#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 0.27 -0.85 5.09 1.01 -1.26 -5.05 120.40 119.61 1urk s VAL 7 Ca 0.00 -2.09 -0.17 0.00 0.00 0.00 0.00 61.98 59.72 1urk s VAL 7 Cb 0.00 -1.21 -0.22 0.00 0.00 0.00 0.00 36.38 34.95 1urk s VAL 7 CO 0.00 -1.07 2.19 -2.65 0.00 0.00 0.00 175.10 173.57 1urk n PRO 8 N 3.59 0.25 -2.78 2.72 -0.02 -1.26 -4.79 135.00 132.72 1urk n PRO 8 Ca 0.18 -0.50 -0.43 0.00 -2.02 0.00 0.00 63.50 60.73 1urk n PRO 8 Cb 0.41 -2.40 0.01 0.00 -0.02 0.00 0.00 33.50 31.49 1urk n PRO 8 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1urk n SER 9 N 12.33 5.87 -2.71 2.55 7.64 -1.26 -4.83 113.62 133.21 1urk n SER 9 Ca 0.52 -3.27 -0.05 0.00 1.01 0.00 0.00 58.87 57.08 1urk n SER 9 Cb 0.32 -1.36 -0.04 0.00 -1.01 0.00 0.00 64.21 62.12 1urk n SER 9 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1urk n ASN 10 N 2.44 -1.88 0.00 6.43 3.02 -1.26 -4.68 115.26 119.32 1urk n ASN 10 Ca 0.31 1.27 0.00 0.00 -0.03 0.00 0.00 54.58 56.13 1urk n ASN 10 Cb 0.35 -4.50 0.00 0.00 -0.61 0.00 0.00 39.78 35.01 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 -1.23 -1.84 0.00 0.00 9.92 -1.26 -4.90 116.55 117.24 1urk n ASP 12 Ca 0.00 -2.63 0.00 0.00 -0.53 0.00 0.00 54.79 51.63 1urk n ASP 12 Cb 0.00 0.50 0.00 0.00 -0.64 0.00 0.00 41.12 40.98 1urk n ASP 12 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1urk n LEU 14 N 0.00 0.00 -2.30 0.00 4.32 0.83 -4.84 117.00 115.00 1urk n LEU 14 Ca 0.00 0.00 -0.20 0.00 -0.02 0.00 0.00 56.01 55.79 1urk n LEU 14 Cb 0.00 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 41.78 1urk n LEU 14 CO 0.00 0.00 -0.24 -3.20 -1.22 0.00 0.00 177.39 172.73 1urk n ASN 15 N -2.85 -5.58 -3.82 -1.43 5.15 -1.25 -1.59 115.26 103.89 1urk n ASN 15 Ca 0.00 0.07 -0.27 0.00 -0.60 0.00 0.00 54.58 53.78 1urk n ASN 15 Cb 0.00 -4.69 0.04 0.00 -0.53 0.00 0.00 39.78 34.60 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 -0.91 -0.47 2.27 8.20 0.00 -1.26 -4.93 105.19 108.10 1urk n GLY 16 Ca -0.23 0.19 -0.13 0.00 0.00 0.00 0.00 46.02 45.85 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 -1.72 -2.16 3.44 -0.02 0.00 -0.62 -4.86 105.19 99.26 1urk n GLY 17 Ca -0.03 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 44.86 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 -1.69 5.01 0.60 2.61 2.01 -0.99 -4.95 115.64 118.24 1urk s THR 18 Ca 0.28 -0.58 -0.19 0.00 0.31 0.00 0.00 61.69 61.51 1urk s THR 18 Cb -0.05 -4.19 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 1urk s THR 18 CO 0.24 -0.65 1.15 0.00 -0.69 0.00 0.00 174.62 174.67 1urk s VAL 20 N -1.42 0.14 -0.24 0.00 -7.23 -0.59 -4.78 120.40 106.28 1urk s VAL 20 Ca 0.77 -1.12 -0.28 0.00 -1.81 0.00 0.00 61.98 59.54 1urk s VAL 20 Cb -0.41 -1.08 0.15 0.00 0.56 0.00 0.00 36.38 35.60 1urk s VAL 20 CO 0.45 -0.62 1.14 -0.44 -0.31 0.00 0.00 175.10 175.32 1urk s SER 21 N -2.39 -0.29 0.07 4.85 0.01 -1.26 0.08 113.70 114.78 1urk s SER 21 Ca -0.01 0.44 0.00 0.00 1.31 0.00 0.00 55.95 57.69 1urk s SER 21 Cb 0.01 0.40 0.00 0.00 0.21 0.00 0.00 66.02 66.65 1urk s SER 21 CO -0.07 -0.18 0.00 -3.20 0.41 0.00 0.00 173.24 170.20 1urk n ASN 22 N 1.29 -0.11 0.08 2.44 5.15 -1.18 -4.97 115.26 117.96 1urk n ASN 22 Ca -0.09 -0.02 0.00 0.00 -0.60 0.00 0.00 54.58 53.87 1urk n ASN 22 Cb 0.57 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.82 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 -0.13 0.00 -1.09 1.20 4.81 -1.26 -4.82 118.16 116.88 1urk n LYS 23 Ca 0.00 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.19 1urk n LYS 23 Cb 0.00 -0.20 0.06 0.00 0.02 0.00 0.00 35.03 34.91 1urk n LYS 23 CO 0.00 0.00 0.00 2.48 1.17 0.00 0.00 177.40 181.05 1urk n TYR 24 N -3.27 2.33 -0.10 5.64 0.18 -1.26 -4.86 117.16 115.82 1urk n TYR 24 Ca 0.00 -2.41 0.00 0.00 1.88 0.00 0.00 57.90 57.37 1urk n TYR 24 Cb 0.06 -1.17 0.00 0.00 -0.38 0.00 0.00 39.34 37.85 1urk n TYR 24 CO 0.00 0.00 0.00 1.97 -2.08 0.00 0.00 176.86 176.75 1urk n PHE 25 N -0.27 0.00 0.00 -3.48 1.16 -1.26 -5.09 117.46 108.52 1urk n PHE 25 Ca 0.45 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 56.03 1urk n PHE 25 Cb 0.66 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.53 1urk n PHE 25 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 1urk n SER 26 N 0.00 0.47 -2.68 5.98 2.88 -1.26 -5.00 113.62 114.01 1urk n SER 26 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 1urk n SER 26 Cb 0.00 0.01 0.10 0.00 -0.75 0.00 0.00 64.21 63.57 1urk n SER 26 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1urk n ASN 27 N -1.47 -1.49 -2.86 -3.46 2.85 -1.26 -5.04 115.26 102.55 1urk n ASN 27 Ca 0.00 -2.28 -0.31 0.00 -0.11 0.00 0.00 54.58 51.87 1urk n ASN 27 Cb 0.06 1.32 -0.00 0.00 1.24 0.00 0.00 39.78 42.40 1urk n ASN 27 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1urk n ILE 28 N 0.37 3.33 -2.97 -1.44 2.08 -1.26 -4.98 119.36 114.50 1urk n ILE 28 Ca -0.04 -5.14 -0.43 0.00 0.56 0.00 0.00 62.75 57.69 1urk n ILE 28 Cb 0.74 -1.34 -0.04 0.00 -0.75 0.00 0.00 39.64 38.25 1urk n ILE 28 CO 0.00 0.00 0.00 -1.00 0.56 0.00 0.00 176.55 176.11 1urk s HIS 29 N -3.74 2.83 0.00 1.39 3.76 -1.26 -3.09 115.29 115.18 1urk s HIS 29 Ca 0.48 -0.56 0.00 0.00 -0.15 0.00 0.00 55.06 54.83 1urk s HIS 29 Cb 0.35 -4.06 0.00 0.00 1.11 0.00 0.00 32.58 29.97 1urk s HIS 29 CO -0.21 -1.41 0.00 -2.67 -0.85 0.00 0.00 174.74 169.59 1urk n TRP 30 N 7.08 0.00 -3.93 1.40 2.14 0.11 -4.87 117.44 119.37 1urk n TRP 30 Ca -0.05 0.00 -0.09 0.00 2.07 0.00 0.00 57.50 59.43 1urk n TRP 30 Cb 0.45 0.00 -0.09 0.00 -0.81 0.00 0.00 31.31 30.86 1urk n TRP 30 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1urk s ASN 32 N -2.19 3.58 0.26 0.00 2.47 -0.57 -4.85 114.94 113.64 1urk s ASN 32 Ca -0.04 -1.27 0.07 0.00 0.42 0.00 0.00 52.86 52.05 1urk s ASN 32 Cb -0.01 -0.79 -0.04 0.00 -1.45 0.00 0.00 41.25 38.97 1urk s ASN 32 CO -0.05 -0.35 0.17 0.00 -3.72 0.00 0.00 177.10 173.14 1urk n PRO 34 N -1.14 0.86 0.30 0.00 -0.02 -1.26 -4.82 135.00 128.92 1urk n PRO 34 Ca -0.07 0.31 0.19 0.00 -2.02 0.00 0.00 63.50 61.90 1urk n PRO 34 Cb 0.58 -1.61 0.89 0.00 -0.02 0.00 0.00 33.50 33.35 1urk n PRO 34 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1urk h LYS 35 N 1.38 0.00 -0.38 -0.52 1.57 -1.97 -1.10 116.57 115.55 1urk h LYS 35 Ca -0.38 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 1urk h LYS 35 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 1urk h LYS 35 CO 0.57 0.02 0.00 0.36 -0.57 0.00 0.00 179.45 179.82 1urk n LYS 36 N -3.16 1.65 -3.55 3.15 2.85 -1.26 -4.85 118.16 113.00 1urk n LYS 36 Ca -0.01 -0.81 -0.20 0.00 -1.05 0.00 0.00 58.31 56.25 1urk n LYS 36 Cb 0.21 -1.31 -0.01 0.00 -0.65 0.00 0.00 35.03 33.27 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 -1.66 3.02 0.00 5.58 0.40 -0.42 -2.10 117.98 122.80 1urk s PHE 37 Ca 0.15 -0.26 0.00 0.00 -0.60 0.00 0.00 56.93 56.21 1urk s PHE 37 Cb 0.09 -1.96 0.00 0.00 0.51 0.00 0.00 43.02 41.65 1urk s PHE 37 CO 0.08 0.02 0.00 0.41 0.70 0.00 0.00 175.22 176.44 1urk n GLY 38 N -1.57 1.68 0.00 4.36 0.00 -0.61 -4.90 105.19 104.15 1urk n GLY 38 Ca -0.00 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.25 3.22 5.82 -0.02 0.00 -1.26 -1.64 105.19 111.06 1urk n GLY 39 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 0.00 -2.83 1.61 6.02 -1.26 -0.00 117.38 120.92 1urk n GLN 40 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.72 1urk n GLN 40 Cb 0.00 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 1urk n GLN 40 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 1urk n HIS 41 N 0.00 3.83 -3.52 1.08 -0.00 -1.26 -4.91 115.22 110.44 1urk n HIS 41 Ca 0.00 -3.78 -0.21 0.00 0.46 0.00 0.00 57.72 54.19 1urk n HIS 41 Cb 0.00 -0.39 0.03 0.00 -0.12 0.00 0.00 29.99 29.51 1urk n HIS 41 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1urk n GLU 43 N -3.23 4.93 -4.14 0.00 0.28 -0.91 -1.68 120.64 115.90 1urk n GLU 43 Ca -0.11 -0.00 -0.34 0.00 -0.16 0.00 0.00 57.16 56.54 1urk n GLU 43 Cb 0.59 -0.77 -0.08 0.00 1.43 0.00 0.00 31.44 32.62 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 -1.55 4.76 -0.72 3.84 1.01 -0.65 -4.74 121.20 123.15 1urk s ILE 44 Ca 0.02 -0.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.40 1urk s ILE 44 Cb 0.04 -3.10 0.18 0.00 0.01 0.00 0.00 42.46 39.59 1urk s ILE 44 CO 0.21 0.48 0.56 -0.62 0.00 0.00 0.00 174.94 175.58 1urk s ASP 45 N -1.34 5.56 1.01 3.58 2.15 -1.26 -1.57 116.67 124.81 1urk s ASP 45 Ca 0.18 -3.09 -0.22 0.00 0.43 0.00 0.00 52.55 49.85 1urk s ASP 45 Cb -0.12 -1.90 -0.11 0.00 -0.30 0.00 0.00 42.92 40.49 1urk s ASP 45 CO 0.08 -0.33 -0.90 0.29 -0.17 0.00 0.00 175.17 174.14 1urk n LYS 46 N 3.19 -0.28 0.02 4.34 5.02 -0.89 -4.86 118.16 124.70 1urk n LYS 46 Ca 0.12 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1urk n LYS 46 Cb 0.38 -1.19 0.00 0.00 -0.02 0.00 0.00 35.03 34.20 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 2.22 -0.32 0.00 4.39 2.88 -1.26 -4.97 113.62 116.56 1urk n SER 47 Ca -0.01 0.49 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 1urk n SER 47 Cb 0.66 0.73 0.00 0.00 -0.75 0.00 0.00 64.21 64.84 1urk n SER 47 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 1urk n LYS 48 N -2.96 0.00 -1.65 -1.46 0.00 -1.26 -5.06 118.16 105.76 1urk n LYS 48 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1urk n LYS 48 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 1urk n LYS 48 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1urk n THR 49 N 0.00 -4.44 0.00 0.58 -1.04 -1.26 -5.04 114.28 103.08 1urk n THR 49 Ca 0.00 2.09 0.00 0.00 -2.04 0.00 0.00 64.05 64.10 1urk n THR 49 Cb 0.00 -3.06 0.00 0.00 -1.82 0.00 0.00 70.33 65.45 1urk n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1urk n TYR 51 N -0.83 0.00 0.00 0.00 0.18 -1.26 -4.87 117.16 110.39 1urk n TYR 51 Ca 0.00 0.00 -0.00 0.00 1.88 0.00 0.00 57.90 59.78 1urk n TYR 51 Cb 0.00 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 38.96 1urk n TYR 51 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 1urk n GLU 52 N 0.00 0.01 -0.47 -3.48 2.13 -1.26 -4.42 120.64 113.15 1urk n GLU 52 Ca 0.00 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.60 1urk n GLU 52 Cb 0.00 -0.17 0.19 0.00 0.27 0.00 0.00 31.44 31.73 1urk n GLU 52 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1urk n GLY 53 N 3.01 -2.79 0.25 8.31 0.00 -1.26 -4.84 105.19 107.87 1urk n GLY 53 Ca -0.00 -1.02 -0.03 0.00 0.00 0.00 0.00 46.02 44.96 1urk n GLY 53 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1urk h ASN 54 N -2.87 0.52 0.00 1.61 4.21 -1.96 -3.48 115.58 113.61 1urk h ASN 54 Ca -0.31 -0.16 0.00 0.00 1.21 0.00 0.00 56.30 57.04 1urk h ASN 54 Cb 0.95 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 38.00 1urk h ASN 54 CO 0.20 0.73 0.00 0.61 -1.29 0.00 0.00 177.43 177.68 1urk n GLY 55 N -0.46 0.66 0.00 2.83 0.00 -1.26 -4.21 105.19 102.75 1urk n GLY 55 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 0.00 0.00 -3.67 1.61 -0.00 -1.26 -4.40 115.22 107.50 1urk n HIS 56 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.72 57.42 1urk n HIS 56 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 29.85 1urk n HIS 56 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 1urk s PHE 57 N -1.94 1.47 -0.28 1.57 0.40 -1.26 -4.55 117.98 113.38 1urk s PHE 57 Ca 0.00 -1.77 0.00 0.00 -0.60 0.00 0.00 56.93 54.56 1urk s PHE 57 Cb 0.00 -1.55 0.00 0.00 0.51 0.00 0.00 43.02 41.98 1urk s PHE 57 CO 0.00 -0.85 0.00 2.48 0.70 0.00 0.00 175.22 177.55 1urk n TYR 58 N 4.51 0.00 0.09 0.36 4.11 -1.26 -5.09 117.16 119.88 1urk n TYR 58 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.92 1urk n TYR 58 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.74 1urk n TYR 58 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1urk n ARG 59 N 0.00 0.00 0.00 -3.48 3.00 -1.26 -5.03 116.66 109.89 1urk n ARG 59 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 1urk n ARG 59 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 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 0.20 3.09 0.00 -0.13 0.00 -1.26 -4.80 105.19 102.29 1urk n GLY 60 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 14.00 0.00 -2.04 1.61 3.00 -1.26 -5.11 118.16 128.37 1urk n LYS 61 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.29 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 -2.78 0.19 3.14 0.00 -1.26 -4.72 120.51 112.08 1urk n ALA 62 Ca 0.00 0.85 0.02 0.00 0.00 0.00 0.00 53.44 54.31 1urk n ALA 62 Cb 0.00 -1.87 0.01 0.00 0.00 0.00 0.00 19.45 17.59 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 1.21 1.22 -4.97 0.00 7.64 -1.26 -3.98 113.62 113.47 1urk n SER 63 Ca -0.11 -1.11 -0.21 0.00 1.01 0.00 0.00 58.87 58.45 1urk n SER 63 Cb 0.17 0.14 -0.00 0.00 -1.01 0.00 0.00 64.21 63.51 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 -0.51 4.34 0.00 0.44 -4.23 -1.26 -4.09 115.64 110.33 1urk s THR 64 Ca 0.05 -0.80 0.00 0.00 -1.18 0.00 0.00 61.69 59.76 1urk s THR 64 Cb 0.04 -3.55 0.00 0.00 1.34 0.00 0.00 72.50 70.33 1urk s THR 64 CO 0.07 -0.27 0.00 -0.90 -0.54 0.00 0.00 174.62 172.98 1urk n ASP 65 N -1.74 0.00 -1.40 3.99 5.75 -0.91 -3.92 116.55 118.33 1urk n ASP 65 Ca -0.02 0.00 -0.08 0.00 -0.01 0.00 0.00 54.79 54.69 1urk n ASP 65 Cb 0.58 0.00 0.07 0.00 -1.03 0.00 0.00 41.12 40.74 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 1.71 0.00 2.12 -2.24 -1.25 -2.15 114.28 112.47 1urk n THR 66 Ca 0.00 -0.66 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1urk n THR 66 Cb 0.00 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 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 -0.06 0.00 0.00 -0.78 2.00 -1.26 -4.94 117.12 112.09 1urk n MET 67 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.90 1urk n MET 67 Cb 0.89 -0.63 0.00 0.00 0.00 0.00 0.00 33.22 33.48 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 2.35 1.21 3.74 3.03 0.00 -1.25 -5.11 105.19 109.15 1urk n GLY 68 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 2.49 0.00 1.61 1.70 -1.26 -4.70 118.95 118.79 1urk s ARG 69 Ca 0.00 1.78 0.13 0.00 -0.47 0.00 0.00 55.73 57.17 1urk s ARG 69 Cb 0.00 -1.87 0.77 0.00 -0.57 0.00 0.00 34.95 33.27 1urk s ARG 69 CO 0.00 -1.57 1.23 -0.35 -1.08 0.00 0.00 175.30 173.53 1urk n PRO 70 N -2.27 0.60 -0.43 3.89 -0.04 -1.26 -2.13 135.00 133.35 1urk n PRO 70 Ca 0.13 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.65 1urk n PRO 70 Cb 0.50 -1.34 -0.02 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 -5.38 4.09 0.43 0.00 1.43 -0.38 -4.92 118.68 113.96 1urk s LEU 72 Ca 0.00 1.20 -0.23 0.00 -1.03 0.00 0.00 54.13 54.07 1urk s LEU 72 Cb 0.00 -3.35 -0.11 0.00 0.03 0.00 0.00 46.19 42.76 1urk s LEU 72 CO 0.00 -0.59 0.76 -2.65 0.23 0.00 0.00 176.35 174.11 1urk n PRO 73 N 6.14 0.90 0.14 1.29 -0.02 -1.26 -4.71 135.00 137.48 1urk n PRO 73 Ca 0.09 0.33 0.09 0.00 -2.02 0.00 0.00 63.50 61.98 1urk n PRO 73 Cb 0.47 -1.77 0.47 0.00 -0.02 0.00 0.00 33.50 32.65 1urk n PRO 73 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1urk n TRP 74 N -0.78 0.59 0.02 6.00 7.02 -0.92 -0.40 117.44 128.97 1urk n TRP 74 Ca 0.11 0.31 -0.10 0.00 -1.02 0.00 0.00 57.50 56.79 1urk n TRP 74 Cb 0.40 -0.96 -0.13 0.00 -2.42 0.00 0.00 31.31 28.20 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 0.09 -0.02 -0.99 -1.24 -1.83 -1.42 115.58 110.17 1urk h ASN 75 Ca 0.00 -0.15 -0.63 0.00 0.71 0.00 0.00 56.30 56.24 1urk h ASN 75 Cb 0.09 -0.03 -0.07 0.00 0.73 0.00 0.00 38.32 39.05 1urk h ASN 75 CO 0.00 1.12 1.55 -1.20 -1.29 0.00 0.00 177.43 177.62 1urk n SER 76 N -3.24 0.53 -0.49 1.15 7.64 0.46 -4.62 113.62 115.06 1urk n SER 76 Ca -0.12 0.41 0.37 0.00 1.01 0.00 0.00 58.87 60.54 1urk n SER 76 Cb 1.02 -0.92 0.58 0.00 -1.01 0.00 0.00 64.21 63.87 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 9.13 1.32 0.32 -0.43 0.00 -1.26 -0.03 120.51 129.56 1urk n ALA 77 Ca 0.60 0.48 -0.13 0.00 0.00 0.00 0.00 53.44 54.39 1urk n ALA 77 Cb 0.00 -0.80 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.43 0.00 2.02 -1.93 -0.68 112.91 111.89 1urk h THR 78 Ca 0.66 -0.15 0.07 0.00 0.77 0.00 0.00 66.41 67.77 1urk h THR 78 Cb 2.63 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 69.02 1urk h THR 78 CO -0.03 0.00 0.29 1.62 0.37 0.00 0.00 175.52 177.77 1urk h VAL 79 N -0.97 0.93 -0.92 3.16 3.04 -0.74 0.34 116.25 121.09 1urk h VAL 79 Ca -0.08 -0.10 0.04 0.00 -1.01 0.00 0.00 66.70 65.55 1urk h VAL 79 Cb 0.63 0.62 -0.06 0.00 -2.01 0.00 0.00 31.29 30.48 1urk h VAL 79 CO 0.14 0.05 0.59 -0.07 -1.01 0.00 0.00 177.57 177.27 1urk h LEU 80 N 0.28 0.98 -1.62 3.16 3.38 -1.03 0.31 115.31 120.76 1urk h LEU 80 Ca 0.19 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 1urk h LEU 80 Cb 0.41 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1urk h LEU 80 CO -0.04 0.66 0.12 1.56 0.09 0.00 0.00 178.44 180.82 1urk h GLN 81 N 1.13 0.36 0.00 1.13 4.20 0.12 -3.42 115.11 118.65 1urk h GLN 81 Ca 0.38 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.05 1urk h GLN 81 Cb 0.05 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1urk h GLN 81 CO -0.14 0.30 0.00 1.04 -0.67 0.00 0.00 178.83 179.36 1urk n GLN 82 N -4.44 3.19 0.00 1.46 6.02 0.11 -5.11 117.38 118.61 1urk n GLN 82 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.00 1urk n GLN 82 Cb 0.12 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.38 1urk n GLN 82 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1urk n THR 83 N 0.00 0.00 -2.55 5.09 -1.04 -1.24 -4.80 114.28 109.73 1urk n THR 83 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1urk n THR 83 Cb 0.00 -0.01 0.00 0.00 -1.82 0.00 0.00 70.33 68.50 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 0.00 -0.42 -1.42 4.01 -1.26 -4.75 117.16 113.32 1urk n TYR 84 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1urk n TYR 84 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 -0.79 0.00 -1.88 -0.72 1.44 -1.26 -4.93 115.22 107.08 1urk n HIS 85 Ca 0.00 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.36 1urk n HIS 85 Cb 0.00 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.15 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 6.06 0.00 1.59 0.00 -0.54 -3.82 120.51 120.80 1urk n ALA 86 Ca 0.00 -3.96 0.00 0.00 0.00 0.00 0.00 53.44 49.48 1urk n ALA 86 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 17.95 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 -0.64 0.00 -2.69 0.00 8.25 -1.26 -4.93 115.22 113.95 1urk n HIS 87 Ca 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.98 1urk n HIS 87 Cb 0.50 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.61 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 -2.77 -0.41 -4.01 -1.26 -5.01 116.66 103.21 1urk n ARG 88 Ca 0.00 0.00 -0.32 0.00 -1.04 0.00 0.00 57.85 56.49 1urk n ARG 88 Cb 0.00 0.00 -0.01 0.00 -3.04 0.00 0.00 32.46 29.41 1urk n ARG 88 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1urk n SER 89 N -0.36 5.62 0.00 2.89 7.64 -1.26 -4.51 113.62 123.64 1urk n SER 89 Ca 0.00 -3.70 0.00 0.00 1.01 0.00 0.00 58.87 56.18 1urk n SER 89 Cb 0.00 -0.78 0.00 0.00 -1.01 0.00 0.00 64.21 62.42 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 -0.21 0.00 0.32 6.43 9.92 -1.26 -4.83 116.55 126.91 1urk n ASP 90 Ca 0.38 0.00 0.15 0.00 -0.53 0.00 0.00 54.79 54.79 1urk n ASP 90 Cb 0.36 0.00 0.78 0.00 -0.64 0.00 0.00 41.12 41.62 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 1.42 0.19 2.24 0.00 -1.83 -2.47 119.26 118.82 1urk h ALA 91 Ca 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1urk h ALA 91 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1urk h ALA 91 CO 0.00 -0.38 -0.09 1.37 0.00 0.00 0.00 179.25 180.14 1urk h LEU 92 N 0.00 -0.22 -1.06 0.00 -0.00 -1.89 2.65 115.31 114.80 1urk h LEU 92 Ca 0.01 0.01 0.05 0.00 -0.00 0.00 0.00 57.88 57.95 1urk h LEU 92 Cb 0.75 0.06 -0.06 0.00 -0.00 0.00 0.00 40.66 41.41 1urk h LEU 92 CO -0.00 -0.15 0.63 -0.61 -0.00 0.00 0.00 178.44 178.32 1urk h GLN 93 N -0.27 1.15 -0.65 0.17 4.15 -1.82 -2.12 115.11 115.71 1urk h GLN 93 Ca -0.03 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.32 1urk h GLN 93 Cb 0.20 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 27.63 1urk h GLN 93 CO 0.04 0.76 0.00 1.28 -1.93 0.00 0.00 178.83 178.98 1urk n LEU 94 N -4.46 3.77 -3.54 -2.39 7.99 -1.07 -5.00 117.00 112.30 1urk n LEU 94 Ca 0.14 -1.96 -0.34 0.00 -0.01 0.00 0.00 56.01 53.84 1urk n LEU 94 Cb 0.13 -0.44 0.03 0.00 -0.11 0.00 0.00 43.42 43.04 1urk n LEU 94 CO 0.34 0.93 -0.24 0.61 -1.51 0.00 0.00 177.39 177.52 1urk n GLY 95 N 1.47 -0.28 0.00 -0.72 0.00 0.88 -4.97 105.19 101.57 1urk n GLY 95 Ca 0.22 1.03 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 -0.80 0.00 0.00 0.99 4.77 -0.34 -4.98 117.00 116.64 1urk n LEU 96 Ca -0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1urk n LEU 96 Cb 0.67 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.76 1urk n LEU 96 CO 0.57 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 1urk n GLY 97 N 4.58 1.00 2.95 -0.72 0.00 -1.25 -4.78 105.19 106.97 1urk n GLY 97 Ca 0.00 -1.41 -0.31 0.00 0.00 0.00 0.00 46.02 44.30 1urk n GLY 97 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1urk s LYS 98 N 0.00 1.37 0.00 1.61 -2.85 -1.26 -3.65 119.74 114.96 1urk s LYS 98 Ca 0.00 -1.58 0.00 0.00 -1.00 0.00 0.00 55.97 53.39 1urk s LYS 98 Cb 0.00 -2.85 0.00 0.00 -2.06 0.00 0.00 37.83 32.92 1urk s LYS 98 CO 0.00 -0.89 0.00 -2.39 0.10 0.00 0.00 175.35 172.17 1urk n HIS 99 N 4.44 -0.20 -3.39 1.78 1.44 -1.26 -4.95 115.22 113.07 1urk n HIS 99 Ca -0.00 0.00 -0.26 0.00 -2.01 0.00 0.00 57.72 55.45 1urk n HIS 99 Cb 0.42 0.00 -0.09 0.00 0.12 0.00 0.00 29.99 30.44 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 -0.20 0.11 -3.96 4.39 0.23 -1.26 -2.16 115.26 112.41 1urk n ASN 100 Ca 0.00 -2.56 -0.26 0.00 -0.53 0.00 0.00 54.58 51.24 1urk n ASN 100 Cb 0.00 -0.59 -0.07 0.00 -2.08 0.00 0.00 39.78 37.04 1urk n ASN 100 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1urk n TYR 101 N 2.36 0.45 -2.94 -2.53 4.02 -1.26 -4.57 117.16 112.68 1urk n TYR 101 Ca 0.27 -2.40 -0.20 0.00 -0.01 0.00 0.00 57.90 55.56 1urk n TYR 101 Cb 0.48 -0.11 0.06 0.00 -0.02 0.00 0.00 39.34 39.76 1urk n TYR 101 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1urk n ARG 103 N -2.32 -0.51 -2.70 0.00 -4.01 -1.25 -5.00 116.66 100.88 1urk n ARG 103 Ca 0.15 0.00 -0.06 0.00 -1.04 0.00 0.00 57.85 56.90 1urk n ARG 103 Cb 0.61 0.00 0.09 0.00 -3.04 0.00 0.00 32.46 30.12 1urk n ARG 103 CO 0.00 0.00 0.00 -1.71 -3.04 0.00 0.00 177.63 172.88 1urk n ASN 104 N 0.21 -1.84 0.12 2.89 4.05 -1.26 -2.01 115.26 117.41 1urk n ASN 104 Ca 0.00 -2.58 0.06 0.00 0.45 0.00 0.00 54.58 52.52 1urk n ASN 104 Cb 0.00 1.37 0.34 0.00 1.23 0.00 0.00 39.78 42.72 1urk n ASN 104 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 177.26 171.56 1urk n PRO 105 N 0.93 0.08 -0.22 1.20 -0.02 -1.26 -1.57 135.00 134.15 1urk n PRO 105 Ca 0.02 0.54 0.03 0.00 -2.02 0.00 0.00 63.50 62.07 1urk n PRO 105 Cb 0.71 -1.92 0.05 0.00 -0.02 0.00 0.00 33.50 32.31 1urk n PRO 105 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1urk n ASP 106 N -1.94 1.03 0.00 2.55 2.03 -1.26 -5.04 116.55 113.91 1urk n ASP 106 Ca -0.01 -2.21 0.00 0.00 0.52 0.00 0.00 54.79 53.10 1urk n ASP 106 Cb 0.17 -0.22 0.00 0.00 -0.72 0.00 0.00 41.12 40.35 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 -0.54 0.00 -0.91 1.67 2.85 -0.61 -4.73 115.26 112.99 1urk n ASN 107 Ca 0.05 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.43 1urk n ASN 107 Cb 0.59 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.57 1urk n ASN 107 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1urk n ARG 108 N 0.00 -1.57 -2.17 1.20 0.63 -1.26 -2.08 116.66 111.40 1urk n ARG 108 Ca 0.00 0.69 -0.02 0.00 -0.92 0.00 0.00 57.85 57.60 1urk n ARG 108 Cb 0.00 -4.84 -0.00 0.00 0.45 0.00 0.00 32.46 28.07 1urk n ARG 108 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 1urk n ARG 109 N -1.00 -2.47 0.00 -0.14 0.63 -1.26 -4.71 116.66 107.71 1urk n ARG 109 Ca -0.09 0.10 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1urk n ARG 109 Cb 0.44 -4.51 0.00 0.00 0.45 0.00 0.00 32.46 28.84 1urk n ARG 109 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1urk n ARG 110 N -2.24 0.00 -1.58 -0.14 1.74 -0.88 -4.99 116.66 108.56 1urk n ARG 110 Ca -0.02 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.61 1urk n ARG 110 Cb 0.42 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.84 1urk n ARG 110 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1urk n PRO 111 N 0.00 1.31 -4.39 5.56 -0.02 -1.26 -4.76 135.00 131.45 1urk n PRO 111 Ca 0.00 0.46 -0.20 0.00 -2.02 0.00 0.00 63.50 61.74 1urk n PRO 111 Cb 0.00 -1.82 -0.10 0.00 -0.02 0.00 0.00 33.50 31.56 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 -1.02 1.71 -0.01 6.00 1.48 -0.85 0.17 118.94 126.41 1urk s TRP 112 Ca 0.59 -1.16 -0.07 0.00 -1.06 0.00 0.00 56.10 54.40 1urk s TRP 112 Cb -0.71 -1.04 0.01 0.00 -1.16 0.00 0.00 33.47 30.56 1urk s TRP 112 CO 0.60 -0.26 0.15 0.00 -4.06 0.00 0.00 176.95 173.38 1urk s TYR 114 N -1.01 1.97 -0.17 0.00 2.02 -1.26 -1.54 117.35 117.36 1urk s TYR 114 Ca -0.11 0.39 -0.07 0.00 -0.37 0.00 0.00 57.07 56.91 1urk s TYR 114 Cb -0.06 -4.05 -0.04 0.00 -0.40 0.00 0.00 41.96 37.41 1urk s TYR 114 CO 0.01 -1.33 0.06 0.54 -1.57 0.00 0.00 175.55 173.26 1urk s VAL 115 N 10.50 4.75 -0.00 0.71 0.11 -0.29 -1.24 120.40 134.93 1urk s VAL 115 Ca 0.68 -0.05 -0.37 0.00 -2.93 0.00 0.00 61.98 59.31 1urk s VAL 115 Cb -0.02 -3.12 -0.15 0.00 -1.53 0.00 0.00 36.38 31.56 1urk s VAL 115 CO 0.10 0.49 1.55 0.00 -3.33 0.00 0.00 175.10 173.91 1urk n GLN 116 N 3.26 1.48 -0.71 1.54 6.02 -1.26 -0.54 117.38 127.18 1urk n GLN 116 Ca -0.17 0.54 0.03 0.00 -0.01 0.00 0.00 57.00 57.38 1urk n GLN 116 Cb 0.53 -2.24 0.29 0.00 1.02 0.00 0.00 30.24 29.83 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 3.49 2.15 0.00 5.09 3.14 -0.55 -4.74 118.33 126.90 1urk n VAL 117 Ca 0.20 -1.10 0.00 0.00 -2.96 0.00 0.00 64.34 60.49 1urk n VAL 117 Cb 0.21 -0.37 0.00 0.00 -1.06 0.00 0.00 33.84 32.62 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 0.33 1.86 0.00 7.55 0.00 -1.26 -4.71 105.19 108.96 1urk n GLY 118 Ca 0.24 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -3.74 0.99 -0.00 -1.26 -5.10 117.00 107.89 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 -0.09 -1.59 -0.00 0.00 0.00 177.39 175.71 1urk s LYS 120 N 0.00 0.25 -0.77 1.47 0.00 -1.26 -5.07 119.74 114.36 1urk s LYS 120 Ca 0.00 0.50 -0.24 0.00 0.00 0.00 0.00 55.97 56.23 1urk s LYS 120 Cb 0.00 -0.03 -0.17 0.00 0.00 0.00 0.00 37.83 37.63 1urk s LYS 120 CO 0.00 -0.12 2.42 -2.30 0.00 0.00 0.00 175.35 175.34 1urk n PRO 121 N 3.82 0.51 -3.53 1.78 -0.02 -1.26 -1.49 135.00 134.80 1urk n PRO 121 Ca -0.21 -0.30 -0.37 0.00 -2.02 0.00 0.00 63.50 60.60 1urk n PRO 121 Cb 0.55 -2.76 -0.06 0.00 -0.02 0.00 0.00 33.50 31.21 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 10.34 4.43 -0.28 2.45 2.96 0.30 -4.62 118.68 134.27 1urk s LEU 122 Ca 1.09 0.90 -0.29 0.00 -0.22 0.00 0.00 54.13 55.61 1urk s LEU 122 Cb -0.46 -2.70 0.00 0.00 0.50 0.00 0.00 46.19 43.53 1urk s LEU 122 CO 0.29 0.28 1.22 0.68 -1.32 0.00 0.00 176.35 177.51 1urk s VAL 123 N -1.18 4.29 -0.20 1.68 -7.23 -1.25 -1.14 120.40 115.37 1urk s VAL 123 Ca 0.26 1.49 -0.03 0.00 -1.81 0.00 0.00 61.98 61.89 1urk s VAL 123 Cb -0.16 -4.20 -0.01 0.00 0.56 0.00 0.00 36.38 32.57 1urk s VAL 123 CO 0.14 -0.40 -0.05 -1.10 -0.31 0.00 0.00 175.10 173.38 1urk s GLN 124 N 3.86 3.43 -0.41 4.82 1.11 -0.59 -4.74 119.66 127.14 1urk s GLN 124 Ca 0.52 -0.61 -0.33 0.00 0.01 0.00 0.00 55.36 54.95 1urk s GLN 124 Cb -0.16 -2.96 -0.11 0.00 -1.01 0.00 0.00 33.01 28.77 1urk s GLN 124 CO 0.19 -0.09 2.26 0.39 0.01 0.00 0.00 175.29 178.05 1urk n GLU 125 N 4.47 1.06 -1.04 2.91 1.02 -1.26 -2.04 120.64 125.76 1urk n GLU 125 Ca -0.18 0.25 -0.36 0.00 -0.02 0.00 0.00 57.16 56.85 1urk n GLU 125 Cb 0.51 -2.57 -0.03 0.00 -0.02 0.00 0.00 31.44 29.33 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 -0.67 3.68 -0.28 0.00 -1.94 -0.91 -4.73 119.30 114.45 1urk s MET 127 Ca 0.49 -1.75 -0.01 0.00 -1.71 0.00 0.00 55.69 52.72 1urk s MET 127 Cb -0.71 -5.06 0.14 0.00 2.01 0.00 0.00 34.83 31.20 1urk s MET 127 CO 0.42 -1.89 0.32 0.08 -0.01 0.00 0.00 175.02 173.93 1urk s VAL 128 N 3.09 -0.46 0.00 -6.03 1.01 -1.26 -4.96 120.40 111.79 1urk s VAL 128 Ca 0.38 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.99 1urk s VAL 128 Cb -0.03 -0.94 0.00 0.00 0.00 0.00 0.00 36.38 35.41 1urk s VAL 128 CO -0.07 -0.37 0.00 1.57 0.00 0.00 0.00 175.10 176.23 1urk n HIS 129 N 5.33 0.00 -0.59 5.22 -0.00 -1.26 -4.89 115.22 119.03 1urk n HIS 129 Ca -0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.16 1urk n HIS 129 Cb 0.48 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.35 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 0.00 -0.33 -4.17 0.26 5.68 -1.26 -4.18 116.55 112.55 1urk n ASP 130 Ca 0.00 -0.59 -0.34 0.00 -0.50 0.00 0.00 54.79 53.36 1urk n ASP 130 Cb 0.00 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.83 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 4.65 0.00 -3.17 0.00 0.00 -1.26 -5.09 120.51 115.64 1urk n ALA 132 Ca -0.18 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.12 1urk n ALA 132 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.89 1urk n ALA 132 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1urk s ASP 133 N 0.00 0.12 -2.00 0.00 1.11 -1.26 -4.89 116.67 109.75 1urk s ASP 133 Ca 0.00 -1.93 0.00 0.00 0.18 0.00 0.00 52.55 50.80 1urk s ASP 133 Cb 0.00 0.88 0.00 0.00 1.07 0.00 0.00 42.92 44.87 1urk s ASP 133 CO 0.00 -0.16 0.00 0.61 1.18 0.00 0.00 175.17 176.80 1urk n GLY 134 N 3.49 1.37 0.00 0.21 0.00 -1.26 -5.24 105.19 103.77 1urk n GLY 134 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1urk n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60