#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 0.67 -0.04 0.00 -0.00 0.38 -4.98 118.94 114.97 2vxj s TRP 2 Ca 0.00 -0.15 0.02 0.00 -0.00 0.00 0.00 56.10 55.97 2vxj s TRP 2 Cb 0.00 -0.50 0.01 0.00 -0.00 0.00 0.00 33.47 32.98 2vxj s TRP 2 CO 0.00 -0.08 -0.08 -1.59 -0.00 0.00 0.00 176.95 175.20 2vxj s LYS 3 N 0.24 1.09 0.00 5.86 0.00 -1.26 -0.37 119.74 125.30 2vxj s LYS 3 Ca -0.03 -0.27 0.00 0.00 0.00 0.00 0.00 55.97 55.68 2vxj s LYS 3 Cb -0.07 -1.00 0.00 0.00 0.00 0.00 0.00 37.83 36.76 2vxj s LYS 3 CO -0.00 0.03 0.00 0.41 0.00 0.00 0.00 175.35 175.79 2vxj n GLY 4 N 3.65 1.31 3.39 0.59 0.00 -0.76 -5.02 105.19 108.35 2vxj n GLY 4 Ca -0.22 -0.66 -0.32 0.00 0.00 0.00 0.00 46.02 44.82 2vxj n GLY 4 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vxj s GLU 5 N 0.74 2.47 -0.41 1.61 0.41 -1.26 -0.87 118.70 121.38 2vxj s GLU 5 Ca 0.00 -0.79 -0.09 0.00 -0.41 0.00 0.00 54.97 53.68 2vxj s GLU 5 Cb 0.00 -2.27 0.08 0.00 -1.78 0.00 0.00 34.13 30.16 2vxj s GLU 5 CO 0.00 0.54 0.25 0.08 -0.49 0.00 0.00 175.26 175.64 2vxj s VAL 6 N -0.53 4.18 0.14 2.63 1.01 0.11 -4.92 120.40 123.02 2vxj s VAL 6 Ca 0.07 -1.41 -0.31 0.00 0.00 0.00 0.00 61.98 60.34 2vxj s VAL 6 Cb -0.11 -3.56 -0.08 0.00 0.00 0.00 0.00 36.38 32.63 2vxj s VAL 6 CO 0.01 -0.50 1.30 -0.76 0.00 0.00 0.00 175.10 175.15 2vxj s LEU 7 N 1.41 4.39 0.48 3.92 1.02 -1.26 -1.47 118.68 127.18 2vxj s LEU 7 Ca 0.03 2.27 0.16 0.00 0.02 0.00 0.00 54.13 56.61 2vxj s LEU 7 Cb -0.23 -3.59 1.17 0.00 0.02 0.00 0.00 46.19 43.56 2vxj s LEU 7 CO 0.02 -0.54 2.05 0.00 0.02 0.00 0.00 176.35 177.90 2vxj h ALA 8 N 6.17 2.08 -0.10 4.21 0.00 -0.77 -1.86 119.26 128.99 2vxj h ALA 8 Ca -0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.47 2vxj h ALA 8 Cb 1.21 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2vxj h ALA 8 CO 0.81 -0.16 0.00 0.27 0.00 0.00 0.00 179.25 180.17 2vxj n ASN 9 N -4.47 1.08 -4.53 0.00 0.23 -1.26 -4.71 115.26 101.59 2vxj n ASN 9 Ca 0.05 -1.57 -0.42 0.00 -0.53 0.00 0.00 54.58 52.10 2vxj n ASN 9 Cb 0.29 -0.06 -0.03 0.00 -2.08 0.00 0.00 39.78 37.90 2vxj n ASN 9 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 2vxj s ASN 10 N -1.63 6.56 0.25 0.53 3.84 -0.70 -4.73 114.94 119.06 2vxj s ASN 10 Ca 0.32 -1.67 0.03 0.00 0.21 0.00 0.00 52.86 51.75 2vxj s ASN 10 Cb 0.16 -2.52 0.30 0.00 -0.55 0.00 0.00 41.25 38.64 2vxj s ASN 10 CO 0.26 -1.37 1.62 -0.08 -2.79 0.00 0.00 177.10 174.73 2vxj h GLU 11 N 9.42 0.36 -0.59 0.43 4.81 -1.87 -3.06 114.58 124.08 2vxj h GLU 11 Ca 0.20 -0.20 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 2vxj h GLU 11 Cb 1.01 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 2vxj h GLU 11 CO 1.35 0.76 0.15 0.00 -0.73 0.00 0.00 179.01 180.54 2vxj h ALA 12 N 1.21 1.16 0.00 2.92 0.00 -1.97 -3.49 119.26 119.10 2vxj h ALA 12 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2vxj h ALA 12 Cb 0.94 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2vxj h ALA 12 CO 0.08 0.57 0.00 0.41 0.00 0.00 0.00 179.25 180.31 2vxj n GLY 13 N -0.84 3.00 3.44 0.00 0.00 -1.16 -4.96 105.19 104.68 2vxj n GLY 13 Ca 0.04 -1.86 -0.44 0.00 0.00 0.00 0.00 46.02 43.76 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 -3.45 3.09 0.22 1.61 2.00 0.82 -4.92 119.66 119.02 2vxj s GLN 14 Ca 0.00 -0.97 -0.30 0.00 -2.00 0.00 0.00 55.36 52.10 2vxj s GLN 14 Cb 0.00 -4.08 -0.09 0.00 0.80 0.00 0.00 33.01 29.65 2vxj s GLN 14 CO 0.00 -1.10 1.15 0.54 -0.50 0.00 0.00 175.29 175.38 2vxj s VAL 15 N 2.30 3.56 0.35 1.34 0.11 -1.26 -0.12 120.40 126.68 2vxj s VAL 15 Ca 0.12 1.41 0.07 0.00 -2.93 0.00 0.00 61.98 60.65 2vxj s VAL 15 Cb -0.20 -3.90 -0.01 0.00 -1.53 0.00 0.00 36.38 30.74 2vxj s VAL 15 CO 0.11 0.27 0.40 0.42 -3.33 0.00 0.00 175.10 172.97 2vxj s THR 16 N -0.49 3.59 -1.31 5.04 -4.23 0.05 -4.94 115.64 113.36 2vxj s THR 16 Ca 0.49 -1.18 0.16 0.00 -1.18 0.00 0.00 61.69 59.98 2vxj s THR 16 Cb -0.32 -3.23 0.23 0.00 1.34 0.00 0.00 72.50 70.52 2vxj s THR 16 CO 0.38 -0.13 1.46 -1.54 -0.54 0.00 0.00 174.62 174.25 2vxj n SER 17 N -1.55 0.00 -4.65 3.99 3.41 -1.26 -4.61 113.62 108.94 2vxj n SER 17 Ca 0.01 0.19 -0.42 0.00 -0.26 0.00 0.00 58.87 58.38 2vxj n SER 17 Cb 0.59 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 64.16 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 -2.69 4.78 -0.30 -1.33 -1.09 -1.26 -5.01 121.20 114.30 2vxj s ILE 18 Ca 0.13 1.77 -0.10 0.00 -2.23 0.00 0.00 60.65 60.21 2vxj s ILE 18 Cb 0.10 -4.20 -0.02 0.00 -1.58 0.00 0.00 42.46 36.77 2vxj s ILE 18 CO 0.25 -0.09 0.16 -0.63 -1.23 0.00 0.00 174.94 173.40 2vxj s ILE 19 N 2.84 4.79 -0.10 2.92 -1.09 -1.26 -1.28 121.20 128.02 2vxj s ILE 19 Ca 0.39 -0.26 -0.30 0.00 -2.23 0.00 0.00 60.65 58.26 2vxj s ILE 19 Cb -0.15 -3.39 -0.02 0.00 -1.58 0.00 0.00 42.46 37.31 2vxj s ILE 19 CO 0.08 0.12 1.09 -0.47 -1.23 0.00 0.00 174.94 174.53 2vxj s TYR 20 N 1.66 3.36 0.17 3.97 6.14 0.59 -4.89 117.35 128.34 2vxj s TYR 20 Ca 0.05 1.42 0.09 0.00 0.64 0.00 0.00 57.07 59.28 2vxj s TYR 20 Cb -0.17 -3.29 -0.04 0.00 0.42 0.00 0.00 41.96 38.88 2vxj s TYR 20 CO 0.07 -0.70 -0.11 -0.80 0.64 0.00 0.00 175.55 174.65 2vxj s ASN 21 N 1.28 4.16 0.01 4.32 0.01 -1.26 -0.81 114.94 122.65 2vxj s ASN 21 Ca 0.51 -0.59 -0.38 0.00 -0.71 0.00 0.00 52.86 51.69 2vxj s ASN 21 Cb -0.20 -0.67 -0.17 0.00 0.41 0.00 0.00 41.25 40.61 2vxj s ASN 21 CO 0.18 0.11 1.38 -2.65 -1.51 0.00 0.00 177.10 174.62 2vxj n PRO 22 N 0.16 1.02 -0.03 -0.60 -0.02 -1.26 -1.19 135.00 133.07 2vxj n PRO 22 Ca -0.11 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2vxj n PRO 22 Cb 0.55 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 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 2.70 1.51 3.77 -1.23 0.00 -1.26 -5.04 105.19 105.64 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 -3.04 6.65 -0.18 1.61 1.01 -0.33 -5.02 116.67 117.37 2vxj s ASP 24 Ca 0.00 2.74 -0.06 0.00 0.71 0.00 0.00 52.55 55.94 2vxj s ASP 24 Cb 0.00 -2.65 -0.03 0.00 1.01 0.00 0.00 42.92 41.25 2vxj s ASP 24 CO 0.00 -0.62 0.02 -0.69 0.21 0.00 0.00 175.17 174.08 2vxj s VAL 25 N -1.15 4.34 0.11 -1.27 1.01 -1.26 -4.47 120.40 117.71 2vxj s VAL 25 Ca 0.50 -0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.36 2vxj s VAL 25 Cb -0.41 -2.94 -0.04 0.00 0.00 0.00 0.00 36.38 33.00 2vxj s VAL 25 CO 0.54 0.47 -0.16 0.27 0.00 0.00 0.00 175.10 176.21 2vxj s ILE 26 N 0.47 1.45 -0.06 2.22 -4.36 0.03 -0.73 121.20 120.22 2vxj s ILE 26 Ca 0.00 -1.61 0.04 0.00 -0.26 0.00 0.00 60.65 58.82 2vxj s ILE 26 Cb -0.13 -1.48 0.00 0.00 1.25 0.00 0.00 42.46 42.10 2vxj s ILE 26 CO 0.02 -0.27 -0.17 -0.89 0.24 0.00 0.00 174.94 173.87 2vxj s THR 27 N -1.68 1.45 -0.08 8.37 2.01 -0.12 -0.58 115.64 125.00 2vxj s THR 27 Ca 0.07 -0.70 0.04 0.00 0.31 0.00 0.00 61.69 61.41 2vxj s THR 27 Cb -0.07 -1.26 0.00 0.00 0.01 0.00 0.00 72.50 71.17 2vxj s THR 27 CO 0.04 0.42 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.56 2vxj s ILE 28 N 0.27 1.70 -0.17 1.82 1.01 0.97 -0.82 121.20 125.98 2vxj s ILE 28 Ca -0.09 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.75 2vxj s ILE 28 Cb -0.14 -1.49 0.01 0.00 0.01 0.00 0.00 42.46 40.86 2vxj s ILE 28 CO 0.04 0.48 -0.19 -0.69 0.00 0.00 0.00 174.94 174.58 2vxj s VAL 29 N 0.41 2.25 -0.05 2.92 1.01 -0.64 -1.16 120.40 125.13 2vxj s VAL 29 Ca -0.16 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 60.98 2vxj s VAL 29 Cb -0.17 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 34.25 2vxj s VAL 29 CO 0.06 0.53 -0.18 0.00 0.00 0.00 0.00 175.10 175.51 2vxj s ALA 30 N 1.14 2.47 0.10 5.51 0.00 -0.20 -1.11 121.76 129.66 2vxj s ALA 30 Ca 0.01 -1.01 -0.02 0.00 0.00 0.00 0.00 51.96 50.94 2vxj s ALA 30 Cb -0.14 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.10 2vxj s ALA 30 CO -0.08 0.50 0.04 0.00 0.00 0.00 0.00 175.76 176.23 2vxj s ALA 31 N -0.53 0.62 0.00 0.00 0.00 -0.42 -4.76 121.76 116.68 2vxj s ALA 31 Ca 0.07 -1.29 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2vxj s ALA 31 Cb -0.11 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.62 2vxj s ALA 31 CO 0.01 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.73 2vxj n GLY 32 N -0.02 0.40 2.89 0.00 0.00 -1.26 -0.81 105.19 106.40 2vxj n GLY 32 Ca -0.09 -2.22 -0.20 0.00 0.00 0.00 0.00 46.02 43.52 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 -0.48 0.71 0.13 1.61 0.52 -1.16 -4.19 118.94 116.09 2vxj s TRP 33 Ca 0.00 -0.19 -0.09 0.00 0.02 0.00 0.00 56.10 55.84 2vxj s TRP 33 Cb 0.00 -0.63 -0.00 0.00 -1.15 0.00 0.00 33.47 31.68 2vxj s TRP 33 CO 0.00 -0.17 0.26 0.00 0.02 0.00 0.00 176.95 177.05 2vxj s ALA 34 N 0.85 -0.14 -0.00 0.98 0.00 -0.40 -2.50 121.76 120.54 2vxj s ALA 34 Ca -0.11 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.14 2vxj s ALA 34 Cb -0.14 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.68 2vxj s ALA 34 CO 0.00 -0.59 -0.07 0.45 0.00 0.00 0.00 175.76 175.55 2vxj s SER 35 N -2.92 0.83 -0.02 0.00 0.15 0.26 -0.60 113.70 111.39 2vxj s SER 35 Ca 0.12 -0.15 0.10 0.00 0.70 0.00 0.00 55.95 56.72 2vxj s SER 35 Cb 0.04 -0.08 0.33 0.00 -1.71 0.00 0.00 66.02 64.59 2vxj s SER 35 CO -0.05 0.07 1.23 0.00 1.20 0.00 0.00 173.24 175.69 2vxj n TYR 36 N 2.82 0.57 0.00 3.44 4.11 -1.26 -1.42 117.16 125.42 2vxj n TYR 36 Ca -0.14 -0.26 0.00 0.00 -0.00 0.00 0.00 57.90 57.51 2vxj n TYR 36 Cb 0.57 -0.05 0.00 0.00 -0.00 0.00 0.00 39.34 39.86 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 0.93 0.93 3.37 -7.48 0.00 -1.26 -4.66 105.19 97.01 2vxj n GLY 37 Ca 0.12 0.03 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2vxj n GLY 37 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2vxj n PRO 38 N 0.00 -0.96 0.08 1.61 -0.02 -1.26 -4.92 135.00 129.53 2vxj n PRO 38 Ca 0.00 -0.25 -0.02 0.00 -2.02 0.00 0.00 63.50 61.21 2vxj n PRO 38 Cb 0.00 -1.82 0.22 0.00 -0.02 0.00 0.00 33.50 31.88 2vxj n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vxj h THR 39 N -1.85 1.30 -4.24 3.45 1.03 -2.01 -3.45 112.91 107.15 2vxj h THR 39 Ca -0.49 -1.47 -0.50 0.00 -0.01 0.00 0.00 66.41 63.94 2vxj h THR 39 Cb 1.32 1.63 0.13 0.00 -1.07 0.00 0.00 68.15 70.16 2vxj h THR 39 CO 0.37 0.44 0.30 -1.58 -0.01 0.00 0.00 175.52 175.05 2vxj s GLN 40 N -4.20 1.98 0.09 0.00 0.74 -1.26 -5.07 119.66 111.94 2vxj s GLN 40 Ca -0.05 1.00 0.07 0.00 0.05 0.00 0.00 55.36 56.43 2vxj s GLN 40 Cb 0.13 -1.88 -0.03 0.00 1.10 0.00 0.00 33.01 32.33 2vxj s GLN 40 CO 0.77 -1.79 -0.18 0.15 -0.55 0.00 0.00 175.29 173.70 2vxj s LYS 41 N -4.94 0.99 0.14 1.67 1.02 -1.26 -4.63 119.74 112.73 2vxj s LYS 41 Ca 0.62 -1.06 0.07 0.00 0.02 0.00 0.00 55.97 55.62 2vxj s LYS 41 Cb -0.17 -1.13 -0.04 0.00 -0.52 0.00 0.00 37.83 35.97 2vxj s LYS 41 CO 0.56 0.26 -0.16 -1.58 -0.92 0.00 0.00 175.35 173.51 2vxj s TRP 42 N -1.20 1.60 0.31 3.18 0.51 0.23 -4.88 118.94 118.68 2vxj s TRP 42 Ca 0.03 -0.52 -0.04 0.00 -2.12 0.00 0.00 56.10 53.44 2vxj s TRP 42 Cb -0.10 -0.81 0.07 0.00 -0.81 0.00 0.00 33.47 31.82 2vxj s TRP 42 CO 0.03 0.23 0.42 0.41 -0.51 0.00 0.00 176.95 177.54 2vxj n GLY 43 N 0.37 -0.82 0.14 0.98 0.00 -1.26 -1.27 105.19 103.33 2vxj n GLY 43 Ca -0.14 -1.75 0.10 0.00 0.00 0.00 0.00 46.02 44.23 2vxj n GLY 43 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2vxj n PRO 44 N -1.87 0.13 0.00 1.61 -0.02 -1.26 -0.25 135.00 133.35 2vxj n PRO 44 Ca 0.06 0.59 0.14 0.00 -2.02 0.00 0.00 63.50 62.26 2vxj n PRO 44 Cb 0.19 -1.90 0.53 0.00 -0.02 0.00 0.00 33.50 32.30 2vxj n PRO 44 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2vxj n GLN 45 N -2.18 0.00 0.00 -0.52 6.02 -1.26 -1.33 117.38 118.12 2vxj n GLN 45 Ca -0.01 -0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.98 2vxj n GLN 45 Cb 0.06 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 29.82 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 1.50 -0.55 3.31 1.08 0.00 0.66 -4.38 105.19 106.81 2vxj n GLY 46 Ca 0.07 -1.11 -0.45 0.00 0.00 0.00 0.00 46.02 44.53 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 6.07 0.00 1.61 -1.08 0.45 -4.58 116.67 115.14 2vxj s ASP 47 Ca 0.00 -1.68 0.12 0.00 -0.52 0.00 0.00 52.55 50.47 2vxj s ASP 47 Cb 0.00 -2.16 0.62 0.00 -1.46 0.00 0.00 42.92 39.92 2vxj s ASP 47 CO 0.00 -0.76 1.26 -2.11 0.52 0.00 0.00 175.17 174.08 2vxj n ARG 48 N 5.17 0.21 -0.03 4.34 1.85 -1.26 -2.79 116.66 124.15 2vxj n ARG 48 Ca -0.12 0.14 0.09 0.00 -1.00 0.00 0.00 57.85 56.96 2vxj n ARG 48 Cb 0.41 -1.50 0.09 0.00 -1.05 0.00 0.00 32.46 30.41 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 -1.23 1.62 -3.83 2.89 1.02 -1.26 -4.99 120.64 114.86 2vxj n GLU 49 Ca 0.06 -1.65 -0.36 0.00 -0.02 0.00 0.00 57.16 55.19 2vxj n GLU 49 Cb 0.08 -1.35 -0.12 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 -1.43 3.12 0.95 -0.32 2.46 -1.12 -5.07 115.29 113.88 2vxj s HIS 50 Ca 0.23 -0.29 -0.12 0.00 0.47 0.00 0.00 55.06 55.35 2vxj s HIS 50 Cb 0.15 -2.20 0.16 0.00 -0.13 0.00 0.00 32.58 30.56 2vxj s HIS 50 CO 0.23 -0.24 1.09 -1.25 -2.47 0.00 0.00 174.74 172.10 2vxj s PRO 51 N 1.34 0.81 -0.61 2.88 0.04 -1.26 -4.65 135.00 133.54 2vxj s PRO 51 Ca 0.05 0.70 -0.21 0.00 0.04 0.00 0.00 61.00 61.58 2vxj s PRO 51 Cb -0.15 -1.77 0.08 0.00 0.04 0.00 0.00 34.50 32.71 2vxj s PRO 51 CO 0.04 -2.52 0.82 0.34 0.04 0.00 0.00 177.00 175.72 2vxj s ASP 52 N -3.39 6.19 0.00 6.66 -1.08 -1.26 -4.90 116.67 118.88 2vxj s ASP 52 Ca 0.64 -1.16 0.18 0.00 -0.52 0.00 0.00 52.55 51.70 2vxj s ASP 52 Cb -0.19 -2.36 0.65 0.00 -1.46 0.00 0.00 42.92 39.57 2vxj s ASP 52 CO 0.58 -1.24 1.48 0.00 0.52 0.00 0.00 175.17 176.50 2vxj n GLN 53 N 6.96 1.73 0.00 4.34 10.64 -1.26 -4.78 117.38 135.01 2vxj n GLN 53 Ca -0.06 -1.11 0.00 0.00 -1.83 0.00 0.00 57.00 53.99 2vxj n GLN 53 Cb 0.44 -1.36 0.00 0.00 -0.86 0.00 0.00 30.24 28.46 2vxj n GLN 53 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2vxj n GLY 54 N 1.11 0.24 3.77 2.61 0.00 -1.26 -5.03 105.19 106.62 2vxj n GLY 54 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 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 4.27 0.56 0.99 1.43 -1.26 -4.12 118.68 120.55 2vxj s LEU 55 Ca 0.00 2.32 0.25 0.00 -1.03 0.00 0.00 54.13 55.67 2vxj s LEU 55 Cb 0.00 -3.94 1.56 0.00 0.03 0.00 0.00 46.19 43.84 2vxj s LEU 55 CO 0.00 -0.54 2.13 0.16 0.23 0.00 0.00 176.35 178.33 2vxj h ILE 56 N 2.51 0.65 -3.41 -0.59 3.07 -1.64 -3.37 117.51 114.72 2vxj h ILE 56 Ca -0.48 0.00 -0.60 0.00 1.55 0.00 0.00 64.86 65.33 2vxj h ILE 56 Cb 1.23 0.90 -0.37 0.00 -0.27 0.00 0.00 36.82 38.30 2vxj h ILE 56 CO 0.63 0.00 -0.80 0.00 -1.05 0.00 0.00 178.15 176.93 2vxj n HIS 58 N 4.74 0.22 -0.25 0.00 8.25 -1.26 -3.31 115.22 123.61 2vxj n HIS 58 Ca -0.14 0.07 0.09 0.00 -0.26 0.00 0.00 57.72 57.49 2vxj n HIS 58 Cb 0.47 -0.61 0.25 0.00 1.12 0.00 0.00 29.99 31.22 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 -1.68 3.53 -4.06 0.41 9.92 -1.26 -4.90 116.55 118.51 2vxj n ASP 59 Ca 0.06 -1.99 -0.08 0.00 -0.53 0.00 0.00 54.79 52.25 2vxj n ASP 59 Cb 0.31 -0.38 -0.10 0.00 -0.64 0.00 0.00 41.12 40.32 2vxj n ASP 59 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2vxj s ALA 60 N -1.03 0.39 0.63 2.24 0.00 -1.21 -4.86 121.76 117.93 2vxj s ALA 60 Ca 0.39 -1.05 -0.14 0.00 0.00 0.00 0.00 51.96 51.15 2vxj s ALA 60 Cb 0.20 0.26 -0.02 0.00 0.00 0.00 0.00 23.12 23.56 2vxj s ALA 60 CO 0.27 -0.34 1.07 -0.06 0.00 0.00 0.00 175.76 176.70 2vxj s PHE 61 N -3.44 2.95 0.29 0.00 0.08 -1.26 -4.88 117.98 111.73 2vxj s PHE 61 Ca 0.02 1.50 -0.30 0.00 0.12 0.00 0.00 56.93 58.28 2vxj s PHE 61 Cb 0.04 -3.01 -0.12 0.00 -0.57 0.00 0.00 43.02 39.37 2vxj s PHE 61 CO -0.08 -1.24 1.55 0.00 -0.10 0.00 0.00 175.22 175.34 2vxj n GLY 63 N 1.98 1.05 3.83 0.00 0.00 0.21 -0.41 105.19 111.84 2vxj n GLY 63 Ca 0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.58 3.00 0.06 4.61 0.00 -0.27 -3.73 121.76 121.84 2vxj s ALA 64 Ca 0.00 0.31 -0.31 0.00 0.00 0.00 0.00 51.96 51.96 2vxj s ALA 64 Cb 0.00 -3.15 -0.05 0.00 0.00 0.00 0.00 23.12 19.91 2vxj s ALA 64 CO 0.00 -0.22 1.19 -1.17 0.00 0.00 0.00 175.76 175.56 2vxj s LEU 65 N -3.84 4.37 0.40 0.00 2.96 -0.44 -0.78 118.68 121.35 2vxj s LEU 65 Ca 0.61 2.00 0.04 0.00 -0.22 0.00 0.00 54.13 56.56 2vxj s LEU 65 Cb -0.11 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.98 2vxj s LEU 65 CO 0.26 -0.46 0.14 0.68 -1.32 0.00 0.00 176.35 175.65 2vxj s VAL 66 N 1.07 0.55 0.10 1.68 -7.23 -0.22 -1.22 120.40 115.12 2vxj s VAL 66 Ca 0.58 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.67 2vxj s VAL 66 Cb -0.29 -2.37 -0.00 0.00 0.56 0.00 0.00 36.38 34.28 2vxj s VAL 66 CO 0.29 0.00 0.20 0.00 -0.31 0.00 0.00 175.10 175.28 2vxj s MET 67 N -3.69 0.89 0.03 4.82 0.23 0.28 -0.97 119.30 120.88 2vxj s MET 67 Ca 0.25 -0.99 0.08 0.00 -1.03 0.00 0.00 55.69 54.01 2vxj s MET 67 Cb 0.03 0.35 -0.03 0.00 -1.53 0.00 0.00 34.83 33.65 2vxj s MET 67 CO 0.16 -0.29 -0.25 0.15 -2.03 0.00 0.00 175.02 172.76 2vxj s LYS 68 N -3.88 1.75 -0.32 3.16 1.02 0.20 0.29 119.74 121.97 2vxj s LYS 68 Ca 0.07 -1.01 -0.01 0.00 0.02 0.00 0.00 55.97 55.04 2vxj s LYS 68 Cb 0.05 -1.85 0.07 0.00 -0.52 0.00 0.00 37.83 35.57 2vxj s LYS 68 CO -0.09 0.49 0.02 0.42 -0.92 0.00 0.00 175.35 175.26 2vxj s ILE 69 N -0.74 2.82 0.00 2.17 1.01 -1.26 -0.86 121.20 124.34 2vxj s ILE 69 Ca 0.10 -1.64 0.00 0.00 0.00 0.00 0.00 60.65 59.11 2vxj s ILE 69 Cb -0.10 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.65 2vxj s ILE 69 CO 0.01 -0.24 0.00 0.61 0.00 0.00 0.00 174.94 175.32 2vxj n GLY 70 N 4.55 2.54 0.23 6.18 0.00 -0.03 -2.01 105.19 116.65 2vxj n GLY 70 Ca -0.10 0.35 0.14 0.00 0.00 0.00 0.00 46.02 46.42 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 8.16 0.78 -4.75 1.61 3.02 -1.26 -4.94 115.26 117.88 2vxj n ASN 71 Ca 0.00 -1.04 -0.30 0.00 -0.03 0.00 0.00 54.58 53.21 2vxj n ASN 71 Cb 0.00 -0.01 0.11 0.00 -0.61 0.00 0.00 39.78 39.27 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 -2.19 4.05 1.04 6.41 1.04 -0.85 -5.05 113.70 118.14 2vxj s SER 72 Ca 0.36 1.61 -0.17 0.00 0.48 0.00 0.00 55.95 58.23 2vxj s SER 72 Cb 0.21 -2.31 0.22 0.00 0.10 0.00 0.00 66.02 64.24 2vxj s SER 72 CO 0.40 -2.29 1.24 -0.83 0.98 0.00 0.00 173.24 172.74 2vxj s GLY 73 N -3.47 1.70 0.46 7.32 0.00 -1.26 -4.64 107.32 107.43 2vxj s GLY 73 Ca 0.62 -1.06 -0.24 0.00 0.00 0.00 0.00 44.72 44.04 2vxj s GLY 73 CO 0.56 -0.27 1.26 -0.51 0.00 0.00 0.00 173.10 174.14 2vxj s THR 74 N -3.54 2.69 -0.10 0.90 -4.23 -1.26 -4.62 115.64 105.48 2vxj s THR 74 Ca 0.72 0.56 0.01 0.00 -1.18 0.00 0.00 61.69 61.80 2vxj s THR 74 Cb -0.07 -3.30 0.02 0.00 1.34 0.00 0.00 72.50 70.49 2vxj s THR 74 CO 0.54 0.03 -0.13 -0.63 -0.54 0.00 0.00 174.62 173.89 2vxj s ILE 75 N -1.38 1.31 0.30 2.99 1.01 0.15 -4.92 121.20 120.65 2vxj s ILE 75 Ca 0.62 -0.52 -0.30 0.00 0.00 0.00 0.00 60.65 60.45 2vxj s ILE 75 Cb -0.35 -1.23 -0.12 0.00 0.01 0.00 0.00 42.46 40.78 2vxj s ILE 75 CO 0.43 0.41 1.59 -2.65 0.00 0.00 0.00 174.94 174.72 2vxj n PRO 76 N 4.34 2.69 -0.06 2.79 -0.02 -1.26 -0.55 135.00 142.93 2vxj n PRO 76 Ca -0.18 0.96 -0.13 0.00 -2.02 0.00 0.00 63.50 62.13 2vxj n PRO 76 Cb 0.51 -2.74 -0.05 0.00 -0.02 0.00 0.00 33.50 31.20 2vxj n PRO 76 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2vxj n VAL 77 N 2.06 0.70 0.00 -1.45 0.31 -0.66 -4.86 118.33 114.43 2vxj n VAL 77 Ca 0.08 -0.19 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2vxj n VAL 77 Cb 0.37 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 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 -3.45 0.00 0.10 4.52 3.02 -0.36 -1.04 115.26 118.04 2vxj n ASN 78 Ca -0.25 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.42 2vxj n ASN 78 Cb 0.69 0.00 0.45 0.00 -0.61 0.00 0.00 39.78 40.31 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 0.70 0.00 3.41 -2.24 -1.26 -4.59 114.28 110.30 2vxj n THR 79 Ca 0.00 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2vxj n THR 79 Cb 0.00 -0.90 0.00 0.00 -2.10 0.00 0.00 70.33 67.33 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 0.56 1.00 3.01 3.38 0.00 -0.21 -1.03 105.19 111.89 2vxj n GLY 80 Ca 0.04 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 43.92 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 1.89 -0.34 0.99 1.43 -0.31 -4.93 118.68 117.41 2vxj s LEU 81 Ca 0.00 -0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 52.88 2vxj s LEU 81 Cb 0.00 -0.51 0.06 0.00 0.03 0.00 0.00 46.19 45.77 2vxj s LEU 81 CO 0.00 0.09 0.09 0.12 0.23 0.00 0.00 176.35 176.87 2vxj s PHE 82 N 0.00 3.31 -1.20 0.29 2.19 -1.26 -0.02 117.98 121.29 2vxj s PHE 82 Ca 0.00 -1.75 -0.08 0.00 0.33 0.00 0.00 56.93 55.43 2vxj s PHE 82 Cb -0.06 -2.39 -0.02 0.00 -1.31 0.00 0.00 43.02 39.24 2vxj s PHE 82 CO 0.00 -0.80 0.76 0.54 1.83 0.00 0.00 175.22 177.55 2vxj n ARG 83 N 4.71 -3.07 -3.88 10.12 1.74 -0.87 -4.93 116.66 120.48 2vxj n ARG 83 Ca -0.11 0.60 -0.34 0.00 -0.77 0.00 0.00 57.85 57.23 2vxj n ARG 83 Cb 0.44 -4.91 -0.05 0.00 -1.02 0.00 0.00 32.46 26.92 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 -3.56 3.57 -0.05 -1.55 -0.00 0.25 -4.75 118.94 112.84 2vxj s TRP 84 Ca 0.25 0.43 0.06 0.00 -0.00 0.00 0.00 56.10 56.83 2vxj s TRP 84 Cb -0.07 -1.88 -0.01 0.00 -0.00 0.00 0.00 33.47 31.52 2vxj s TRP 84 CO 0.82 0.67 -0.23 0.08 -0.00 0.00 0.00 176.95 178.28 2vxj s VAL 85 N -1.25 1.91 0.68 5.86 1.01 -1.26 -0.79 120.40 126.56 2vxj s VAL 85 Ca 0.24 -0.98 -0.13 0.00 0.00 0.00 0.00 61.98 61.11 2vxj s VAL 85 Cb -0.13 -1.62 0.01 0.00 0.00 0.00 0.00 36.38 34.64 2vxj s VAL 85 CO 0.15 0.53 1.07 0.00 0.00 0.00 0.00 175.10 176.85 2vxj s ALA 86 N -0.12 2.58 0.80 5.51 0.00 -1.26 -5.03 121.76 124.24 2vxj s ALA 86 Ca -0.04 0.27 -0.14 0.00 0.00 0.00 0.00 51.96 52.05 2vxj s ALA 86 Cb -0.13 -3.23 0.05 0.00 0.00 0.00 0.00 23.12 19.81 2vxj s ALA 86 CO 0.03 -1.23 0.98 -2.30 0.00 0.00 0.00 175.76 173.24 2vxj n PRO 87 N -2.82 0.18 -1.70 0.00 -0.02 -1.26 -4.93 135.00 124.45 2vxj n PRO 87 Ca 0.09 0.13 -0.40 0.00 -2.02 0.00 0.00 63.50 61.29 2vxj n PRO 87 Cb 0.53 -2.25 0.02 0.00 -0.02 0.00 0.00 33.50 31.78 2vxj n PRO 87 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2vxj n ASN 88 N -2.38 2.36 0.00 2.55 3.02 -1.26 -2.76 115.26 116.78 2vxj n ASN 88 Ca 0.12 1.06 0.00 0.00 -0.03 0.00 0.00 54.58 55.73 2vxj n ASN 88 Cb 0.51 -1.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.18 2vxj n ASN 88 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2vxj n ASN 89 N -0.03 0.00 -4.67 6.41 3.02 -1.26 -5.02 115.26 113.70 2vxj n ASN 89 Ca 0.08 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.24 2vxj n ASN 89 Cb 0.41 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.52 2vxj n ASN 89 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2vxj s VAL 90 N -3.62 5.09 -0.04 2.41 1.01 -1.11 -5.04 120.40 119.09 2vxj s VAL 90 Ca 0.00 1.05 -0.29 0.00 0.00 0.00 0.00 61.98 62.74 2vxj s VAL 90 Cb 0.00 -3.88 0.10 0.00 0.00 0.00 0.00 36.38 32.60 2vxj s VAL 90 CO 0.00 0.18 0.86 0.00 0.00 0.00 0.00 175.10 176.14 2vxj s GLN 91 N 1.53 0.84 0.00 2.72 -2.07 -1.26 -4.67 119.66 116.75 2vxj s GLN 91 Ca 0.26 -0.10 0.00 0.00 -1.82 0.00 0.00 55.36 53.70 2vxj s GLN 91 Cb -0.16 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.15 2vxj s GLN 91 CO 0.10 -0.32 0.00 0.41 -1.32 0.00 0.00 175.29 174.16 2vxj n GLY 92 N 0.20 0.75 3.78 2.60 0.00 0.01 -3.82 105.19 108.70 2vxj n GLY 92 Ca -0.12 -2.16 -0.41 0.00 0.00 0.00 0.00 46.02 43.33 2vxj n GLY 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vxj s ALA 93 N -1.28 3.52 -0.17 4.61 0.00 -1.26 -0.30 121.76 126.89 2vxj s ALA 93 Ca 0.00 1.53 -0.18 0.00 0.00 0.00 0.00 51.96 53.31 2vxj s ALA 93 Cb 0.00 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 2vxj s ALA 93 CO 0.00 -1.03 0.49 0.42 0.00 0.00 0.00 175.76 175.64 2vxj s ILE 94 N -1.14 5.15 -0.12 0.00 1.01 -0.40 -0.85 121.20 124.85 2vxj s ILE 94 Ca 0.54 0.94 0.01 0.00 0.00 0.00 0.00 60.65 62.13 2vxj s ILE 94 Cb -0.45 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.18 2vxj s ILE 94 CO 0.61 0.24 -0.14 -0.89 0.00 0.00 0.00 174.94 174.76 2vxj s THR 95 N 1.20 2.95 -0.14 2.92 2.01 -0.04 -0.77 115.64 123.77 2vxj s THR 95 Ca 0.25 -0.70 -0.09 0.00 0.31 0.00 0.00 61.69 61.45 2vxj s THR 95 Cb -0.15 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 2vxj s THR 95 CO 0.10 0.53 0.17 -0.76 -0.69 0.00 0.00 174.62 173.97 2vxj s LEU 96 N 0.24 4.33 -0.01 4.42 1.43 0.83 -0.63 118.68 129.29 2vxj s LEU 96 Ca -0.09 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.44 2vxj s LEU 96 Cb -0.16 -2.14 0.01 0.00 0.03 0.00 0.00 46.19 43.94 2vxj s LEU 96 CO 0.05 0.31 0.00 -0.63 0.23 0.00 0.00 176.35 176.31 2vxj s ILE 97 N -0.49 0.04 0.15 -0.59 1.01 -0.15 -0.13 121.20 121.05 2vxj s ILE 97 Ca 0.14 0.03 -0.30 0.00 0.00 0.00 0.00 60.65 60.51 2vxj s ILE 97 Cb -0.12 -0.07 -0.08 0.00 0.01 0.00 0.00 42.46 42.20 2vxj s ILE 97 CO 0.03 0.04 1.23 -0.47 0.00 0.00 0.00 174.94 175.77 2vxj s TYR 98 N 0.27 3.39 -0.29 3.97 5.04 -1.26 -1.06 117.35 127.41 2vxj s TYR 98 Ca -0.02 1.32 -0.26 0.00 -2.44 0.00 0.00 57.07 55.66 2vxj s TYR 98 Cb -0.04 -3.48 0.01 0.00 0.35 0.00 0.00 41.96 38.80 2vxj s TYR 98 CO -0.01 -1.44 0.93 1.21 -1.34 0.00 0.00 175.55 174.90 2vxj s ASN 99 N 0.47 6.85 0.07 4.32 2.47 0.04 -4.92 114.94 124.24 2vxj s ASN 99 Ca 0.56 0.97 -0.04 0.00 0.42 0.00 0.00 52.86 54.77 2vxj s ASN 99 Cb -0.33 -2.48 0.01 0.00 -1.45 0.00 0.00 41.25 37.01 2vxj s ASN 99 CO 0.34 -0.69 0.18 -0.67 -3.72 0.00 0.00 177.10 172.55 2vxj n ASP 100 N 6.40 -0.46 -4.73 -4.21 -0.08 -1.26 -0.62 116.55 111.59 2vxj n ASP 100 Ca 0.08 -1.30 -0.40 0.00 -1.51 0.00 0.00 54.79 51.67 2vxj n ASP 100 Cb 0.47 0.75 -0.05 0.00 2.34 0.00 0.00 41.12 44.64 2vxj n ASP 100 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2vxj s VAL 101 N -2.71 4.95 0.27 5.18 1.01 -1.26 -1.48 120.40 126.36 2vxj s VAL 101 Ca 0.04 1.47 -0.30 0.00 0.00 0.00 0.00 61.98 63.19 2vxj s VAL 101 Cb -0.01 -4.05 -0.13 0.00 0.00 0.00 0.00 36.38 32.19 2vxj s VAL 101 CO 0.02 0.30 1.26 -2.65 0.00 0.00 0.00 175.10 174.03 2vxj n PRO 102 N 3.42 1.81 -0.28 2.72 -0.02 -1.26 -1.97 135.00 139.42 2vxj n PRO 102 Ca -0.02 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2vxj n PRO 102 Cb 0.51 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 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 1.56 1.23 0.36 -1.23 0.00 -1.26 -4.91 105.19 100.94 2vxj n GLY 103 Ca 0.10 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.00 2.04 0.41 2.61 -2.24 -0.83 -4.71 114.28 109.55 2vxj n THR 104 Ca 0.00 -2.18 0.12 0.00 -2.27 0.00 0.00 64.05 59.72 2vxj n THR 104 Cb 0.00 -0.25 0.13 0.00 -2.10 0.00 0.00 70.33 68.11 2vxj n THR 104 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 2vxj h TYR 105 N 0.61 0.00 0.00 4.78 -1.99 -1.91 -3.36 116.97 115.09 2vxj h TYR 105 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 2vxj h TYR 105 Cb 1.15 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.88 2vxj h TYR 105 CO 0.19 0.00 -0.07 0.78 -0.00 0.00 0.00 178.16 179.07 2vxj h GLY 106 N 4.32 0.00 -1.78 3.88 0.00 -1.85 -1.31 103.07 106.34 2vxj h GLY 106 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vxj h GLY 106 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.70 2vxj n ASN 107 N -3.52 2.85 -4.77 0.19 6.94 -1.26 -4.96 115.26 110.73 2vxj n ASN 107 Ca -0.02 -1.90 -0.34 0.00 -0.02 0.00 0.00 54.58 52.30 2vxj n ASN 107 Cb 0.19 -0.12 0.04 0.00 -2.36 0.00 0.00 39.78 37.53 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 -1.72 5.15 0.12 0.53 -0.87 -0.49 -4.34 114.94 113.32 2vxj s ASN 108 Ca 0.34 2.09 -0.03 0.00 -1.57 0.00 0.00 52.86 53.69 2vxj s ASN 108 Cb 0.21 -2.56 -0.03 0.00 -0.02 0.00 0.00 41.25 38.84 2vxj s ASN 108 CO 0.31 -1.60 0.09 -0.94 -2.57 0.00 0.00 177.10 172.38 2vxj s SER 109 N -2.31 0.28 0.32 -1.22 1.04 -0.51 -4.45 113.70 106.86 2vxj s SER 109 Ca 0.69 -1.07 0.00 0.00 0.48 0.00 0.00 55.95 56.05 2vxj s SER 109 Cb -0.22 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.20 2vxj s SER 109 CO 0.38 -0.74 0.00 0.61 0.98 0.00 0.00 173.24 174.48 2vxj n GLY 110 N -0.08 -1.82 3.66 7.32 0.00 -1.26 -0.58 105.19 112.44 2vxj n GLY 110 Ca -0.08 -1.28 -0.08 0.00 0.00 0.00 0.00 46.02 44.58 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 -4.30 -0.36 -0.09 1.61 1.04 -1.04 -0.12 113.70 110.43 2vxj s SER 111 Ca 0.00 -0.31 0.02 0.00 0.48 0.00 0.00 55.95 56.13 2vxj s SER 111 Cb 0.00 0.61 -0.02 0.00 0.10 0.00 0.00 66.02 66.71 2vxj s SER 111 CO 0.00 -1.08 -0.14 -0.36 0.98 0.00 0.00 173.24 172.65 2vxj s PHE 112 N -3.68 2.76 -0.19 5.02 0.08 -0.54 -3.00 117.98 118.43 2vxj s PHE 112 Ca 0.07 -0.43 -0.22 0.00 0.12 0.00 0.00 56.93 56.48 2vxj s PHE 112 Cb -0.03 -1.74 -0.02 0.00 -0.57 0.00 0.00 43.02 40.65 2vxj s PHE 112 CO -0.02 -0.03 0.69 0.45 -0.10 0.00 0.00 175.22 176.21 2vxj s SER 113 N -0.14 6.76 -0.02 1.36 0.15 0.01 0.08 113.70 121.91 2vxj s SER 113 Ca -0.01 0.93 0.05 0.00 0.70 0.00 0.00 55.95 57.61 2vxj s SER 113 Cb -0.14 -2.38 -0.01 0.00 -1.71 0.00 0.00 66.02 61.79 2vxj s SER 113 CO 0.03 -0.31 -0.16 -0.69 1.20 0.00 0.00 173.24 173.32 2vxj s VAL 114 N 2.00 1.25 -0.06 4.45 1.01 -0.05 -1.30 120.40 127.70 2vxj s VAL 114 Ca 0.31 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.68 2vxj s VAL 114 Cb -0.16 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 2vxj s VAL 114 CO 0.11 0.36 -0.19 0.20 0.00 0.00 0.00 175.10 175.58 2vxj s ASN 115 N -0.25 3.60 -0.06 3.32 0.01 -0.27 -1.83 114.94 119.47 2vxj s ASN 115 Ca 0.04 -0.35 0.02 0.00 -0.71 0.00 0.00 52.86 51.85 2vxj s ASN 115 Cb -0.07 -0.90 0.02 0.00 0.41 0.00 0.00 41.25 40.70 2vxj s ASN 115 CO -0.00 0.28 -0.10 -0.63 -1.51 0.00 0.00 177.10 175.15 2vxj s ILE 116 N -0.36 0.93 0.14 0.60 1.01 0.50 -1.63 121.20 122.39 2vxj s ILE 116 Ca 0.03 -0.36 0.07 0.00 0.00 0.00 0.00 60.65 60.39 2vxj s ILE 116 Cb -0.12 -0.87 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 2vxj s ILE 116 CO 0.02 0.31 -0.17 -0.83 0.00 0.00 0.00 174.94 174.27 2vxj s GLY 117 N 0.73 1.25 -0.08 6.18 0.00 0.00 -0.47 107.32 114.92 2vxj s GLY 117 Ca -0.14 -1.39 -0.15 0.00 0.00 0.00 0.00 44.72 43.04 2vxj s GLY 117 CO 0.03 -1.44 0.37 0.54 0.00 0.00 0.00 173.10 172.60 2vxj s LYS 118 N -2.70 4.09 0.48 2.90 1.02 -1.26 -0.95 119.74 123.33 2vxj s LYS 118 Ca 0.12 0.29 0.05 0.00 0.02 0.00 0.00 55.97 56.46 2vxj s LYS 118 Cb -0.06 -3.33 0.02 0.00 -0.52 0.00 0.00 37.83 33.94 2vxj s LYS 118 CO 0.05 0.43 0.66 -0.51 -0.92 0.00 0.00 175.35 175.06 2vxj s ASP 119 N -0.19 5.49 0.59 2.83 1.01 0.09 -4.96 116.67 121.53 2vxj s ASP 119 Ca 0.22 -0.25 -0.20 0.00 0.71 0.00 0.00 52.55 53.02 2vxj s ASP 119 Cb -0.15 -0.73 -0.04 0.00 1.01 0.00 0.00 42.92 43.01 2vxj s ASP 119 CO 0.09 -0.93 1.23 0.00 0.21 0.00 0.00 175.17 175.77 2vxj n GLN 120 N -2.06 1.28 0.00 8.23 6.02 -1.26 -4.64 117.38 124.95 2vxj n GLN 120 Ca 0.08 0.49 0.00 0.00 -0.01 0.00 0.00 57.00 57.56 2vxj n GLN 120 Cb 0.59 -2.44 0.00 0.00 1.02 0.00 0.00 30.24 29.41 2vxj n GLN 120 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92