0.00 0.00 0.00 0.00 19.45 18.74 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 -0.63 0.00 2.02 -1.93 0.18 112.91 112.56 1urk h THR 78 Ca 0.57 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.68 1urk h THR 78 Cb 2.07 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.46 1urk h THR 78 CO -0.14 0.00 0.15 1.62 0.37 0.00 0.00 175.52 177.51 1urk h VAL 79 N -0.50 1.26 -0.69 3.16 3.04 -0.74 -0.14 116.25 121.63 1urk h VAL 79 Ca -0.03 -0.94 0.20 0.00 -1.01 0.00 0.00 66.70 64.92 1urk h VAL 79 Cb 0.42 0.66 -0.03 0.00 -2.01 0.00 0.00 31.29 30.34 1urk h VAL 79 CO -0.01 0.35 0.68 -0.07 -1.01 0.00 0.00 177.57 177.51 1urk h LEU 80 N 0.92 0.00 0.24 3.16 3.38 -0.97 0.97 115.31 123.02 1urk h LEU 80 Ca 0.20 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.83 1urk h LEU 80 Cb 0.37 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.15 1urk h LEU 80 CO 0.00 0.00 -1.52 -0.61 0.09 0.00 0.00 178.44 176.41 1urk h GLN 81 N 0.00 0.51 0.00 1.13 4.15 0.12 -3.46 115.11 117.57 1urk h GLN 81 Ca 0.33 -0.87 0.00 0.00 0.77 0.00 0.00 58.65 58.87 1urk h GLN 81 Cb 1.68 0.33 0.00 0.00 0.21 0.00 0.00 27.48 29.69 1urk h GLN 81 CO -0.00 1.42 0.00 0.00 -1.93 0.00 0.00 178.83 178.31 1urk n GLN 82 N -3.71 0.42 0.00 1.69 -0.00 0.34 -5.06 117.38 111.06 1urk n GLN 82 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.82 1urk n GLN 82 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 31.33 1urk n GLN 82 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1urk n THR 83 N -1.03 0.00 -1.50 -0.39 -2.24 -1.26 -4.66 114.28 103.19 1urk n THR 83 Ca 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 1urk n THR 83 Cb 0.00 -0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.07 1urk n THR 83 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1urk n TYR 84 N 0.00 0.51 -0.16 4.78 4.01 -1.26 -4.69 117.16 120.35 1urk n TYR 84 Ca 0.00 0.31 0.00 0.00 -0.16 0.00 0.00 57.90 58.05 1urk n TYR 84 Cb 0.00 -2.09 0.00 0.00 -0.31 0.00 0.00 39.34 36.94 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 9.97 0.00 -3.65 -0.72 1.44 -1.26 -4.86 115.22 116.15 1urk n HIS 85 Ca 0.65 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 56.07 1urk n HIS 85 Cb 0.07 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.09 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 3.80 0.00 1.59 0.00 0.13 -3.83 120.51 119.20 1urk n ALA 86 Ca 0.00 -4.65 0.00 0.00 0.00 0.00 0.00 53.44 48.79 1urk n ALA 86 Cb 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.33 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 1.53 0.00 -3.87 0.00 8.25 -1.26 -4.84 115.22 115.03 1urk n HIS 87 Ca 0.24 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.60 1urk n HIS 87 Cb 0.37 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.48 1urk n HIS 87 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 1urk n ARG 88 N 0.00 1.34 -0.40 -0.41 0.63 -1.26 -5.01 116.66 111.54 1urk n ARG 88 Ca 0.00 -1.25 0.08 0.00 -0.92 0.00 0.00 57.85 55.76 1urk n ARG 88 Cb 0.00 0.21 0.27 0.00 0.45 0.00 0.00 32.46 33.40 1urk n ARG 88 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1urk n SER 89 N -1.64 3.54 0.00 6.15 2.88 -1.26 -3.92 113.62 119.37 1urk n SER 89 Ca -0.03 -2.19 0.00 0.00 -1.33 0.00 0.00 58.87 55.32 1urk n SER 89 Cb 0.22 -0.46 0.00 0.00 -0.75 0.00 0.00 64.21 63.23 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 1.02 0.04 0.07 -3.46 8.00 -1.26 -4.60 116.55 116.36 1urk n ASP 90 Ca 0.20 -0.45 0.07 0.00 0.71 0.00 0.00 54.79 55.32 1urk n ASP 90 Cb 0.62 0.80 0.33 0.00 -0.02 0.00 0.00 41.12 42.84 1urk n ASP 90 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1urk n ALA 91 N -0.80 1.33 0.14 2.24 0.00 -1.25 -1.33 120.51 120.84 1urk n ALA 91 Ca 0.00 0.05 0.09 0.00 0.00 0.00 0.00 53.44 53.59 1urk n ALA 91 Cb 0.00 -1.22 0.05 0.00 0.00 0.00 0.00 19.45 18.29 1urk n ALA 91 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1urk h LEU 92 N 0.00 0.00 0.05 0.00 -0.00 -1.84 1.65 115.31 115.17 1urk h LEU 92 Ca 0.00 0.00 -0.28 0.00 -0.00 0.00 0.00 57.88 57.60 1urk h LEU 92 Cb 0.15 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.78 1urk h LEU 92 CO 0.00 0.12 -1.50 1.56 -0.00 0.00 0.00 178.44 178.62 1urk h GLN 93 N 0.00 0.10 -0.06 0.17 4.20 -1.52 -3.33 115.11 114.67 1urk h GLN 93 Ca -0.02 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1urk h GLN 93 Cb 1.11 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.95 1urk h GLN 93 CO 0.01 0.87 0.00 1.28 -0.67 0.00 0.00 178.83 180.32 1urk n LEU 94 N -3.28 1.96 -3.14 1.46 7.99 -1.11 -5.04 117.00 115.84 1urk n LEU 94 Ca -0.14 -1.15 -0.21 0.00 -0.01 0.00 0.00 56.01 54.51 1urk n LEU 94 Cb 1.02 -0.03 0.02 0.00 -0.11 0.00 0.00 43.42 44.32 1urk n LEU 94 CO 0.47 0.40 -0.08 0.61 -1.51 0.00 0.00 177.39 177.29 1urk n GLY 95 N 0.52 -0.73 0.00 -0.72 0.00 0.55 -5.00 105.19 99.81 1urk n GLY 95 Ca 0.06 1.19 0.00 0.00 0.00 0.00 0.00 46.02 47.27 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 -0.36 0.00 0.00 0.99 4.77 -0.10 -4.99 117.00 117.32 1urk n LEU 96 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1urk n LEU 96 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1urk n LEU 96 CO 0.52 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1urk n GLY 97 N 5.00 0.36 3.30 -0.72 0.00 -1.25 -4.94 105.19 106.94 1urk n GLY 97 Ca 0.00 -1.32 -0.45 0.00 0.00 0.00 0.00 46.02 44.25 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 -0.48 3.63 -0.15 1.61 2.20 -1.26 -2.28 119.74 123.01 1urk s LYS 98 Ca 0.00 -2.68 -0.34 0.00 -0.36 0.00 0.00 55.97 52.59 1urk s LYS 98 Cb 0.00 -4.37 0.13 0.00 -1.51 0.00 0.00 37.83 32.08 1urk s LYS 98 CO 0.00 -1.27 1.15 -3.38 -0.36 0.00 0.00 175.35 171.49 1urk s HIS 99 N -0.26 -0.17 -0.74 4.03 -3.43 -1.26 -4.98 115.29 108.48 1urk s HIS 99 Ca 0.21 0.10 0.03 0.00 -0.80 0.00 0.00 55.06 54.60 1urk s HIS 99 Cb -0.11 0.52 0.31 0.00 -1.43 0.00 0.00 32.58 31.87 1urk s HIS 99 CO -0.08 -0.27 1.15 0.27 -2.00 0.00 0.00 174.74 173.81 1urk n ASN 100 N -0.13 5.16 -4.75 7.38 6.94 -1.26 -2.41 115.26 126.18 1urk n ASN 100 Ca -0.01 -3.61 -0.23 0.00 -0.02 0.00 0.00 54.58 50.71 1urk n ASN 100 Cb 0.59 -0.79 0.09 0.00 -2.36 0.00 0.00 39.78 37.31 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 -3.38 1.88 -0.02 -2.53 2.02 -1.26 -4.61 117.35 109.45 1urk s TYR 101 Ca 0.43 -0.21 -0.01 0.00 -0.37 0.00 0.00 57.07 56.91 1urk s TYR 101 Cb 0.21 -2.93 -0.00 0.00 -0.40 0.00 0.00 41.96 38.84 1urk s TYR 101 CO -0.08 -1.52 -0.01 0.00 -1.57 0.00 0.00 175.55 172.36 1urk n ARG 103 N -2.47 0.00 0.00 0.00 5.12 -1.25 -4.22 116.66 113.84 1urk n ARG 103 Ca -0.01 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 1urk n ARG 103 Cb 0.02 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.32 1urk n ARG 103 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1urk n ASN 104 N -1.15 0.00 0.00 0.55 4.05 -1.25 -2.73 115.26 114.73 1urk n ASN 104 Ca 0.00 0.00 0.05 0.00 0.45 0.00 0.00 54.58 55.08 1urk n ASN 104 Cb 0.00 0.00 0.27 0.00 1.23 0.00 0.00 39.78 41.28 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 0.00 0.13 -3.99 1.20 -0.04 -1.26 -4.25 135.00 126.79 1urk n PRO 105 Ca 0.00 0.21 -0.32 0.00 -0.04 0.00 0.00 63.50 63.34 1urk n PRO 105 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 1urk n PRO 105 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1urk s ASP 106 N -2.65 4.77 -0.53 3.54 1.01 -1.26 -5.01 116.67 116.54 1urk s ASP 106 Ca 0.09 -1.91 -0.05 0.00 0.71 0.00 0.00 52.55 51.40 1urk s ASP 106 Cb 0.07 -1.64 -0.18 0.00 1.01 0.00 0.00 42.92 42.18 1urk s ASP 106 CO 0.17 -0.35 1.17 -0.46 0.21 0.00 0.00 175.17 175.91 1urk n ASN 107 N 4.36 -0.83 -4.59 0.27 0.23 -1.26 -4.82 115.26 108.62 1urk n ASN 107 Ca -0.02 -0.32 -0.28 0.00 -0.53 0.00 0.00 54.58 53.43 1urk n ASN 107 Cb 0.42 -0.29 -0.10 0.00 -2.08 0.00 0.00 39.78 37.73 1urk n ASN 107 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1urk s ARG 108 N 3.83 1.96 -0.05 -3.83 1.81 -1.26 -5.01 118.95 116.40 1urk s ARG 108 Ca 0.70 -2.15 0.06 0.00 -1.72 0.00 0.00 55.73 52.62 1urk s ARG 108 Cb -0.45 -1.40 0.27 0.00 -0.45 0.00 0.00 34.95 32.92 1urk s ARG 108 CO 0.30 -0.18 1.06 0.54 -0.68 0.00 0.00 175.30 176.34 1urk n ARG 109 N -0.99 2.06 -3.62 3.54 1.74 -1.26 -4.86 116.66 113.28 1urk n ARG 109 Ca -0.08 -1.06 -0.05 0.00 -0.77 0.00 0.00 57.85 55.90 1urk n ARG 109 Cb 0.67 -1.53 -0.04 0.00 -1.02 0.00 0.00 32.46 30.54 1urk n ARG 109 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1urk s ARG 110 N -1.64 0.24 0.03 5.56 0.52 -1.26 -4.74 118.95 117.66 1urk s ARG 110 Ca 0.19 0.01 -0.30 0.00 -0.52 0.00 0.00 55.73 55.10 1urk s ARG 110 Cb 0.12 0.11 -0.06 0.00 0.52 0.00 0.00 34.95 35.65 1urk s ARG 110 CO 0.08 -0.09 1.36 -1.25 0.02 0.00 0.00 175.30 175.43 1urk s PRO 111 N -1.44 4.31 0.51 3.54 0.04 -1.26 -4.81 135.00 135.89 1urk s PRO 111 Ca 0.07 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.06 1urk s PRO 111 Cb -0.01 -3.49 -0.01 0.00 0.04 0.00 0.00 34.50 31.04 1urk s PRO 111 CO -0.05 -0.51 0.02 1.67 0.04 0.00 0.00 177.00 178.18 1urk s TRP 112 N 1.99 1.78 -0.13 0.56 1.48 -1.10 0.20 118.94 123.72 1urk s TRP 112 Ca 0.63 -1.04 -0.22 0.00 -1.06 0.00 0.00 56.10 54.41 1urk s TRP 112 Cb -0.32 -1.53 0.05 0.00 -1.16 0.00 0.00 33.47 30.52 1urk s TRP 112 CO 0.27 0.13 0.56 0.00 -4.06 0.00 0.00 176.95 173.85 1urk s TYR 114 N -0.44 1.72 0.00 0.00 1.51 -1.26 -1.67 117.35 117.21 1urk s TYR 114 Ca -0.06 0.89 -0.12 0.00 -1.01 0.00 0.00 57.07 56.78 1urk s TYR 114 Cb -0.03 -3.89 -0.05 0.00 -0.11 0.00 0.00 41.96 37.88 1urk s TYR 114 CO 0.04 -1.44 0.36 0.14 -1.11 0.00 0.00 175.55 173.54 1urk s VAL 115 N 11.62 5.13 0.03 0.71 -7.23 -0.79 -1.54 120.40 128.33 1urk s VAL 115 Ca 0.73 0.60 -0.30 0.00 -1.81 0.00 0.00 61.98 61.21 1urk s VAL 115 Cb -0.05 -3.64 -0.09 0.00 0.56 0.00 0.00 36.38 33.16 1urk s VAL 115 CO 0.07 0.50 1.93 -1.10 -0.31 0.00 0.00 175.10 176.19 1urk s GLN 116 N -1.33 4.15 -0.71 4.82 -1.52 -1.26 -0.78 119.66 123.02 1urk s GLN 116 Ca 0.25 2.57 0.01 0.00 -1.95 0.00 0.00 55.36 56.24 1urk s GLN 116 Cb -0.15 -4.13 0.37 0.00 -0.22 0.00 0.00 33.01 28.87 1urk s GLN 116 CO 0.13 -0.94 1.60 0.28 -0.25 0.00 0.00 175.29 176.12 1urk n VAL 117 N 5.53 3.46 0.00 1.09 0.31 -1.13 -4.86 118.33 122.74 1urk n VAL 117 Ca 0.20 -4.84 0.00 0.00 -0.01 0.00 0.00 64.34 59.69 1urk n VAL 117 Cb 0.41 -1.30 0.00 0.00 -0.91 0.00 0.00 33.84 32.04 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 -0.43 2.41 0.00 2.92 0.00 -1.26 -4.29 105.19 104.54 1urk n GLY 118 Ca 0.46 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.46 0.99 -0.00 -1.26 -5.06 117.00 108.21 1urk n LEU 119 Ca 0.00 -0.17 -0.17 0.00 -0.00 0.00 0.00 56.01 55.68 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 0.21 -0.17 -0.54 -0.00 0.00 0.00 177.39 176.89 1urk s LYS 120 N 0.00 0.22 -0.74 1.47 -0.14 -1.26 -5.07 119.74 114.21 1urk s LYS 120 Ca 0.00 0.26 -0.26 0.00 -1.36 0.00 0.00 55.97 54.61 1urk s LYS 120 Cb 0.00 -1.07 -0.15 0.00 -1.68 0.00 0.00 37.83 34.93 1urk s LYS 120 CO 0.00 -0.66 2.47 -2.30 -0.76 0.00 0.00 175.35 174.10 1urk n PRO 121 N 5.33 0.54 -3.57 -1.68 -0.02 -1.26 -2.83 135.00 131.51 1urk n PRO 121 Ca -0.05 -0.14 -0.38 0.00 -2.02 0.00 0.00 63.50 60.91 1urk n PRO 121 Cb 0.50 -2.65 -0.06 0.00 -0.02 0.00 0.00 33.50 31.27 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 10.40 4.46 -0.05 2.45 0.20 0.04 -4.60 118.68 131.59 1urk s LEU 122 Ca 1.12 0.87 -0.30 0.00 0.69 0.00 0.00 54.13 56.52 1urk s LEU 122 Cb -0.56 -2.49 -0.05 0.00 -0.43 0.00 0.00 46.19 42.65 1urk s LEU 122 CO 0.33 0.34 1.53 0.68 -0.29 0.00 0.00 176.35 178.94 1urk s VAL 123 N -1.04 3.67 -0.10 1.68 -7.23 -1.26 -1.89 120.40 114.23 1urk s VAL 123 Ca 0.22 0.91 0.04 0.00 -1.81 0.00 0.00 61.98 61.34 1urk s VAL 123 Cb -0.16 -3.59 0.00 0.00 0.56 0.00 0.00 36.38 33.20 1urk s VAL 123 CO 0.12 -0.05 -0.22 -1.10 -0.31 0.00 0.00 175.10 173.53 1urk s GLN 124 N 3.44 2.91 0.97 4.82 1.11 -0.67 -4.76 119.66 127.47 1urk s GLN 124 Ca 0.68 -0.83 -0.12 0.00 0.01 0.00 0.00 55.36 55.10 1urk s GLN 124 Cb -0.32 -2.23 0.17 0.00 -1.01 0.00 0.00 33.01 29.62 1urk s GLN 124 CO 0.27 0.13 0.35 0.39 0.01 0.00 0.00 175.29 176.44 1urk n GLU 125 N 3.65 -2.21 -4.69 2.91 1.02 -1.26 -1.51 120.64 118.54 1urk n GLU 125 Ca -0.19 -0.66 -0.32 0.00 -0.02 0.00 0.00 57.16 55.97 1urk n GLU 125 Cb 0.53 -1.43 -0.17 0.00 -0.02 0.00 0.00 31.44 30.35 1urk n GLU 125 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1urk s MET 127 N 0.79 3.70 -0.02 0.00 0.23 -1.00 -4.67 119.30 118.33 1urk s MET 127 Ca -0.08 0.50 0.20 0.00 -1.03 0.00 0.00 55.69 55.28 1urk s MET 127 Cb -0.16 -3.91 0.34 0.00 -1.53 0.00 0.00 34.83 29.58 1urk s MET 127 CO -0.01 -1.34 1.14 1.33 -2.03 0.00 0.00 175.02 174.11 1urk n VAL 128 N 6.74 0.08 -2.19 5.16 0.24 -1.26 -4.90 118.33 122.20 1urk n VAL 128 Ca 0.11 -0.90 -0.26 0.00 -2.04 0.00 0.00 64.34 61.25 1urk n VAL 128 Cb 0.49 0.91 0.09 0.00 -1.47 0.00 0.00 33.84 33.86 1urk n VAL 128 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1urk s HIS 129 N -0.24 2.54 0.01 6.34 5.04 -1.26 -4.80 115.29 122.92 1urk s HIS 129 Ca 0.25 0.35 -0.01 0.00 -1.54 0.00 0.00 55.06 54.11 1urk s HIS 129 Cb 0.30 -3.33 0.00 0.00 0.04 0.00 0.00 32.58 29.59 1urk s HIS 129 CO -0.12 -1.66 0.01 -0.25 -2.34 0.00 0.00 174.74 170.38 1urk n ASP 130 N -3.06 -8.73 -2.56 9.88 9.92 -1.26 -4.87 116.55 115.86 1urk n ASP 130 Ca 0.10 1.82 -0.19 0.00 -0.53 0.00 0.00 54.79 56.00 1urk n ASP 130 Cb 0.60 -5.06 0.01 0.00 -0.64 0.00 0.00 41.12 36.03 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 -0.29 1.62 -2.30 0.00 0.00 -1.26 -5.03 120.51 113.25 1urk n ALA 132 Ca 0.25 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.65 1urk n ALA 132 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.19 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 -0.62 -0.75 -0.02 0.00 8.00 -1.26 -4.93 116.55 116.97 1urk n ASP 133 Ca 0.00 -2.06 -0.02 0.00 0.71 0.00 0.00 54.79 53.42 1urk n ASP 133 Cb 0.00 0.30 -0.02 0.00 -0.02 0.00 0.00 41.12 41.37 1urk n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1urk n GLY 134 N -0.42 -0.14 0.09 0.44 0.00 -1.26 -5.27 105.19 98.62 1urk n GLY 134 Ca -0.19 -0.05 0.01 0.00 0.00 0.00 0.00 46.02 45.79 1urk n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60