#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 -0.09 0.65 5.09 1.01 -1.26 -4.97 120.40 120.83 1urk s VAL 7 Ca 0.00 -1.34 0.25 0.00 0.00 0.00 0.00 61.98 60.89 1urk s VAL 7 Cb 0.00 -0.90 0.27 0.00 0.00 0.00 0.00 36.38 35.75 1urk s VAL 7 CO 0.00 -0.79 1.75 -0.65 0.00 0.00 0.00 175.10 175.41 1urk h PRO 8 N 7.08 0.00 -3.82 2.72 0.11 -2.09 -3.14 132.00 132.86 1urk h PRO 8 Ca 0.05 0.00 -0.78 0.00 0.11 0.00 0.00 66.00 65.38 1urk h PRO 8 Cb 1.01 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 31.88 1urk h PRO 8 CO 0.24 0.00 0.86 0.45 -0.21 0.00 0.00 178.00 179.34 1urk n SER 9 N -2.98 5.53 -2.74 -2.05 2.88 -1.26 -4.82 113.62 108.18 1urk n SER 9 Ca 0.01 -3.07 -0.28 0.00 -1.33 0.00 0.00 58.87 54.20 1urk n SER 9 Cb 0.57 -1.43 -0.01 0.00 -0.75 0.00 0.00 64.21 62.58 1urk n SER 9 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1urk n ASN 10 N 3.43 4.83 -1.64 -3.46 0.23 -1.19 -5.05 115.26 112.41 1urk n ASN 10 Ca 0.29 -3.71 0.00 0.00 -0.53 0.00 0.00 54.58 50.63 1urk n ASN 10 Cb 0.39 -0.55 0.00 0.00 -2.08 0.00 0.00 39.78 37.54 1urk n ASN 10 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1urk n ASP 12 N -0.76 3.37 -3.55 0.00 9.92 -1.26 -4.95 116.55 119.31 1urk n ASP 12 Ca 0.00 -3.53 -0.11 0.00 -0.53 0.00 0.00 54.79 50.62 1urk n ASP 12 Cb 0.00 -0.69 -0.04 0.00 -0.64 0.00 0.00 41.12 39.76 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 -0.28 0.00 -2.03 0.00 -0.00 -0.02 -4.74 117.00 109.93 1urk n LEU 14 Ca -0.16 0.00 -0.18 0.00 -0.00 0.00 0.00 56.01 55.66 1urk n LEU 14 Cb 0.64 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 44.02 1urk n LEU 14 CO 0.15 0.00 -0.21 0.59 -0.00 0.00 0.00 177.39 177.92 1urk n ASN 15 N 0.00 -5.12 0.00 1.45 4.13 -1.26 -1.65 115.26 112.82 1urk n ASN 15 Ca 0.00 0.22 0.00 0.00 1.68 0.00 0.00 54.58 56.48 1urk n ASN 15 Cb 0.00 -4.40 0.00 0.00 -1.54 0.00 0.00 39.78 33.84 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 -0.69 1.44 3.63 7.41 0.00 -1.26 -4.95 105.19 110.77 1urk n GLY 16 Ca -0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 1urk n GLY 16 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1urk s GLY 17 N -2.00 1.93 0.09 -0.02 0.00 -0.66 -4.61 107.32 102.05 1urk s GLY 17 Ca 0.00 -0.58 -0.31 0.00 0.00 0.00 0.00 44.72 43.83 1urk s GLY 17 CO 0.00 1.11 1.50 -1.59 0.00 0.00 0.00 173.10 174.13 1urk s THR 18 N 2.01 3.18 -0.25 0.90 2.01 -0.15 -4.36 115.64 118.99 1urk s THR 18 Ca 0.21 0.74 -0.11 0.00 0.31 0.00 0.00 61.69 62.84 1urk s THR 18 Cb -0.15 -3.48 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 1urk s THR 18 CO 0.09 0.03 0.16 0.00 -0.69 0.00 0.00 174.62 174.21 1urk s VAL 20 N 1.19 3.95 -0.25 0.00 -7.23 -1.19 -4.95 120.40 111.92 1urk s VAL 20 Ca 0.07 -1.03 -0.03 0.00 -1.81 0.00 0.00 61.98 59.18 1urk s VAL 20 Cb -0.14 -3.36 0.10 0.00 0.56 0.00 0.00 36.38 33.54 1urk s VAL 20 CO 0.06 -0.15 0.19 -0.44 -0.31 0.00 0.00 175.10 174.44 1urk s SER 21 N -4.17 2.33 1.00 4.85 0.01 -1.26 -4.10 113.70 112.35 1urk s SER 21 Ca 0.45 -0.77 -0.18 0.00 1.31 0.00 0.00 55.95 56.76 1urk s SER 21 Cb -0.09 0.06 -0.10 0.00 0.21 0.00 0.00 66.02 66.10 1urk s SER 21 CO 0.31 -0.38 -0.64 -3.20 0.41 0.00 0.00 173.24 169.74 1urk n ASN 22 N 5.29 -4.49 0.00 2.44 5.15 -1.21 -4.95 115.26 117.48 1urk n ASN 22 Ca -0.05 0.16 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 1urk n ASN 22 Cb 0.46 -0.82 0.00 0.00 -0.53 0.00 0.00 39.78 38.89 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 1.34 0.00 -2.76 1.20 4.81 -1.26 -4.88 118.16 116.61 1urk n LYS 23 Ca -0.00 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.41 1urk n LYS 23 Cb 0.59 -0.22 0.07 0.00 0.02 0.00 0.00 35.03 35.49 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 -2.48 0.30 -1.36 5.64 0.18 -1.26 -4.87 117.16 113.31 1urk n TYR 24 Ca 0.00 -2.17 0.08 0.00 1.88 0.00 0.00 57.90 57.68 1urk n TYR 24 Cb 0.13 0.23 0.15 0.00 -0.38 0.00 0.00 39.34 39.48 1urk n TYR 24 CO 0.00 0.00 0.00 1.19 -2.08 0.00 0.00 176.86 175.97 1urk n PHE 25 N -0.68 0.00 -1.44 -3.48 3.72 -1.26 -4.99 117.46 109.33 1urk n PHE 25 Ca 0.02 -1.11 0.00 0.00 -0.05 0.00 0.00 57.45 56.31 1urk n PHE 25 Cb 0.82 -0.18 0.00 0.00 -0.94 0.00 0.00 39.48 39.18 1urk n PHE 25 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1urk n SER 26 N -1.19 -1.92 -2.96 4.37 2.88 -1.26 -4.70 113.62 108.84 1urk n SER 26 Ca 0.16 0.00 -0.01 0.00 -1.33 0.00 0.00 58.87 57.69 1urk n SER 26 Cb 0.68 -0.76 -0.01 0.00 -0.75 0.00 0.00 64.21 63.36 1urk n SER 26 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1urk n ASN 27 N -1.16 -5.79 -3.06 -3.46 4.13 -1.26 -4.97 115.26 99.69 1urk n ASN 27 Ca 0.00 0.99 -0.17 0.00 1.68 0.00 0.00 54.58 57.08 1urk n ASN 27 Cb 0.48 -2.70 -0.01 0.00 -1.54 0.00 0.00 39.78 36.01 1urk n ASN 27 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1urk n ILE 28 N 2.00 -0.25 -3.49 2.41 2.08 -1.26 -5.07 119.36 115.79 1urk n ILE 28 Ca -0.10 -3.59 -0.38 0.00 0.56 0.00 0.00 62.75 59.24 1urk n ILE 28 Cb 0.24 -0.16 -0.06 0.00 -0.75 0.00 0.00 39.64 38.91 1urk n ILE 28 CO 0.00 0.00 0.00 -1.38 0.56 0.00 0.00 176.55 175.73 1urk s HIS 29 N -1.34 3.73 -0.01 1.39 -3.43 -1.26 -3.35 115.29 111.02 1urk s HIS 29 Ca 0.35 1.01 -0.21 0.00 -0.80 0.00 0.00 55.06 55.40 1urk s HIS 29 Cb 0.29 -2.30 0.04 0.00 -1.43 0.00 0.00 32.58 29.18 1urk s HIS 29 CO -0.10 0.64 0.46 1.67 -2.00 0.00 0.00 174.74 175.42 1urk s TRP 30 N -1.09 -0.37 0.64 0.38 -2.14 -1.26 -4.95 118.94 110.16 1urk s TRP 30 Ca 0.24 0.55 -0.14 0.00 2.66 0.00 0.00 56.10 59.41 1urk s TRP 30 Cb -0.17 0.24 -0.01 0.00 -3.10 0.00 0.00 33.47 30.43 1urk s TRP 30 CO 0.14 -0.51 1.08 0.00 -2.66 0.00 0.00 176.95 174.99 1urk n ASN 32 N -2.41 1.60 -4.89 0.00 2.85 0.11 -4.85 115.26 107.67 1urk n ASN 32 Ca 0.09 -3.13 -0.29 0.00 -0.11 0.00 0.00 54.58 51.15 1urk n ASN 32 Cb 0.53 -0.61 -0.01 0.00 1.24 0.00 0.00 39.78 40.93 1urk n ASN 32 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1urk s PRO 34 N -4.53 1.42 0.57 0.00 0.04 -1.26 -4.90 135.00 126.33 1urk s PRO 34 Ca 0.49 0.91 0.35 0.00 0.04 0.00 0.00 61.00 62.80 1urk s PRO 34 Cb -0.10 -1.82 1.64 0.00 0.04 0.00 0.00 34.50 34.26 1urk s PRO 34 CO 0.42 -2.15 2.10 1.57 0.04 0.00 0.00 177.00 178.97 1urk h LYS 35 N -1.49 0.00 -0.20 4.56 2.10 -2.01 -1.18 116.57 118.35 1urk h LYS 35 Ca -0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.17 1urk h LYS 35 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1urk h LYS 35 CO 0.53 0.04 0.00 0.36 -2.00 0.00 0.00 179.45 178.38 1urk n LYS 36 N -3.21 1.40 -3.96 0.07 2.85 -1.26 -4.84 118.16 109.21 1urk n LYS 36 Ca -0.01 -0.59 -0.24 0.00 -1.05 0.00 0.00 58.31 56.43 1urk n LYS 36 Cb 0.24 -1.15 -0.05 0.00 -0.65 0.00 0.00 35.03 33.41 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 -1.76 2.51 -1.90 5.58 0.40 -0.45 0.62 117.98 122.99 1urk s PHE 37 Ca 0.11 -0.60 0.00 0.00 -0.60 0.00 0.00 56.93 55.84 1urk s PHE 37 Cb 0.06 -2.01 0.00 0.00 0.51 0.00 0.00 43.02 41.58 1urk s PHE 37 CO 0.07 0.03 0.00 0.41 0.70 0.00 0.00 175.22 176.43 1urk n GLY 38 N -1.38 -1.51 0.68 4.36 0.00 0.41 -4.71 105.19 103.04 1urk n GLY 38 Ca -0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 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 -0.17 -1.23 4.62 -0.02 0.00 -1.26 0.21 105.19 107.34 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 0.70 0.00 -1.95 1.61 1.13 -1.26 0.54 117.38 118.15 1urk n GLN 40 Ca 0.00 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.66 1urk n GLN 40 Cb 0.00 0.00 0.04 0.00 0.11 0.00 0.00 30.24 30.39 1urk n GLN 40 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1urk n HIS 41 N 0.00 2.95 -4.08 1.08 8.25 -1.26 -4.86 115.22 117.30 1urk n HIS 41 Ca 0.00 -2.33 -0.42 0.00 -0.26 0.00 0.00 57.72 54.71 1urk n HIS 41 Cb 0.00 -1.19 0.00 0.00 1.12 0.00 0.00 29.99 29.92 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 -4.88 2.91 -3.78 0.00 0.28 0.13 -2.62 120.64 112.69 1urk n GLU 43 Ca -0.16 -2.99 -0.15 0.00 -0.16 0.00 0.00 57.16 53.71 1urk n GLU 43 Cb 0.59 -1.94 -0.16 0.00 1.43 0.00 0.00 31.44 31.37 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 -2.97 -0.06 -0.87 3.84 1.01 0.78 -4.93 121.20 118.01 1urk s ILE 44 Ca 0.46 0.20 -0.16 0.00 0.00 0.00 0.00 60.65 61.15 1urk s ILE 44 Cb 0.38 -0.08 0.17 0.00 0.01 0.00 0.00 42.46 42.94 1urk s ILE 44 CO 0.08 0.08 0.94 -1.81 0.00 0.00 0.00 174.94 174.24 1urk s ASP 45 N 1.02 6.68 1.10 3.58 1.01 -1.26 -0.44 116.67 128.35 1urk s ASP 45 Ca -0.08 -2.33 -0.12 0.00 0.71 0.00 0.00 52.55 50.72 1urk s ASP 45 Cb -0.12 -2.31 0.19 0.00 1.01 0.00 0.00 42.92 41.69 1urk s ASP 45 CO -0.03 -0.83 0.43 0.29 0.21 0.00 0.00 175.17 175.24 1urk n LYS 46 N 5.31 -2.60 0.00 8.23 5.02 0.20 -4.68 118.16 129.64 1urk n LYS 46 Ca 0.18 -0.72 0.00 0.00 -2.02 0.00 0.00 58.31 55.75 1urk n LYS 46 Cb 0.48 -1.06 0.00 0.00 -0.02 0.00 0.00 35.03 34.42 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 -3.38 0.00 -0.72 4.39 7.64 -1.26 -4.86 113.62 115.43 1urk n SER 47 Ca 0.07 0.00 0.11 0.00 1.01 0.00 0.00 58.87 60.05 1urk n SER 47 Cb 0.30 0.00 0.32 0.00 -1.01 0.00 0.00 64.21 63.81 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 -0.10 1.94 -4.72 1.43 3.00 -1.26 -3.98 118.16 114.47 1urk n LYS 48 Ca 0.00 -1.42 -0.33 0.00 -0.00 0.00 0.00 58.31 56.56 1urk n LYS 48 Cb 0.00 -1.42 -0.14 0.00 0.00 0.00 0.00 35.03 33.47 1urk n LYS 48 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1urk s THR 49 N -1.70 3.07 -1.48 3.15 -1.32 -1.26 -4.54 115.64 111.56 1urk s THR 49 Ca 0.33 -0.65 -0.01 0.00 -1.21 0.00 0.00 61.69 60.15 1urk s THR 49 Cb 0.18 -2.30 0.00 0.00 -1.51 0.00 0.00 72.50 68.88 1urk s THR 49 CO 0.27 0.52 0.09 0.00 -2.21 0.00 0.00 174.62 173.28 1urk n TYR 51 N -3.84 -0.88 -1.35 0.00 4.11 -1.26 -4.56 117.16 109.37 1urk n TYR 51 Ca -0.19 0.44 -0.53 0.00 -0.00 0.00 0.00 57.90 57.63 1urk n TYR 51 Cb 0.65 -1.27 -0.13 0.00 -0.00 0.00 0.00 39.34 38.59 1urk n TYR 51 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.86 174.95 1urk n GLU 52 N -2.92 0.06 0.00 -3.48 2.13 -0.93 -4.39 120.64 111.11 1urk n GLU 52 Ca 0.08 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.91 1urk n GLU 52 Cb 0.32 -1.57 0.00 0.00 0.27 0.00 0.00 31.44 30.46 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 7.08 0.22 0.08 8.31 0.00 -1.26 -4.09 105.19 115.53 1urk n GLY 53 Ca 0.58 -1.17 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 1urk n GLY 53 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1urk n ASN 54 N 0.00 1.87 0.00 1.61 5.03 -1.26 -4.91 115.26 117.60 1urk n ASN 54 Ca 0.00 0.49 0.00 0.00 0.87 0.00 0.00 54.58 55.94 1urk n ASN 54 Cb 0.00 -0.81 0.00 0.00 -1.02 0.00 0.00 39.78 37.95 1urk n ASN 54 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1urk n GLY 55 N 1.53 1.09 0.40 7.41 0.00 -1.26 -2.77 105.19 111.60 1urk n GLY 55 Ca -0.12 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.09 1urk n GLY 55 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1urk h HIS 56 N 0.00 0.00 0.00 1.61 6.17 -1.96 -3.40 115.15 117.57 1urk h HIS 56 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.08 1urk h HIS 56 Cb 0.00 0.00 0.00 0.00 2.52 0.00 0.00 27.41 29.93 1urk h HIS 56 CO 0.00 0.00 0.00 0.34 0.71 0.00 0.00 177.93 178.98 1urk n PHE 57 N -3.26 0.00 -1.70 5.26 -0.00 -1.26 -4.81 117.46 111.69 1urk n PHE 57 Ca 0.08 0.00 0.14 0.00 -0.00 0.00 0.00 57.45 57.68 1urk n PHE 57 Cb 0.84 0.00 -0.04 0.00 -0.00 0.00 0.00 39.48 40.28 1urk n PHE 57 CO 0.00 0.00 0.00 0.98 -0.00 0.00 0.00 176.76 177.74 1urk n TYR 58 N 0.00 -3.18 -2.14 -5.13 9.36 -1.26 -4.84 117.16 109.97 1urk n TYR 58 Ca 0.00 1.31 -0.05 0.00 3.32 0.00 0.00 57.90 62.48 1urk n TYR 58 Cb 0.00 -2.39 -0.04 0.00 -0.63 0.00 0.00 39.34 36.28 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 -3.45 0.18 0.00 2.98 3.00 -1.26 -5.13 116.66 112.98 1urk n ARG 59 Ca 0.01 -1.17 0.00 0.00 -0.01 0.00 0.00 57.85 56.68 1urk n ARG 59 Cb 0.48 0.41 0.00 0.00 0.00 0.00 0.00 32.46 33.35 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 -0.13 -3.06 0.00 -0.13 0.00 -1.26 -5.03 105.19 95.58 1urk n GLY 60 Ca -0.23 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.76 1urk n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1urk n LYS 61 N -0.41 0.00 -4.09 1.61 5.02 -1.26 -4.97 118.16 114.05 1urk n LYS 61 Ca 0.00 0.00 -0.39 0.00 -2.02 0.00 0.00 58.31 55.90 1urk n LYS 61 Cb 0.00 0.00 -0.02 0.00 -0.02 0.00 0.00 35.03 34.99 1urk n LYS 61 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1urk n ALA 62 N -2.26 -2.38 0.59 7.82 0.00 -1.26 -4.65 120.51 118.37 1urk n ALA 62 Ca 0.00 -0.47 0.12 0.00 0.00 0.00 0.00 53.44 53.09 1urk n ALA 62 Cb 0.00 -2.15 0.45 0.00 0.00 0.00 0.00 19.45 17.75 1urk n ALA 62 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1urk n SER 63 N -2.50 0.56 -4.98 0.00 7.64 -1.26 -4.13 113.62 108.96 1urk n SER 63 Ca -0.19 0.59 -0.19 0.00 1.01 0.00 0.00 58.87 60.08 1urk n SER 63 Cb 0.62 -0.73 -0.01 0.00 -1.01 0.00 0.00 64.21 63.08 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 -3.15 4.27 0.00 0.44 -4.23 -1.25 -4.28 115.64 107.45 1urk s THR 64 Ca 0.09 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 1urk s THR 64 Cb 0.12 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.48 1urk s THR 64 CO 0.48 -0.19 0.00 -0.90 -0.54 0.00 0.00 174.62 173.47 1urk n ASP 65 N -1.57 0.00 -1.14 3.99 5.75 -0.86 -4.39 116.55 118.32 1urk n ASP 65 Ca -0.02 0.00 -0.02 0.00 -0.01 0.00 0.00 54.79 54.74 1urk n ASP 65 Cb 0.58 0.00 0.11 0.00 -1.03 0.00 0.00 41.12 40.78 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 1.24 0.00 2.12 -2.24 -1.26 -3.06 114.28 111.07 1urk n THR 66 Ca 0.00 -0.53 0.00 0.00 -2.27 0.00 0.00 64.05 61.25 1urk n THR 66 Cb 0.00 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 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 0.11 0.80 0.00 -0.78 2.81 -1.26 -4.83 117.12 113.97 1urk n MET 67 Ca 0.13 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.02 1urk n MET 67 Cb 0.69 -0.84 0.00 0.00 -0.71 0.00 0.00 33.22 32.37 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 2.65 1.32 3.76 3.03 0.00 -1.25 -5.11 105.19 109.60 1urk n GLY 68 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 3.19 0.00 1.61 0.52 -1.26 -4.75 118.95 118.26 1urk s ARG 69 Ca 0.00 1.84 0.17 0.00 -0.52 0.00 0.00 55.73 57.22 1urk s ARG 69 Cb 0.00 -2.07 0.96 0.00 0.52 0.00 0.00 34.95 34.36 1urk s ARG 69 CO 0.00 -1.04 1.43 -0.35 0.02 0.00 0.00 175.30 175.36 1urk n PRO 70 N -1.28 0.45 -0.88 3.54 -0.04 -1.26 -2.03 135.00 133.50 1urk n PRO 70 Ca 0.12 0.03 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 1urk n PRO 70 Cb 0.49 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 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 -5.51 4.41 0.32 0.00 1.43 -0.75 -4.88 118.68 113.69 1urk s LEU 72 Ca 0.00 0.72 -0.28 0.00 -1.03 0.00 0.00 54.13 53.54 1urk s LEU 72 Cb 0.00 -2.55 -0.10 0.00 0.03 0.00 0.00 46.19 43.58 1urk s LEU 72 CO 0.00 0.30 1.18 -2.16 0.23 0.00 0.00 176.35 175.90 1urk s PRO 73 N -1.36 4.46 0.65 1.29 0.04 -1.26 -4.60 135.00 134.21 1urk s PRO 73 Ca 0.24 1.94 0.29 0.00 0.04 0.00 0.00 61.00 63.50 1urk s PRO 73 Cb -0.14 -3.07 1.55 0.00 0.04 0.00 0.00 34.50 32.88 1urk s PRO 73 CO 0.13 0.00 1.87 -1.49 0.04 0.00 0.00 177.00 177.55 1urk h TRP 74 N 3.48 0.00 -0.09 0.56 4.06 -1.62 0.18 115.95 122.52 1urk h TRP 74 Ca -0.48 0.00 -0.22 0.00 2.06 0.00 0.00 58.89 60.25 1urk h TRP 74 Cb 1.22 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.39 1urk h TRP 74 CO 0.57 0.00 -0.83 -2.95 -3.56 0.00 0.00 178.44 171.67 1urk h ASN 75 N 0.00 0.79 0.00 -3.49 -1.07 -1.75 -3.27 115.58 106.78 1urk h ASN 75 Ca 0.00 -0.54 -0.53 0.00 0.07 0.00 0.00 56.30 55.30 1urk h ASN 75 Cb 0.69 -0.23 -0.06 0.00 -2.07 0.00 0.00 38.32 36.64 1urk h ASN 75 CO 0.00 1.33 1.38 -1.20 0.07 0.00 0.00 177.43 179.01 1urk n SER 76 N -3.88 0.41 -0.38 6.14 7.64 0.62 -4.46 113.62 119.72 1urk n SER 76 Ca -0.07 0.33 0.30 0.00 1.01 0.00 0.00 58.87 60.44 1urk n SER 76 Cb 0.77 -0.79 0.49 0.00 -1.01 0.00 0.00 64.21 63.66 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 8.08 1.05 0.40 -0.43 0.00 -1.26 0.50 120.51 128.86 1urk n ALA 77 Ca 0.54 0.51 -0.19 0.00 0.00 0.00 0.00 53.44 54.29 1urk n ALA 77 Cb 0.00 -0.72 -0.10 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.59 0.00 2.02 -1.93 -0.07 112.91 112.34 1urk h THR 78 Ca 0.60 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.73 1urk h THR 78 Cb 2.14 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 68.53 1urk h THR 78 CO -0.18 0.00 0.19 1.62 0.37 0.00 0.00 175.52 177.53 1urk h VAL 79 N -1.17 1.24 -0.89 3.16 3.04 -0.24 0.65 116.25 122.04 1urk h VAL 79 Ca -0.10 -0.80 0.26 0.00 -1.01 0.00 0.00 66.70 65.05 1urk h VAL 79 Cb 0.95 0.65 -0.04 0.00 -2.01 0.00 0.00 31.29 30.85 1urk h VAL 79 CO 0.07 0.30 0.82 -0.07 -1.01 0.00 0.00 177.57 177.68 1urk h LEU 80 N 0.83 0.00 0.22 3.16 3.38 -0.94 0.96 115.31 122.92 1urk h LEU 80 Ca 0.19 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.83 1urk h LEU 80 Cb 0.27 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.05 1urk h LEU 80 CO -0.01 0.00 -1.53 1.56 0.09 0.00 0.00 178.44 178.55 1urk h GLN 81 N 0.00 0.46 0.00 1.13 7.50 0.10 -3.46 115.11 120.84 1urk h GLN 81 Ca 0.42 -0.79 0.00 0.00 0.50 0.00 0.00 58.65 58.78 1urk h GLN 81 Cb 2.06 0.29 0.00 0.00 0.05 0.00 0.00 27.48 29.88 1urk h GLN 81 CO -0.00 1.38 0.00 1.04 -1.50 0.00 0.00 178.83 179.74 1urk n GLN 82 N -3.71 2.41 0.00 1.46 1.13 0.33 -5.06 117.38 113.94 1urk n GLN 82 Ca -0.20 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.86 1urk n GLN 82 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.42 1urk n GLN 82 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1urk n THR 83 N 0.00 0.00 -1.29 5.09 -1.04 -1.26 -4.75 114.28 111.02 1urk n THR 83 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.67 1urk n THR 83 Cb 0.00 0.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.37 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 0.43 -0.83 -1.42 4.01 -1.26 -4.54 117.16 113.55 1urk n TYR 84 Ca 0.00 0.29 0.00 0.00 -0.16 0.00 0.00 57.90 58.03 1urk n TYR 84 Cb 0.00 -1.89 0.00 0.00 -0.31 0.00 0.00 39.34 37.14 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 8.62 0.00 -0.94 -0.72 1.44 -1.26 -4.92 115.22 117.43 1urk n HIS 85 Ca 0.57 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 56.28 1urk n HIS 85 Cb 0.04 0.00 0.00 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 0.00 -0.04 0.00 1.59 0.00 -1.26 -3.90 120.51 116.90 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 0.20 -0.25 0.00 0.00 0.00 0.00 0.00 19.45 19.40 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 -0.53 0.00 -2.39 0.00 8.25 -1.26 -4.79 115.22 114.50 1urk n HIS 87 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1urk n HIS 87 Cb 0.25 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.36 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 0.00 3.80 -0.07 -0.41 1.74 -1.26 -5.03 116.66 115.42 1urk n ARG 88 Ca 0.00 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.17 1urk n ARG 88 Cb 0.00 0.00 0.12 0.00 -1.02 0.00 0.00 32.46 31.56 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 0.00 2.70 0.00 0.55 7.64 -1.26 -4.33 113.62 118.92 1urk n SER 89 Ca 0.00 -1.79 0.00 0.00 1.01 0.00 0.00 58.87 58.09 1urk n SER 89 Cb 0.00 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 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 0.98 0.19 0.14 6.43 9.92 -1.26 -4.61 116.55 128.34 1urk n ASP 90 Ca 0.12 -0.54 0.13 0.00 -0.53 0.00 0.00 54.79 53.97 1urk n ASP 90 Cb 0.45 0.61 0.46 0.00 -0.64 0.00 0.00 41.12 42.00 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 -1.97 -2.54 119.26 118.00 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 0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1urk h ALA 91 CO 0.00 0.00 -0.30 1.47 0.00 0.00 0.00 179.25 180.42 1urk n LEU 92 N -2.35 0.41 0.02 0.00 -0.00 -1.26 -1.30 117.00 112.52 1urk n LEU 92 Ca 0.03 0.27 -0.06 0.00 -0.00 0.00 0.00 56.01 56.25 1urk n LEU 92 Cb 0.33 -0.33 -0.11 0.00 -0.00 0.00 0.00 43.42 43.30 1urk n LEU 92 CO 0.25 0.02 -0.20 1.56 -0.00 0.00 0.00 177.39 179.01 1urk h GLN 93 N 0.00 0.00 -0.00 1.47 1.08 -1.75 -3.31 115.11 112.60 1urk h GLN 93 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1urk h GLN 93 Cb 0.57 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.00 1urk h GLN 93 CO 0.00 0.64 -0.86 1.28 -0.95 0.00 0.00 178.83 178.94 1urk n LEU 94 N -3.14 1.14 -2.83 1.46 7.99 -1.22 -5.04 117.00 115.36 1urk n LEU 94 Ca -0.09 -0.55 -0.04 0.00 -0.01 0.00 0.00 56.01 55.32 1urk n LEU 94 Cb 0.97 0.00 0.01 0.00 -0.11 0.00 0.00 43.42 44.28 1urk n LEU 94 CO 0.45 0.26 -0.30 0.61 -1.51 0.00 0.00 177.39 176.90 1urk n GLY 95 N 1.46 -2.85 0.00 -0.72 0.00 -0.42 -5.01 105.19 97.64 1urk n GLY 95 Ca 0.05 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.81 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 0.37 0.35 0.00 0.99 4.77 -1.14 -5.05 117.00 117.29 1urk n LEU 96 Ca 0.04 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1urk n LEU 96 Cb 0.22 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1urk n LEU 96 CO 0.44 -0.22 0.00 0.61 -1.33 0.00 0.00 177.39 176.89 1urk n GLY 97 N 2.11 -0.61 3.15 -0.72 0.00 -1.26 -4.55 105.19 103.30 1urk n GLY 97 Ca 0.00 -1.30 -0.39 0.00 0.00 0.00 0.00 46.02 44.33 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 0.00 2.88 0.27 1.61 2.20 -1.26 -4.30 119.74 121.13 1urk s LYS 98 Ca 0.00 -2.61 -0.11 0.00 -0.36 0.00 0.00 55.97 52.90 1urk s LYS 98 Cb 0.00 -3.91 -0.00 0.00 -1.51 0.00 0.00 37.83 32.41 1urk s LYS 98 CO 0.00 -1.21 0.47 -3.38 -0.36 0.00 0.00 175.35 170.88 1urk s HIS 99 N -0.17 0.51 -0.67 4.03 -3.43 -1.26 -4.96 115.29 109.34 1urk s HIS 99 Ca 0.18 -0.86 0.04 0.00 -0.80 0.00 0.00 55.06 53.63 1urk s HIS 99 Cb -0.17 0.14 0.31 0.00 -1.43 0.00 0.00 32.58 31.43 1urk s HIS 99 CO -0.05 -1.03 1.01 0.27 -2.00 0.00 0.00 174.74 172.94 1urk n ASN 100 N -0.59 4.68 -4.81 7.38 0.23 -1.26 -1.94 115.26 118.94 1urk n ASN 100 Ca -0.01 -3.61 -0.24 0.00 -0.53 0.00 0.00 54.58 50.19 1urk n ASN 100 Cb 0.62 -0.69 0.01 0.00 -2.08 0.00 0.00 39.78 37.64 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 0.17 -0.92 -0.09 -2.53 4.02 -1.26 -4.79 117.16 111.76 1urk n TYR 101 Ca 0.32 -2.25 -0.11 0.00 -0.01 0.00 0.00 57.90 55.84 1urk n TYR 101 Cb 0.38 -0.46 -0.05 0.00 -0.02 0.00 0.00 39.34 39.19 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 -4.51 0.00 -2.70 0.00 5.12 -1.26 -4.26 116.66 109.05 1urk n ARG 103 Ca -0.18 0.00 -0.06 0.00 -1.93 0.00 0.00 57.85 55.67 1urk n ARG 103 Cb 0.47 0.00 0.09 0.00 -1.16 0.00 0.00 32.46 31.86 1urk n ARG 103 CO 0.00 0.00 0.00 0.27 -1.93 0.00 0.00 177.63 175.97 1urk n ASN 104 N -2.62 -1.95 0.00 0.55 2.04 -1.26 -2.72 115.26 109.31 1urk n ASN 104 Ca 0.00 -2.81 0.09 0.00 -0.44 0.00 0.00 54.58 51.42 1urk n ASN 104 Cb 0.00 1.52 0.53 0.00 -2.53 0.00 0.00 39.78 39.30 1urk n ASN 104 CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 1urk n PRO 105 N 0.76 0.50 -3.80 -0.53 -0.04 -1.26 -4.41 135.00 126.21 1urk n PRO 105 Ca 0.02 0.03 -0.29 0.00 -0.04 0.00 0.00 63.50 63.23 1urk n PRO 105 Cb 0.71 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.51 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 -2.17 3.52 -0.85 3.54 -1.08 -1.26 -5.04 116.67 113.33 1urk s ASP 106 Ca 0.25 -1.16 -0.09 0.00 -0.52 0.00 0.00 52.55 51.03 1urk s ASP 106 Cb 0.13 -0.86 -0.28 0.00 -1.46 0.00 0.00 42.92 40.44 1urk s ASP 106 CO 0.24 -0.31 1.85 -3.20 0.52 0.00 0.00 175.17 174.27 1urk n ASN 107 N 4.87 -1.15 -0.17 -0.34 5.15 -1.26 -4.59 115.26 117.76 1urk n ASN 107 Ca -0.08 -0.42 0.02 0.00 -0.60 0.00 0.00 54.58 53.49 1urk n ASN 107 Cb 0.45 -0.47 0.04 0.00 -0.53 0.00 0.00 39.78 39.27 1urk n ASN 107 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1urk n ARG 108 N 4.83 2.32 -1.73 1.20 5.12 -1.26 -4.96 116.66 122.18 1urk n ARG 108 Ca 0.57 -1.48 -0.17 0.00 -1.93 0.00 0.00 57.85 54.84 1urk n ARG 108 Cb 0.11 -1.07 -0.06 0.00 -1.16 0.00 0.00 32.46 30.28 1urk n ARG 108 CO 0.00 0.00 0.00 -2.13 -1.93 0.00 0.00 177.63 173.57 1urk n ARG 109 N -0.14 -1.51 -3.33 5.56 0.63 -1.26 -4.86 116.66 111.75 1urk n ARG 109 Ca 0.03 0.98 0.03 0.00 -0.92 0.00 0.00 57.85 57.97 1urk n ARG 109 Cb 0.26 -5.38 -0.05 0.00 0.45 0.00 0.00 32.46 27.75 1urk n ARG 109 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 1urk s ARG 110 N -3.86 0.05 -0.53 -0.14 3.52 -1.11 -4.76 118.95 112.11 1urk s ARG 110 Ca 0.00 0.11 -0.31 0.00 -0.13 0.00 0.00 55.73 55.40 1urk s ARG 110 Cb 0.00 0.05 -0.12 0.00 -1.56 0.00 0.00 34.95 33.32 1urk s ARG 110 CO 0.00 -0.01 2.38 -2.30 -0.81 0.00 0.00 175.30 174.56 1urk n PRO 111 N 4.13 0.87 -3.40 5.12 -0.02 -1.26 -4.74 135.00 135.71 1urk n PRO 111 Ca -0.10 0.14 -0.19 0.00 -2.02 0.00 0.00 63.50 61.33 1urk n PRO 111 Cb 0.56 -2.62 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 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 9.41 2.80 -0.01 6.00 1.48 -1.10 0.11 118.94 137.63 1urk s TRP 112 Ca 1.11 -0.41 -0.11 0.00 -1.06 0.00 0.00 56.10 55.63 1urk s TRP 112 Cb -0.69 -2.18 0.01 0.00 -1.16 0.00 0.00 33.47 29.45 1urk s TRP 112 CO 0.41 -0.18 0.22 0.00 -4.06 0.00 0.00 176.95 173.34 1urk n TYR 114 N 1.39 3.83 -3.63 0.00 4.01 -1.26 -1.49 117.16 120.01 1urk n TYR 114 Ca -0.22 -2.25 -0.37 0.00 -0.16 0.00 0.00 57.90 54.90 1urk n TYR 114 Cb 0.56 -2.63 -0.06 0.00 -0.31 0.00 0.00 39.34 36.90 1urk n TYR 114 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1urk s VAL 115 N 7.17 5.18 0.08 -0.72 0.11 -0.78 -1.80 120.40 129.64 1urk s VAL 115 Ca 0.60 0.58 -0.31 0.00 -2.93 0.00 0.00 61.98 59.92 1urk s VAL 115 Cb 0.02 -3.61 -0.10 0.00 -1.53 0.00 0.00 36.38 31.16 1urk s VAL 115 CO 0.10 0.53 1.88 -1.10 -3.33 0.00 0.00 175.10 173.19 1urk s GLN 116 N -1.24 4.14 -0.14 1.54 -0.21 -1.26 -0.79 119.66 121.69 1urk s GLN 116 Ca 0.23 2.59 0.17 0.00 0.02 0.00 0.00 55.36 58.37 1urk s GLN 116 Cb -0.15 -3.84 0.40 0.00 1.00 0.00 0.00 33.01 30.42 1urk s GLN 116 CO 0.12 -0.89 1.28 0.28 -2.12 0.00 0.00 175.29 173.96 1urk n VAL 117 N 5.09 2.02 0.00 1.09 0.31 -1.21 -4.83 118.33 120.80 1urk n VAL 117 Ca 0.19 -1.99 0.00 0.00 -0.01 0.00 0.00 64.34 62.52 1urk n VAL 117 Cb 0.39 -0.20 0.00 0.00 -0.91 0.00 0.00 33.84 33.13 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 -0.89 1.23 0.44 2.92 0.00 -1.26 -4.71 105.19 102.92 1urk n GLY 118 Ca 0.18 -0.79 -0.14 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 -1.48 -7.63 0.99 4.07 -2.01 -3.44 115.31 105.81 1urk h LEU 119 Ca 0.00 0.18 -0.11 0.00 0.08 0.00 0.00 57.88 58.03 1urk h LEU 119 Cb 0.00 0.58 -0.18 0.00 1.08 0.00 0.00 40.66 42.14 1urk h LEU 119 CO 0.00 -0.49 -0.33 -1.59 -1.08 0.00 0.00 178.44 174.96 1urk s LYS 120 N -5.82 0.71 -0.31 1.13 -2.85 -1.26 -5.09 119.74 106.25 1urk s LYS 120 Ca -0.16 -0.47 -0.33 0.00 -1.00 0.00 0.00 55.97 54.00 1urk s LYS 120 Cb 0.08 0.30 -0.10 0.00 -2.06 0.00 0.00 37.83 36.05 1urk s LYS 120 CO 0.62 -0.21 2.19 -2.30 0.10 0.00 0.00 175.35 175.76 1urk n PRO 121 N 0.84 1.32 -3.88 1.78 -0.02 -1.26 -3.33 135.00 130.45 1urk n PRO 121 Ca -0.20 0.36 -0.33 0.00 -2.02 0.00 0.00 63.50 61.32 1urk n PRO 121 Cb 0.58 -2.67 -0.05 0.00 -0.02 0.00 0.00 33.50 31.35 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 7.53 4.36 -0.24 2.45 1.43 0.03 -4.70 118.68 129.53 1urk s LEU 122 Ca 1.07 0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 54.24 1urk s LEU 122 Cb -0.72 -2.78 0.00 0.00 0.03 0.00 0.00 46.19 42.72 1urk s LEU 122 CO 0.45 0.22 1.17 0.68 0.23 0.00 0.00 176.35 179.10 1urk s VAL 123 N -1.40 4.42 -0.20 -1.59 -7.23 -1.25 -1.87 120.40 111.27 1urk s VAL 123 Ca 0.31 1.68 -0.02 0.00 -1.81 0.00 0.00 61.98 62.13 1urk s VAL 123 Cb -0.13 -4.21 -0.00 0.00 0.56 0.00 0.00 36.38 32.60 1urk s VAL 123 CO 0.22 -0.29 -0.09 -1.10 -0.31 0.00 0.00 175.10 173.53 1urk s GLN 124 N 3.58 3.30 -0.84 4.82 1.11 -0.56 -4.75 119.66 126.32 1urk s GLN 124 Ca 0.50 -0.68 -0.22 0.00 0.01 0.00 0.00 55.36 54.97 1urk s GLN 124 Cb -0.17 -2.86 -0.19 0.00 -1.01 0.00 0.00 33.01 28.79 1urk s GLN 124 CO 0.14 -0.13 2.30 0.39 0.01 0.00 0.00 175.29 178.00 1urk n GLU 125 N 4.55 0.39 -1.39 2.91 1.02 -1.26 -1.96 120.64 124.90 1urk n GLU 125 Ca -0.19 -0.73 -0.59 0.00 -0.02 0.00 0.00 57.16 55.63 1urk n GLU 125 Cb 0.51 -3.09 -0.10 0.00 -0.02 0.00 0.00 31.44 28.73 1urk n GLU 125 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1urk n MET 127 N 5.32 0.52 -2.56 0.00 2.81 -1.17 -4.72 117.12 117.33 1urk n MET 127 Ca 0.40 0.19 -0.05 0.00 -1.81 0.00 0.00 57.70 56.42 1urk n MET 127 Cb -0.05 -1.77 0.04 0.00 -0.71 0.00 0.00 33.22 30.74 1urk n MET 127 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 1urk n VAL 128 N 3.29 1.52 -1.30 2.03 3.14 -1.26 -4.91 118.33 120.84 1urk n VAL 128 Ca 0.25 -3.14 0.00 0.00 -2.96 0.00 0.00 64.34 58.49 1urk n VAL 128 Cb 0.07 0.70 0.00 0.00 -1.06 0.00 0.00 33.84 33.55 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 -0.58 0.00 -2.29 1.45 -0.00 -1.26 -4.91 115.22 107.62 1urk n HIS 129 Ca 0.16 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.27 1urk n HIS 129 Cb 0.85 0.00 0.03 0.00 -0.12 0.00 0.00 29.99 30.76 1urk n HIS 129 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 1urk n ASP 130 N 0.00 -4.04 -2.21 0.26 9.92 -1.26 -4.90 116.55 114.32 1urk n ASP 130 Ca 0.00 -0.32 -0.22 0.00 -0.53 0.00 0.00 54.79 53.73 1urk n ASP 130 Cb 0.00 -2.62 -0.03 0.00 -0.64 0.00 0.00 41.12 37.84 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 0.77 2.84 -2.26 0.00 0.00 -1.26 -3.96 120.51 116.64 1urk n ALA 132 Ca 0.40 -1.06 0.04 0.00 0.00 0.00 0.00 53.44 52.83 1urk n ALA 132 Cb 0.59 -1.01 0.06 0.00 0.00 0.00 0.00 19.45 19.09 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 0.76 1.12 -0.01 0.00 8.00 -1.26 -4.79 116.55 120.37 1urk n ASP 133 Ca 0.18 -2.43 -0.00 0.00 0.71 0.00 0.00 54.79 53.24 1urk n ASP 133 Cb 0.62 -0.35 -0.02 0.00 -0.02 0.00 0.00 41.12 41.35 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 0.09 -0.13 4.00 0.44 0.00 -1.25 -5.19 105.19 103.15 1urk n GLY 134 Ca 0.09 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1urk n GLY 134 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60