#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 0.22 0.26 5.09 0.31 -1.26 -4.49 118.33 118.46 1urk n VAL 7 Ca 0.00 0.45 0.16 0.00 -0.01 0.00 0.00 64.34 64.94 1urk n VAL 7 Cb 0.00 -1.63 0.62 0.00 -0.91 0.00 0.00 33.84 31.92 1urk n VAL 7 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1urk h PRO 8 N -0.15 0.00 -6.24 5.55 0.13 -2.13 -3.42 132.00 125.74 1urk h PRO 8 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 1urk h PRO 8 Cb 0.11 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.21 1urk h PRO 8 CO 0.00 0.05 0.80 0.45 -0.23 0.00 0.00 178.00 179.07 1urk s SER 9 N -5.83 6.99 -0.30 1.44 0.15 -1.26 -4.90 113.70 109.99 1urk s SER 9 Ca 0.01 1.78 0.19 0.00 0.70 0.00 0.00 55.95 58.64 1urk s SER 9 Cb 0.09 -2.55 0.48 0.00 -1.71 0.00 0.00 66.02 62.33 1urk s SER 9 CO 0.57 -0.67 1.04 -3.20 1.20 0.00 0.00 173.24 172.17 1urk n ASN 10 N 5.86 1.76 -2.08 5.45 5.15 -1.26 -4.93 115.26 125.20 1urk n ASN 10 Ca 0.12 -2.48 -0.01 0.00 -0.60 0.00 0.00 54.58 51.62 1urk n ASN 10 Cb 0.45 -0.50 0.01 0.00 -0.53 0.00 0.00 39.78 39.22 1urk n ASN 10 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1urk n ASP 12 N -0.86 -1.39 -3.50 0.00 8.00 -1.26 -4.94 116.55 112.60 1urk n ASP 12 Ca -0.01 -2.08 -0.14 0.00 0.71 0.00 0.00 54.79 53.27 1urk n ASP 12 Cb 0.27 1.19 -0.05 0.00 -0.02 0.00 0.00 41.12 42.50 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 0.47 0.00 -3.90 0.00 4.77 0.19 -4.25 117.00 114.28 1urk n LEU 14 Ca -0.16 -1.14 -0.31 0.00 -0.03 0.00 0.00 56.01 54.37 1urk n LEU 14 Cb 0.59 -0.41 -0.04 0.00 -2.33 0.00 0.00 43.42 41.24 1urk n LEU 14 CO 0.19 -0.83 -0.07 0.59 -1.33 0.00 0.00 177.39 175.93 1urk n ASN 15 N -3.05 -2.51 -3.93 -1.43 4.13 -1.26 -0.97 115.26 106.25 1urk n ASN 15 Ca 0.09 -0.74 -0.41 0.00 1.68 0.00 0.00 54.58 55.21 1urk n ASN 15 Cb 0.34 -2.13 0.03 0.00 -1.54 0.00 0.00 39.78 36.48 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 -1.08 -0.90 1.89 7.41 0.00 -1.26 -4.89 105.19 106.36 1urk n GLY 16 Ca 0.06 0.38 -0.12 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.94 -2.47 3.55 -0.02 0.00 -0.14 -4.74 105.19 99.43 1urk n GLY 17 Ca -0.10 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.52 3.92 -0.14 2.61 2.01 -0.02 -4.90 115.64 117.61 1urk s THR 18 Ca 0.27 -0.57 -0.29 0.00 0.31 0.00 0.00 61.69 61.41 1urk s THR 18 Cb -0.05 -5.02 -0.03 0.00 0.01 0.00 0.00 72.50 67.42 1urk s THR 18 CO 0.22 -1.90 1.48 0.00 -0.69 0.00 0.00 174.62 173.73 1urk s VAL 20 N 4.03 2.47 -0.11 0.00 -7.23 -0.85 -4.96 120.40 113.75 1urk s VAL 20 Ca 0.65 -1.40 -0.11 0.00 -1.81 0.00 0.00 61.98 59.31 1urk s VAL 20 Cb -0.27 -2.86 0.03 0.00 0.56 0.00 0.00 36.38 33.84 1urk s VAL 20 CO 0.23 0.00 0.32 -0.55 -0.31 0.00 0.00 175.10 174.79 1urk s SER 21 N -4.14 -0.31 0.16 4.85 0.15 -1.26 -3.45 113.70 109.70 1urk s SER 21 Ca 0.46 0.57 -0.31 0.00 0.70 0.00 0.00 55.95 57.37 1urk s SER 21 Cb -0.02 0.61 -0.17 0.00 -1.71 0.00 0.00 66.02 64.73 1urk s SER 21 CO 0.27 -0.15 0.76 -3.20 1.20 0.00 0.00 173.24 172.12 1urk n ASN 22 N 2.70 -0.43 0.00 5.45 4.05 0.03 -4.86 115.26 122.20 1urk n ASN 22 Ca -0.14 1.14 0.00 0.00 0.45 0.00 0.00 54.58 56.03 1urk n ASN 22 Cb 0.58 -1.01 0.00 0.00 1.23 0.00 0.00 39.78 40.58 1urk n ASN 22 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 1urk n LYS 23 N 1.17 0.00 0.03 1.20 4.81 -1.26 -4.82 118.16 119.29 1urk n LYS 23 Ca 0.17 0.00 0.11 0.00 -0.87 0.00 0.00 58.31 57.72 1urk n LYS 23 Cb 0.22 -0.41 -0.02 0.00 0.02 0.00 0.00 35.03 34.84 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 -2.34 0.32 -0.11 5.64 4.02 -1.26 -4.90 117.16 118.53 1urk n TYR 24 Ca 0.00 0.09 0.00 0.00 -0.01 0.00 0.00 57.90 57.98 1urk n TYR 24 Cb 0.19 -0.51 0.00 0.00 -0.02 0.00 0.00 39.34 39.00 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 -2.10 0.00 0.00 -0.72 3.72 -1.26 -5.08 117.46 112.01 1urk n PHE 25 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 1urk n PHE 25 Cb 0.47 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.01 1urk n PHE 25 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1urk n SER 26 N 0.00 1.01 -1.34 4.37 7.64 -1.26 -4.91 113.62 119.13 1urk n SER 26 Ca 0.00 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.92 1urk n SER 26 Cb 0.00 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.24 1urk n SER 26 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1urk n ASN 27 N -2.29 1.01 -4.39 6.43 4.13 -1.26 -4.96 115.26 113.94 1urk n ASN 27 Ca 0.00 -2.18 -0.45 0.00 1.68 0.00 0.00 54.58 53.62 1urk n ASN 27 Cb 0.22 -0.31 -0.03 0.00 -1.54 0.00 0.00 39.78 38.12 1urk n ASN 27 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1urk s ILE 28 N -0.32 5.13 0.35 2.41 -1.09 -1.26 -4.91 121.20 121.51 1urk s ILE 28 Ca 0.32 -1.87 0.07 0.00 -2.23 0.00 0.00 60.65 56.94 1urk s ILE 28 Cb 0.36 -4.60 -0.07 0.00 -1.58 0.00 0.00 42.46 36.57 1urk s ILE 28 CO -0.15 -1.24 -0.03 -1.38 -1.23 0.00 0.00 174.94 170.91 1urk s HIS 29 N 1.59 2.29 -0.04 3.97 -3.43 -1.26 -0.79 115.29 117.63 1urk s HIS 29 Ca 0.23 -0.67 -0.12 0.00 -0.80 0.00 0.00 55.06 53.70 1urk s HIS 29 Cb -0.10 -1.46 0.04 0.00 -1.43 0.00 0.00 32.58 29.63 1urk s HIS 29 CO -0.07 0.39 0.52 -2.67 -2.00 0.00 0.00 174.74 170.91 1urk n TRP 30 N -0.80 -0.02 -4.39 0.38 2.14 -1.22 -4.87 117.44 108.66 1urk n TRP 30 Ca -0.05 -0.19 -0.23 0.00 2.07 0.00 0.00 57.50 59.10 1urk n TRP 30 Cb 0.65 0.08 -0.11 0.00 -0.81 0.00 0.00 31.31 31.12 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 -2.94 1.86 0.57 0.00 0.01 -0.72 -4.89 114.94 108.82 1urk s ASN 32 Ca 0.21 -0.61 0.07 0.00 -0.71 0.00 0.00 52.86 51.82 1urk s ASN 32 Cb -0.06 0.31 0.07 0.00 0.41 0.00 0.00 41.25 41.99 1urk s ASN 32 CO 0.10 -0.37 0.61 0.00 -1.51 0.00 0.00 177.10 175.93 1urk n PRO 34 N -2.04 0.83 0.11 0.00 -0.02 -1.26 -4.84 135.00 127.77 1urk n PRO 34 Ca 0.07 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 1urk n PRO 34 Cb 0.61 -1.52 0.31 0.00 -0.02 0.00 0.00 33.50 32.89 1urk n PRO 34 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1urk h LYS 35 N 1.64 0.23 0.00 -0.52 2.10 -2.01 -1.48 116.57 116.54 1urk h LYS 35 Ca -0.35 -0.08 0.00 0.00 -2.00 0.00 0.00 60.65 58.22 1urk h LYS 35 Cb 1.38 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.69 1urk h LYS 35 CO 0.59 0.48 0.00 0.36 -2.00 0.00 0.00 179.45 178.89 1urk n LYS 36 N -4.16 0.39 -0.67 0.07 2.85 -1.26 -4.74 118.16 110.64 1urk n LYS 36 Ca -0.01 0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.32 1urk n LYS 36 Cb 0.37 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 1urk n LYS 36 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 1urk n PHE 37 N -1.17 -3.02 -1.21 5.58 3.01 -0.56 0.21 117.46 120.30 1urk n PHE 37 Ca 0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.57 1urk n PHE 37 Cb 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.58 1urk n PHE 37 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1urk n GLY 38 N 5.00 -2.31 0.55 1.37 0.00 0.41 -4.68 105.19 105.53 1urk n GLY 38 Ca 0.00 -1.33 0.00 0.00 0.00 0.00 0.00 46.02 44.69 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 -0.71 -0.98 4.25 -0.02 0.00 -1.26 0.80 105.19 107.27 1urk n GLY 39 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 0.52 0.00 -1.46 1.61 6.02 -1.26 0.56 117.38 123.37 1urk n GLN 40 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 1urk n GLN 40 Cb 0.00 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.27 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 2.21 -4.18 1.08 8.25 -1.26 -4.78 115.22 116.54 1urk n HIS 41 Ca 0.00 -2.23 -0.32 0.00 -0.26 0.00 0.00 57.72 54.92 1urk n HIS 41 Cb 0.00 -1.26 -0.06 0.00 1.12 0.00 0.00 29.99 29.79 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 -4.60 2.20 -3.71 0.00 0.28 0.93 -2.44 120.64 113.30 1urk n GLU 43 Ca -0.29 -3.20 -0.13 0.00 -0.16 0.00 0.00 57.16 53.38 1urk n GLU 43 Cb 0.67 -2.04 -0.09 0.00 1.43 0.00 0.00 31.44 31.41 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 -3.54 0.01 0.38 3.84 1.01 0.24 -4.92 121.20 118.21 1urk s ILE 44 Ca 0.52 -0.05 -0.04 0.00 0.00 0.00 0.00 60.65 61.08 1urk s ILE 44 Cb 0.45 -0.65 0.08 0.00 0.01 0.00 0.00 42.46 42.35 1urk s ILE 44 CO 0.04 -0.03 0.52 0.47 0.00 0.00 0.00 174.94 175.94 1urk n ASP 45 N 2.57 0.32 -3.05 3.58 9.92 -1.26 0.16 116.55 128.78 1urk n ASP 45 Ca -0.14 -1.36 -0.16 0.00 -0.53 0.00 0.00 54.79 52.60 1urk n ASP 45 Cb 0.57 -0.37 -0.04 0.00 -0.64 0.00 0.00 41.12 40.63 1urk n ASP 45 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1urk n LYS 46 N -2.04 0.64 0.00 -1.24 5.02 0.57 -4.64 118.16 116.46 1urk n LYS 46 Ca 0.07 -2.93 0.00 0.00 -2.02 0.00 0.00 58.31 53.44 1urk n LYS 46 Cb 0.26 2.71 0.00 0.00 -0.02 0.00 0.00 35.03 37.98 1urk n LYS 46 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1urk n SER 47 N -1.64 0.00 0.00 4.39 7.64 -1.26 -4.96 113.62 117.79 1urk n SER 47 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.90 1urk n SER 47 Cb 0.59 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.80 1urk n SER 47 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 1urk n LYS 48 N -1.32 0.92 -2.33 1.43 4.81 -1.26 -5.08 118.16 115.33 1urk n LYS 48 Ca 0.00 -0.82 -0.05 0.00 -0.87 0.00 0.00 58.31 56.57 1urk n LYS 48 Cb 0.00 -0.82 -0.04 0.00 0.02 0.00 0.00 35.03 34.19 1urk n LYS 48 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1urk n THR 49 N -0.20-10.66 -1.20 3.15 -1.04 -1.26 -4.83 114.28 98.24 1urk n THR 49 Ca 0.00 2.16 0.07 0.00 -2.04 0.00 0.00 64.05 64.24 1urk n THR 49 Cb 0.24 -5.86 -0.02 0.00 -1.82 0.00 0.00 70.33 62.88 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 -1.15 3.24 -0.58 0.00 1.13 -1.26 -4.93 117.35 113.80 1urk s TYR 51 Ca 0.00 0.17 0.22 0.00 -1.41 0.00 0.00 57.07 56.05 1urk s TYR 51 Cb 0.00 -2.38 -0.25 0.00 -1.10 0.00 0.00 41.96 38.23 1urk s TYR 51 CO 0.00 -0.12 0.74 -1.91 -2.51 0.00 0.00 175.55 171.75 1urk n GLU 52 N 4.94 0.28 -2.49 -3.49 2.13 -1.26 -4.96 120.64 115.80 1urk n GLU 52 Ca -0.14 -0.08 -0.23 0.00 0.66 0.00 0.00 57.16 57.38 1urk n GLU 52 Cb 0.52 -1.51 0.12 0.00 0.27 0.00 0.00 31.44 30.84 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 1.39 0.55 0.15 8.31 0.00 -1.26 -4.98 105.19 109.35 1urk n GLY 53 Ca 0.01 -2.01 -0.06 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.63 0.02 0.00 1.61 -1.07 -1.93 -3.47 115.58 110.11 1urk h ASN 54 Ca -0.33 0.06 0.00 0.00 0.07 0.00 0.00 56.30 56.10 1urk h ASN 54 Cb 1.19 0.07 0.00 0.00 -2.07 0.00 0.00 38.32 37.51 1urk h ASN 54 CO 0.34 0.05 0.00 0.61 0.07 0.00 0.00 177.43 178.50 1urk n GLY 55 N -1.23 0.71 0.05 9.14 0.00 -1.26 -3.96 105.19 108.63 1urk n GLY 55 Ca 0.01 -0.30 0.06 0.00 0.00 0.00 0.00 46.02 45.79 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 0.19 -3.57 1.61 -0.00 -1.26 -3.93 115.22 108.26 1urk n HIS 56 Ca 0.00 0.06 -0.26 0.00 -0.00 0.00 0.00 57.72 57.52 1urk n HIS 56 Cb 0.00 -0.70 -0.16 0.00 -0.00 0.00 0.00 29.99 29.13 1urk n HIS 56 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 1urk s PHE 57 N -3.24 0.17 0.14 1.57 -0.12 -1.26 -4.75 117.98 110.49 1urk s PHE 57 Ca -0.07 -0.45 0.00 0.00 -0.05 0.00 0.00 56.93 56.36 1urk s PHE 57 Cb 0.11 -0.72 0.00 0.00 -0.63 0.00 0.00 43.02 41.78 1urk s PHE 57 CO 0.87 -0.63 0.00 0.98 -0.05 0.00 0.00 175.22 176.39 1urk n TYR 58 N 5.27 -2.97 -3.10 3.49 9.36 -1.26 -5.05 117.16 122.89 1urk n TYR 58 Ca -0.06 0.49 -0.14 0.00 3.32 0.00 0.00 57.90 61.51 1urk n TYR 58 Cb 0.47 1.53 0.07 0.00 -0.63 0.00 0.00 39.34 40.78 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 -3.04 -3.09 0.00 2.98 1.74 -1.26 -4.99 116.66 109.01 1urk n ARG 59 Ca 0.00 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 57.84 1urk n ARG 59 Cb 0.00 -5.36 0.00 0.00 -1.02 0.00 0.00 32.46 26.08 1urk n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1urk n GLY 60 N -1.22 -1.47 2.81 -0.13 0.00 -1.26 -4.96 105.19 98.95 1urk n GLY 60 Ca -0.12 0.00 0.01 0.00 0.00 0.00 0.00 46.02 45.91 1urk n GLY 60 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1urk s LYS 61 N -0.13 0.26 -0.40 1.61 2.20 -1.26 -5.07 119.74 116.95 1urk s LYS 61 Ca 0.00 -0.11 0.06 0.00 -0.36 0.00 0.00 55.97 55.56 1urk s LYS 61 Cb 0.00 0.03 0.31 0.00 -1.51 0.00 0.00 37.83 36.66 1urk s LYS 61 CO 0.00 -0.37 1.23 0.00 -0.36 0.00 0.00 175.35 175.85 1urk n ALA 62 N 3.64 -1.24 -0.27 3.13 0.00 -1.26 -4.96 120.51 119.55 1urk n ALA 62 Ca 0.07 -1.06 0.18 0.00 0.00 0.00 0.00 53.44 52.63 1urk n ALA 62 Cb 0.63 -1.65 0.47 0.00 0.00 0.00 0.00 19.45 18.89 1urk n ALA 62 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1urk h SER 63 N 2.44 0.50 -4.13 0.00 4.64 -1.94 -3.39 113.55 111.68 1urk h SER 63 Ca -0.23 0.05 -0.49 0.00 -0.47 0.00 0.00 61.79 60.65 1urk h SER 63 Cb 1.18 -0.04 0.14 0.00 -0.31 0.00 0.00 62.40 63.37 1urk h SER 63 CO 0.03 0.20 0.27 0.42 -0.87 0.00 0.00 176.83 176.87 1urk s THR 64 N -5.52 2.77 0.00 2.95 -4.23 -1.25 -4.47 115.64 105.88 1urk s THR 64 Ca -0.09 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.67 1urk s THR 64 Cb 0.23 -2.76 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1urk s THR 64 CO 0.79 -0.33 0.00 0.47 -0.54 0.00 0.00 174.62 175.01 1urk n ASP 65 N -3.79 0.00 -1.41 3.99 8.00 -0.86 -4.40 116.55 118.08 1urk n ASP 65 Ca 0.07 0.00 -0.08 0.00 0.71 0.00 0.00 54.79 55.49 1urk n ASP 65 Cb 0.55 0.00 0.07 0.00 -0.02 0.00 0.00 41.12 41.73 1urk n ASP 65 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1urk n THR 66 N -0.03 1.74 0.05 -3.53 -2.24 0.17 -1.96 114.28 108.47 1urk n THR 66 Ca 0.00 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.09 1urk n THR 66 Cb 0.00 -0.77 0.00 0.00 -2.10 0.00 0.00 70.33 67.46 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 -0.08 0.00 0.00 -0.78 2.81 -1.26 -4.67 117.12 113.15 1urk n MET 67 Ca 0.21 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.10 1urk n MET 67 Cb 0.90 -0.20 0.00 0.00 -0.71 0.00 0.00 33.22 33.22 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 2.18 0.53 3.73 3.03 0.00 -1.26 -5.07 105.19 108.34 1urk n GLY 68 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1urk n GLY 68 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1urk n ARG 69 N 0.00 1.53 0.00 1.61 1.85 -1.26 -4.72 116.66 115.67 1urk n ARG 69 Ca 0.00 0.57 0.05 0.00 -1.00 0.00 0.00 57.85 57.47 1urk n ARG 69 Cb 0.00 -2.54 0.27 0.00 -1.05 0.00 0.00 32.46 29.14 1urk n ARG 69 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1urk n PRO 70 N -1.20 0.15 -0.98 2.89 -0.04 -1.26 -2.02 135.00 132.54 1urk n PRO 70 Ca 0.12 0.19 0.13 0.00 -0.04 0.00 0.00 63.50 63.89 1urk n PRO 70 Cb 0.45 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.37 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 -6.42 4.51 0.33 0.00 1.43 -0.87 -4.91 118.68 112.75 1urk s LEU 72 Ca 0.00 -0.27 -0.27 0.00 -1.03 0.00 0.00 54.13 52.56 1urk s LEU 72 Cb 0.00 -2.48 -0.13 0.00 0.03 0.00 0.00 46.19 43.60 1urk s LEU 72 CO 0.00 -0.49 0.96 -2.65 0.23 0.00 0.00 176.35 174.40 1urk n PRO 73 N 5.66 1.26 0.24 1.29 -0.02 -1.26 -4.59 135.00 137.58 1urk n PRO 73 Ca -0.06 0.45 0.16 0.00 -2.02 0.00 0.00 63.50 62.02 1urk n PRO 73 Cb 0.49 -1.84 0.70 0.00 -0.02 0.00 0.00 33.50 32.82 1urk n PRO 73 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1urk h TRP 74 N 1.78 0.00 0.02 6.00 4.06 -1.65 0.34 115.95 126.49 1urk h TRP 74 Ca -0.40 0.00 -0.26 0.00 2.06 0.00 0.00 58.89 60.29 1urk h TRP 74 Cb 1.35 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.52 1urk h TRP 74 CO 0.46 0.00 -1.04 -0.97 -3.56 0.00 0.00 178.44 173.33 1urk h ASN 75 N 0.00 0.74 0.00 -3.49 -0.73 -1.72 -3.23 115.58 107.16 1urk h ASN 75 Ca 0.08 -0.62 -0.48 0.00 1.87 0.00 0.00 56.30 57.15 1urk h ASN 75 Cb 1.03 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 39.35 1urk h ASN 75 CO -0.00 1.42 1.05 -0.24 -0.37 0.00 0.00 177.43 179.29 1urk n SER 76 N -3.79 0.42 -0.38 1.15 2.88 0.12 -4.29 113.62 109.73 1urk n SER 76 Ca -0.10 0.36 0.30 0.00 -1.33 0.00 0.00 58.87 58.10 1urk n SER 76 Cb 0.88 -0.65 0.48 0.00 -0.75 0.00 0.00 64.21 64.17 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 6.08 1.04 0.27 -1.46 0.00 -1.26 0.09 120.51 125.26 1urk n ALA 77 Ca 0.42 0.49 -0.12 0.00 0.00 0.00 0.00 53.44 54.22 1urk n ALA 77 Cb -0.01 -0.70 -0.06 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 -0.54 0.00 2.02 -1.93 -0.12 112.91 112.34 1urk h THR 78 Ca 0.58 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.73 1urk h THR 78 Cb 2.10 0.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 1urk h THR 78 CO -0.16 0.00 0.20 1.62 0.37 0.00 0.00 175.52 177.56 1urk h VAL 79 N -0.75 1.22 -0.86 3.16 3.04 -0.64 0.27 116.25 121.70 1urk h VAL 79 Ca -0.07 -0.71 0.25 0.00 -1.01 0.00 0.00 66.70 65.17 1urk h VAL 79 Cb 0.60 0.68 -0.03 0.00 -2.01 0.00 0.00 31.29 30.53 1urk h VAL 79 CO 0.06 0.27 0.80 -0.07 -1.01 0.00 0.00 177.57 177.62 1urk h LEU 80 N 0.73 0.00 0.14 3.16 3.38 -1.07 1.07 115.31 122.72 1urk h LEU 80 Ca 0.18 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.91 1urk h LEU 80 Cb 0.22 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.99 1urk h LEU 80 CO -0.01 0.00 -1.01 -0.61 0.09 0.00 0.00 178.44 176.90 1urk h GLN 81 N 0.00 0.43 0.00 1.13 4.15 0.98 -3.46 115.11 118.34 1urk h GLN 81 Ca 0.41 -0.66 0.00 0.00 0.77 0.00 0.00 58.65 59.17 1urk h GLN 81 Cb 2.00 0.23 0.00 0.00 0.21 0.00 0.00 27.48 29.93 1urk h GLN 81 CO -0.00 1.29 0.00 0.00 -1.93 0.00 0.00 178.83 178.19 1urk n GLN 82 N -3.99 1.70 0.00 1.69 -0.00 0.37 -5.06 117.38 112.09 1urk n GLN 82 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.86 1urk n GLN 82 Cb 0.89 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 31.13 1urk n GLN 82 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 1urk n THR 83 N -0.30 0.00 -1.51 -0.39 -1.04 -1.26 -4.71 114.28 105.07 1urk n THR 83 Ca 0.00 0.00 -0.26 0.00 -2.04 0.00 0.00 64.05 61.75 1urk n THR 83 Cb 0.00 0.00 -0.19 0.00 -1.82 0.00 0.00 70.33 68.32 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 0.29 -0.07 -1.42 4.01 -1.26 -4.43 117.16 114.28 1urk n TYR 84 Ca 0.00 0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.84 1urk n TYR 84 Cb 0.00 -1.22 0.00 0.00 -0.31 0.00 0.00 39.34 37.81 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 8.24 0.00 -0.47 -0.72 1.44 -1.26 -4.90 115.22 117.55 1urk n HIS 85 Ca 0.65 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.36 1urk n HIS 85 Cb 0.15 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.26 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 -0.10 0.00 -2.51 1.59 0.00 -1.26 -3.61 120.51 114.61 1urk n ALA 86 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1urk n ALA 86 Cb 0.02 -0.11 -0.00 0.00 0.00 0.00 0.00 19.45 19.35 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 -0.27 -0.01 -3.06 0.00 8.25 -1.26 -4.76 115.22 114.09 1urk n HIS 87 Ca 0.00 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 1urk n HIS 87 Cb 0.11 0.60 0.00 0.00 1.12 0.00 0.00 29.99 31.83 1urk n HIS 87 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1urk n ARG 88 N -0.05 3.27 -2.38 -0.41 1.74 -1.26 -5.02 116.66 112.55 1urk n ARG 88 Ca -0.03 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.67 1urk n ARG 88 Cb 0.51 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 31.97 1urk n ARG 88 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1urk n SER 89 N -0.08 6.85 0.00 0.55 7.64 -1.26 -4.32 113.62 123.00 1urk n SER 89 Ca 0.00 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 56.13 1urk n SER 89 Cb 0.00 -0.99 0.00 0.00 -1.01 0.00 0.00 64.21 62.21 1urk n SER 89 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1urk n ASP 90 N -0.31 0.00 0.30 6.43 5.68 -1.26 -4.96 116.55 122.43 1urk n ASP 90 Ca 0.47 0.00 0.19 0.00 -0.50 0.00 0.00 54.79 54.95 1urk n ASP 90 Cb 0.30 0.00 0.91 0.00 -1.14 0.00 0.00 41.12 41.19 1urk n ASP 90 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1urk h ALA 91 N 0.00 1.05 0.00 2.12 0.00 -1.96 -0.92 119.26 119.55 1urk h ALA 91 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 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 0.03 -0.49 1.37 0.00 0.00 0.00 179.25 180.16 1urk h LEU 92 N 0.00 0.00 -0.66 0.00 -0.00 -1.93 -3.18 115.31 109.54 1urk h LEU 92 Ca -0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.77 1urk h LEU 92 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 1urk h LEU 92 CO 0.00 0.06 0.00 0.00 -0.00 0.00 0.00 178.44 178.50 1urk n GLN 93 N -2.35 1.42 -0.04 0.17 6.02 -0.35 -3.39 117.38 118.86 1urk n GLN 93 Ca 0.03 -0.65 -0.01 0.00 -0.01 0.00 0.00 57.00 56.37 1urk n GLN 93 Cb 0.47 -1.25 -0.11 0.00 1.02 0.00 0.00 30.24 30.37 1urk n GLN 93 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1urk n LEU 94 N -0.06 0.00 0.00 1.08 4.77 -1.20 -5.03 117.00 116.56 1urk n LEU 94 Ca 0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1urk n LEU 94 Cb 0.19 0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1urk n LEU 94 CO 0.08 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1urk n GLY 95 N 1.98 0.70 0.10 -0.72 0.00 -1.22 -4.89 105.19 101.14 1urk n GLY 95 Ca -0.13 -0.40 -0.14 0.00 0.00 0.00 0.00 46.02 45.35 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 0.00 2.94 0.00 0.99 4.77 -1.26 -4.91 117.00 119.54 1urk n LEU 96 Ca 0.00 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1urk n LEU 96 Cb 0.00 -0.68 0.00 0.00 -2.33 0.00 0.00 43.42 40.41 1urk n LEU 96 CO 0.00 0.83 0.00 0.61 -1.33 0.00 0.00 177.39 177.50 1urk n GLY 97 N 2.55 0.54 2.67 -0.72 0.00 -1.26 -3.13 105.19 105.83 1urk n GLY 97 Ca -0.35 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 44.69 1urk n GLY 97 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1urk n LYS 98 N 0.00 2.98 -4.45 1.61 2.85 -1.26 -4.14 118.16 115.75 1urk n LYS 98 Ca 0.00 -3.80 -0.30 0.00 -1.05 0.00 0.00 58.31 53.16 1urk n LYS 98 Cb 0.00 -2.27 -0.06 0.00 -0.65 0.00 0.00 35.03 32.05 1urk n LYS 98 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 177.40 173.97 1urk s HIS 99 N -3.87 2.02 -0.33 5.58 -3.43 -1.18 -4.68 115.29 109.39 1urk s HIS 99 Ca 0.52 -0.83 0.16 0.00 -0.80 0.00 0.00 55.06 54.11 1urk s HIS 99 Cb 0.44 -1.76 0.59 0.00 -1.43 0.00 0.00 32.58 30.42 1urk s HIS 99 CO -0.28 0.10 1.50 0.27 -2.00 0.00 0.00 174.74 174.33 1urk n ASN 100 N -1.33 4.29 -4.77 7.38 0.23 -1.26 -2.22 115.26 117.59 1urk n ASN 100 Ca -0.11 -2.87 -0.40 0.00 -0.53 0.00 0.00 54.58 50.68 1urk n ASN 100 Cb 0.66 -0.55 -0.02 0.00 -2.08 0.00 0.00 39.78 37.79 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 -2.58 3.09 0.32 -2.53 2.02 -1.26 -4.43 117.35 111.98 1urk s TYR 101 Ca 0.44 1.49 -0.26 0.00 -0.37 0.00 0.00 57.07 58.37 1urk s TYR 101 Cb 0.34 -3.54 -0.10 0.00 -0.40 0.00 0.00 41.96 38.26 1urk s TYR 101 CO 0.12 -1.56 0.99 0.00 -1.57 0.00 0.00 175.55 173.53 1urk s ARG 103 N -1.97 0.46 -0.88 0.00 1.81 -0.80 -4.86 118.95 112.70 1urk s ARG 103 Ca 0.50 -0.01 -0.01 0.00 -1.72 0.00 0.00 55.73 54.49 1urk s ARG 103 Cb -0.22 0.20 0.24 0.00 -0.45 0.00 0.00 34.95 34.73 1urk s ARG 103 CO 0.28 -0.10 0.90 -1.71 -0.68 0.00 0.00 175.30 173.98 1urk n ASN 104 N 2.05 4.49 0.00 0.23 4.05 -1.25 -2.70 115.26 122.12 1urk n ASN 104 Ca -0.18 -3.24 0.00 0.00 0.45 0.00 0.00 54.58 51.61 1urk n ASN 104 Cb 0.57 -1.01 0.00 0.00 1.23 0.00 0.00 39.78 40.56 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 1.85 0.00 -3.45 1.20 -0.04 -1.26 -4.72 135.00 128.58 1urk n PRO 105 Ca 0.24 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.51 1urk n PRO 105 Cb 0.37 -0.28 -0.12 0.00 -0.04 0.00 0.00 33.50 33.43 1urk n PRO 105 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1urk s ASP 106 N -1.59 1.75 0.00 3.54 2.15 -1.26 -4.89 116.67 116.36 1urk s ASP 106 Ca 0.00 -0.58 0.00 0.00 0.43 0.00 0.00 52.55 52.40 1urk s ASP 106 Cb 0.00 0.37 0.00 0.00 -0.30 0.00 0.00 42.92 42.99 1urk s ASP 106 CO 0.00 -0.37 0.00 0.59 -0.17 0.00 0.00 175.17 175.22 1urk n ASN 107 N 5.31 0.00 -3.64 -0.34 3.02 -1.26 -5.13 115.26 113.22 1urk n ASN 107 Ca -0.04 0.00 -0.17 0.00 -0.03 0.00 0.00 54.58 54.34 1urk n ASN 107 Cb 0.47 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.55 1urk n ASN 107 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1urk s ARG 108 N 0.00 1.57 -0.11 3.52 6.06 -1.26 -5.05 118.95 123.68 1urk s ARG 108 Ca 0.00 -1.89 0.17 0.00 -2.50 0.00 0.00 55.73 51.50 1urk s ARG 108 Cb 0.00 0.30 -0.24 0.00 0.06 0.00 0.00 34.95 35.08 1urk s ARG 108 CO 0.00 -0.56 0.38 -2.13 -2.50 0.00 0.00 175.30 170.48 1urk n ARG 109 N -0.51 0.66 -4.10 5.12 0.63 -1.26 -4.93 116.66 112.27 1urk n ARG 109 Ca 0.06 0.09 -0.22 0.00 -0.92 0.00 0.00 57.85 56.86 1urk n ARG 109 Cb 0.64 -1.64 -0.05 0.00 0.45 0.00 0.00 32.46 31.86 1urk n ARG 109 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1urk s ARG 110 N -2.67 2.69 -0.07 -0.14 0.52 -1.26 -4.50 118.95 113.52 1urk s ARG 110 Ca -0.07 -1.23 -0.30 0.00 -0.52 0.00 0.00 55.73 53.61 1urk s ARG 110 Cb 0.08 -2.41 -0.05 0.00 0.52 0.00 0.00 34.95 33.08 1urk s ARG 110 CO 0.83 0.30 1.54 -1.25 0.02 0.00 0.00 175.30 176.75 1urk s PRO 111 N -3.83 4.20 0.47 3.54 0.04 -1.25 -4.65 135.00 133.51 1urk s PRO 111 Ca 0.35 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1urk s PRO 111 Cb -0.07 -3.89 0.00 0.00 0.04 0.00 0.00 34.50 30.59 1urk s PRO 111 CO 0.24 -0.79 0.03 -2.67 0.04 0.00 0.00 177.00 173.85 1urk n TRP 112 N 6.81 0.97 -3.70 0.56 4.27 -1.10 -0.54 117.44 124.71 1urk n TRP 112 Ca 0.16 -2.29 -0.11 0.00 -3.89 0.00 0.00 57.50 51.37 1urk n TRP 112 Cb 0.43 -0.32 -0.11 0.00 -1.36 0.00 0.00 31.31 29.96 1urk n TRP 112 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1urk s TYR 114 N 1.29 1.17 -0.01 0.00 2.02 -1.26 -2.51 117.35 118.04 1urk s TYR 114 Ca -0.09 1.88 0.00 0.00 -0.37 0.00 0.00 57.07 58.50 1urk s TYR 114 Cb -0.08 -3.48 -0.04 0.00 -0.40 0.00 0.00 41.96 37.96 1urk s TYR 114 CO -0.11 -1.67 0.04 0.54 -1.57 0.00 0.00 175.55 172.78 1urk s VAL 115 N 14.32 4.48 0.06 0.71 0.11 -0.92 -2.06 120.40 137.11 1urk s VAL 115 Ca 0.92 -0.46 -0.30 0.00 -2.93 0.00 0.00 61.98 59.20 1urk s VAL 115 Cb -0.13 -3.02 -0.09 0.00 -1.53 0.00 0.00 36.38 31.61 1urk s VAL 115 CO 0.09 0.38 1.88 -1.10 -3.33 0.00 0.00 175.10 173.03 1urk s GLN 116 N -1.59 4.15 -0.38 1.54 -0.21 -1.26 -0.82 119.66 121.09 1urk s GLN 116 Ca 0.21 2.56 0.06 0.00 0.02 0.00 0.00 55.36 58.21 1urk s GLN 116 Cb -0.12 -3.91 0.52 0.00 1.00 0.00 0.00 33.01 30.50 1urk s GLN 116 CO 0.11 -0.89 1.59 0.28 -2.12 0.00 0.00 175.29 174.26 1urk n VAL 117 N 5.20 2.83 0.00 1.09 0.31 -1.19 -4.85 118.33 121.72 1urk n VAL 117 Ca 0.19 -2.84 0.00 0.00 -0.01 0.00 0.00 64.34 61.68 1urk n VAL 117 Cb 0.40 -0.58 0.00 0.00 -0.91 0.00 0.00 33.84 32.75 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 -1.05 2.91 0.00 2.92 0.00 -1.26 -4.70 105.19 104.01 1urk n GLY 118 Ca 0.44 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.67 0.99 -0.00 -1.26 -5.07 117.00 108.00 1urk n LEU 119 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 56.01 55.87 1urk n LEU 119 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.28 1urk n LEU 119 CO 0.00 0.01 -0.15 -0.54 -0.00 0.00 0.00 177.39 176.71 1urk s LYS 120 N 0.00 0.13 -0.64 1.47 -0.14 -1.26 -5.08 119.74 114.22 1urk s LYS 120 Ca 0.00 0.71 -0.28 0.00 -1.36 0.00 0.00 55.97 55.03 1urk s LYS 120 Cb 0.00 -0.07 -0.12 0.00 -1.68 0.00 0.00 37.83 35.95 1urk s LYS 120 CO 0.00 -0.28 2.49 -2.30 -0.76 0.00 0.00 175.35 174.50 1urk n PRO 121 N 5.29 0.71 -3.59 -1.68 -0.02 -1.26 -3.16 135.00 131.29 1urk n PRO 121 Ca -0.07 0.03 -0.37 0.00 -2.02 0.00 0.00 63.50 61.07 1urk n PRO 121 Cb 0.50 -2.72 -0.06 0.00 -0.02 0.00 0.00 33.50 31.20 1urk n PRO 121 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1urk s LEU 122 N 10.70 4.43 -0.12 2.45 1.43 -0.00 -4.60 118.68 132.97 1urk s LEU 122 Ca 1.12 0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 54.75 1urk s LEU 122 Cb -0.60 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 1urk s LEU 122 CO 0.36 0.30 1.54 0.68 0.23 0.00 0.00 176.35 179.46 1urk s VAL 123 N -1.15 3.79 -0.14 -1.59 -7.23 -1.26 -2.17 120.40 110.65 1urk s VAL 123 Ca 0.24 0.95 0.02 0.00 -1.81 0.00 0.00 61.98 61.38 1urk s VAL 123 Cb -0.15 -3.65 0.01 0.00 0.56 0.00 0.00 36.38 33.15 1urk s VAL 123 CO 0.13 -0.13 -0.20 -1.10 -0.31 0.00 0.00 175.10 173.50 1urk s GLN 124 N 4.01 2.80 1.03 4.82 1.11 -1.04 -4.79 119.66 127.59 1urk s GLN 124 Ca 0.68 -0.77 -0.21 0.00 0.01 0.00 0.00 55.36 55.07 1urk s GLN 124 Cb -0.29 -2.34 -0.06 0.00 -1.01 0.00 0.00 33.01 29.31 1urk s GLN 124 CO 0.25 -0.09 -0.67 0.39 0.01 0.00 0.00 175.29 175.19 1urk n GLU 125 N 4.30 -0.52 -4.19 2.91 1.02 -1.26 -1.92 120.64 120.98 1urk n GLU 125 Ca -0.20 -0.14 -0.25 0.00 -0.02 0.00 0.00 57.16 56.55 1urk n GLU 125 Cb 0.51 -1.33 -0.07 0.00 -0.02 0.00 0.00 31.44 30.53 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 -3.23 3.15 -0.12 0.00 0.23 -0.83 -4.55 119.30 113.96 1urk s MET 127 Ca 0.30 -0.67 0.15 0.00 -1.03 0.00 0.00 55.69 54.44 1urk s MET 127 Cb -0.09 -4.25 0.35 0.00 -1.53 0.00 0.00 34.83 29.32 1urk s MET 127 CO 0.21 -1.93 1.17 1.55 -2.03 0.00 0.00 175.02 173.99 1urk n VAL 128 N 6.08 1.37 -2.03 5.16 3.14 -1.26 -4.83 118.33 125.95 1urk n VAL 128 Ca -0.00 -2.16 0.00 0.00 -2.96 0.00 0.00 64.34 59.22 1urk n VAL 128 Cb 0.47 0.15 0.00 0.00 -1.06 0.00 0.00 33.84 33.39 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 -0.66 0.00 -3.23 1.45 -0.00 -1.26 -4.67 115.22 106.84 1urk n HIS 129 Ca 0.13 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.70 1urk n HIS 129 Cb 0.80 0.00 0.08 0.00 -0.00 0.00 0.00 29.99 30.86 1urk n HIS 129 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.34 172.87 1urk n ASP 130 N 0.00 -2.39 -4.56 0.26 2.03 -1.26 -4.87 116.55 105.76 1urk n ASP 130 Ca 0.00 -0.52 -0.39 0.00 0.52 0.00 0.00 54.79 54.40 1urk n ASP 130 Cb 0.00 -4.42 -0.03 0.00 -0.72 0.00 0.00 41.12 35.95 1urk n ASP 130 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1urk n ALA 132 N 11.98 0.00 -3.22 0.00 0.00 -1.26 -5.09 120.51 122.91 1urk n ALA 132 Ca 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.61 1urk n ALA 132 Cb 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.93 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 -4.00 -0.73 0.00 0.00 1.01 -1.26 -5.01 116.67 106.68 1urk s ASP 133 Ca 0.00 0.22 0.00 0.00 0.71 0.00 0.00 52.55 53.48 1urk s ASP 133 Cb 0.00 1.67 0.00 0.00 1.01 0.00 0.00 42.92 45.60 1urk s ASP 133 CO 0.00 -0.30 0.00 0.61 0.21 0.00 0.00 175.17 175.69 1urk n GLY 134 N 5.40 0.00 0.00 0.21 0.00 -1.26 -5.16 105.19 104.37 1urk n GLY 134 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1urk n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60