#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xm7 s ALA 0 N 0.00 2.46 0.06 -2.53 0.00 -1.26 -4.98 121.76 115.52 1xm7 s ALA 0 Ca 0.00 0.89 0.01 0.00 0.00 0.00 0.00 51.96 52.86 1xm7 s ALA 0 Cb 0.00 -3.42 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1xm7 s ALA 0 CO 0.00 -1.28 -0.06 -1.64 0.00 0.00 0.00 175.76 172.79 1xm7 s MET 1 N -3.56 0.64 0.10 0.00 -1.94 -1.26 -4.99 119.30 108.29 1xm7 s MET 1 Ca 0.75 -1.08 0.04 0.00 -1.71 0.00 0.00 55.69 53.69 1xm7 s MET 1 Cb -0.28 -0.08 -0.04 0.00 2.01 0.00 0.00 34.83 36.44 1xm7 s MET 1 CO 0.36 -0.03 0.04 -1.64 -0.01 0.00 0.00 175.02 173.75 1xm7 s MET 2 N -3.01 2.69 0.06 2.03 -1.94 -1.26 -1.10 119.30 116.78 1xm7 s MET 2 Ca 0.02 -0.81 0.00 0.00 -1.71 0.00 0.00 55.69 53.19 1xm7 s MET 2 Cb 0.00 -2.60 -0.04 0.00 2.01 0.00 0.00 34.83 34.20 1xm7 s MET 2 CO -0.04 0.54 -0.05 0.71 -0.01 0.00 0.00 175.02 176.17 1xm7 s TYR 3 N -1.42 0.64 -0.02 -0.03 1.51 -0.69 -2.93 117.35 114.41 1xm7 s TYR 3 Ca 0.28 -0.94 0.01 0.00 -1.01 0.00 0.00 57.07 55.41 1xm7 s TYR 3 Cb -0.11 -0.42 0.02 0.00 -0.11 0.00 0.00 41.96 41.34 1xm7 s TYR 3 CO 0.20 -0.27 -0.01 -0.06 -1.11 0.00 0.00 175.55 174.31 1xm7 s PHE 4 N -3.45 0.29 0.05 2.71 0.40 0.17 -1.27 117.98 116.89 1xm7 s PHE 4 Ca 0.06 -0.01 -0.02 0.00 -0.60 0.00 0.00 56.93 56.36 1xm7 s PHE 4 Cb 0.04 -0.34 -0.03 0.00 0.51 0.00 0.00 43.02 43.20 1xm7 s PHE 4 CO -0.07 -0.10 0.01 -1.50 0.70 0.00 0.00 175.22 174.26 1xm7 s ILE 5 N 0.76 0.20 0.22 0.64 2.07 -0.30 -0.48 121.20 124.30 1xm7 s ILE 5 Ca -0.08 -1.67 -0.20 0.00 -1.41 0.00 0.00 60.65 57.30 1xm7 s ILE 5 Cb -0.11 -1.43 0.03 0.00 0.13 0.00 0.00 42.46 41.09 1xm7 s ILE 5 CO -0.01 -0.92 0.60 -0.55 -1.91 0.00 0.00 174.94 172.15 1xm7 s SER 6 N -2.84 -0.33 -1.58 4.50 0.15 -0.28 -0.58 113.70 112.75 1xm7 s SER 6 Ca 0.06 -0.42 -0.17 0.00 0.70 0.00 0.00 55.95 56.12 1xm7 s SER 6 Cb 0.07 0.63 0.15 0.00 -1.71 0.00 0.00 66.02 65.16 1xm7 s SER 6 CO -0.10 -1.13 0.67 0.47 1.20 0.00 0.00 173.24 174.36 1xm7 n ASP 7 N -0.39 -3.09 -0.30 5.45 9.92 0.39 -2.41 116.55 126.12 1xm7 n ASP 7 Ca -0.09 -0.86 0.11 0.00 -0.53 0.00 0.00 54.79 53.41 1xm7 n ASP 7 Cb 0.62 -2.56 0.34 0.00 -0.64 0.00 0.00 41.12 38.88 1xm7 n ASP 7 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 1xm7 h THR 8 N -1.23 0.84 -6.27 -3.53 1.35 -1.71 -3.44 112.91 98.92 1xm7 h THR 8 Ca -0.53 -0.27 -0.46 0.00 -0.55 0.00 0.00 66.41 64.60 1xm7 h THR 8 Cb 1.35 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.77 1xm7 h THR 8 CO 0.72 0.14 -0.85 1.41 -0.25 0.00 0.00 175.52 176.69 1xm7 n HIS 9 N -4.59 -1.84 -1.75 4.73 8.25 -0.79 -4.89 115.22 114.34 1xm7 n HIS 9 Ca 0.18 0.81 -0.42 0.00 -0.26 0.00 0.00 57.72 58.04 1xm7 n HIS 9 Cb 0.45 -4.09 -0.01 0.00 1.12 0.00 0.00 29.99 27.46 1xm7 n HIS 9 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1xm7 n PHE 10 N -4.35 2.84 -0.52 4.41 3.72 -0.46 -2.05 117.46 121.06 1xm7 n PHE 10 Ca -0.27 0.36 0.00 0.00 -0.05 0.00 0.00 57.45 57.49 1xm7 n PHE 10 Cb 0.67 -2.55 0.00 0.00 -0.94 0.00 0.00 39.48 36.65 1xm7 n PHE 10 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1xm7 n TYR 11 N 1.31 0.00 -2.58 1.38 4.02 -1.26 0.65 117.16 120.68 1xm7 n TYR 11 Ca 0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.52 1xm7 n TYR 11 Cb 0.37 -1.05 -0.01 0.00 -0.02 0.00 0.00 39.34 38.63 1xm7 n TYR 11 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1xm7 s HIS 12 N -1.72 2.71 0.24 -0.72 2.46 -0.87 -4.79 115.29 112.60 1xm7 s HIS 12 Ca 0.00 -1.36 -0.05 0.00 0.47 0.00 0.00 55.06 54.11 1xm7 s HIS 12 Cb 0.00 -4.73 0.26 0.00 -0.13 0.00 0.00 32.58 27.97 1xm7 s HIS 12 CO 0.00 -1.85 1.81 1.49 -2.47 0.00 0.00 174.74 173.72 1xm7 h GLU 13 N 8.34 1.08 0.00 2.88 4.81 -1.90 -2.16 114.58 127.64 1xm7 h GLU 13 Ca 0.36 -0.19 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1xm7 h GLU 13 Cb 0.92 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.12 1xm7 h GLU 13 CO 1.44 0.88 0.00 -1.71 -0.73 0.00 0.00 179.01 178.90 1xm7 n ASN 14 N -4.29 0.61 0.25 1.04 5.15 -1.26 -1.05 115.26 115.72 1xm7 n ASN 14 Ca 0.06 0.74 0.10 0.00 -0.60 0.00 0.00 54.58 54.89 1xm7 n ASN 14 Cb 0.18 -0.84 0.65 0.00 -0.53 0.00 0.00 39.78 39.25 1xm7 n ASN 14 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1xm7 h ILE 15 N 0.00 0.76 0.00 -1.44 -0.00 -1.78 0.25 117.51 115.30 1xm7 h ILE 15 Ca 0.00 -0.56 -0.07 0.00 -0.00 0.00 0.00 64.86 64.23 1xm7 h ILE 15 Cb 0.11 1.34 -0.01 0.00 -0.00 0.00 0.00 36.82 38.26 1xm7 h ILE 15 CO 0.00 0.14 -0.32 0.40 -0.00 0.00 0.00 178.15 178.37 1xm7 h ILE 16 N 0.00 0.83 0.19 2.19 2.04 -1.25 -0.95 117.51 120.57 1xm7 h ILE 16 Ca -0.00 -1.32 -0.35 0.00 1.00 0.00 0.00 64.86 64.19 1xm7 h ILE 16 Cb 0.33 1.81 0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1xm7 h ILE 16 CO 0.02 0.32 -1.72 0.78 0.00 0.00 0.00 178.15 177.55 1xm7 h ASN 17 N 0.00 0.64 0.22 1.72 -0.26 -0.78 -3.19 115.58 113.92 1xm7 h ASN 17 Ca -0.00 -0.94 -0.01 0.00 -0.56 0.00 0.00 56.30 54.79 1xm7 h ASN 17 Cb 0.78 -0.21 0.00 0.00 -1.06 0.00 0.00 38.32 37.84 1xm7 h ASN 17 CO 0.04 1.78 -0.10 -0.07 -1.06 0.00 0.00 177.43 178.02 1xm7 h LEU 18 N 0.10 -0.25 -6.70 1.61 3.38 -0.54 -3.33 115.31 109.57 1xm7 h LEU 18 Ca -0.34 -0.19 -0.65 0.00 0.09 0.00 0.00 57.88 56.79 1xm7 h LEU 18 Cb 2.10 0.06 -0.39 0.00 0.09 0.00 0.00 40.66 42.52 1xm7 h LEU 18 CO 0.18 0.07 -0.30 0.59 0.09 0.00 0.00 178.44 179.07 1xm7 n ASN 19 N -5.09 4.07 0.29 -0.43 3.02 -0.37 -4.91 115.26 111.84 1xm7 n ASN 19 Ca -0.09 -3.33 0.15 0.00 -0.03 0.00 0.00 54.58 51.27 1xm7 n ASN 19 Cb 0.23 -0.85 0.89 0.00 -0.61 0.00 0.00 39.78 39.44 1xm7 n ASN 19 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1xm7 h PRO 20 N 4.95 0.00 0.07 3.52 0.11 -1.67 -1.58 132.00 137.41 1xm7 h PRO 20 Ca 0.18 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 66.05 1xm7 h PRO 20 Cb 0.70 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.83 1xm7 h PRO 20 CO 0.89 0.02 -0.99 0.93 -0.21 0.00 0.00 178.00 178.64 1xm7 h GLU 21 N 0.00 0.54 0.00 1.05 4.39 -1.91 -3.39 114.58 115.26 1xm7 h GLU 21 Ca -0.00 -0.68 -0.35 0.00 0.34 0.00 0.00 59.36 58.67 1xm7 h GLU 21 Cb 0.05 0.22 -0.07 0.00 -0.10 0.00 0.00 28.75 28.85 1xm7 h GLU 21 CO 0.00 1.28 -2.33 1.55 -1.16 0.00 0.00 179.01 178.36 1xm7 n VAL 22 N -3.96 1.33 -3.11 3.13 3.14 -1.21 -4.99 118.33 112.65 1xm7 n VAL 22 Ca -0.12 -0.82 -0.30 0.00 -2.96 0.00 0.00 64.34 60.13 1xm7 n VAL 22 Cb 0.86 -0.49 -0.04 0.00 -1.06 0.00 0.00 33.84 33.12 1xm7 n VAL 22 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1xm7 s ARG 23 N -2.47 3.77 0.19 1.45 1.81 -0.60 -5.07 118.95 118.04 1xm7 s ARG 23 Ca -0.10 0.34 -0.20 0.00 -1.72 0.00 0.00 55.73 54.04 1xm7 s ARG 23 Cb 0.06 -2.51 0.04 0.00 -0.45 0.00 0.00 34.95 32.10 1xm7 s ARG 23 CO 0.79 0.11 0.59 -0.59 -0.68 0.00 0.00 175.30 175.52 1xm7 s PHE 24 N -2.15 -0.32 0.10 -0.53 -0.12 -1.26 -4.70 117.98 108.99 1xm7 s PHE 24 Ca 0.49 0.01 -0.31 0.00 -0.05 0.00 0.00 56.93 57.07 1xm7 s PHE 24 Cb -0.11 0.52 -0.09 0.00 -0.63 0.00 0.00 43.02 42.72 1xm7 s PHE 24 CO 0.27 -0.94 1.62 0.21 -0.05 0.00 0.00 175.22 176.34 1xm7 s LYS 25 N -3.82 4.21 0.00 1.99 2.47 -1.26 -2.26 119.74 121.06 1xm7 s LYS 25 Ca 0.06 2.33 0.00 0.00 -1.56 0.00 0.00 55.97 56.80 1xm7 s LYS 25 Cb -0.02 -3.47 0.00 0.00 -1.46 0.00 0.00 37.83 32.88 1xm7 s LYS 25 CO -0.06 -0.69 0.00 0.41 0.16 0.00 0.00 175.35 175.17 1xm7 n GLY 26 N 3.91 0.82 0.20 5.54 0.00 -1.26 -4.97 105.19 109.44 1xm7 n GLY 26 Ca 0.15 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 46.03 1xm7 n GLY 26 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 1xm7 h PHE 27 N 0.00 0.00 -0.76 1.61 -5.15 -1.89 -2.79 116.94 107.96 1xm7 h PHE 27 Ca 0.00 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.73 1xm7 h PHE 27 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.14 1xm7 h PHE 27 CO 0.00 0.30 0.29 0.93 -2.00 0.00 0.00 178.31 177.84 1xm7 h GLU 28 N 0.00 1.13 -0.64 6.09 3.07 -1.93 -1.73 114.58 120.57 1xm7 h GLU 28 Ca -0.00 -0.20 -0.08 0.00 -0.50 0.00 0.00 59.36 58.57 1xm7 h GLU 28 Cb 0.59 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.29 1xm7 h GLU 28 CO 0.04 0.92 0.07 0.82 -1.40 0.00 0.00 179.01 179.45 1xm7 h ILE 29 N 1.10 1.26 -0.30 3.13 5.03 -1.92 -1.88 117.51 123.94 1xm7 h ILE 29 Ca 0.25 -1.07 0.01 0.00 -0.12 0.00 0.00 64.86 63.93 1xm7 h ILE 29 Cb 0.22 0.70 -0.02 0.00 -3.03 0.00 0.00 36.82 34.69 1xm7 h ILE 29 CO -0.02 0.40 0.19 0.58 -0.68 0.00 0.00 178.15 178.61 1xm7 h VAL 30 N 1.00 1.06 0.41 1.67 2.07 -1.34 0.36 116.25 121.48 1xm7 h VAL 30 Ca 0.19 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 1xm7 h VAL 30 Cb 0.48 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1xm7 h VAL 30 CO 0.02 0.07 -0.25 0.40 0.02 0.00 0.00 177.57 177.83 1xm7 h ILE 31 N 0.38 0.48 -0.83 4.57 2.04 -1.17 -0.75 117.51 122.23 1xm7 h ILE 31 Ca 0.11 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.01 1xm7 h ILE 31 Cb -0.02 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.48 1xm7 h ILE 31 CO -0.04 0.00 0.55 -0.07 0.00 0.00 0.00 178.15 178.59 1xm7 h LEU 32 N -0.64 0.88 0.03 1.44 3.38 -1.18 -0.55 115.31 118.66 1xm7 h LEU 32 Ca -0.05 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1xm7 h LEU 32 Cb 0.52 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1xm7 h LEU 32 CO 0.05 0.60 -0.01 0.74 0.09 0.00 0.00 178.44 179.90 1xm7 h THR 33 N 1.02 1.08 -0.38 0.22 2.02 -0.04 0.12 112.91 116.94 1xm7 h THR 33 Ca 0.34 -0.33 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 1xm7 h THR 33 Cb 0.06 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1xm7 h THR 33 CO -0.10 0.09 0.11 0.78 0.37 0.00 0.00 175.52 176.76 1xm7 h ASN 34 N -0.18 0.51 -0.08 4.18 -0.26 -0.51 -2.04 115.58 117.20 1xm7 h ASN 34 Ca -0.00 -0.06 -0.09 0.00 -0.56 0.00 0.00 56.30 55.58 1xm7 h ASN 34 Cb 0.17 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.30 1xm7 h ASN 34 CO 0.01 0.50 -0.29 -0.07 -1.06 0.00 0.00 177.43 176.52 1xm7 h LEU 35 N 0.55 0.39 -0.66 1.61 3.38 -0.95 -3.28 115.31 116.36 1xm7 h LEU 35 Ca 0.13 -0.62 0.11 0.00 0.09 0.00 0.00 57.88 57.59 1xm7 h LEU 35 Cb 0.19 -0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 1xm7 h LEU 35 CO -0.01 0.95 0.23 0.25 0.09 0.00 0.00 178.44 179.96 1xm7 h LEU 36 N -0.14 0.20 -2.01 1.67 5.85 -0.43 -1.41 115.31 119.04 1xm7 h LEU 36 Ca -0.01 0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.74 1xm7 h LEU 36 Cb 0.92 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 1xm7 h LEU 36 CO 0.06 0.10 0.07 2.29 -0.34 0.00 0.00 178.44 180.63 1xm7 n LYS 37 N -5.02 1.55 0.00 1.25 2.85 -0.79 -3.99 118.16 114.01 1xm7 n LYS 37 Ca 0.11 -0.67 0.00 0.00 -1.05 0.00 0.00 58.31 56.70 1xm7 n LYS 37 Cb 0.33 -1.46 0.00 0.00 -0.65 0.00 0.00 35.03 33.25 1xm7 n LYS 37 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1xm7 n VAL 38 N 0.14 0.00 -2.50 0.58 3.14 -0.86 -5.06 118.33 113.77 1xm7 n VAL 38 Ca 0.10 0.00 -0.41 0.00 -2.96 0.00 0.00 64.34 61.07 1xm7 n VAL 38 Cb 0.61 0.00 -0.04 0.00 -1.06 0.00 0.00 33.84 33.35 1xm7 n VAL 38 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 1xm7 s LEU 39 N -1.39 4.48 0.20 6.55 1.43 -0.59 -5.05 118.68 124.30 1xm7 s LEU 39 Ca 0.00 2.10 0.10 0.00 -1.03 0.00 0.00 54.13 55.30 1xm7 s LEU 39 Cb 0.00 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.57 1xm7 s LEU 39 CO 0.00 -0.25 -0.20 -0.54 0.23 0.00 0.00 176.35 175.59 1xm7 s LYS 40 N -0.27 1.44 0.40 1.70 -0.14 -1.26 -4.78 119.74 116.83 1xm7 s LYS 40 Ca 0.50 -1.53 0.19 0.00 -1.36 0.00 0.00 55.97 53.77 1xm7 s LYS 40 Cb -0.30 -1.58 1.12 0.00 -1.68 0.00 0.00 37.83 35.40 1xm7 s LYS 40 CO 0.35 0.32 1.75 -1.35 -0.76 0.00 0.00 175.35 175.66 1xm7 h PRO 41 N 3.00 0.36 0.00 -1.68 0.11 -1.97 -1.04 132.00 130.79 1xm7 h PRO 41 Ca -0.43 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1xm7 h PRO 41 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1xm7 h PRO 41 CO 0.52 0.24 -0.13 -0.85 -0.21 0.00 0.00 178.00 177.57 1xm7 n GLU 42 N -4.65 0.02 -1.30 1.05 0.00 -1.26 -3.54 120.64 110.96 1xm7 n GLU 42 Ca 0.27 0.01 -0.29 0.00 0.00 0.00 0.00 57.16 57.15 1xm7 n GLU 42 Cb 0.92 -1.52 0.18 0.00 0.00 0.00 0.00 31.44 31.02 1xm7 n GLU 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 1xm7 s ASP 43 N -3.10 2.48 -0.04 -1.84 -0.00 -0.39 -4.53 116.67 109.25 1xm7 s ASP 43 Ca 0.13 0.93 0.01 0.00 -0.00 0.00 0.00 52.55 53.63 1xm7 s ASP 43 Cb 0.18 -1.45 0.02 0.00 -0.00 0.00 0.00 42.92 41.67 1xm7 s ASP 43 CO 0.58 -3.19 -0.06 -0.89 -0.00 0.00 0.00 175.17 171.61 1xm7 s THR 44 N -3.12 0.62 -0.18 -1.27 2.01 -0.26 -1.35 115.64 112.09 1xm7 s THR 44 Ca 0.67 -0.20 -0.04 0.00 0.31 0.00 0.00 61.69 62.43 1xm7 s THR 44 Cb -0.15 -0.61 -0.02 0.00 0.01 0.00 0.00 72.50 71.73 1xm7 s THR 44 CO 0.56 0.23 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.47 1xm7 s LEU 45 N 0.70 3.15 -0.30 4.42 2.96 0.37 -1.70 118.68 128.28 1xm7 s LEU 45 Ca -0.10 -0.22 -0.09 0.00 -0.22 0.00 0.00 54.13 53.50 1xm7 s LEU 45 Cb -0.13 -1.78 -0.01 0.00 0.50 0.00 0.00 46.19 44.78 1xm7 s LEU 45 CO 0.01 0.09 0.12 -0.31 -1.32 0.00 0.00 176.35 174.94 1xm7 s TYR 46 N 0.83 3.16 -0.25 5.38 1.51 -0.39 -0.79 117.35 126.79 1xm7 s TYR 46 Ca -0.01 -0.67 -0.10 0.00 -1.01 0.00 0.00 57.07 55.28 1xm7 s TYR 46 Cb -0.14 -2.31 -0.05 0.00 -0.11 0.00 0.00 41.96 39.34 1xm7 s TYR 46 CO 0.02 -0.48 0.16 -1.58 -1.11 0.00 0.00 175.55 172.56 1xm7 s HIS 47 N 1.58 3.26 -0.50 2.71 2.46 0.31 -1.15 115.29 123.96 1xm7 s HIS 47 Ca 0.04 0.13 0.01 0.00 0.47 0.00 0.00 55.06 55.71 1xm7 s HIS 47 Cb -0.17 -2.30 0.50 0.00 -0.13 0.00 0.00 32.58 30.47 1xm7 s HIS 47 CO 0.05 -0.05 1.93 1.28 -2.47 0.00 0.00 174.74 175.48 1xm7 n LEU 48 N 4.60 6.91 0.00 8.88 4.77 0.26 -0.96 117.00 141.46 1xm7 n LEU 48 Ca -0.15 -3.74 0.00 0.00 -0.03 0.00 0.00 56.01 52.09 1xm7 n LEU 48 Cb 0.52 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 1xm7 n LEU 48 CO 0.34 1.21 0.00 0.61 -1.33 0.00 0.00 177.39 178.22 1xm7 n GLY 49 N -0.81 3.01 2.66 -0.72 0.00 -0.60 -3.75 105.19 104.98 1xm7 n GLY 49 Ca 0.55 -1.63 -0.07 0.00 0.00 0.00 0.00 46.02 44.87 1xm7 n GLY 49 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xm7 n ASP 50 N 0.00 -5.48 0.00 1.61 10.43 -1.26 -0.46 116.55 121.38 1xm7 n ASP 50 Ca 0.00 -0.34 0.00 0.00 2.57 0.00 0.00 54.79 57.02 1xm7 n ASP 50 Cb 0.00 -3.83 0.00 0.00 1.84 0.00 0.00 41.12 39.13 1xm7 n ASP 50 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 1xm7 n PHE 51 N -2.29 0.00 -4.24 1.24 7.35 -1.26 -1.89 117.46 116.36 1xm7 n PHE 51 Ca -0.03 0.00 -0.18 0.00 -0.76 0.00 0.00 57.45 56.48 1xm7 n PHE 51 Cb 0.55 -0.38 -0.11 0.00 0.35 0.00 0.00 39.48 39.90 1xm7 n PHE 51 CO 0.00 0.00 0.00 -0.08 -0.76 0.00 0.00 176.76 175.92 1xm7 s THR 52 N -1.80 1.33 0.09 -2.13 -1.32 -1.26 -1.35 115.64 109.20 1xm7 s THR 52 Ca 0.00 -1.75 0.06 0.00 -1.21 0.00 0.00 61.69 58.79 1xm7 s THR 52 Cb 0.00 -1.56 -0.23 0.00 -1.51 0.00 0.00 72.50 69.21 1xm7 s THR 52 CO 0.00 -0.44 1.17 -0.25 -2.21 0.00 0.00 174.62 172.89 1xm7 h TRP 53 N 3.46 0.09 -3.31 9.09 -0.00 -0.07 -3.45 115.95 121.75 1xm7 h TRP 53 Ca -0.40 -0.07 -0.08 0.00 -0.00 0.00 0.00 58.89 58.34 1xm7 h TRP 53 Cb 1.20 -0.00 -0.02 0.00 -0.00 0.00 0.00 29.16 30.33 1xm7 h TRP 53 CO 0.65 1.06 0.14 -3.38 -0.00 0.00 0.00 178.44 176.91 1xm7 s HIS 54 N -2.68 0.36 -0.18 2.65 -3.43 -1.26 -4.99 115.29 105.74 1xm7 s HIS 54 Ca -0.01 -0.90 0.16 0.00 -0.80 0.00 0.00 55.06 53.51 1xm7 s HIS 54 Cb 0.09 0.58 0.45 0.00 -1.43 0.00 0.00 32.58 32.27 1xm7 s HIS 54 CO 0.83 -1.43 1.34 1.19 -2.00 0.00 0.00 174.74 174.67 1xm7 n PHE 55 N -0.53 0.63 -2.99 0.38 3.72 -1.26 -4.82 117.46 112.59 1xm7 n PHE 55 Ca -0.06 -1.07 -0.44 0.00 -0.05 0.00 0.00 57.45 55.83 1xm7 n PHE 55 Cb 0.60 -0.29 -0.01 0.00 -0.94 0.00 0.00 39.48 38.84 1xm7 n PHE 55 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1xm7 s ASN 56 N -2.39 6.90 -0.32 4.37 3.04 -1.26 -4.90 114.94 120.37 1xm7 s ASN 56 Ca 0.39 -2.65 -0.02 0.00 0.04 0.00 0.00 52.86 50.62 1xm7 s ASN 56 Cb 0.34 -2.38 -0.03 0.00 -1.54 0.00 0.00 41.25 37.64 1xm7 s ASN 56 CO 0.05 -0.83 1.45 -0.67 -3.04 0.00 0.00 177.10 174.06 1xm7 n ASP 57 N 5.68 2.01 0.07 -4.21 4.64 -1.26 -4.62 116.55 118.87 1xm7 n ASP 57 Ca 0.29 -2.06 0.08 0.00 -1.38 0.00 0.00 54.79 51.73 1xm7 n ASP 57 Cb 0.45 -0.68 0.38 0.00 -1.04 0.00 0.00 41.12 40.23 1xm7 n ASP 57 CO 0.00 0.00 0.00 2.29 -0.82 0.00 0.00 177.20 178.67 1xm7 n LYS 58 N 4.28 0.10 -0.05 -0.67 2.85 -1.26 -2.40 118.16 121.01 1xm7 n LYS 58 Ca 0.18 0.41 0.03 0.00 -1.05 0.00 0.00 58.31 57.88 1xm7 n LYS 58 Cb 0.09 -1.71 0.04 0.00 -0.65 0.00 0.00 35.03 32.80 1xm7 n LYS 58 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1xm7 n ASN 59 N -1.90 1.82 -0.46 -5.58 3.02 -1.26 -4.98 115.26 105.92 1xm7 n ASN 59 Ca 0.02 -2.25 -0.06 0.00 -0.03 0.00 0.00 54.58 52.26 1xm7 n ASN 59 Cb 0.15 -0.14 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 1xm7 n ASN 59 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1xm7 n GLU 60 N -0.72 -1.46 -0.03 3.52 -0.58 -1.01 -4.90 120.64 115.46 1xm7 n GLU 60 Ca 0.05 0.65 -0.10 0.00 -0.42 0.00 0.00 57.16 57.34 1xm7 n GLU 60 Cb 0.42 -4.87 -0.04 0.00 -0.57 0.00 0.00 31.44 26.38 1xm7 n GLU 60 CO 0.00 0.00 0.00 1.88 -0.48 0.00 0.00 177.13 178.53 1xm7 h TYR 61 N 0.00 0.21 -0.66 -0.32 0.05 -1.94 0.28 116.97 114.59 1xm7 h TYR 61 Ca -0.12 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.59 1xm7 h TYR 61 Cb 0.92 -0.07 -0.03 0.00 1.01 0.00 0.00 36.73 38.56 1xm7 h TYR 61 CO 0.50 0.14 0.12 -0.07 -1.05 0.00 0.00 178.16 177.80 1xm7 h LEU 62 N 0.21 1.02 -0.96 3.88 3.38 -1.92 -0.97 115.31 119.97 1xm7 h LEU 62 Ca 0.06 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 1xm7 h LEU 62 Cb -0.01 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1xm7 h LEU 62 CO -0.01 1.01 0.07 -0.09 0.09 0.00 0.00 178.44 179.51 1xm7 h ARG 63 N 1.01 0.83 -0.28 1.13 2.43 -1.88 -0.93 114.38 116.69 1xm7 h ARG 63 Ca 0.20 -0.20 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1xm7 h ARG 63 Cb 0.41 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 1xm7 h ARG 63 CO 0.01 0.79 -0.08 0.82 -1.51 0.00 0.00 179.97 180.00 1xm7 h ILE 64 N 0.79 1.28 -0.48 1.20 2.04 -0.62 -1.31 117.51 120.41 1xm7 h ILE 64 Ca 0.16 -1.11 0.07 0.00 1.00 0.00 0.00 64.86 64.98 1xm7 h ILE 64 Cb 0.37 1.44 -0.06 0.00 -0.74 0.00 0.00 36.82 37.84 1xm7 h ILE 64 CO 0.01 0.35 0.16 -0.25 0.00 0.00 0.00 178.15 178.42 1xm7 h TRP 65 N 0.29 0.28 -0.59 1.37 2.91 -0.85 -1.35 115.95 118.01 1xm7 h TRP 65 Ca 0.07 0.03 0.02 0.00 1.13 0.00 0.00 58.89 60.13 1xm7 h TRP 65 Cb 0.56 -0.05 -0.04 0.00 -0.51 0.00 0.00 29.16 29.12 1xm7 h TRP 65 CO 0.05 0.08 0.37 -0.22 -1.03 0.00 0.00 178.44 177.70 1xm7 h LYS 66 N 0.33 0.72 0.00 2.65 3.64 -1.02 -2.01 116.57 120.88 1xm7 h LYS 66 Ca 0.23 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1xm7 h LYS 66 Cb 0.25 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1xm7 h LYS 66 CO -0.25 0.48 -0.10 0.00 -2.27 0.00 0.00 179.45 177.30 1xm7 h ALA 67 N 1.25 1.20 -2.58 5.00 0.00 -0.27 -3.44 119.26 120.41 1xm7 h ALA 67 Ca 0.23 -0.09 -0.57 0.00 0.00 0.00 0.00 54.91 54.48 1xm7 h ALA 67 Cb -0.01 -0.02 0.12 0.00 0.00 0.00 0.00 17.79 17.88 1xm7 h ALA 67 CO -0.09 0.13 0.48 1.28 0.00 0.00 0.00 179.25 181.05 1xm7 n LEU 68 N -3.50 3.64 -4.77 0.00 4.77 -0.60 -4.96 117.00 111.58 1xm7 n LEU 68 Ca -0.01 1.17 -0.31 0.00 -0.03 0.00 0.00 56.01 56.82 1xm7 n LEU 68 Cb 0.25 -1.48 0.08 0.00 -2.33 0.00 0.00 43.42 39.94 1xm7 n LEU 68 CO 0.29 -0.60 0.71 -2.16 -1.33 0.00 0.00 177.39 174.30 1xm7 s PRO 69 N -1.99 2.41 0.00 3.23 0.04 -1.26 -4.95 135.00 132.48 1xm7 s PRO 69 Ca 0.58 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.81 1xm7 s PRO 69 Cb -0.55 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1xm7 s PRO 69 CO 0.61 -1.53 0.00 0.41 0.04 0.00 0.00 177.00 176.53 1xm7 n GLY 70 N -1.12 1.29 3.80 0.56 0.00 -1.23 -4.62 105.19 103.87 1xm7 n GLY 70 Ca 0.09 -1.87 -0.37 0.00 0.00 0.00 0.00 46.02 43.87 1xm7 n GLY 70 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xm7 s ARG 71 N -2.62 4.43 -0.17 1.61 3.52 -0.46 -4.89 118.95 120.38 1xm7 s ARG 71 Ca 0.00 1.09 0.00 0.00 -0.13 0.00 0.00 55.73 56.69 1xm7 s ARG 71 Cb 0.00 -2.89 0.03 0.00 -1.56 0.00 0.00 34.95 30.53 1xm7 s ARG 71 CO 0.00 0.37 -0.09 0.15 -0.81 0.00 0.00 175.30 174.91 1xm7 s LYS 72 N -1.91 1.87 -0.07 5.12 1.02 -1.26 0.14 119.74 124.65 1xm7 s LYS 72 Ca 0.45 -0.60 0.01 0.00 0.02 0.00 0.00 55.97 55.85 1xm7 s LYS 72 Cb -0.18 -2.11 -0.03 0.00 -0.52 0.00 0.00 37.83 34.98 1xm7 s LYS 72 CO 0.23 -0.36 -0.08 0.42 -0.92 0.00 0.00 175.35 174.64 1xm7 s ILE 73 N 1.53 3.59 -0.09 2.17 1.09 0.03 0.89 121.20 130.40 1xm7 s ILE 73 Ca 0.02 -0.51 0.04 0.00 -1.10 0.00 0.00 60.65 59.09 1xm7 s ILE 73 Cb -0.15 -2.47 -0.01 0.00 -1.06 0.00 0.00 42.46 38.78 1xm7 s ILE 73 CO -0.09 0.59 -0.22 -0.22 -0.10 0.00 0.00 174.94 174.90 1xm7 s LEU 74 N -0.66 2.24 -0.46 2.97 1.98 0.24 -0.53 118.68 124.47 1xm7 s LEU 74 Ca 0.10 -0.48 -0.01 0.00 -2.89 0.00 0.00 54.13 50.85 1xm7 s LEU 74 Cb -0.11 -1.45 0.12 0.00 0.66 0.00 0.00 46.19 45.41 1xm7 s LEU 74 CO 0.02 0.20 0.24 -0.69 -1.89 0.00 0.00 176.35 174.22 1xm7 s VAL 75 N 0.14 3.09 0.04 1.68 1.01 -0.14 0.25 120.40 126.47 1xm7 s VAL 75 Ca -0.11 -2.50 -0.39 0.00 0.00 0.00 0.00 61.98 58.98 1xm7 s VAL 75 Cb -0.16 -3.12 -0.19 0.00 0.00 0.00 0.00 36.38 32.91 1xm7 s VAL 75 CO 0.06 -0.73 1.13 0.23 0.00 0.00 0.00 175.10 175.80 1xm7 n MET 76 N 4.06 0.36 -2.90 2.72 0.00 -0.39 -1.56 117.12 119.41 1xm7 n MET 76 Ca 0.02 0.13 -0.20 0.00 0.00 0.00 0.00 57.70 57.65 1xm7 n MET 76 Cb 0.39 -1.66 0.06 0.00 0.00 0.00 0.00 33.22 32.02 1xm7 n MET 76 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1xm7 s GLY 77 N 0.11 1.78 0.53 3.03 0.00 -1.26 -4.63 107.32 106.88 1xm7 s GLY 77 Ca 0.88 -1.91 0.28 0.00 0.00 0.00 0.00 44.72 43.97 1xm7 s GLY 77 CO 0.54 -1.49 2.08 -0.57 0.00 0.00 0.00 173.10 173.66 1xm7 h ASN 78 N 0.10 0.00 1.03 1.64 -0.00 -1.95 -2.19 115.58 114.21 1xm7 h ASN 78 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 55.96 1xm7 h ASN 78 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.60 1xm7 h ASN 78 CO 0.42 0.11 -0.58 0.45 -0.00 0.00 0.00 177.43 177.83 1xm7 h HIS 79 N 0.00 0.00 -2.93 0.67 3.86 -1.97 -3.44 115.15 111.34 1xm7 h HIS 79 Ca -0.00 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 1xm7 h HIS 79 Cb 0.32 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 28.75 1xm7 h HIS 79 CO 0.00 0.00 0.89 -0.51 0.86 0.00 0.00 177.93 179.17 1xm7 s ASP 80 N -4.58 6.96 0.00 2.45 -0.00 -0.82 -4.80 116.67 115.87 1xm7 s ASP 80 Ca 0.06 1.68 0.00 0.00 -0.00 0.00 0.00 52.55 54.29 1xm7 s ASP 80 Cb 0.12 -2.54 0.00 0.00 -0.00 0.00 0.00 42.92 40.50 1xm7 s ASP 80 CO 0.72 -0.75 0.00 0.29 -0.00 0.00 0.00 175.17 175.43 1xm7 n LYS 81 N 6.54 0.20 -1.77 8.23 5.02 -1.26 -4.71 118.16 130.40 1xm7 n LYS 81 Ca 0.14 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.01 1xm7 n LYS 81 Cb 0.45 -0.56 -0.01 0.00 -0.02 0.00 0.00 35.03 34.89 1xm7 n LYS 81 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1xm7 n ASP 82 N -1.20 3.81 -0.21 4.39 -0.08 -1.26 -4.73 116.55 117.28 1xm7 n ASP 82 Ca 0.00 -2.83 0.16 0.00 -1.51 0.00 0.00 54.79 50.61 1xm7 n ASP 82 Cb 0.06 -1.60 0.49 0.00 2.34 0.00 0.00 41.12 42.40 1xm7 n ASP 82 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1xm7 h LYS 83 N 6.55 0.45 -0.19 -0.67 3.64 -1.99 -1.73 116.57 122.63 1xm7 h LYS 83 Ca 0.53 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.87 1xm7 h LYS 83 Cb 0.68 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1xm7 h LYS 83 CO 1.83 0.30 0.06 1.49 -2.27 0.00 0.00 179.45 180.86 1xm7 h GLU 84 N 0.46 0.29 -0.11 1.90 4.57 -2.02 -2.48 114.58 117.19 1xm7 h GLU 84 Ca 0.41 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.46 1xm7 h GLU 84 Cb 0.92 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.46 1xm7 h GLU 84 CO -0.15 0.38 -0.28 0.77 -1.18 0.00 0.00 179.01 178.55 1xm7 h SER 85 N 0.13 0.20 0.26 1.04 0.02 -1.76 -2.85 113.55 110.59 1xm7 h SER 85 Ca 0.06 -0.06 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 1xm7 h SER 85 Cb 0.21 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1xm7 h SER 85 CO -0.00 0.48 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.66 1xm7 h LEU 86 N 0.18 0.24 -1.37 5.07 3.38 -1.16 -2.85 115.31 118.80 1xm7 h LEU 86 Ca 0.03 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1xm7 h LEU 86 Cb 0.59 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1xm7 h LEU 86 CO 0.04 0.66 0.26 0.11 0.09 0.00 0.00 178.44 179.60 1xm7 h LYS 87 N 0.19 0.00 0.00 1.13 1.57 -1.19 0.31 116.57 118.58 1xm7 h LYS 87 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1xm7 h LYS 87 Cb 0.86 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1xm7 h LYS 87 CO 0.07 0.00 -0.22 1.49 -0.57 0.00 0.00 179.45 180.22 1xm7 h GLU 88 N 0.00 0.00 -0.01 3.15 4.81 -1.66 -3.32 114.58 117.55 1xm7 h GLU 88 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xm7 h GLU 88 Cb 0.52 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1xm7 h GLU 88 CO 0.00 0.00 -0.06 0.66 -0.73 0.00 0.00 179.01 178.88 1xm7 n TYR 89 N -2.75 0.00 -4.26 0.92 4.01 0.10 -5.01 117.16 110.18 1xm7 n TYR 89 Ca 0.04 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.60 1xm7 n TYR 89 Cb 0.50 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.40 1xm7 n TYR 89 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1xm7 s PHE 90 N -0.74 1.06 -0.49 -0.72 0.08 -0.88 -4.87 117.98 111.41 1xm7 s PHE 90 Ca 0.06 -0.37 0.23 0.00 0.12 0.00 0.00 56.93 56.97 1xm7 s PHE 90 Cb 0.05 -0.62 0.20 0.00 -0.57 0.00 0.00 43.02 42.07 1xm7 s PHE 90 CO 0.11 0.01 1.20 -0.44 -0.10 0.00 0.00 175.22 176.00 1xm7 h ASP 91 N 4.85 0.00 -3.79 1.36 3.45 0.21 -3.44 116.42 119.06 1xm7 h ASP 91 Ca -0.37 -0.15 -0.08 0.00 0.43 0.00 0.00 57.03 56.85 1xm7 h ASP 91 Cb 1.19 0.00 -0.23 0.00 -0.56 0.00 0.00 39.33 39.73 1xm7 h ASP 91 CO 0.43 0.08 -0.10 -1.61 -1.57 0.00 0.00 179.24 176.46 1xm7 s GLU 92 N -3.24 0.60 -0.07 3.56 2.02 -1.11 -5.00 118.70 115.46 1xm7 s GLU 92 Ca 0.04 0.78 -0.00 0.00 0.02 0.00 0.00 54.97 55.80 1xm7 s GLU 92 Cb 0.12 0.26 0.03 0.00 0.10 0.00 0.00 34.13 34.63 1xm7 s GLU 92 CO 0.75 -0.09 -0.03 0.42 0.02 0.00 0.00 175.26 176.33 1xm7 s ILE 93 N 0.50 0.59 -0.11 -1.63 1.01 -1.26 0.82 121.20 121.13 1xm7 s ILE 93 Ca -0.02 -0.05 -0.00 0.00 0.00 0.00 0.00 60.65 60.58 1xm7 s ILE 93 Cb -0.04 -0.67 -0.02 0.00 0.01 0.00 0.00 42.46 41.73 1xm7 s ILE 93 CO -0.02 0.28 -0.08 -0.31 0.00 0.00 0.00 174.94 174.80 1xm7 s TYR 94 N 1.59 2.90 0.29 3.97 1.51 0.14 -4.98 117.35 122.78 1xm7 s TYR 94 Ca 0.00 -0.25 0.03 0.00 -1.01 0.00 0.00 57.07 55.85 1xm7 s TYR 94 Cb -0.13 -1.80 0.45 0.00 -0.11 0.00 0.00 41.96 40.37 1xm7 s TYR 94 CO -0.04 0.08 1.75 -0.44 -1.11 0.00 0.00 175.55 175.79 1xm7 h ASP 95 N 6.01 0.46 0.00 2.29 3.32 -1.93 -1.02 116.42 125.55 1xm7 h ASP 95 Ca -0.38 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.53 1xm7 h ASP 95 Cb 1.19 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.61 1xm7 h ASP 95 CO 0.56 0.69 -0.18 0.33 -1.72 0.00 0.00 179.24 178.91 1xm7 n PHE 96 N -4.14 -0.13 -4.05 4.55 -0.00 -1.26 -4.38 117.46 108.04 1xm7 n PHE 96 Ca -0.00 0.02 -0.10 0.00 -0.00 0.00 0.00 57.45 57.37 1xm7 n PHE 96 Cb 0.38 0.41 -0.07 0.00 -0.00 0.00 0.00 39.48 40.20 1xm7 n PHE 96 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.76 178.28 1xm7 s TYR 97 N -2.00 0.61 -0.18 -5.13 1.13 -1.26 -4.24 117.35 106.28 1xm7 s TYR 97 Ca 0.00 -0.93 -0.10 0.00 -1.41 0.00 0.00 57.07 54.63 1xm7 s TYR 97 Cb 0.00 -0.09 0.06 0.00 -1.10 0.00 0.00 41.96 40.83 1xm7 s TYR 97 CO 0.00 -0.83 0.44 0.21 -2.51 0.00 0.00 175.55 172.86 1xm7 s LYS 98 N -4.05 0.42 -0.13 -3.49 2.47 -0.32 -4.89 119.74 109.75 1xm7 s LYS 98 Ca 0.26 0.83 -0.03 0.00 -1.56 0.00 0.00 55.97 55.47 1xm7 s LYS 98 Cb 0.02 -0.01 -0.03 0.00 -1.46 0.00 0.00 37.83 36.36 1xm7 s LYS 98 CO 0.08 -0.16 -0.02 0.42 0.16 0.00 0.00 175.35 175.84 1xm7 s ILE 99 N 1.41 4.10 0.09 5.43 1.01 -1.26 -0.07 121.20 131.90 1xm7 s ILE 99 Ca -0.09 -0.30 0.07 0.00 0.00 0.00 0.00 60.65 60.33 1xm7 s ILE 99 Cb -0.08 -2.77 -0.03 0.00 0.01 0.00 0.00 42.46 39.58 1xm7 s ILE 99 CO -0.13 0.53 -0.19 0.27 0.00 0.00 0.00 174.94 175.41 1xm7 s ILE 100 N -0.05 1.56 -0.24 2.92 -4.36 -0.11 -4.99 121.20 115.94 1xm7 s ILE 100 Ca 0.02 -1.48 -0.05 0.00 -0.26 0.00 0.00 60.65 58.89 1xm7 s ILE 100 Cb -0.13 -1.43 -0.01 0.00 1.25 0.00 0.00 42.46 42.14 1xm7 s ILE 100 CO 0.02 -0.09 0.01 -1.61 0.24 0.00 0.00 174.94 173.51 1xm7 s GLU 101 N -1.85 3.37 -0.10 0.37 2.02 -1.26 -0.02 118.70 121.22 1xm7 s GLU 101 Ca 0.04 -0.65 -0.04 0.00 0.02 0.00 0.00 54.97 54.34 1xm7 s GLU 101 Cb -0.10 -3.15 0.05 0.00 0.10 0.00 0.00 34.13 31.03 1xm7 s GLU 101 CO 0.04 -0.25 0.22 -1.58 0.02 0.00 0.00 175.26 173.70 1xm7 s HIS 102 N 1.51 -0.31 -0.74 1.61 2.46 -0.75 -4.85 115.29 114.22 1xm7 s HIS 102 Ca 0.05 0.78 -0.01 0.00 0.47 0.00 0.00 55.06 56.34 1xm7 s HIS 102 Cb -0.15 -0.09 0.00 0.00 -0.13 0.00 0.00 32.58 32.21 1xm7 s HIS 102 CO -0.01 -0.29 0.19 1.63 -2.47 0.00 0.00 174.74 173.80 1xm7 n LYS 103 N 4.99 -1.75 -0.92 2.88 4.76 -1.26 -2.48 118.16 124.39 1xm7 n LYS 103 Ca -0.12 0.43 0.00 0.00 -2.87 0.00 0.00 58.31 55.75 1xm7 n LYS 103 Cb 0.51 -4.32 0.00 0.00 -1.84 0.00 0.00 35.03 29.38 1xm7 n LYS 103 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xm7 n GLY 104 N -1.07 0.38 3.92 0.72 0.00 -1.26 -4.98 105.19 102.90 1xm7 n GLY 104 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 1xm7 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xm7 s LYS 105 N -0.72 2.66 -0.22 1.61 -0.14 -1.04 -5.11 119.74 116.78 1xm7 s LYS 105 Ca 0.00 -1.41 0.02 0.00 -1.36 0.00 0.00 55.97 53.22 1xm7 s LYS 105 Cb 0.00 -2.52 0.05 0.00 -1.68 0.00 0.00 37.83 33.68 1xm7 s LYS 105 CO 0.00 -0.19 -0.12 1.03 -0.76 0.00 0.00 175.35 175.31 1xm7 s ARG 106 N -4.19 2.30 -0.19 1.68 0.52 -1.26 -1.81 118.95 116.00 1xm7 s ARG 106 Ca 0.50 -1.04 -0.09 0.00 -0.52 0.00 0.00 55.73 54.58 1xm7 s ARG 106 Cb -0.06 -2.64 -0.05 0.00 0.52 0.00 0.00 34.95 32.73 1xm7 s ARG 106 CO 0.29 -0.44 0.10 0.42 0.02 0.00 0.00 175.30 175.69 1xm7 s ILE 107 N 1.26 5.11 -0.23 1.52 1.09 0.97 -0.69 121.20 130.23 1xm7 s ILE 107 Ca -0.03 0.08 -0.12 0.00 -1.10 0.00 0.00 60.65 59.49 1xm7 s ILE 107 Cb -0.17 -3.32 -0.05 0.00 -1.06 0.00 0.00 42.46 37.86 1xm7 s ILE 107 CO -0.08 0.45 0.21 -0.22 -0.10 0.00 0.00 174.94 175.20 1xm7 s LEU 108 N 0.36 4.13 -0.14 2.97 2.96 0.37 -0.93 118.68 128.38 1xm7 s LEU 108 Ca 0.06 0.20 -0.02 0.00 -0.22 0.00 0.00 54.13 54.14 1xm7 s LEU 108 Cb -0.12 -2.19 -0.02 0.00 0.50 0.00 0.00 46.19 44.36 1xm7 s LEU 108 CO -0.01 0.04 -0.07 -0.76 -1.32 0.00 0.00 176.35 174.22 1xm7 s LEU 109 N 1.09 3.04 0.04 -0.68 1.43 0.90 -0.96 118.68 123.54 1xm7 s LEU 109 Ca 0.10 -0.20 -0.27 0.00 -1.03 0.00 0.00 54.13 52.72 1xm7 s LEU 109 Cb -0.14 -1.71 0.09 0.00 0.03 0.00 0.00 46.19 44.46 1xm7 s LEU 109 CO 0.05 0.17 0.77 -0.55 0.23 0.00 0.00 176.35 177.02 1xm7 s SER 110 N 0.34 -0.47 0.28 2.29 0.15 -1.01 -1.17 113.70 114.11 1xm7 s SER 110 Ca -0.07 0.12 0.12 0.00 0.70 0.00 0.00 55.95 56.82 1xm7 s SER 110 Cb -0.15 0.47 0.35 0.00 -1.71 0.00 0.00 66.02 64.99 1xm7 s SER 110 CO 0.04 -0.72 1.59 -0.74 1.20 0.00 0.00 173.24 174.61 1xm7 h HIS 111 N 2.16 0.00 -3.14 3.44 2.76 -1.74 -3.33 115.15 115.31 1xm7 h HIS 111 Ca -0.27 0.00 -0.59 0.00 -2.20 0.00 0.00 60.37 57.32 1xm7 h HIS 111 Cb 1.25 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.17 1xm7 h HIS 111 CO 0.26 0.60 -0.26 0.71 -1.30 0.00 0.00 177.93 177.95 1xm7 s TYR 112 N -3.48 3.55 0.65 5.26 1.51 -1.26 -2.42 117.35 121.16 1xm7 s TYR 112 Ca -0.00 0.74 -0.06 0.00 -1.01 0.00 0.00 57.07 56.73 1xm7 s TYR 112 Cb 0.12 -2.13 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1xm7 s TYR 112 CO 0.75 0.49 0.96 -1.25 -1.11 0.00 0.00 175.55 175.39 1xm7 s PRO 113 N -2.13 2.57 0.52 -1.71 0.04 -1.26 -4.81 135.00 128.22 1xm7 s PRO 113 Ca 0.36 -0.13 0.31 0.00 0.04 0.00 0.00 61.00 61.57 1xm7 s PRO 113 Cb -0.13 -2.22 1.21 0.00 0.04 0.00 0.00 34.50 33.40 1xm7 s PRO 113 CO 0.20 -0.97 1.93 0.00 0.04 0.00 0.00 177.00 178.20 1xm7 h ALA 114 N -0.39 1.01 -2.08 8.56 0.00 -1.93 -3.41 119.26 121.03 1xm7 h ALA 114 Ca -0.45 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.41 1xm7 h ALA 114 Cb 1.29 -0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.85 1xm7 h ALA 114 CO 0.60 0.08 -0.03 0.21 0.00 0.00 0.00 179.25 180.12 1xm7 s LYS 115 N -3.66 0.66 -0.57 0.00 2.20 -1.26 -4.68 119.74 112.43 1xm7 s LYS 115 Ca 0.01 1.19 -0.21 0.00 -0.36 0.00 0.00 55.97 56.60 1xm7 s LYS 115 Cb 0.09 0.16 0.06 0.00 -1.51 0.00 0.00 37.83 36.63 1xm7 s LYS 115 CO 0.57 -0.15 0.81 0.34 -0.36 0.00 0.00 175.35 176.56 1xm7 s ASP 116 N 1.68 6.23 0.52 1.43 -1.08 -1.26 -3.70 116.67 120.49 1xm7 s ASP 116 Ca -0.10 -0.87 0.31 0.00 -0.52 0.00 0.00 52.55 51.37 1xm7 s ASP 116 Cb -0.06 -2.36 1.71 0.00 -1.46 0.00 0.00 42.92 40.75 1xm7 s ASP 116 CO -0.19 -1.16 1.95 1.55 0.52 0.00 0.00 175.17 177.84 1xm7 h PRO 117 N 9.26 0.00 0.00 4.34 0.13 -1.92 -3.25 132.00 140.56 1xm7 h PRO 117 Ca -0.28 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.79 1xm7 h PRO 117 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1xm7 h PRO 117 CO 1.08 0.00 -0.89 -0.89 -0.23 0.00 0.00 178.00 177.07 1xm7 n ILE 118 N -2.67 1.30 -0.01 -3.56 -0.00 -1.26 -4.96 119.36 108.20 1xm7 n ILE 118 Ca -0.02 0.14 0.01 0.00 -0.00 0.00 0.00 62.75 62.88 1xm7 n ILE 118 Cb 0.14 -1.98 -0.05 0.00 -0.00 0.00 0.00 39.64 37.75 1xm7 n ILE 118 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 1xm7 n THR 119 N -4.01 0.17 -3.80 1.39 -2.24 -1.25 -5.03 114.28 99.50 1xm7 n THR 119 Ca -0.14 -0.18 -0.35 0.00 -2.27 0.00 0.00 64.05 61.11 1xm7 n THR 119 Cb 0.40 -0.15 0.03 0.00 -2.10 0.00 0.00 70.33 68.51 1xm7 n THR 119 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1xm7 n GLU 120 N -1.93 -0.92 0.06 -0.78 4.07 -1.23 -4.89 120.64 115.04 1xm7 n GLU 120 Ca -0.05 0.39 -0.12 0.00 -0.06 0.00 0.00 57.16 57.33 1xm7 n GLU 120 Cb 0.38 -3.51 -0.13 0.00 -0.06 0.00 0.00 31.44 28.12 1xm7 n GLU 120 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1xm7 h ARG 121 N -1.93 0.12 -2.21 5.31 1.12 -1.96 -3.37 114.38 111.46 1xm7 h ARG 121 Ca -0.66 -0.21 -0.57 0.00 -1.11 0.00 0.00 59.98 57.44 1xm7 h ARG 121 Cb 1.37 0.08 -0.41 0.00 -0.01 0.00 0.00 29.97 30.99 1xm7 h ARG 121 CO 0.48 1.02 -0.77 0.66 -3.11 0.00 0.00 179.97 178.25 1xm7 n TYR 122 N -3.38 3.06 -0.18 2.20 4.01 -1.26 -4.90 117.16 116.71 1xm7 n TYR 122 Ca -0.08 -3.96 0.23 0.00 -0.16 0.00 0.00 57.90 53.93 1xm7 n TYR 122 Cb 1.00 -0.48 0.62 0.00 -0.31 0.00 0.00 39.34 40.17 1xm7 n TYR 122 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1xm7 h PRO 123 N 3.11 0.19 -0.01 -0.72 0.13 -1.97 -0.48 132.00 132.25 1xm7 h PRO 123 Ca 0.13 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1xm7 h PRO 123 Cb 0.63 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.71 1xm7 h PRO 123 CO 0.74 0.12 0.00 -0.44 -0.23 0.00 0.00 178.00 178.20 1xm7 h ASP 124 N 0.19 0.01 -0.10 1.44 5.19 -1.96 0.61 116.42 121.81 1xm7 h ASP 124 Ca 0.42 -0.07 -0.02 0.00 -0.62 0.00 0.00 57.03 56.74 1xm7 h ASP 124 Cb 1.33 -0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.83 1xm7 h ASP 124 CO -0.08 0.08 -0.00 -0.09 -3.12 0.00 0.00 179.24 176.02 1xm7 h ARG 125 N -0.06 0.18 -1.00 3.56 9.65 -1.57 -1.99 114.38 123.15 1xm7 h ARG 125 Ca 0.00 -0.06 0.11 0.00 -1.10 0.00 0.00 59.98 58.94 1xm7 h ARG 125 Cb 0.07 -0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 28.55 1xm7 h ARG 125 CO -0.00 0.44 0.63 1.96 2.80 0.00 0.00 179.97 185.81 1xm7 h GLN 126 N -0.11 0.98 -0.40 0.20 4.20 -1.08 -0.85 115.11 118.05 1xm7 h GLN 126 Ca 0.03 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 1xm7 h GLN 126 Cb 0.36 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 27.91 1xm7 h GLN 126 CO 0.01 0.65 -0.18 1.49 -0.67 0.00 0.00 178.83 180.12 1xm7 h GLU 127 N 1.01 0.77 -0.10 1.46 4.81 -0.69 -1.91 114.58 119.94 1xm7 h GLU 127 Ca 0.49 -0.29 -0.07 0.00 -0.13 0.00 0.00 59.36 59.36 1xm7 h GLU 127 Cb 0.46 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.78 1xm7 h GLU 127 CO -0.25 0.89 -0.25 0.52 -0.73 0.00 0.00 179.01 179.19 1xm7 h MET 128 N 0.68 0.17 -0.17 1.92 2.86 -0.42 -1.54 114.93 118.43 1xm7 h MET 128 Ca 0.10 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.62 1xm7 h MET 128 Cb 0.68 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.32 1xm7 h MET 128 CO 0.05 0.41 -0.17 0.28 1.06 0.00 0.00 176.91 178.55 1xm7 h VAL 129 N 0.15 1.34 -0.57 -2.22 2.07 -0.91 -2.26 116.25 113.86 1xm7 h VAL 129 Ca 0.02 -1.32 0.06 0.00 0.82 0.00 0.00 66.70 66.28 1xm7 h VAL 129 Cb 0.53 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 1xm7 h VAL 129 CO 0.04 0.40 0.29 0.03 0.02 0.00 0.00 177.57 178.34 1xm7 h ARG 130 N 0.06 0.52 -0.61 1.57 3.08 -1.01 0.10 114.38 118.10 1xm7 h ARG 130 Ca 0.03 -0.03 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 1xm7 h ARG 130 Cb 0.70 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 1xm7 h ARG 130 CO 0.04 0.35 0.13 1.49 -1.07 0.00 0.00 179.97 180.91 1xm7 h GLU 131 N 0.54 0.95 -0.08 0.04 4.81 -1.26 -1.86 114.58 117.73 1xm7 h GLU 131 Ca 0.26 -0.22 -0.16 0.00 -0.13 0.00 0.00 59.36 59.11 1xm7 h GLU 131 Cb 0.18 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1xm7 h GLU 131 CO -0.19 0.86 -0.65 0.82 -0.73 0.00 0.00 179.01 179.12 1xm7 h ILE 132 N 0.91 1.38 0.58 2.32 2.04 -0.79 0.58 117.51 124.53 1xm7 h ILE 132 Ca 0.19 -2.05 -0.02 0.00 1.00 0.00 0.00 64.86 63.98 1xm7 h ILE 132 Cb 0.35 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.46 1xm7 h ILE 132 CO 0.00 0.61 -0.36 0.22 0.00 0.00 0.00 178.15 178.63 1xm7 h TYR 133 N 0.23 -0.95 0.28 1.37 3.20 -0.33 -1.60 116.97 119.17 1xm7 h TYR 133 Ca -0.01 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.83 1xm7 h TYR 133 Cb 1.19 0.34 0.00 0.00 1.54 0.00 0.00 36.73 39.81 1xm7 h TYR 133 CO 0.03 -0.54 -0.13 0.74 -1.64 0.00 0.00 178.16 176.61 1xm7 h PHE 134 N -0.89 -0.34 0.00 -3.82 0.04 -1.36 0.25 116.94 110.82 1xm7 h PHE 134 Ca -0.07 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.69 1xm7 h PHE 134 Cb 0.72 0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.99 1xm7 h PHE 134 CO -0.10 -0.00 0.07 0.87 -0.60 0.00 0.00 178.31 178.54 1xm7 h LYS 135 N -0.95 0.00 -0.14 1.51 6.56 -0.98 0.74 116.57 123.33 1xm7 h LYS 135 Ca -0.04 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.55 1xm7 h LYS 135 Cb 0.49 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.15 1xm7 h LYS 135 CO 0.06 0.00 0.00 -1.91 -2.06 0.00 0.00 179.45 175.54 1xm7 n GLU 136 N -2.31 2.87 -3.42 3.15 4.07 -0.60 -5.03 120.64 119.36 1xm7 n GLU 136 Ca -0.01 -1.80 -0.18 0.00 -0.06 0.00 0.00 57.16 55.10 1xm7 n GLU 136 Cb 0.10 -1.15 0.01 0.00 -0.06 0.00 0.00 31.44 30.34 1xm7 n GLU 136 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1xm7 n ASN 137 N -0.17 -6.17 -4.84 4.31 3.02 0.25 -4.98 115.26 106.68 1xm7 n ASN 137 Ca 0.06 -0.39 -0.33 0.00 -0.03 0.00 0.00 54.58 53.89 1xm7 n ASN 137 Cb 0.36 -3.13 -0.06 0.00 -0.61 0.00 0.00 39.78 36.33 1xm7 n ASN 137 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xm7 n ASP 139 N 0.93 0.30 -3.90 0.00 8.00 0.14 -4.87 116.55 117.15 1xm7 n ASP 139 Ca -0.11 0.06 -0.11 0.00 0.71 0.00 0.00 54.79 55.34 1xm7 n ASP 139 Cb 0.52 0.71 -0.11 0.00 -0.02 0.00 0.00 41.12 42.23 1xm7 n ASP 139 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1xm7 s LEU 140 N -5.67 1.83 -0.19 0.64 2.96 -1.15 -4.42 118.68 112.67 1xm7 s LEU 140 Ca -0.11 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1xm7 s LEU 140 Cb 0.07 0.38 0.04 0.00 0.50 0.00 0.00 46.19 47.17 1xm7 s LEU 140 CO 0.81 -0.27 -0.12 -0.22 -1.32 0.00 0.00 176.35 175.24 1xm7 s LEU 141 N -1.08 2.26 -0.17 -0.68 1.98 0.13 0.14 118.68 121.27 1xm7 s LEU 141 Ca -0.12 -0.84 -0.06 0.00 -2.89 0.00 0.00 54.13 50.22 1xm7 s LEU 141 Cb -0.07 -1.27 -0.04 0.00 0.66 0.00 0.00 46.19 45.48 1xm7 s LEU 141 CO 0.00 -0.12 0.03 -0.63 -1.89 0.00 0.00 176.35 173.74 1xm7 s ILE 142 N 1.38 4.47 0.18 6.68 1.01 -0.13 -1.47 121.20 133.33 1xm7 s ILE 142 Ca -0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 60.65 60.48 1xm7 s ILE 142 Cb -0.16 -2.99 0.01 0.00 0.01 0.00 0.00 42.46 39.33 1xm7 s ILE 142 CO -0.09 0.48 0.27 0.00 0.00 0.00 0.00 174.94 175.61 1xm7 n HIS 143 N 3.43 -1.04 0.00 3.97 1.44 -0.76 -2.39 115.22 119.86 1xm7 n HIS 143 Ca -0.17 -1.19 0.00 0.00 -2.01 0.00 0.00 57.72 54.35 1xm7 n HIS 143 Cb 0.52 0.31 0.00 0.00 0.12 0.00 0.00 29.99 30.94 1xm7 n HIS 143 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1xm7 n GLY 144 N -0.30 4.45 4.90 -1.39 0.00 -1.01 0.12 105.19 111.96 1xm7 n GLY 144 Ca -0.00 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1xm7 n GLY 144 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1xm7 n HIS 145 N 0.00 0.00 -2.56 1.61 -0.00 -1.20 -4.58 115.22 108.49 1xm7 n HIS 145 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.30 1xm7 n HIS 145 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 29.99 29.97 1xm7 n HIS 145 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1xm7 s VAL 146 N 0.00 4.01 1.02 3.57 1.01 -1.26 -5.01 120.40 123.75 1xm7 s VAL 146 Ca 0.00 0.92 -0.14 0.00 0.00 0.00 0.00 61.98 62.77 1xm7 s VAL 146 Cb 0.00 -4.67 0.20 0.00 0.00 0.00 0.00 36.38 31.91 1xm7 s VAL 146 CO 0.00 -1.27 1.11 -1.00 0.00 0.00 0.00 175.10 173.94 1xm7 s HIS 147 N 5.02 1.90 0.80 5.22 0.09 -1.26 -4.88 115.29 122.17 1xm7 s HIS 147 Ca 0.45 0.86 -0.11 0.00 -0.00 0.00 0.00 55.06 56.26 1xm7 s HIS 147 Cb -0.08 -3.34 0.07 0.00 -0.00 0.00 0.00 32.58 29.24 1xm7 s HIS 147 CO 0.26 -3.00 1.09 -0.46 -0.00 0.00 0.00 174.74 172.64 1xm7 s TRP 148 N -3.04 2.50 0.10 1.40 -0.00 -1.26 -5.01 118.94 113.62 1xm7 s TRP 148 Ca 0.66 1.52 -0.26 0.00 -0.00 0.00 0.00 56.10 58.03 1xm7 s TRP 148 Cb -0.16 -3.07 0.08 0.00 -0.00 0.00 0.00 33.47 30.31 1xm7 s TRP 148 CO 0.57 -1.92 0.86 0.54 -0.00 0.00 0.00 176.95 177.00 1xm7 s ASN 149 N -3.37 -0.31 0.00 5.86 4.22 -1.26 -5.04 114.94 115.05 1xm7 s ASN 149 Ca 0.62 -0.21 0.00 0.00 -2.14 0.00 0.00 52.86 51.12 1xm7 s ASN 149 Cb -0.17 0.48 0.00 0.00 1.28 0.00 0.00 41.25 42.84 1xm7 s ASN 149 CO 0.56 -0.84 0.41 0.54 -2.04 0.00 0.00 177.10 175.73 1xm7 n ARG 150 N -0.37 0.81 0.10 3.55 1.74 -1.26 -4.12 116.66 117.11 1xm7 n ARG 150 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1xm7 n ARG 150 Cb 0.62 -1.41 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 1xm7 n ARG 150 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1xm7 n GLU 151 N 0.10 0.00 0.00 5.56 4.71 -1.26 -5.33 120.64 124.42 1xm7 n GLU 151 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1xm7 n GLU 151 Cb 0.20 -0.18 0.00 0.00 -1.01 0.00 0.00 31.44 30.45 1xm7 n GLU 151 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xm7 n GLY 152 N 2.20 4.09 0.00 0.62 0.00 -1.26 -5.27 105.19 105.57 1xm7 n GLY 152 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1xm7 n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xm7 n ALA 156 N 0.00 1.54 0.24 0.00 0.00 -1.24 -4.75 120.51 116.29 1xm7 n ALA 156 Ca 0.00 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.48 1xm7 n ALA 156 Cb 0.00 -0.02 0.52 0.00 0.00 0.00 0.00 19.45 19.94 1xm7 n ALA 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xm7 h LYS 158 N 0.00 0.00 0.00 0.00 2.10 -1.90 -2.81 116.57 113.96 1xm7 h LYS 158 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1xm7 h LYS 158 Cb 0.13 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.46 1xm7 h LYS 158 CO 0.00 0.39 0.00 -0.25 -2.00 0.00 0.00 179.45 177.59 1xm7 n ASP 159 N -3.79 0.00 -4.19 7.07 8.00 -0.27 -4.14 116.55 119.24 1xm7 n ASP 159 Ca -0.01 -0.29 -0.18 0.00 0.71 0.00 0.00 54.79 55.02 1xm7 n ASP 159 Cb 0.47 -0.07 -0.12 0.00 -0.02 0.00 0.00 41.12 41.37 1xm7 n ASP 159 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1xm7 s TYR 160 N -2.15 1.25 -1.36 1.24 1.51 -1.09 -5.02 117.35 111.73 1xm7 s TYR 160 Ca 0.18 -0.50 -0.09 0.00 -1.01 0.00 0.00 57.07 55.66 1xm7 s TYR 160 Cb 0.09 -0.69 -0.09 0.00 -0.11 0.00 0.00 41.96 41.16 1xm7 s TYR 160 CO 0.17 0.07 3.01 0.54 -1.11 0.00 0.00 175.55 178.23 1xm7 n ARG 161 N 1.05 3.53 -3.86 -0.62 3.00 -1.26 -4.85 116.66 113.66 1xm7 n ARG 161 Ca -0.20 -2.14 -0.36 0.00 -0.01 0.00 0.00 57.85 55.14 1xm7 n ARG 161 Cb 0.55 -2.66 -0.06 0.00 0.00 0.00 0.00 32.46 30.29 1xm7 n ARG 161 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1xm7 s ILE 162 N 1.66 5.47 -0.44 0.55 -1.09 -1.08 -5.06 121.20 121.20 1xm7 s ILE 162 Ca 0.68 0.18 -0.13 0.00 -2.23 0.00 0.00 60.65 59.15 1xm7 s ILE 162 Cb 0.20 -3.44 0.06 0.00 -1.58 0.00 0.00 42.46 37.70 1xm7 s ILE 162 CO -0.06 0.56 0.32 -1.61 -1.23 0.00 0.00 174.94 172.92 1xm7 s GLU 163 N -1.21 2.85 0.07 2.79 0.41 -1.26 -4.12 118.70 118.22 1xm7 s GLU 163 Ca 0.18 -1.30 0.07 0.00 -0.41 0.00 0.00 54.97 53.50 1xm7 s GLU 163 Cb -0.12 -3.96 -0.03 0.00 -1.78 0.00 0.00 34.13 28.24 1xm7 s GLU 163 CO 0.07 -0.93 -0.18 0.00 -0.49 0.00 0.00 175.26 173.74 1xm7 s ILE 165 N -1.03 1.20 -0.42 0.00 1.10 -0.54 -4.97 121.20 116.54 1xm7 s ILE 165 Ca 0.04 -0.44 -0.24 0.00 -0.51 0.00 0.00 60.65 59.50 1xm7 s ILE 165 Cb -0.09 -1.15 0.02 0.00 0.15 0.00 0.00 42.46 41.39 1xm7 s ILE 165 CO 0.03 0.39 0.83 0.21 -2.11 0.00 0.00 174.94 174.28 1xm7 s ASN 166 N 1.28 6.50 -0.05 4.50 3.84 -1.26 -1.83 114.94 127.93 1xm7 s ASN 166 Ca -0.02 0.15 0.08 0.00 0.21 0.00 0.00 52.86 53.27 1xm7 s ASN 166 Cb -0.14 -2.41 0.31 0.00 -0.55 0.00 0.00 41.25 38.46 1xm7 s ASN 166 CO -0.04 -0.89 1.12 0.00 -2.79 0.00 0.00 177.10 174.51 1xm7 n ALA 167 N 6.74 2.77 -1.98 1.71 0.00 0.31 -4.83 120.51 125.23 1xm7 n ALA 167 Ca 0.04 -0.67 -0.42 0.00 0.00 0.00 0.00 53.44 52.39 1xm7 n ALA 167 Cb 0.48 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 1xm7 n ALA 167 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1xm7 s ASN 168 N -0.66 6.65 0.46 0.00 3.04 -1.26 -1.12 114.94 122.05 1xm7 s ASN 168 Ca 0.22 2.29 0.33 0.00 0.04 0.00 0.00 52.86 55.74 1xm7 s ASN 168 Cb 0.14 -2.54 1.47 0.00 -1.54 0.00 0.00 41.25 38.79 1xm7 s ASN 168 CO 0.10 -0.92 1.62 -0.37 -3.04 0.00 0.00 177.10 174.49 1xm7 h VAL 169 N 5.48 0.12 0.00 -5.21 -1.51 -1.76 0.20 116.25 113.56 1xm7 h VAL 169 Ca -0.40 -0.02 -0.02 0.00 -1.23 0.00 0.00 66.70 65.02 1xm7 h VAL 169 Cb 1.18 0.04 -0.00 0.00 -2.13 0.00 0.00 31.29 30.38 1xm7 h VAL 169 CO 0.95 0.01 -0.11 -0.33 -1.23 0.00 0.00 177.57 176.86 1xm7 h GLU 170 N 0.07 0.00 -0.01 5.19 5.08 -1.89 0.47 114.58 123.50 1xm7 h GLU 170 Ca 0.83 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.19 1xm7 h GLU 170 Cb 2.73 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.98 1xm7 h GLU 170 CO -0.35 0.11 -0.51 0.91 -1.00 0.00 0.00 179.01 178.17 1xm7 n TRP 171 N -4.04 0.00 -1.53 4.33 7.02 0.69 -4.34 117.44 119.57 1xm7 n TRP 171 Ca -0.02 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.52 1xm7 n TRP 171 Cb 0.19 -0.11 0.14 0.00 -2.42 0.00 0.00 31.31 29.11 1xm7 n TRP 171 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1xm7 n ASN 172 N -0.92 1.70 -3.60 -0.99 4.13 -0.82 -4.98 115.26 109.79 1xm7 n ASN 172 Ca 0.08 -3.17 -0.23 0.00 1.68 0.00 0.00 54.58 52.94 1xm7 n ASN 172 Cb 0.37 -0.43 0.08 0.00 -1.54 0.00 0.00 39.78 38.25 1xm7 n ASN 172 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1xm7 n ASP 173 N -0.95 -5.56 -3.37 6.41 4.64 -1.05 -2.37 116.55 114.29 1xm7 n ASP 173 Ca 0.14 -0.57 -0.24 0.00 -1.38 0.00 0.00 54.79 52.74 1xm7 n ASP 173 Cb 0.72 -4.97 0.00 0.00 -1.04 0.00 0.00 41.12 35.84 1xm7 n ASP 173 CO 0.00 0.00 0.00 -1.22 -0.82 0.00 0.00 177.20 175.16 1xm7 n TYR 174 N -4.85 -1.83 -4.32 -0.67 4.02 0.09 -4.96 117.16 104.63 1xm7 n TYR 174 Ca -0.04 0.51 -0.26 0.00 -0.01 0.00 0.00 57.90 58.10 1xm7 n TYR 174 Cb 0.58 -3.17 -0.13 0.00 -0.02 0.00 0.00 39.34 36.60 1xm7 n TYR 174 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 1xm7 s LYS 175 N -6.03 1.22 0.73 -0.72 1.02 -1.00 -4.21 119.74 110.75 1xm7 s LYS 175 Ca 0.41 -1.23 -0.11 0.00 0.02 0.00 0.00 55.97 55.06 1xm7 s LYS 175 Cb -0.21 -1.56 0.03 0.00 -0.52 0.00 0.00 37.83 35.57 1xm7 s LYS 175 CO 0.51 0.36 1.09 -1.25 -0.92 0.00 0.00 175.35 175.14 1xm7 s PRO 176 N -1.98 2.63 -0.15 -1.68 0.04 -1.26 -4.76 135.00 127.84 1xm7 s PRO 176 Ca 0.09 0.56 -0.10 0.00 0.04 0.00 0.00 61.00 61.59 1xm7 s PRO 176 Cb -0.10 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 1xm7 s PRO 176 CO 0.05 -1.22 0.18 0.42 0.04 0.00 0.00 177.00 176.47 1xm7 s ILE 177 N -3.27 5.41 0.45 0.56 1.01 0.37 -4.85 121.20 120.87 1xm7 s ILE 177 Ca 0.59 0.29 0.07 0.00 0.00 0.00 0.00 60.65 61.60 1xm7 s ILE 177 Cb -0.12 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.84 1xm7 s ILE 177 CO 0.53 0.51 0.25 -0.94 0.00 0.00 0.00 174.94 175.28 1xm7 s SER 178 N -0.23 4.55 0.28 3.58 1.04 -1.26 0.45 113.70 122.11 1xm7 s SER 178 Ca 0.13 -1.10 0.02 0.00 0.48 0.00 0.00 55.95 55.48 1xm7 s SER 178 Cb -0.12 -0.24 0.64 0.00 0.10 0.00 0.00 66.02 66.40 1xm7 s SER 178 CO 0.02 -0.70 1.73 -0.33 0.98 0.00 0.00 173.24 174.95 1xm7 h GLU 179 N 1.22 0.52 -1.30 4.02 5.08 -1.95 0.12 114.58 122.29 1xm7 h GLU 179 Ca -0.41 -0.03 0.38 0.00 -1.00 0.00 0.00 59.36 58.29 1xm7 h GLU 179 Cb 1.27 -0.12 -0.08 0.00 0.50 0.00 0.00 28.75 30.32 1xm7 h GLU 179 CO 0.66 0.35 0.90 0.00 -1.00 0.00 0.00 179.01 179.91 1xm7 h ARG 180 N 0.54 0.11 0.00 2.33 3.08 -1.95 0.90 114.38 119.38 1xm7 h ARG 180 Ca 0.52 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.56 1xm7 h ARG 180 Cb 0.86 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.89 1xm7 h ARG 180 CO -0.44 0.07 -0.24 1.49 -1.07 0.00 0.00 179.97 179.78 1xm7 h GLU 181 N 0.11 0.00 0.00 0.04 4.81 -1.15 -3.03 114.58 115.36 1xm7 h GLU 181 Ca 0.68 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.68 1xm7 h GLU 181 Cb 2.38 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 31.71 1xm7 h GLU 181 CO -0.16 0.00 -2.12 1.51 -0.73 0.00 0.00 179.01 177.51 1xm7 n ILE 182 N -2.81 0.96 0.27 2.32 3.06 0.29 -3.84 119.36 119.61 1xm7 n ILE 182 Ca 0.03 -0.73 0.14 0.00 -2.50 0.00 0.00 62.75 59.70 1xm7 n ILE 182 Cb 0.51 -0.38 0.40 0.00 0.54 0.00 0.00 39.64 40.72 1xm7 n ILE 182 CO 0.00 0.00 0.00 0.44 -2.50 0.00 0.00 176.55 174.49 1xm7 h ASP 183 N 0.00 0.00 0.23 9.51 3.45 -0.91 -1.68 116.42 127.03 1xm7 h ASP 183 Ca -0.33 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.13 1xm7 h ASP 183 Cb 1.78 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.55 1xm7 h ASP 183 CO 0.02 0.00 0.00 1.17 -1.57 0.00 0.00 179.24 178.86 1xm7 n LYS 184 N -3.02 0.37 -0.18 3.56 4.81 -1.14 -1.79 118.16 120.77 1xm7 n LYS 184 Ca 0.03 0.08 0.07 0.00 -0.87 0.00 0.00 58.31 57.62 1xm7 n LYS 184 Cb 0.42 -1.50 0.10 0.00 0.02 0.00 0.00 35.03 34.07 1xm7 n LYS 184 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1xm7 n LEU 185 N -1.19 1.73 -0.24 3.14 4.77 -0.63 -5.08 117.00 119.49 1xm7 n LEU 185 Ca 0.10 -2.52 0.03 0.00 -0.03 0.00 0.00 56.01 53.59 1xm7 n LEU 185 Cb 0.12 -0.31 0.02 0.00 -2.33 0.00 0.00 43.42 40.92 1xm7 n LEU 185 CO 0.13 0.59 0.34 0.00 -1.33 0.00 0.00 177.39 177.12