#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vxj s TRP 2 N 0.00 0.30 -0.02 0.00 -0.00 -0.05 -5.01 118.94 114.17 2vxj s TRP 2 Ca 0.00 -0.08 0.01 0.00 -0.00 0.00 0.00 56.10 56.03 2vxj s TRP 2 Cb 0.00 -0.19 0.02 0.00 -0.00 0.00 0.00 33.47 33.29 2vxj s TRP 2 CO 0.00 -0.01 -0.01 0.21 -0.00 0.00 0.00 176.95 177.14 2vxj s LYS 3 N -0.16 0.22 0.00 5.86 2.20 -1.26 -1.11 119.74 125.49 2vxj s LYS 3 Ca 0.01 0.02 0.00 0.00 -0.36 0.00 0.00 55.97 55.64 2vxj s LYS 3 Cb -0.02 -0.34 0.00 0.00 -1.51 0.00 0.00 37.83 35.96 2vxj s LYS 3 CO -0.00 -0.06 0.00 0.41 -0.36 0.00 0.00 175.35 175.33 2vxj n GLY 4 N 3.70 -0.55 3.87 5.54 0.00 -0.80 -5.01 105.19 111.93 2vxj n GLY 4 Ca -0.21 -0.95 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 2vxj n GLY 4 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vxj s GLU 5 N -2.00 3.61 -0.33 1.61 2.56 -1.26 -1.49 118.70 121.39 2vxj s GLU 5 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.97 55.00 2vxj s GLU 5 Cb 0.00 -3.16 0.08 0.00 2.00 0.00 0.00 34.13 33.05 2vxj s GLU 5 CO 0.00 0.71 0.05 0.08 -0.56 0.00 0.00 175.26 175.54 2vxj s VAL 6 N -1.13 2.72 0.13 3.70 1.01 -0.16 -4.93 120.40 121.75 2vxj s VAL 6 Ca 0.21 -1.88 -0.29 0.00 0.00 0.00 0.00 61.98 60.03 2vxj s VAL 6 Cb -0.14 -2.78 -0.07 0.00 0.00 0.00 0.00 36.38 33.40 2vxj s VAL 6 CO 0.10 -0.39 0.90 -0.76 0.00 0.00 0.00 175.10 174.96 2vxj s LEU 7 N 1.10 4.53 0.42 3.92 1.02 -1.26 -1.51 118.68 126.90 2vxj s LEU 7 Ca 0.02 1.75 0.09 0.00 0.02 0.00 0.00 54.13 56.01 2vxj s LEU 7 Cb -0.20 -3.50 0.93 0.00 0.02 0.00 0.00 46.19 43.44 2vxj s LEU 7 CO -0.05 0.02 2.05 0.00 0.02 0.00 0.00 176.35 178.40 2vxj h ALA 8 N 5.20 1.79 -0.18 4.21 0.00 -1.56 -2.34 119.26 126.39 2vxj h ALA 8 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2vxj h ALA 8 Cb 1.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2vxj h ALA 8 CO 0.70 0.17 0.00 0.27 0.00 0.00 0.00 179.25 180.39 2vxj n ASN 9 N -4.48 1.80 -4.47 0.00 6.94 -1.26 -4.73 115.26 109.05 2vxj n ASN 9 Ca 0.04 -1.73 -0.43 0.00 -0.02 0.00 0.00 54.58 52.44 2vxj n ASN 9 Cb 0.12 -0.11 -0.02 0.00 -2.36 0.00 0.00 39.78 37.40 2vxj n ASN 9 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 2vxj s ASN 10 N -1.57 6.65 0.39 0.53 3.84 -0.88 -4.77 114.94 119.13 2vxj s ASN 10 Ca 0.33 -2.03 0.07 0.00 0.21 0.00 0.00 52.86 51.44 2vxj s ASN 10 Cb 0.18 -2.43 0.80 0.00 -0.55 0.00 0.00 41.25 39.25 2vxj s ASN 10 CO 0.27 -1.12 1.99 -0.08 -2.79 0.00 0.00 177.10 175.36 2vxj h GLU 11 N 8.83 0.43 0.00 0.43 4.81 -1.87 -2.54 114.58 124.68 2vxj h GLU 11 Ca 0.19 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 2vxj h GLU 11 Cb 1.00 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.29 2vxj h GLU 11 CO 1.19 0.39 -0.59 0.00 -0.73 0.00 0.00 179.01 179.26 2vxj h ALA 12 N 1.68 1.01 0.00 2.92 0.00 -1.97 -3.49 119.26 119.41 2vxj h ALA 12 Ca 0.11 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2vxj h ALA 12 Cb 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2vxj h ALA 12 CO -0.01 0.74 0.00 0.41 0.00 0.00 0.00 179.25 180.40 2vxj n GLY 13 N 0.20 1.66 3.39 0.00 0.00 -0.96 -4.92 105.19 104.56 2vxj n GLY 13 Ca -0.01 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 2vxj n GLY 13 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2vxj s GLN 14 N -2.23 2.87 0.34 1.61 2.00 0.99 -4.89 119.66 120.35 2vxj s GLN 14 Ca 0.00 -1.14 -0.28 0.00 -2.00 0.00 0.00 55.36 51.94 2vxj s GLN 14 Cb 0.00 -3.88 -0.10 0.00 0.80 0.00 0.00 33.01 29.83 2vxj s GLN 14 CO 0.00 -0.79 1.26 0.54 -0.50 0.00 0.00 175.29 175.80 2vxj s VAL 15 N 1.60 2.87 0.44 1.34 0.11 -1.26 -0.78 120.40 124.72 2vxj s VAL 15 Ca 0.03 0.84 0.07 0.00 -2.93 0.00 0.00 61.98 60.00 2vxj s VAL 15 Cb -0.20 -3.52 -0.01 0.00 -1.53 0.00 0.00 36.38 31.11 2vxj s VAL 15 CO 0.07 0.17 0.35 0.42 -3.33 0.00 0.00 175.10 172.79 2vxj s THR 16 N -1.20 2.38 -2.20 5.04 -4.23 -0.68 -4.93 115.64 109.83 2vxj s THR 16 Ca 0.51 -1.43 0.24 0.00 -1.18 0.00 0.00 61.69 59.82 2vxj s THR 16 Cb -0.37 -2.82 0.57 0.00 1.34 0.00 0.00 72.50 71.22 2vxj s THR 16 CO 0.49 0.00 1.75 -1.54 -0.54 0.00 0.00 174.62 174.78 2vxj n SER 17 N -1.54 0.88 -4.61 3.99 3.41 -1.26 -4.68 113.62 109.81 2vxj n SER 17 Ca 0.02 -1.46 -0.41 0.00 -0.26 0.00 0.00 58.87 56.75 2vxj n SER 17 Cb 0.63 -0.04 -0.06 0.00 -0.26 0.00 0.00 64.21 64.48 2vxj n SER 17 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2vxj s ILE 18 N -1.93 4.91 -0.39 -1.33 -1.09 -1.26 -5.01 121.20 115.10 2vxj s ILE 18 Ca 0.35 1.01 -0.11 0.00 -2.23 0.00 0.00 60.65 59.66 2vxj s ILE 18 Cb 0.18 -4.02 0.04 0.00 -1.58 0.00 0.00 42.46 37.07 2vxj s ILE 18 CO 0.28 -0.13 0.23 -0.63 -1.23 0.00 0.00 174.94 173.47 2vxj s ILE 19 N 2.67 4.65 -0.06 2.92 1.01 -1.26 -0.16 121.20 130.96 2vxj s ILE 19 Ca 0.27 -0.92 -0.30 0.00 0.00 0.00 0.00 60.65 59.71 2vxj s ILE 19 Cb -0.15 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 2vxj s ILE 19 CO 0.11 -0.30 1.32 -0.47 0.00 0.00 0.00 174.94 175.60 2vxj s TYR 20 N 1.56 2.90 0.14 3.97 6.14 -0.23 -4.88 117.35 126.93 2vxj s TYR 20 Ca 0.02 0.95 0.08 0.00 0.64 0.00 0.00 57.07 58.76 2vxj s TYR 20 Cb -0.20 -3.57 -0.04 0.00 0.42 0.00 0.00 41.96 38.58 2vxj s TYR 20 CO 0.07 -2.01 -0.08 -0.80 0.64 0.00 0.00 175.55 173.37 2vxj s ASN 21 N 1.88 4.42 0.01 4.32 0.01 -1.26 -1.23 114.94 123.09 2vxj s ASN 21 Ca 0.60 -0.44 -0.38 0.00 -0.71 0.00 0.00 52.86 51.93 2vxj s ASN 21 Cb -0.27 -0.83 -0.17 0.00 0.41 0.00 0.00 41.25 40.39 2vxj s ASN 21 CO 0.22 0.14 1.41 -2.65 -1.51 0.00 0.00 177.10 174.72 2vxj n PRO 22 N 0.40 1.11 0.00 -0.60 -0.02 -1.26 -0.93 135.00 133.69 2vxj n PRO 22 Ca -0.12 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2vxj n PRO 22 Cb 0.54 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 2vxj n PRO 22 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vxj n GLY 23 N 2.82 1.85 3.77 -1.23 0.00 -1.26 -5.04 105.19 106.10 2vxj n GLY 23 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 2vxj n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vxj s ASP 24 N -1.97 6.59 -0.16 1.61 1.01 -0.11 -4.95 116.67 118.70 2vxj s ASP 24 Ca 0.00 2.83 -0.06 0.00 0.71 0.00 0.00 52.55 56.03 2vxj s ASP 24 Cb 0.00 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 41.24 2vxj s ASP 24 CO 0.00 -0.69 0.04 -0.69 0.21 0.00 0.00 175.17 174.04 2vxj s VAL 25 N -1.01 4.60 0.08 -1.27 1.01 -1.26 -4.47 120.40 118.08 2vxj s VAL 25 Ca 0.52 -0.11 0.05 0.00 0.00 0.00 0.00 61.98 62.44 2vxj s VAL 25 Cb -0.43 -3.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 2vxj s VAL 25 CO 0.56 0.50 -0.15 0.27 0.00 0.00 0.00 175.10 176.29 2vxj s ILE 26 N 0.05 1.16 -0.06 2.22 -4.36 0.12 -0.26 121.20 120.07 2vxj s ILE 26 Ca 0.04 -1.35 0.04 0.00 -0.26 0.00 0.00 60.65 59.13 2vxj s ILE 26 Cb -0.12 -1.13 -0.00 0.00 1.25 0.00 0.00 42.46 42.45 2vxj s ILE 26 CO 0.01 -0.23 -0.19 -0.89 0.24 0.00 0.00 174.94 173.88 2vxj s THR 27 N -1.33 1.62 -0.03 8.37 2.01 -0.53 0.10 115.64 125.84 2vxj s THR 27 Ca -0.01 -0.80 0.05 0.00 0.31 0.00 0.00 61.69 61.25 2vxj s THR 27 Cb -0.10 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.00 2vxj s THR 27 CO 0.02 0.46 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.59 2vxj s ILE 28 N 0.19 1.61 -0.08 1.82 1.01 0.28 -1.65 121.20 124.37 2vxj s ILE 28 Ca -0.09 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 59.74 2vxj s ILE 28 Cb -0.14 -1.36 0.01 0.00 0.01 0.00 0.00 42.46 40.99 2vxj s ILE 28 CO 0.04 0.46 -0.13 -0.69 0.00 0.00 0.00 174.94 174.62 2vxj s VAL 29 N -0.20 1.20 -0.03 2.92 1.01 -0.83 -1.51 120.40 122.95 2vxj s VAL 29 Ca 0.01 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.54 2vxj s VAL 29 Cb -0.10 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 2vxj s VAL 29 CO 0.01 0.37 -0.18 0.00 0.00 0.00 0.00 175.10 175.30 2vxj s ALA 30 N 0.78 1.56 0.07 5.51 0.00 -0.40 -1.13 121.76 128.15 2vxj s ALA 30 Ca -0.12 -0.75 -0.06 0.00 0.00 0.00 0.00 51.96 51.02 2vxj s ALA 30 Cb -0.15 -0.46 -0.01 0.00 0.00 0.00 0.00 23.12 22.49 2vxj s ALA 30 CO 0.02 0.33 0.12 0.00 0.00 0.00 0.00 175.76 176.23 2vxj s ALA 31 N -0.19 -0.02 0.00 0.00 0.00 -0.02 -4.79 121.76 116.75 2vxj s ALA 31 Ca 0.01 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.24 2vxj s ALA 31 Cb -0.10 0.37 0.00 0.00 0.00 0.00 0.00 23.12 23.40 2vxj s ALA 31 CO 0.01 -0.43 0.00 0.41 0.00 0.00 0.00 175.76 175.75 2vxj n GLY 32 N 0.19 0.47 2.90 0.00 0.00 -1.26 -0.23 105.19 107.25 2vxj n GLY 32 Ca -0.16 -2.22 -0.20 0.00 0.00 0.00 0.00 46.02 43.44 2vxj n GLY 32 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2vxj s TRP 33 N -0.54 0.77 0.11 1.61 0.52 -1.13 -4.19 118.94 116.09 2vxj s TRP 33 Ca 0.00 -0.21 -0.08 0.00 0.02 0.00 0.00 56.10 55.83 2vxj s TRP 33 Cb 0.00 -0.67 -0.01 0.00 -1.15 0.00 0.00 33.47 31.64 2vxj s TRP 33 CO 0.00 -0.19 0.20 0.00 0.02 0.00 0.00 176.95 176.98 2vxj s ALA 34 N 0.86 -0.02 0.03 0.98 0.00 -0.70 -2.20 121.76 120.71 2vxj s ALA 34 Ca -0.12 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.07 2vxj s ALA 34 Cb -0.14 0.62 -0.02 0.00 0.00 0.00 0.00 23.12 23.58 2vxj s ALA 34 CO 0.00 -0.54 -0.12 0.45 0.00 0.00 0.00 175.76 175.55 2vxj s SER 35 N -2.91 1.46 0.00 0.00 0.15 0.62 -0.61 113.70 112.41 2vxj s SER 35 Ca 0.11 -0.39 0.20 0.00 0.70 0.00 0.00 55.95 56.57 2vxj s SER 35 Cb 0.05 -0.10 0.80 0.00 -1.71 0.00 0.00 66.02 65.06 2vxj s SER 35 CO -0.06 0.04 1.57 0.00 1.20 0.00 0.00 173.24 175.98 2vxj n TYR 36 N 2.11 0.18 0.00 3.44 4.11 -1.26 -0.99 117.16 124.74 2vxj n TYR 36 Ca -0.17 -0.09 0.00 0.00 -0.00 0.00 0.00 57.90 57.64 2vxj n TYR 36 Cb 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.89 2vxj n TYR 36 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2vxj n GLY 37 N 1.07 0.28 3.69 -7.48 0.00 -1.25 -4.50 105.19 97.01 2vxj n GLY 37 Ca 0.16 0.18 -0.31 0.00 0.00 0.00 0.00 46.02 46.04 2vxj n GLY 37 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2vxj s PRO 38 N 0.00 1.23 0.49 1.61 0.02 -1.26 -4.93 135.00 132.17 2vxj s PRO 38 Ca 0.00 1.47 0.28 0.00 0.02 0.00 0.00 61.00 62.76 2vxj s PRO 38 Cb 0.00 -1.76 1.21 0.00 0.02 0.00 0.00 34.50 33.97 2vxj s PRO 38 CO 0.00 -2.46 1.95 1.79 -0.33 0.00 0.00 177.00 177.95 2vxj h THR 39 N -1.74 0.44 -4.05 0.99 1.35 -2.01 -3.44 112.91 104.44 2vxj h THR 39 Ca -0.43 -0.80 -0.48 0.00 -0.55 0.00 0.00 66.41 64.15 2vxj h THR 39 Cb 1.26 1.57 0.15 0.00 -1.73 0.00 0.00 68.15 69.40 2vxj h THR 39 CO 0.44 0.14 0.25 -1.10 -0.25 0.00 0.00 175.52 174.99 2vxj s GLN 40 N -3.83 1.15 0.11 4.72 -0.21 -1.26 -5.07 119.66 115.28 2vxj s GLN 40 Ca -0.01 0.75 0.04 0.00 0.02 0.00 0.00 55.36 56.17 2vxj s GLN 40 Cb 0.11 -1.80 -0.04 0.00 1.00 0.00 0.00 33.01 32.28 2vxj s GLN 40 CO 0.60 -2.30 -0.10 0.15 -2.12 0.00 0.00 175.29 171.52 2vxj s LYS 41 N -4.95 0.91 0.10 2.91 1.02 -1.26 -4.57 119.74 113.90 2vxj s LYS 41 Ca 0.64 -1.23 0.06 0.00 0.02 0.00 0.00 55.97 55.46 2vxj s LYS 41 Cb -0.18 -0.59 -0.03 0.00 -0.52 0.00 0.00 37.83 36.51 2vxj s LYS 41 CO 0.57 0.09 -0.15 -1.58 -0.92 0.00 0.00 175.35 173.36 2vxj s TRP 42 N -2.61 1.38 0.66 3.18 0.51 0.22 -4.87 118.94 117.41 2vxj s TRP 42 Ca 0.08 -0.51 -0.11 0.00 -2.12 0.00 0.00 56.10 53.44 2vxj s TRP 42 Cb -0.02 -0.74 0.17 0.00 -0.81 0.00 0.00 33.47 32.06 2vxj s TRP 42 CO 0.00 0.12 0.53 0.41 -0.51 0.00 0.00 176.95 177.51 2vxj n GLY 43 N 0.85 -2.91 0.00 0.98 0.00 -1.26 -1.72 105.19 101.12 2vxj n GLY 43 Ca -0.18 -1.42 0.05 0.00 0.00 0.00 0.00 46.02 44.47 2vxj n GLY 43 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2vxj n PRO 44 N -3.39 0.10 0.00 1.61 -0.04 -1.26 -1.56 135.00 130.46 2vxj n PRO 44 Ca 0.08 0.23 0.14 0.00 -0.04 0.00 0.00 63.50 63.90 2vxj n PRO 44 Cb 0.30 -1.50 0.60 0.00 -0.04 0.00 0.00 33.50 32.86 2vxj n PRO 44 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2vxj n GLN 45 N -1.36 0.04 0.00 0.54 6.02 -1.26 -1.35 117.38 120.01 2vxj n GLN 45 Ca 0.04 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.03 2vxj n GLN 45 Cb 0.10 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.86 2vxj n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vxj n GLY 46 N 1.48 -0.89 3.30 1.08 0.00 -0.60 -4.35 105.19 105.21 2vxj n GLY 46 Ca 0.08 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 2vxj n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2vxj s ASP 47 N -4.00 5.84 0.08 1.61 -1.08 0.16 -4.63 116.67 114.64 2vxj s ASP 47 Ca 0.00 -1.54 0.16 0.00 -0.52 0.00 0.00 52.55 50.65 2vxj s ASP 47 Cb 0.00 -2.07 0.68 0.00 -1.46 0.00 0.00 42.92 40.07 2vxj s ASP 47 CO 0.00 -0.62 1.50 -2.11 0.52 0.00 0.00 175.17 174.45 2vxj n ARG 48 N 5.03 0.05 0.00 4.34 1.85 -1.26 -2.62 116.66 124.05 2vxj n ARG 48 Ca -0.11 0.33 0.11 0.00 -1.00 0.00 0.00 57.85 57.18 2vxj n ARG 48 Cb 0.43 -1.61 0.04 0.00 -1.05 0.00 0.00 32.46 30.27 2vxj n ARG 48 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2vxj n GLU 49 N -1.71 0.91 -3.63 2.89 1.02 -1.26 -5.00 120.64 113.86 2vxj n GLU 49 Ca 0.03 -0.72 -0.36 0.00 -0.02 0.00 0.00 57.16 56.08 2vxj n GLU 49 Cb 0.17 -1.49 -0.07 0.00 -0.02 0.00 0.00 31.44 30.03 2vxj n GLU 49 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2vxj s HIS 50 N -2.59 3.48 0.61 -0.32 2.46 -1.08 -5.07 115.29 112.79 2vxj s HIS 50 Ca 0.17 0.54 -0.17 0.00 0.47 0.00 0.00 55.06 56.08 2vxj s HIS 50 Cb 0.18 -2.24 -0.02 0.00 -0.13 0.00 0.00 32.58 30.36 2vxj s HIS 50 CO 0.62 0.34 1.12 -1.25 -2.47 0.00 0.00 174.74 173.10 2vxj s PRO 51 N 0.15 3.02 -0.51 2.88 0.04 -1.26 -4.69 135.00 134.63 2vxj s PRO 51 Ca 0.15 1.48 -0.28 0.00 0.04 0.00 0.00 61.00 62.38 2vxj s PRO 51 Cb -0.13 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.47 2vxj s PRO 51 CO 0.03 -1.09 1.12 0.34 0.04 0.00 0.00 177.00 177.44 2vxj s ASP 52 N -2.26 6.56 -0.35 6.66 -1.08 -1.26 -4.91 116.67 120.02 2vxj s ASP 52 Ca 0.69 0.30 0.07 0.00 -0.52 0.00 0.00 52.55 53.09 2vxj s ASP 52 Cb -0.22 -2.53 0.61 0.00 -1.46 0.00 0.00 42.92 39.32 2vxj s ASP 52 CO 0.36 -1.29 1.70 0.00 0.52 0.00 0.00 175.17 176.45 2vxj n GLN 53 N 7.90 2.33 0.00 4.34 6.02 -1.26 -4.82 117.38 131.89 2vxj n GLN 53 Ca 0.10 -3.08 0.00 0.00 -0.01 0.00 0.00 57.00 54.01 2vxj n GLN 53 Cb 0.49 -2.02 0.00 0.00 1.02 0.00 0.00 30.24 29.73 2vxj n GLN 53 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vxj n GLY 54 N -0.97 1.06 3.75 1.08 0.00 -1.26 -4.98 105.19 103.86 2vxj n GLY 54 Ca 0.45 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.12 2vxj n GLY 54 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vxj s LEU 55 N 0.00 3.46 0.33 0.99 1.43 -1.26 -4.18 118.68 119.44 2vxj s LEU 55 Ca 0.00 2.27 0.26 0.00 -1.03 0.00 0.00 54.13 55.63 2vxj s LEU 55 Cb 0.00 -4.58 1.11 0.00 0.03 0.00 0.00 46.19 42.75 2vxj s LEU 55 CO 0.00 -1.86 1.77 0.16 0.23 0.00 0.00 176.35 176.65 2vxj h ILE 56 N 0.20 0.00 -3.06 -0.59 3.07 -1.82 -3.38 117.51 111.93 2vxj h ILE 56 Ca -0.48 -0.25 -0.52 0.00 1.55 0.00 0.00 64.86 65.15 2vxj h ILE 56 Cb 1.28 1.02 -0.40 0.00 -0.27 0.00 0.00 36.82 38.45 2vxj h ILE 56 CO 0.53 0.00 -0.76 0.00 -1.05 0.00 0.00 178.15 176.86 2vxj n HIS 58 N 5.12 0.00 0.92 0.00 8.25 -1.26 -3.13 115.22 125.12 2vxj n HIS 58 Ca -0.06 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.51 2vxj n HIS 58 Cb 0.45 -0.44 0.31 0.00 1.12 0.00 0.00 29.99 31.43 2vxj n HIS 58 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2vxj n ASP 59 N -1.44 2.30 -4.01 0.41 8.00 -1.26 -4.89 116.55 115.66 2vxj n ASP 59 Ca 0.06 -1.82 -0.10 0.00 0.71 0.00 0.00 54.79 53.65 2vxj n ASP 59 Cb 0.20 -0.15 -0.08 0.00 -0.02 0.00 0.00 41.12 41.08 2vxj n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vxj s ALA 60 N -1.70 0.20 0.63 2.24 0.00 -1.18 -4.85 121.76 117.10 2vxj s ALA 60 Ca 0.34 -1.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.14 2vxj s ALA 60 Cb 0.19 0.92 -0.02 0.00 0.00 0.00 0.00 23.12 24.21 2vxj s ALA 60 CO 0.28 -0.64 1.04 -0.06 0.00 0.00 0.00 175.76 176.39 2vxj s PHE 61 N -4.00 3.27 0.32 0.00 0.08 -1.26 -4.90 117.98 111.49 2vxj s PHE 61 Ca 0.20 1.41 -0.29 0.00 0.12 0.00 0.00 56.93 58.37 2vxj s PHE 61 Cb 0.04 -2.85 -0.12 0.00 -0.57 0.00 0.00 43.02 39.52 2vxj s PHE 61 CO 0.02 -0.96 1.55 0.00 -0.10 0.00 0.00 175.22 175.73 2vxj n GLY 63 N 1.63 0.50 3.86 0.00 0.00 0.07 0.39 105.19 111.64 2vxj n GLY 63 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 2vxj n GLY 63 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxj s ALA 64 N -2.13 3.20 -0.04 4.61 0.00 -0.62 -3.47 121.76 123.32 2vxj s ALA 64 Ca 0.00 -0.02 -0.26 0.00 0.00 0.00 0.00 51.96 51.68 2vxj s ALA 64 Cb 0.00 -2.92 -0.03 0.00 0.00 0.00 0.00 23.12 20.16 2vxj s ALA 64 CO 0.00 -0.16 0.82 -1.17 0.00 0.00 0.00 175.76 175.25 2vxj s LEU 65 N -4.05 4.34 0.32 0.00 2.96 -0.46 -0.40 118.68 121.40 2vxj s LEU 65 Ca 0.55 1.40 0.03 0.00 -0.22 0.00 0.00 54.13 55.89 2vxj s LEU 65 Cb -0.10 -3.30 -0.05 0.00 0.50 0.00 0.00 46.19 43.24 2vxj s LEU 65 CO 0.33 -0.18 0.10 0.68 -1.32 0.00 0.00 176.35 175.96 2vxj s VAL 66 N 0.90 0.74 0.10 1.68 -7.23 -0.47 -1.23 120.40 114.89 2vxj s VAL 66 Ca 0.44 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.59 2vxj s VAL 66 Cb -0.19 -2.61 -0.04 0.00 0.56 0.00 0.00 36.38 34.10 2vxj s VAL 66 CO 0.22 0.00 0.03 0.00 -0.31 0.00 0.00 175.10 175.04 2vxj s MET 67 N -3.89 0.80 0.11 4.82 0.23 0.02 -1.06 119.30 120.34 2vxj s MET 67 Ca 0.34 -1.33 0.10 0.00 -1.03 0.00 0.00 55.69 53.76 2vxj s MET 67 Cb 0.07 0.24 -0.04 0.00 -1.53 0.00 0.00 34.83 33.56 2vxj s MET 67 CO 0.15 -0.20 -0.22 0.15 -2.03 0.00 0.00 175.02 172.86 2vxj s LYS 68 N -3.99 1.66 -0.24 3.16 1.02 -0.41 -0.29 119.74 120.66 2vxj s LYS 68 Ca 0.17 -1.22 -0.00 0.00 0.02 0.00 0.00 55.97 54.93 2vxj s LYS 68 Cb 0.08 -2.03 0.03 0.00 -0.52 0.00 0.00 37.83 35.39 2vxj s LYS 68 CO -0.03 0.48 -0.10 0.42 -0.92 0.00 0.00 175.35 175.20 2vxj s ILE 69 N -1.06 2.62 0.00 2.17 1.01 -1.26 -1.13 121.20 123.55 2vxj s ILE 69 Ca 0.16 -1.09 0.00 0.00 0.00 0.00 0.00 60.65 59.72 2vxj s ILE 69 Cb -0.10 -2.31 0.00 0.00 0.01 0.00 0.00 42.46 40.05 2vxj s ILE 69 CO 0.07 0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.86 2vxj n GLY 70 N 4.63 3.68 2.09 6.18 0.00 -0.24 -1.64 105.19 119.88 2vxj n GLY 70 Ca -0.17 0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 2vxj n GLY 70 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vxj n ASN 71 N 5.67 5.86 -4.46 1.61 3.02 -1.26 -4.89 115.26 120.82 2vxj n ASN 71 Ca 0.00 -3.76 -0.29 0.00 -0.03 0.00 0.00 54.58 50.50 2vxj n ASN 71 Cb 0.00 -0.77 0.18 0.00 -0.61 0.00 0.00 39.78 38.58 2vxj n ASN 71 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2vxj s SER 72 N -2.28 2.63 0.95 6.41 1.04 -0.65 -5.07 113.70 116.74 2vxj s SER 72 Ca 0.58 0.85 -0.15 0.00 0.48 0.00 0.00 55.95 57.70 2vxj s SER 72 Cb 0.47 -1.30 0.18 0.00 0.10 0.00 0.00 66.02 65.47 2vxj s SER 72 CO 0.02 -3.09 1.25 -0.83 0.98 0.00 0.00 173.24 171.57 2vxj s GLY 73 N -3.97 1.70 0.42 7.32 0.00 -1.26 -4.70 107.32 106.82 2vxj s GLY 73 Ca 0.67 -0.98 -0.25 0.00 0.00 0.00 0.00 44.72 44.16 2vxj s GLY 73 CO 0.55 -0.28 1.27 -0.51 0.00 0.00 0.00 173.10 174.12 2vxj s THR 74 N -3.66 2.73 -0.08 0.90 -4.23 -1.26 -4.61 115.64 105.44 2vxj s THR 74 Ca 0.70 0.62 0.02 0.00 -1.18 0.00 0.00 61.69 61.85 2vxj s THR 74 Cb -0.07 -3.35 0.02 0.00 1.34 0.00 0.00 72.50 70.43 2vxj s THR 74 CO 0.53 0.07 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.94 2vxj s ILE 75 N -1.33 1.07 0.27 2.99 1.01 0.60 -4.94 121.20 120.88 2vxj s ILE 75 Ca 0.59 -0.41 -0.30 0.00 0.00 0.00 0.00 60.65 60.53 2vxj s ILE 75 Cb -0.36 -1.01 -0.11 0.00 0.01 0.00 0.00 42.46 40.99 2vxj s ILE 75 CO 0.45 0.35 1.62 -2.84 0.00 0.00 0.00 174.94 174.52 2vxj s PRO 76 N 0.93 4.12 -0.15 2.79 0.02 -1.26 -0.80 135.00 140.65 2vxj s PRO 76 Ca -0.10 2.58 -0.04 0.00 0.02 0.00 0.00 61.00 63.47 2vxj s PRO 76 Cb -0.15 -3.04 -0.08 0.00 0.02 0.00 0.00 34.50 31.26 2vxj s PRO 76 CO 0.01 -0.66 -0.16 0.28 -0.33 0.00 0.00 177.00 176.13 2vxj n VAL 77 N 2.60 0.82 0.00 3.83 0.31 -0.80 -4.85 118.33 120.24 2vxj n VAL 77 Ca 0.10 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2vxj n VAL 77 Cb 0.37 -1.40 0.00 0.00 -0.91 0.00 0.00 33.84 31.90 2vxj n VAL 77 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2vxj n ASN 78 N -3.34 0.00 0.03 4.52 3.02 -0.37 -0.71 115.26 118.41 2vxj n ASN 78 Ca -0.28 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.37 2vxj n ASN 78 Cb 0.74 0.00 0.43 0.00 -0.61 0.00 0.00 39.78 40.33 2vxj n ASN 78 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2vxj n THR 79 N 0.00 0.67 0.00 3.41 -2.24 -1.26 -4.61 114.28 110.25 2vxj n THR 79 Ca 0.00 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 2vxj n THR 79 Cb 0.00 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.38 2vxj n THR 79 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vxj n GLY 80 N 0.51 1.41 2.96 3.38 0.00 0.12 -1.27 105.19 112.30 2vxj n GLY 80 Ca 0.04 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 43.93 2vxj n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vxj s LEU 81 N 0.00 1.67 -0.32 0.99 1.43 -0.57 -4.93 118.68 116.96 2vxj s LEU 81 Ca 0.00 -0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 52.93 2vxj s LEU 81 Cb 0.00 -0.48 0.06 0.00 0.03 0.00 0.00 46.19 45.81 2vxj s LEU 81 CO 0.00 0.03 0.03 0.12 0.23 0.00 0.00 176.35 176.75 2vxj s PHE 82 N 0.38 3.34 -1.20 0.29 5.36 -1.26 -0.56 117.98 124.34 2vxj s PHE 82 Ca -0.05 -2.05 -0.17 0.00 -0.96 0.00 0.00 56.93 53.69 2vxj s PHE 82 Cb -0.10 -2.32 -0.00 0.00 -0.34 0.00 0.00 43.02 40.26 2vxj s PHE 82 CO 0.00 -0.84 0.71 0.54 -1.46 0.00 0.00 175.22 174.17 2vxj n ARG 83 N 4.58 -1.70 -3.61 10.12 1.74 -1.00 -4.93 116.66 121.86 2vxj n ARG 83 Ca -0.10 0.43 -0.38 0.00 -0.77 0.00 0.00 57.85 57.03 2vxj n ARG 83 Cb 0.43 -4.14 -0.06 0.00 -1.02 0.00 0.00 32.46 27.67 2vxj n ARG 83 CO 0.00 0.00 0.00 -0.46 -1.52 0.00 0.00 177.63 175.65 2vxj s TRP 84 N -3.57 3.66 -0.07 -1.55 -0.00 0.11 -4.77 118.94 112.75 2vxj s TRP 84 Ca 0.37 0.82 0.05 0.00 -0.00 0.00 0.00 56.10 57.34 2vxj s TRP 84 Cb -0.14 -2.19 -0.01 0.00 -0.00 0.00 0.00 33.47 31.13 2vxj s TRP 84 CO 0.87 0.63 -0.23 0.08 -0.00 0.00 0.00 176.95 178.30 2vxj s VAL 85 N -0.90 2.21 0.85 5.86 1.01 -1.26 -0.70 120.40 127.47 2vxj s VAL 85 Ca 0.21 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.07 2vxj s VAL 85 Cb -0.15 -1.82 0.10 0.00 0.00 0.00 0.00 36.38 34.51 2vxj s VAL 85 CO 0.10 0.57 1.09 0.00 0.00 0.00 0.00 175.10 176.85 2vxj s ALA 86 N -0.04 1.85 0.74 5.51 0.00 -1.26 -5.02 121.76 123.54 2vxj s ALA 86 Ca -0.07 -0.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.71 2vxj s ALA 86 Cb -0.15 -3.18 0.04 0.00 0.00 0.00 0.00 23.12 19.83 2vxj s ALA 86 CO 0.05 -2.08 1.20 -2.14 0.00 0.00 0.00 175.76 172.78 2vxj s PRO 87 N -4.98 2.10 0.32 0.00 0.02 -1.26 -4.95 135.00 126.25 2vxj s PRO 87 Ca 0.62 1.71 -0.27 0.00 0.02 0.00 0.00 61.00 63.08 2vxj s PRO 87 Cb -0.17 -1.83 -0.13 0.00 0.02 0.00 0.00 34.50 32.38 2vxj s PRO 87 CO 0.56 -1.85 1.03 -1.71 -0.33 0.00 0.00 177.00 174.70 2vxj n ASN 88 N -2.82 1.41 -2.05 2.53 4.05 -1.26 -2.23 115.26 114.89 2vxj n ASN 88 Ca 0.13 1.16 -0.20 0.00 0.45 0.00 0.00 54.58 56.11 2vxj n ASN 88 Cb 0.50 -1.32 -0.04 0.00 1.23 0.00 0.00 39.78 40.16 2vxj n ASN 88 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2vxj n ASN 89 N 1.07 -5.68 -4.66 1.20 5.03 -1.26 -5.01 115.26 105.95 2vxj n ASN 89 Ca 0.09 0.17 -0.37 0.00 0.87 0.00 0.00 54.58 55.34 2vxj n ASN 89 Cb 0.34 -4.80 -0.09 0.00 -1.02 0.00 0.00 39.78 34.21 2vxj n ASN 89 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2vxj s VAL 90 N -2.92 5.33 0.09 2.41 1.01 -0.95 -5.07 120.40 120.30 2vxj s VAL 90 Ca 0.00 0.27 -0.25 0.00 0.00 0.00 0.00 61.98 61.99 2vxj s VAL 90 Cb 0.00 -3.54 0.08 0.00 0.00 0.00 0.00 36.38 32.92 2vxj s VAL 90 CO 0.00 0.33 0.68 0.00 0.00 0.00 0.00 175.10 176.11 2vxj s GLN 91 N 1.11 1.14 0.00 2.72 -2.07 -1.26 -4.62 119.66 116.68 2vxj s GLN 91 Ca 0.09 -0.32 0.00 0.00 -1.82 0.00 0.00 55.36 53.32 2vxj s GLN 91 Cb -0.14 0.53 0.00 0.00 -1.09 0.00 0.00 33.01 32.31 2vxj s GLN 91 CO 0.05 -0.48 0.00 0.41 -1.32 0.00 0.00 175.29 173.95 2vxj n GLY 92 N -0.14 0.84 3.67 2.60 0.00 -0.36 -3.42 105.19 108.38 2vxj n GLY 92 Ca -0.16 -2.32 -0.45 0.00 0.00 0.00 0.00 46.02 43.09 2vxj n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxj n ALA 93 N -1.00 1.11 -2.65 4.61 0.00 -1.26 -1.07 120.51 120.25 2vxj n ALA 93 Ca 0.00 0.42 -0.42 0.00 0.00 0.00 0.00 53.44 53.44 2vxj n ALA 93 Cb 0.00 -2.28 -0.04 0.00 0.00 0.00 0.00 19.45 17.13 2vxj n ALA 93 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2vxj s ILE 94 N 0.02 4.82 -0.12 0.00 1.01 0.77 -1.08 121.20 126.62 2vxj s ILE 94 Ca 0.69 1.67 -0.02 0.00 0.00 0.00 0.00 60.65 62.99 2vxj s ILE 94 Cb -0.65 -4.16 -0.03 0.00 0.01 0.00 0.00 42.46 37.63 2vxj s ILE 94 CO 0.49 -0.06 -0.06 -0.89 0.00 0.00 0.00 174.94 174.42 2vxj s THR 95 N 2.66 3.74 -0.07 2.92 2.01 -0.28 -1.68 115.64 124.94 2vxj s THR 95 Ca 0.38 -0.43 -0.06 0.00 0.31 0.00 0.00 61.69 61.89 2vxj s THR 95 Cb -0.16 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.72 2vxj s THR 95 CO 0.09 0.54 0.18 -0.76 -0.69 0.00 0.00 174.62 173.97 2vxj s LEU 96 N -0.07 4.39 -0.06 4.42 1.43 0.04 -1.29 118.68 127.53 2vxj s LEU 96 Ca 0.01 0.46 -0.06 0.00 -1.03 0.00 0.00 54.13 53.51 2vxj s LEU 96 Cb -0.13 -2.31 0.02 0.00 0.03 0.00 0.00 46.19 43.79 2vxj s LEU 96 CO 0.03 0.35 0.18 -0.63 0.23 0.00 0.00 176.35 176.50 2vxj s ILE 97 N -1.15 0.00 0.15 -0.59 1.01 -0.23 -0.00 121.20 120.40 2vxj s ILE 97 Ca 0.20 -0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.52 2vxj s ILE 97 Cb -0.12 -0.27 -0.07 0.00 0.01 0.00 0.00 42.46 42.01 2vxj s ILE 97 CO 0.10 -0.02 1.16 -0.47 0.00 0.00 0.00 174.94 175.71 2vxj s TYR 98 N 0.02 3.49 -0.51 3.97 5.04 -1.26 -1.36 117.35 126.73 2vxj s TYR 98 Ca -0.01 1.45 -0.25 0.00 -2.44 0.00 0.00 57.07 55.82 2vxj s TYR 98 Cb -0.02 -3.37 0.03 0.00 0.35 0.00 0.00 41.96 38.95 2vxj s TYR 98 CO 0.00 -1.02 0.97 1.21 -1.34 0.00 0.00 175.55 175.38 2vxj s ASN 99 N 0.31 6.43 0.32 4.32 2.47 0.47 -4.92 114.94 124.34 2vxj s ASN 99 Ca 0.53 -0.07 -0.05 0.00 0.42 0.00 0.00 52.86 53.69 2vxj s ASN 99 Cb -0.31 -2.46 0.00 0.00 -1.45 0.00 0.00 41.25 37.04 2vxj s ASN 99 CO 0.34 -1.18 0.47 -0.62 -3.72 0.00 0.00 177.10 172.39 2vxj s ASP 100 N 2.59 0.67 0.05 -4.21 -1.08 -1.26 -0.75 116.67 112.68 2vxj s ASP 100 Ca 0.35 -1.37 -0.30 0.00 -0.52 0.00 0.00 52.55 50.71 2vxj s ASP 100 Cb -0.11 0.65 -0.04 0.00 -1.46 0.00 0.00 42.92 41.95 2vxj s ASP 100 CO 0.23 -1.27 0.95 -0.69 0.52 0.00 0.00 175.17 174.92 2vxj s VAL 101 N -3.24 4.70 0.33 1.11 1.01 -1.26 -2.31 120.40 120.74 2vxj s VAL 101 Ca 0.29 2.03 -0.29 0.00 0.00 0.00 0.00 61.98 64.01 2vxj s VAL 101 Cb -0.00 -4.30 -0.12 0.00 0.00 0.00 0.00 36.38 31.95 2vxj s VAL 101 CO 0.18 0.24 1.34 -2.65 0.00 0.00 0.00 175.10 174.21 2vxj n PRO 102 N 3.33 2.19 -0.77 2.72 -0.02 -1.26 -1.74 135.00 139.46 2vxj n PRO 102 Ca 0.04 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 2vxj n PRO 102 Cb 0.50 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2vxj n PRO 102 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vxj n GLY 103 N 0.99 0.81 0.38 -1.23 0.00 -1.26 -4.90 105.19 99.97 2vxj n GLY 103 Ca 0.05 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 2vxj n GLY 103 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vxj n THR 104 N -2.23 1.62 0.64 2.61 -2.24 -0.71 -4.72 114.28 109.24 2vxj n THR 104 Ca 0.00 -2.19 0.13 0.00 -2.27 0.00 0.00 64.05 59.72 2vxj n THR 104 Cb 0.00 -0.06 0.31 0.00 -2.10 0.00 0.00 70.33 68.48 2vxj n THR 104 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 2vxj n TYR 105 N -1.03 0.69 -0.09 4.78 4.02 -1.26 -4.15 117.16 120.12 2vxj n TYR 105 Ca 0.14 0.20 0.03 0.00 -0.01 0.00 0.00 57.90 58.26 2vxj n TYR 105 Cb 0.70 -0.77 0.36 0.00 -0.02 0.00 0.00 39.34 39.61 2vxj n TYR 105 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2vxj h GLY 106 N 4.56 0.77 -1.74 2.72 0.00 -1.86 -2.02 103.07 105.51 2vxj h GLY 106 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2vxj h GLY 106 CO 0.00 0.27 0.00 1.16 0.00 0.00 0.00 176.54 177.97 2vxj n ASN 107 N -4.46 2.54 -4.84 0.19 6.94 -1.26 -4.96 115.26 109.42 2vxj n ASN 107 Ca 0.06 -2.06 -0.32 0.00 -0.02 0.00 0.00 54.58 52.24 2vxj n ASN 107 Cb 0.07 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.16 2vxj n ASN 107 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 2vxj s ASN 108 N -0.95 6.16 0.08 0.53 -0.87 -0.76 -3.74 114.94 115.40 2vxj s ASN 108 Ca 0.30 1.57 -0.12 0.00 -1.57 0.00 0.00 52.86 53.04 2vxj s ASN 108 Cb 0.17 -2.50 0.02 0.00 -0.02 0.00 0.00 41.25 38.91 2vxj s ASN 108 CO 0.19 -0.91 0.29 -0.94 -2.57 0.00 0.00 177.10 173.16 2vxj s SER 109 N -3.51 -0.06 0.06 -1.22 1.04 -0.17 -4.47 113.70 105.37 2vxj s SER 109 Ca 0.58 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.60 2vxj s SER 109 Cb -0.12 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2vxj s SER 109 CO 0.43 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.54 2vxj n GLY 110 N 0.09 -1.78 3.79 7.32 0.00 -1.26 -0.28 105.19 113.08 2vxj n GLY 110 Ca -0.16 -1.36 -0.02 0.00 0.00 0.00 0.00 46.02 44.48 2vxj n GLY 110 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vxj s SER 111 N -4.00 -0.07 -0.05 1.61 1.04 -0.94 -1.59 113.70 109.70 2vxj s SER 111 Ca 0.00 -0.42 0.05 0.00 0.48 0.00 0.00 55.95 56.05 2vxj s SER 111 Cb 0.00 0.39 -0.00 0.00 0.10 0.00 0.00 66.02 66.50 2vxj s SER 111 CO 0.00 -0.74 -0.20 -0.36 0.98 0.00 0.00 173.24 172.92 2vxj s PHE 112 N -2.57 1.99 -0.10 5.02 0.08 -0.57 -2.84 117.98 118.98 2vxj s PHE 112 Ca 0.18 -0.62 -0.24 0.00 0.12 0.00 0.00 56.93 56.37 2vxj s PHE 112 Cb -0.00 -1.33 -0.03 0.00 -0.57 0.00 0.00 43.02 41.08 2vxj s PHE 112 CO 0.02 -0.21 0.74 0.45 -0.10 0.00 0.00 175.22 176.12 2vxj s SER 113 N 0.05 6.97 -0.04 1.36 0.15 0.68 -0.99 113.70 121.89 2vxj s SER 113 Ca -0.06 1.17 0.02 0.00 0.70 0.00 0.00 55.95 57.78 2vxj s SER 113 Cb -0.13 -2.43 0.01 0.00 -1.71 0.00 0.00 66.02 61.76 2vxj s SER 113 CO 0.03 -0.22 -0.08 -0.69 1.20 0.00 0.00 173.24 173.49 2vxj s VAL 114 N 1.28 0.71 -0.11 4.45 1.01 -0.56 -0.84 120.40 126.36 2vxj s VAL 114 Ca 0.38 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 62.07 2vxj s VAL 114 Cb -0.17 -0.67 -0.03 0.00 0.00 0.00 0.00 36.38 35.51 2vxj s VAL 114 CO 0.16 0.24 -0.07 0.20 0.00 0.00 0.00 175.10 175.64 2vxj s ASN 115 N 0.48 4.59 -0.04 3.32 0.01 -0.29 -1.91 114.94 121.10 2vxj s ASN 115 Ca -0.07 -0.11 0.03 0.00 -0.71 0.00 0.00 52.86 52.00 2vxj s ASN 115 Cb -0.11 -1.43 0.00 0.00 0.41 0.00 0.00 41.25 40.12 2vxj s ASN 115 CO 0.01 0.27 -0.14 -0.63 -1.51 0.00 0.00 177.10 175.10 2vxj s ILE 116 N -0.25 1.18 0.10 0.60 1.01 -0.27 -1.96 121.20 121.61 2vxj s ILE 116 Ca 0.03 -0.56 0.02 0.00 0.00 0.00 0.00 60.65 60.14 2vxj s ILE 116 Cb -0.13 -1.03 -0.04 0.00 0.01 0.00 0.00 42.46 41.27 2vxj s ILE 116 CO 0.03 0.35 -0.07 -0.83 0.00 0.00 0.00 174.94 174.42 2vxj s GLY 117 N 0.23 0.78 -0.01 6.18 0.00 -0.66 -0.87 107.32 112.96 2vxj s GLY 117 Ca -0.06 -1.35 -0.20 0.00 0.00 0.00 0.00 44.72 43.11 2vxj s GLY 117 CO 0.02 -1.45 0.58 0.54 0.00 0.00 0.00 173.10 172.79 2vxj s LYS 118 N -3.78 4.31 0.67 2.90 1.02 -1.26 -1.45 119.74 122.14 2vxj s LYS 118 Ca 0.12 0.71 -0.03 0.00 0.02 0.00 0.00 55.97 56.78 2vxj s LYS 118 Cb 0.05 -3.35 0.07 0.00 -0.52 0.00 0.00 37.83 34.08 2vxj s LYS 118 CO -0.04 0.36 0.94 -0.51 -0.92 0.00 0.00 175.35 175.18 2vxj s ASP 119 N -0.13 4.77 0.50 2.83 1.01 0.64 -4.94 116.67 121.35 2vxj s ASP 119 Ca 0.31 0.09 -0.23 0.00 0.71 0.00 0.00 52.55 53.43 2vxj s ASP 119 Cb -0.18 -0.73 -0.07 0.00 1.01 0.00 0.00 42.92 42.95 2vxj s ASP 119 CO 0.17 -1.56 1.25 0.00 0.21 0.00 0.00 175.17 175.23 2vxj n GLN 120 N -2.75 1.68 0.00 8.23 6.02 -1.26 -4.59 117.38 124.71 2vxj n GLN 120 Ca 0.10 0.61 0.00 0.00 -0.01 0.00 0.00 57.00 57.70 2vxj n GLN 120 Cb 0.60 -2.42 0.00 0.00 1.02 0.00 0.00 30.24 29.44 2vxj n GLN 120 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92