#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nm2 n GLN 2 N 0.00 3.92 -2.49 2.12 3.00 -1.26 -4.99 117.38 117.67 2nm2 n GLN 2 Ca 0.00 -3.00 -0.29 0.00 -0.01 0.00 0.00 57.00 53.70 2nm2 n GLN 2 Cb 0.00 -2.05 -0.01 0.00 0.00 0.00 0.00 30.24 28.18 2nm2 n GLN 2 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2nm2 s ASP 3 N -1.35 6.33 0.14 1.08 1.01 -1.26 -5.07 116.67 117.55 2nm2 s ASP 3 Ca 0.48 1.12 -0.16 0.00 0.71 0.00 0.00 52.55 54.71 2nm2 s ASP 3 Cb 0.38 -2.33 0.03 0.00 1.01 0.00 0.00 42.92 42.01 2nm2 s ASP 3 CO 0.13 -0.61 0.40 0.42 0.21 0.00 0.00 175.17 175.72 2nm2 s THR 4 N -2.76 0.07 -0.10 -1.27 -4.23 -1.26 -3.41 115.64 102.68 2nm2 s THR 4 Ca 0.51 -0.67 0.01 0.00 -1.18 0.00 0.00 61.69 60.35 2nm2 s THR 4 Cb -0.10 -1.27 0.02 0.00 1.34 0.00 0.00 72.50 72.48 2nm2 s THR 4 CO 0.43 -0.30 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.48 2nm2 s ILE 5 N -3.83 1.16 0.34 2.99 1.01 0.15 -4.86 121.20 118.16 2nm2 s ILE 5 Ca 0.05 -0.42 0.08 0.00 0.00 0.00 0.00 60.65 60.36 2nm2 s ILE 5 Cb 0.02 -1.11 -0.07 0.00 0.01 0.00 0.00 42.46 41.31 2nm2 s ILE 5 CO -0.10 0.38 -0.06 0.72 0.00 0.00 0.00 174.94 175.88 2nm2 s PHE 6 N 1.25 2.29 -0.20 3.97 -0.12 -1.26 -0.18 117.98 123.73 2nm2 s PHE 6 Ca -0.03 -0.60 -0.05 0.00 -0.05 0.00 0.00 56.93 56.20 2nm2 s PHE 6 Cb -0.14 -1.37 0.10 0.00 -0.63 0.00 0.00 43.02 40.98 2nm2 s PHE 6 CO -0.04 0.46 0.39 -0.51 -0.05 0.00 0.00 175.22 175.47 2nm2 s LEU 7 N -3.58 -0.61 0.21 -1.99 1.02 -0.07 -4.99 118.68 108.68 2nm2 s LEU 7 Ca 0.32 0.72 0.11 0.00 0.02 0.00 0.00 54.13 55.31 2nm2 s LEU 7 Cb 0.04 1.21 -0.05 0.00 0.02 0.00 0.00 46.19 47.42 2nm2 s LEU 7 CO 0.16 -0.25 -0.23 -0.54 0.02 0.00 0.00 176.35 175.50 2nm2 s LYS 8 N 2.57 1.55 -0.93 1.70 1.02 -1.26 -0.29 119.74 124.10 2nm2 s LYS 8 Ca 0.03 -1.58 0.00 0.00 0.02 0.00 0.00 55.97 54.44 2nm2 s LYS 8 Cb -0.13 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.37 2nm2 s LYS 8 CO -0.13 0.38 0.00 0.41 -0.92 0.00 0.00 175.35 175.09 2nm2 n GLY 9 N 0.05 0.98 3.59 -3.33 0.00 -1.19 -4.91 105.19 100.38 2nm2 n GLY 9 Ca -0.11 -0.25 -0.45 0.00 0.00 0.00 0.00 46.02 45.21 2nm2 n GLY 9 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2nm2 n MET 10 N -1.82 1.98 -3.60 1.61 2.81 0.46 -4.74 117.12 113.82 2nm2 n MET 10 Ca -0.09 0.61 -0.37 0.00 -1.81 0.00 0.00 57.70 56.04 2nm2 n MET 10 Cb 0.40 -2.97 -0.10 0.00 -0.71 0.00 0.00 33.22 29.85 2nm2 n MET 10 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2nm2 s ARG 11 N 5.68 4.04 -0.01 0.03 0.52 -1.26 0.31 118.95 128.27 2nm2 s ARG 11 Ca 0.99 -0.22 0.03 0.00 -0.52 0.00 0.00 55.73 56.02 2nm2 s ARG 11 Cb -0.50 -3.58 -0.01 0.00 0.52 0.00 0.00 34.95 31.38 2nm2 s ARG 11 CO 0.42 -0.04 -0.10 -0.06 0.02 0.00 0.00 175.30 175.54 2nm2 s PHE 12 N 1.34 0.91 -0.92 -0.53 0.08 -0.79 -4.98 117.98 113.09 2nm2 s PHE 12 Ca 0.09 -0.18 -0.14 0.00 0.12 0.00 0.00 56.93 56.83 2nm2 s PHE 12 Cb -0.14 -0.58 0.22 0.00 -0.57 0.00 0.00 43.02 41.94 2nm2 s PHE 12 CO 0.07 -0.01 0.91 -0.47 -0.10 0.00 0.00 175.22 175.62 2nm2 s TYR 13 N -0.26 3.78 0.16 0.36 6.14 -1.26 -0.76 117.35 125.51 2nm2 s TYR 13 Ca 0.04 -2.07 0.04 0.00 0.64 0.00 0.00 57.07 55.72 2nm2 s TYR 13 Cb -0.04 -3.90 -0.04 0.00 0.42 0.00 0.00 41.96 38.40 2nm2 s TYR 13 CO -0.00 -1.06 0.18 0.20 0.64 0.00 0.00 175.55 175.51 2nm2 s GLY 14 N 2.19 1.69 -0.57 8.97 0.00 -1.00 -4.86 107.32 113.74 2nm2 s GLY 14 Ca 0.23 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.79 2nm2 s GLY 14 CO -0.08 -1.18 1.96 -1.72 0.00 0.00 0.00 173.10 172.08 2nm2 n TYR 15 N -0.45 3.12 -1.52 1.90 4.02 -1.26 -2.34 117.16 120.63 2nm2 n TYR 15 Ca -0.08 -2.56 -0.24 0.00 -0.01 0.00 0.00 57.90 55.01 2nm2 n TYR 15 Cb 0.55 -1.23 0.18 0.00 -0.02 0.00 0.00 39.34 38.82 2nm2 n TYR 15 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2nm2 n HIS 16 N -1.00 -3.92 0.00 -0.72 8.25 -1.26 -3.17 115.22 113.39 2nm2 n HIS 16 Ca 0.61 -0.92 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 2nm2 n HIS 16 Cb 1.04 -0.87 0.00 0.00 1.12 0.00 0.00 29.99 31.29 2nm2 n HIS 16 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2nm2 n GLY 17 N -2.49 3.49 0.13 -1.41 0.00 -0.36 -3.75 105.19 100.79 2nm2 n GLY 17 Ca 0.13 -1.61 -0.10 0.00 0.00 0.00 0.00 46.02 44.44 2nm2 n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2nm2 h ALA 18 N 0.00 0.31 -2.36 4.61 0.00 -1.78 -3.40 119.26 116.63 2nm2 h ALA 18 Ca 0.00 -0.08 -0.52 0.00 0.00 0.00 0.00 54.91 54.32 2nm2 h ALA 18 Cb 0.00 -0.09 0.16 0.00 0.00 0.00 0.00 17.79 17.85 2nm2 h ALA 18 CO 0.00 -0.15 0.30 -1.17 0.00 0.00 0.00 179.25 178.23 2nm2 s LEU 19 N -9.96 3.03 0.13 0.00 2.96 -1.26 -4.97 118.68 108.60 2nm2 s LEU 19 Ca -0.13 2.04 -0.02 0.00 -0.22 0.00 0.00 54.13 55.80 2nm2 s LEU 19 Cb 0.08 -4.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.13 2nm2 s LEU 19 CO 0.71 -2.43 1.31 0.77 -1.32 0.00 0.00 176.35 175.38 2nm2 h SER 20 N -1.20 0.44 -0.06 3.68 4.64 -1.99 -3.29 113.55 115.76 2nm2 h SER 20 Ca -0.44 -0.36 -0.11 0.00 -0.47 0.00 0.00 61.79 60.41 2nm2 h SER 20 Cb 1.25 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 2nm2 h SER 20 CO 0.48 1.18 -0.30 0.00 -0.87 0.00 0.00 176.83 177.32 2nm2 h ALA 21 N 0.79 1.01 0.50 5.18 0.00 -1.96 -2.72 119.26 122.06 2nm2 h ALA 21 Ca -0.08 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 2nm2 h ALA 21 Cb 1.60 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2nm2 h ALA 21 CO 0.16 0.59 -0.40 0.93 0.00 0.00 0.00 179.25 180.53 2nm2 h GLU 22 N 0.45 -0.84 0.00 0.00 5.08 -1.87 0.29 114.58 117.69 2nm2 h GLU 22 Ca 0.06 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2nm2 h GLU 22 Cb 0.74 0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.18 2nm2 h GLU 22 CO 0.06 -0.56 0.00 0.27 -1.00 0.00 0.00 179.01 177.78 2nm2 n ASN 23 N -4.85 0.00 -0.04 1.42 0.23 -1.19 0.35 115.26 111.18 2nm2 n ASN 23 Ca -0.10 0.06 -0.15 0.00 -0.53 0.00 0.00 54.58 53.86 2nm2 n ASN 23 Cb 0.38 -0.19 -0.14 0.00 -2.08 0.00 0.00 39.78 37.75 2nm2 n ASN 23 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 2nm2 n GLU 24 N -1.19 0.69 -0.01 -3.83 2.13 -0.07 -4.59 120.64 113.77 2nm2 n GLU 24 Ca 0.04 0.22 -0.00 0.00 0.66 0.00 0.00 57.16 58.07 2nm2 n GLU 24 Cb 0.04 -1.68 -0.02 0.00 0.27 0.00 0.00 31.44 30.04 2nm2 n GLU 24 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 2nm2 n ILE 25 N -3.19 0.13 -0.75 6.31 5.41 0.82 -5.06 119.36 123.03 2nm2 n ILE 25 Ca -0.29 -0.10 0.10 0.00 1.00 0.00 0.00 62.75 63.46 2nm2 n ILE 25 Cb 1.06 -0.52 -0.03 0.00 -0.71 0.00 0.00 39.64 39.44 2nm2 n ILE 25 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2nm2 n GLY 26 N 2.69 -2.11 3.53 7.39 0.00 1.09 -5.01 105.19 112.75 2nm2 n GLY 26 Ca -0.03 -1.31 -0.05 0.00 0.00 0.00 0.00 46.02 44.63 2nm2 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2nm2 n GLN 27 N -3.23 0.81 -3.16 1.61 10.64 -0.99 -4.99 117.38 118.08 2nm2 n GLN 27 Ca -0.01 -1.69 -0.39 0.00 -1.83 0.00 0.00 57.00 53.08 2nm2 n GLN 27 Cb 0.35 2.19 -0.06 0.00 -0.86 0.00 0.00 30.24 31.86 2nm2 n GLN 27 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 2nm2 s ILE 28 N -2.13 4.85 -0.11 -0.39 -1.09 -1.26 -2.38 121.20 118.69 2nm2 s ILE 28 Ca 0.18 1.34 0.02 0.00 -2.23 0.00 0.00 60.65 59.96 2nm2 s ILE 28 Cb -0.04 -3.97 -0.01 0.00 -1.58 0.00 0.00 42.46 36.86 2nm2 s ILE 28 CO 0.08 0.42 -0.19 -0.36 -1.23 0.00 0.00 174.94 173.65 2nm2 s PHE 29 N -0.23 2.66 -0.61 3.97 0.40 0.06 -4.54 117.98 119.69 2nm2 s PHE 29 Ca 0.33 -0.81 -0.07 0.00 -0.60 0.00 0.00 56.93 55.78 2nm2 s PHE 29 Cb -0.19 -1.75 0.16 0.00 0.51 0.00 0.00 43.02 41.75 2nm2 s PHE 29 CO 0.19 -0.29 0.47 0.15 0.70 0.00 0.00 175.22 176.44 2nm2 s LYS 30 N 0.25 2.73 0.06 0.44 1.02 -0.10 -1.89 119.74 122.25 2nm2 s LYS 30 Ca -0.13 -2.25 -0.29 0.00 0.02 0.00 0.00 55.97 53.33 2nm2 s LYS 30 Cb -0.16 -3.93 -0.05 0.00 -0.52 0.00 0.00 37.83 33.16 2nm2 s LYS 30 CO 0.07 -1.20 0.91 0.08 -0.92 0.00 0.00 175.35 174.29 2nm2 s VAL 31 N 0.48 4.68 -0.26 3.17 1.01 0.15 -2.40 120.40 127.23 2nm2 s VAL 31 Ca 0.13 1.94 0.02 0.00 0.00 0.00 0.00 61.98 64.08 2nm2 s VAL 31 Cb -0.20 -4.26 0.06 0.00 0.00 0.00 0.00 36.38 31.98 2nm2 s VAL 31 CO -0.04 0.28 -0.09 -1.81 0.00 0.00 0.00 175.10 173.45 2nm2 s ASP 32 N 0.31 4.31 -0.23 3.32 1.01 0.45 -0.40 116.67 125.44 2nm2 s ASP 32 Ca 0.46 -1.38 -0.05 0.00 0.71 0.00 0.00 52.55 52.28 2nm2 s ASP 32 Cb -0.22 -1.46 -0.02 0.00 1.01 0.00 0.00 42.92 42.24 2nm2 s ASP 32 CO 0.27 -0.21 0.01 0.68 0.21 0.00 0.00 175.17 176.13 2nm2 s VAL 33 N 1.17 3.81 -0.18 -1.27 -7.23 0.60 -1.48 120.40 115.82 2nm2 s VAL 33 Ca -0.07 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 59.76 2nm2 s VAL 33 Cb -0.20 -2.75 0.01 0.00 0.56 0.00 0.00 36.38 34.00 2nm2 s VAL 33 CO -0.06 0.39 -0.17 -0.89 -0.31 0.00 0.00 175.10 174.06 2nm2 s THR 34 N 1.50 2.38 -0.11 5.32 2.01 0.58 -0.90 115.64 126.42 2nm2 s THR 34 Ca 0.06 -0.84 -0.02 0.00 0.31 0.00 0.00 61.69 61.20 2nm2 s THR 34 Cb -0.15 -2.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.32 2nm2 s THR 34 CO 0.00 0.52 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.65 2nm2 s LEU 35 N 1.20 3.31 -0.40 4.42 1.43 0.75 0.12 118.68 129.49 2nm2 s LEU 35 Ca 0.02 -0.03 -0.15 0.00 -1.03 0.00 0.00 54.13 52.94 2nm2 s LEU 35 Cb -0.14 -1.77 0.02 0.00 0.03 0.00 0.00 46.19 44.33 2nm2 s LEU 35 CO -0.08 0.27 0.29 -0.75 0.23 0.00 0.00 176.35 176.31 2nm2 s LYS 36 N -0.25 3.02 -0.12 1.70 2.20 0.31 0.33 119.74 126.93 2nm2 s LYS 36 Ca 0.04 -0.98 -0.08 0.00 -0.36 0.00 0.00 55.97 54.59 2nm2 s LYS 36 Cb -0.13 -3.96 0.04 0.00 -1.51 0.00 0.00 37.83 32.28 2nm2 s LYS 36 CO 0.02 -0.72 0.30 0.08 -0.36 0.00 0.00 175.35 174.68 2nm2 s VAL 37 N 1.68 -0.02 0.14 4.02 1.01 -1.22 -0.24 120.40 125.77 2nm2 s VAL 37 Ca 0.05 0.07 -0.34 0.00 0.00 0.00 0.00 61.98 61.75 2nm2 s VAL 37 Cb -0.19 -0.44 -0.14 0.00 0.00 0.00 0.00 36.38 35.61 2nm2 s VAL 37 CO 0.10 0.03 1.57 0.47 0.00 0.00 0.00 175.10 177.26 2nm2 n ASP 38 N 3.60 2.93 -0.36 3.32 8.00 -1.26 -4.35 116.55 128.43 2nm2 n ASP 38 Ca -0.19 1.08 0.04 0.00 0.71 0.00 0.00 54.79 56.44 2nm2 n ASP 38 Cb 0.56 -1.39 0.04 0.00 -0.02 0.00 0.00 41.12 40.30 2nm2 n ASP 38 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2nm2 n LEU 39 N 3.50 1.76 -0.04 0.64 4.77 -1.26 -4.71 117.00 121.66 2nm2 n LEU 39 Ca 0.17 -1.02 -0.08 0.00 -0.03 0.00 0.00 56.01 55.05 2nm2 n LEU 39 Cb 0.28 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.34 2nm2 n LEU 39 CO 0.64 0.35 0.81 0.28 -1.33 0.00 0.00 177.39 178.14 2nm2 h SER 40 N 1.73 -0.26 0.86 -1.43 0.02 -1.94 0.24 113.55 112.77 2nm2 h SER 40 Ca 0.00 0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.98 2nm2 h SER 40 Cb 0.37 0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.07 2nm2 h SER 40 CO 0.00 -0.10 -0.49 -0.08 -1.14 0.00 0.00 176.83 175.02 2nm2 h GLU 41 N -0.03 -1.21 -0.55 3.45 4.57 -1.90 0.40 114.58 119.31 2nm2 h GLU 41 Ca 0.11 0.08 0.11 0.00 -1.18 0.00 0.00 59.36 58.48 2nm2 h GLU 41 Cb 0.19 0.27 -0.11 0.00 -0.16 0.00 0.00 28.75 28.95 2nm2 h GLU 41 CO -0.24 -0.81 -0.16 0.00 -1.18 0.00 0.00 179.01 176.63 2nm2 h ALA 42 N -1.21 0.32 -0.25 2.92 0.00 -1.67 0.39 119.26 119.76 2nm2 h ALA 42 Ca -0.12 0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2nm2 h ALA 42 Cb 0.99 0.46 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 2nm2 h ALA 42 CO 0.14 -0.46 -0.34 0.78 0.00 0.00 0.00 179.25 179.37 2nm2 h GLY 43 N -0.03 0.60 0.96 0.00 0.00 -0.45 0.97 103.07 105.13 2nm2 h GLY 43 Ca 0.26 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 2nm2 h GLY 43 CO -0.58 0.50 0.19 -0.09 0.00 0.00 0.00 176.54 176.56 2nm2 h ARG 44 N 0.47 0.49 0.00 4.80 2.43 0.19 -3.37 114.38 119.38 2nm2 h ARG 44 Ca 0.05 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2nm2 h ARG 44 Cb 0.81 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2nm2 h ARG 44 CO 0.07 0.41 -0.02 1.79 -1.51 0.00 0.00 179.97 180.70 2nm2 h THR 45 N 0.44 0.00 0.00 0.20 1.35 -0.18 -3.51 112.91 111.21 2nm2 h THR 45 Ca 0.12 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 2nm2 h THR 45 Cb 0.06 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.48 2nm2 h THR 45 CO -0.02 0.00 0.00 -0.67 -0.25 0.00 0.00 175.52 174.58 2nm2 n ASP 46 N -2.34 0.00 -3.69 5.36 2.03 0.34 -5.07 116.55 113.17 2nm2 n ASP 46 Ca -0.00 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.19 2nm2 n ASP 46 Cb 0.01 0.00 -0.12 0.00 -0.72 0.00 0.00 41.12 40.29 2nm2 n ASP 46 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 2nm2 s ASN 47 N -1.21 -0.23 0.52 1.67 0.02 -1.25 -5.05 114.94 109.41 2nm2 s ASN 47 Ca 0.00 0.73 0.37 0.00 -1.02 0.00 0.00 52.86 52.94 2nm2 s ASN 47 Cb 0.00 0.71 1.54 0.00 0.02 0.00 0.00 41.25 43.52 2nm2 s ASN 47 CO 0.00 -0.20 1.73 1.62 0.02 0.00 0.00 177.10 180.27 2nm2 h VAL 48 N 5.89 0.30 0.00 1.60 3.04 -1.94 0.57 116.25 125.71 2nm2 h VAL 48 Ca -0.31 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.36 2nm2 h VAL 48 Cb 1.15 0.25 0.00 0.00 -2.01 0.00 0.00 31.29 30.68 2nm2 h VAL 48 CO 0.27 0.01 0.01 0.00 -1.01 0.00 0.00 177.57 176.85 2nm2 n ILE 49 N -4.22 1.42 0.68 3.17 0.13 -1.26 0.68 119.36 119.95 2nm2 n ILE 49 Ca 0.31 0.36 0.07 0.00 -1.10 0.00 0.00 62.75 62.40 2nm2 n ILE 49 Cb 1.40 -1.36 -0.09 0.00 -0.84 0.00 0.00 39.64 38.75 2nm2 n ILE 49 CO 0.00 0.00 0.00 0.47 2.80 0.00 0.00 176.55 179.82 2nm2 n ASP 50 N -1.35 0.75 0.00 9.51 8.00 0.20 -5.01 116.55 128.65 2nm2 n ASP 50 Ca 0.00 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.69 2nm2 n ASP 50 Cb 0.01 1.04 0.00 0.00 -0.02 0.00 0.00 41.12 42.15 2nm2 n ASP 50 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2nm2 n THR 51 N -1.40 0.00 -3.91 -3.53 5.66 0.21 -4.14 114.28 107.17 2nm2 n THR 51 Ca 0.03 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.74 2nm2 n THR 51 Cb 0.25 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.86 2nm2 n THR 51 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2nm2 s VAL 52 N 0.79 1.22 -0.78 1.08 1.01 -1.26 -4.95 120.40 117.51 2nm2 s VAL 52 Ca 0.00 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 61.01 2nm2 s VAL 52 Cb 0.00 -1.37 -0.16 0.00 0.00 0.00 0.00 36.38 34.84 2nm2 s VAL 52 CO 0.00 0.15 2.54 1.57 0.00 0.00 0.00 175.10 179.35 2nm2 n HIS 53 N 4.84 0.90 0.32 5.22 -0.00 -1.26 -4.74 115.22 120.50 2nm2 n HIS 53 Ca -0.13 0.23 0.15 0.00 0.46 0.00 0.00 57.72 58.44 2nm2 n HIS 53 Cb 0.48 -2.37 0.67 0.00 -0.12 0.00 0.00 29.99 28.64 2nm2 n HIS 53 CO 0.00 0.00 0.00 0.10 0.46 0.00 0.00 176.34 176.90 2nm2 h TYR 54 N 15.05 0.00 -0.13 1.57 -0.00 -1.97 -0.17 116.97 131.32 2nm2 h TYR 54 Ca -0.12 0.00 -0.12 0.00 0.00 0.00 0.00 58.73 58.49 2nm2 h TYR 54 Cb 1.27 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.98 2nm2 h TYR 54 CO 1.06 0.00 -0.44 0.78 -0.00 0.00 0.00 178.16 179.56 2nm2 h GLY 55 N 1.63 0.33 0.75 0.10 0.00 -2.00 -2.64 103.07 101.25 2nm2 h GLY 55 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 2nm2 h GLY 55 CO 0.00 0.30 -0.05 -2.09 0.00 0.00 0.00 176.54 174.70 2nm2 h GLU 56 N 0.25 -0.13 -1.02 4.80 4.57 -1.41 -2.91 114.58 118.73 2nm2 h GLU 56 Ca 0.02 0.01 0.25 0.00 -1.18 0.00 0.00 59.36 58.46 2nm2 h GLU 56 Cb 0.88 0.03 -0.11 0.00 -0.16 0.00 0.00 28.75 29.40 2nm2 h GLU 56 CO 0.07 0.13 0.63 0.28 -1.18 0.00 0.00 179.01 178.94 2nm2 h VAL 57 N -0.39 0.55 0.08 0.32 2.07 -1.25 -1.12 116.25 116.52 2nm2 h VAL 57 Ca -0.01 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2nm2 h VAL 57 Cb 0.32 -0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.08 2nm2 h VAL 57 CO 0.02 0.09 -0.08 0.15 0.02 0.00 0.00 177.57 177.77 2nm2 h PHE 58 N 0.52 -0.23 -0.97 1.57 3.57 -1.27 0.37 116.94 120.50 2nm2 h PHE 58 Ca 0.61 0.00 0.28 0.00 3.53 0.00 0.00 57.97 62.40 2nm2 h PHE 58 Cb 1.32 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 40.11 2nm2 h PHE 58 CO -0.00 -0.11 0.88 0.93 -2.23 0.00 0.00 178.31 177.78 2nm2 h GLU 59 N -0.17 0.00 0.05 1.11 4.39 -1.23 1.27 114.58 120.01 2nm2 h GLU 59 Ca -0.01 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.60 2nm2 h GLU 59 Cb 0.14 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.80 2nm2 h GLU 59 CO -0.01 0.00 -0.39 0.93 -1.16 0.00 0.00 179.01 178.38 2nm2 h GLU 60 N 0.00 0.18 -0.16 2.33 4.39 -0.43 -1.73 114.58 119.15 2nm2 h GLU 60 Ca 0.46 -0.26 -0.14 0.00 0.34 0.00 0.00 59.36 59.76 2nm2 h GLU 60 Cb 2.23 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.96 2nm2 h GLU 60 CO -0.00 1.07 -0.50 0.28 -1.16 0.00 0.00 179.01 178.69 2nm2 h VAL 61 N -0.59 1.33 0.00 3.13 2.07 0.37 -3.00 116.25 119.55 2nm2 h VAL 61 Ca -0.06 -1.74 -0.07 0.00 0.82 0.00 0.00 66.70 65.64 2nm2 h VAL 61 Cb 1.25 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 2nm2 h VAL 61 CO 0.07 0.53 -0.35 0.50 0.02 0.00 0.00 177.57 178.35 2nm2 h LYS 62 N 0.35 0.00 -0.01 1.57 3.11 0.13 -2.50 116.57 119.23 2nm2 h LYS 62 Ca 0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.85 2nm2 h LYS 62 Cb 1.01 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.24 2nm2 h LYS 62 CO 0.09 0.35 0.00 -1.13 -2.81 0.00 0.00 179.45 175.95 2nm2 n SER 63 N -3.54 0.11 -0.05 4.20 3.41 -0.65 -2.34 113.62 114.76 2nm2 n SER 63 Ca -0.00 -1.36 -0.05 0.00 -0.26 0.00 0.00 58.87 57.20 2nm2 n SER 63 Cb 0.49 -0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 64.35 2nm2 n SER 63 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 2nm2 n ILE 64 N -0.76 0.70 0.02 -1.33 2.08 -0.96 -3.97 119.36 115.14 2nm2 n ILE 64 Ca 0.16 -0.43 -0.14 0.00 0.56 0.00 0.00 62.75 62.90 2nm2 n ILE 64 Cb 0.09 -0.73 -0.14 0.00 -0.75 0.00 0.00 39.64 38.11 2nm2 n ILE 64 CO 0.00 0.00 0.00 0.24 0.56 0.00 0.00 176.55 177.35 2nm2 h MET 65 N 0.00 0.15 -0.01 0.38 2.86 -1.46 -3.30 114.93 113.55 2nm2 h MET 65 Ca -0.28 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 57.10 2nm2 h MET 65 Cb 1.62 0.10 0.00 0.00 0.06 0.00 0.00 31.60 33.38 2nm2 h MET 65 CO 0.01 0.91 -0.26 0.39 1.06 0.00 0.00 176.91 179.03 2nm2 n GLU 66 N -3.31 0.97 0.00 1.72 1.02 -0.99 -4.23 120.64 115.82 2nm2 n GLU 66 Ca -0.20 -0.60 0.00 0.00 -0.02 0.00 0.00 57.16 56.34 2nm2 n GLU 66 Cb 1.04 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.97 2nm2 n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2nm2 n GLY 67 N 1.33 -0.43 3.69 0.62 0.00 -1.24 -4.94 105.19 104.22 2nm2 n GLY 67 Ca 0.12 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 2nm2 n GLY 67 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2nm2 s LYS 68 N 0.00 4.27 1.13 1.61 2.36 -1.26 -4.95 119.74 122.91 2nm2 s LYS 68 Ca 0.00 2.04 -0.13 0.00 -2.55 0.00 0.00 55.97 55.33 2nm2 s LYS 68 Cb 0.00 -3.55 0.25 0.00 -1.05 0.00 0.00 37.83 33.47 2nm2 s LYS 68 CO 0.00 -0.59 0.91 0.00 1.55 0.00 0.00 175.35 177.22 2nm2 n ALA 69 N 5.30 -2.77 -3.53 3.13 0.00 -1.26 -4.99 120.51 116.39 2nm2 n ALA 69 Ca 0.13 -1.10 0.03 0.00 0.00 0.00 0.00 53.44 52.50 2nm2 n ALA 69 Cb 0.43 -1.97 0.02 0.00 0.00 0.00 0.00 19.45 17.93 2nm2 n ALA 69 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2nm2 n VAL 70 N -4.81 0.00 0.00 0.00 0.24 -1.26 -5.01 118.33 107.49 2nm2 n VAL 70 Ca 0.04 -0.45 0.00 0.00 -2.04 0.00 0.00 64.34 61.89 2nm2 n VAL 70 Cb 0.54 0.53 0.00 0.00 -1.47 0.00 0.00 33.84 33.45 2nm2 n VAL 70 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2nm2 n ASN 71 N -1.14 0.00 -4.75 -1.34 5.03 -1.26 -1.22 115.26 110.57 2nm2 n ASN 71 Ca -0.03 0.11 -0.41 0.00 0.87 0.00 0.00 54.58 55.12 2nm2 n ASN 71 Cb 0.36 -0.24 -0.03 0.00 -1.02 0.00 0.00 39.78 38.85 2nm2 n ASN 71 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2nm2 s LEU 72 N -3.26 4.48 0.34 3.41 1.02 -1.26 -3.35 118.68 120.05 2nm2 s LEU 72 Ca 0.00 2.36 0.13 0.00 0.02 0.00 0.00 54.13 56.64 2nm2 s LEU 72 Cb 0.00 -3.62 0.59 0.00 0.02 0.00 0.00 46.19 43.17 2nm2 s LEU 72 CO 0.00 -0.32 1.73 -0.07 0.02 0.00 0.00 176.35 177.71 2nm2 h LEU 73 N 4.26 0.00 -1.92 1.79 3.38 -1.99 -1.96 115.31 118.87 2nm2 h LEU 73 Ca -0.46 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.54 2nm2 h LEU 73 Cb 1.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2nm2 h LEU 73 CO 0.70 0.47 0.13 -0.33 0.09 0.00 0.00 178.44 179.50 2nm2 h GLU 74 N 0.00 0.10 0.55 1.13 3.07 -1.96 0.05 114.58 117.52 2nm2 h GLU 74 Ca -0.00 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.82 2nm2 h GLU 74 Cb 0.86 -0.02 0.01 0.00 -0.84 0.00 0.00 28.75 28.75 2nm2 h GLU 74 CO 0.06 0.07 -0.27 1.25 -1.40 0.00 0.00 179.01 178.72 2nm2 h HIS 75 N 0.10 -0.69 -1.37 4.33 2.76 -1.75 0.29 115.15 118.83 2nm2 h HIS 75 Ca 0.09 -0.02 0.40 0.00 -2.20 0.00 0.00 60.37 58.64 2nm2 h HIS 75 Cb 0.21 0.23 -0.07 0.00 1.55 0.00 0.00 27.41 29.33 2nm2 h HIS 75 CO -0.00 -0.43 0.96 -0.07 -1.30 0.00 0.00 177.93 177.09 2nm2 h LEU 76 N -0.75 0.10 0.18 0.26 3.38 -1.25 0.88 115.31 118.11 2nm2 h LEU 76 Ca -0.08 0.03 -0.25 0.00 0.09 0.00 0.00 57.88 57.67 2nm2 h LEU 76 Cb 0.57 0.02 0.03 0.00 0.09 0.00 0.00 40.66 41.37 2nm2 h LEU 76 CO 0.12 -0.02 -1.09 0.00 0.09 0.00 0.00 178.44 177.55 2nm2 h ALA 77 N 1.37 -0.11 -0.33 1.53 0.00 -0.69 -3.01 119.26 118.03 2nm2 h ALA 77 Ca 0.70 -0.76 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 2nm2 h ALA 77 Cb 2.56 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 20.47 2nm2 h ALA 77 CO -0.11 0.52 0.08 1.49 0.00 0.00 0.00 179.25 181.23 2nm2 h GLU 78 N -0.11 0.53 -0.80 0.00 4.57 0.42 1.19 114.58 120.39 2nm2 h GLU 78 Ca -0.19 -0.13 0.04 0.00 -1.18 0.00 0.00 59.36 57.90 2nm2 h GLU 78 Cb 1.85 -0.07 -0.05 0.00 -0.16 0.00 0.00 28.75 30.32 2nm2 h GLU 78 CO 0.21 0.59 0.50 -0.09 -1.18 0.00 0.00 179.01 179.04 2nm2 h ARG 79 N 0.38 0.94 0.00 1.92 2.43 0.28 0.52 114.38 120.85 2nm2 h ARG 79 Ca 0.10 -0.06 -0.24 0.00 -0.81 0.00 0.00 59.98 58.98 2nm2 h ARG 79 Cb 0.29 -0.21 0.02 0.00 -0.42 0.00 0.00 29.97 29.65 2nm2 h ARG 79 CO 0.00 0.62 -0.94 0.82 -1.51 0.00 0.00 179.97 178.96 2nm2 h ILE 80 N 0.97 1.31 -0.92 1.20 2.04 -1.36 -1.75 117.51 119.01 2nm2 h ILE 80 Ca 0.32 -2.21 0.06 0.00 1.00 0.00 0.00 64.86 64.03 2nm2 h ILE 80 Cb 0.04 2.44 -0.06 0.00 -0.74 0.00 0.00 36.82 38.50 2nm2 h ILE 80 CO -0.12 0.67 0.58 0.00 0.00 0.00 0.00 178.15 179.28 2nm2 h ALA 81 N 0.38 1.25 0.10 1.87 0.00 0.20 -1.72 119.26 121.35 2nm2 h ALA 81 Ca -0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 2nm2 h ALA 81 Cb 1.61 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 19.13 2nm2 h ALA 81 CO 0.19 0.37 -0.05 -0.97 0.00 0.00 0.00 179.25 178.78 2nm2 h ASN 82 N 1.07 -0.12 -0.90 0.00 -0.00 -0.01 -2.67 115.58 112.96 2nm2 h ASN 82 Ca 0.39 -0.41 0.21 0.00 -0.00 0.00 0.00 56.30 56.49 2nm2 h ASN 82 Cb 0.13 0.03 -0.12 0.00 -0.00 0.00 0.00 38.32 38.36 2nm2 h ASN 82 CO -0.16 0.52 0.42 -0.09 -0.00 0.00 0.00 177.43 178.12 2nm2 h ARG 83 N -0.93 0.44 -0.02 6.67 9.65 -1.23 0.61 114.38 129.58 2nm2 h ARG 83 Ca -0.01 -0.03 -0.24 0.00 -1.10 0.00 0.00 59.98 58.60 2nm2 h ARG 83 Cb 0.52 -0.10 0.01 0.00 -1.39 0.00 0.00 29.97 29.01 2nm2 h ARG 83 CO 0.02 0.29 -0.96 0.82 2.80 0.00 0.00 179.97 182.94 2nm2 h ILE 84 N 0.45 1.34 0.07 1.20 1.08 -1.43 -2.82 117.51 117.40 2nm2 h ILE 84 Ca 0.55 -2.32 -0.00 0.00 -0.39 0.00 0.00 64.86 62.70 2nm2 h ILE 84 Cb 1.02 2.35 0.00 0.00 -3.07 0.00 0.00 36.82 37.12 2nm2 h ILE 84 CO -0.50 0.71 -0.03 0.78 -0.69 0.00 0.00 178.15 178.41 2nm2 h ASN 85 N 0.32 -0.08 0.21 1.72 2.35 -0.83 -3.15 115.58 116.12 2nm2 h ASN 85 Ca -0.09 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 2nm2 h ASN 85 Cb 1.60 0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.99 2nm2 h ASN 85 CO 0.18 0.03 -0.10 0.77 -1.65 0.00 0.00 177.43 176.66 2nm2 h SER 86 N -0.18 -0.24 0.00 5.81 4.64 -1.01 -3.10 113.55 119.47 2nm2 h SER 86 Ca -0.01 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2nm2 h SER 86 Cb 0.15 0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2nm2 h SER 86 CO 0.02 -0.17 0.05 0.00 -0.87 0.00 0.00 176.83 175.86 2nm2 n GLN 87 N -2.75 0.00 -3.54 4.77 1.13 -1.07 -4.14 117.38 111.78 2nm2 n GLN 87 Ca -0.03 0.13 -0.15 0.00 -1.94 0.00 0.00 57.00 55.01 2nm2 n GLN 87 Cb 0.11 -1.55 -0.13 0.00 0.11 0.00 0.00 30.24 28.78 2nm2 n GLN 87 CO 0.00 0.00 0.00 0.71 -1.44 0.00 0.00 177.06 176.33 2nm2 s TYR 88 N -2.09 -0.39 -0.61 1.08 1.51 -1.17 -5.01 117.35 110.68 2nm2 s TYR 88 Ca 0.00 0.56 0.24 0.00 -1.01 0.00 0.00 57.07 56.86 2nm2 s TYR 88 Cb 0.00 -0.20 0.34 0.00 -0.11 0.00 0.00 41.96 41.98 2nm2 s TYR 88 CO 0.00 -0.52 1.33 -0.97 -1.11 0.00 0.00 175.55 174.28 2nm2 h ASN 89 N 8.29 0.00 0.62 2.29 -1.24 -1.72 -3.25 115.58 120.57 2nm2 h ASN 89 Ca -0.16 -0.18 -0.05 0.00 0.71 0.00 0.00 56.30 56.62 2nm2 h ASN 89 Cb 1.14 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.18 2nm2 h ASN 89 CO 0.22 0.09 -0.22 0.03 -1.29 0.00 0.00 177.43 176.26 2nm2 h ARG 90 N 0.00 0.00 -6.03 6.67 3.08 -1.95 -3.40 114.38 112.75 2nm2 h ARG 90 Ca 0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.56 2nm2 h ARG 90 Cb 0.77 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.78 2nm2 h ARG 90 CO 0.00 0.22 1.26 0.08 -1.07 0.00 0.00 179.97 180.46 2nm2 s VAL 91 N -3.92 3.44 0.02 2.04 1.01 -1.23 -4.61 120.40 117.15 2nm2 s VAL 91 Ca -0.01 0.18 -0.27 0.00 0.00 0.00 0.00 61.98 61.87 2nm2 s VAL 91 Cb 0.12 -4.15 -0.16 0.00 0.00 0.00 0.00 36.38 32.19 2nm2 s VAL 91 CO 0.63 -1.11 1.21 0.24 0.00 0.00 0.00 175.10 176.08 2nm2 h MET 92 N 13.65 -0.74 -6.38 2.72 2.86 -0.84 -3.38 114.93 122.83 2nm2 h MET 92 Ca -0.23 0.05 -0.61 0.00 -2.06 0.00 0.00 59.70 56.86 2nm2 h MET 92 Cb 1.13 0.17 -0.23 0.00 0.06 0.00 0.00 31.60 32.72 2nm2 h MET 92 CO 1.23 -0.43 -0.84 -2.00 1.06 0.00 0.00 176.91 175.93 2nm2 s GLU 93 N -4.84 1.30 -0.07 1.72 2.12 -1.01 0.17 118.70 118.09 2nm2 s GLU 93 Ca -0.15 -1.16 0.01 0.00 0.36 0.00 0.00 54.97 54.04 2nm2 s GLU 93 Cb 0.02 -1.59 0.02 0.00 0.26 0.00 0.00 34.13 32.84 2nm2 s GLU 93 CO 0.49 0.38 -0.09 0.99 -0.54 0.00 0.00 175.26 176.49 2nm2 s THR 94 N -1.03 0.96 -0.33 -1.70 2.01 0.29 0.11 115.64 115.95 2nm2 s THR 94 Ca 0.09 -0.34 -0.01 0.00 0.31 0.00 0.00 61.69 61.74 2nm2 s THR 94 Cb -0.10 -0.93 0.07 0.00 0.01 0.00 0.00 72.50 71.55 2nm2 s THR 94 CO 0.04 0.33 0.05 -0.54 -0.69 0.00 0.00 174.62 173.81 2nm2 s LYS 95 N 1.04 2.19 -0.22 4.92 1.02 0.31 -0.22 119.74 128.78 2nm2 s LYS 95 Ca -0.08 -1.49 -0.06 0.00 0.02 0.00 0.00 55.97 54.36 2nm2 s LYS 95 Cb -0.14 -3.27 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 2nm2 s LYS 95 CO -0.01 -0.77 0.03 0.08 -0.92 0.00 0.00 175.35 173.76 2nm2 s VAL 96 N 1.17 4.13 -0.05 3.17 1.01 -1.03 -0.31 120.40 128.50 2nm2 s VAL 96 Ca -0.00 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 61.77 2nm2 s VAL 96 Cb -0.20 -2.90 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2nm2 s VAL 96 CO -0.03 0.39 -0.16 -0.60 0.00 0.00 0.00 175.10 174.70 2nm2 s ARG 97 N 1.24 1.80 -0.09 2.72 3.52 -0.55 -2.56 118.95 125.03 2nm2 s ARG 97 Ca 0.04 -0.56 -0.00 0.00 -0.13 0.00 0.00 55.73 55.07 2nm2 s ARG 97 Cb -0.15 -1.53 0.02 0.00 -1.56 0.00 0.00 34.95 31.74 2nm2 s ARG 97 CO 0.02 0.18 -0.05 0.42 -0.81 0.00 0.00 175.30 175.07 2nm2 s ILE 98 N 0.20 0.75 0.01 4.11 1.01 -1.17 -0.41 121.20 125.70 2nm2 s ILE 98 Ca -0.07 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.47 2nm2 s ILE 98 Cb -0.13 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 41.50 2nm2 s ILE 98 CO 0.03 0.31 -0.04 -0.89 0.00 0.00 0.00 174.94 174.35 2nm2 s THR 99 N 1.61 3.86 -0.37 2.92 2.01 -1.01 -3.29 115.64 121.37 2nm2 s THR 99 Ca 0.01 -0.75 0.02 0.00 0.31 0.00 0.00 61.69 61.28 2nm2 s THR 99 Cb -0.13 -2.72 0.11 0.00 0.01 0.00 0.00 72.50 69.78 2nm2 s THR 99 CO -0.05 0.35 0.13 -0.54 -0.69 0.00 0.00 174.62 173.82 2nm2 s LYS 100 N -1.59 1.17 0.46 4.92 1.02 0.53 -0.92 119.74 125.33 2nm2 s LYS 100 Ca 0.19 -1.66 0.29 0.00 0.02 0.00 0.00 55.97 54.81 2nm2 s LYS 100 Cb -0.11 -2.53 0.96 0.00 -0.52 0.00 0.00 37.83 35.63 2nm2 s LYS 100 CO 0.10 -1.03 1.82 0.93 -0.92 0.00 0.00 175.35 176.25 2nm2 h GLU 101 N 7.49 0.00 -0.50 1.68 5.08 -1.80 -2.58 114.58 123.96 2nm2 h GLU 101 Ca -0.07 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.93 2nm2 h GLU 101 Cb 0.98 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 29.96 2nm2 h GLU 101 CO 0.51 0.00 -0.61 0.09 -1.00 0.00 0.00 179.01 177.99 2nm2 n ASN 102 N -2.94 3.87 -4.80 1.42 3.02 -1.26 -4.65 115.26 109.91 2nm2 n ASN 102 Ca 0.02 -3.81 -0.32 0.00 -0.03 0.00 0.00 54.58 50.45 2nm2 n ASN 102 Cb 0.38 -0.44 0.03 0.00 -0.61 0.00 0.00 39.78 39.13 2nm2 n ASN 102 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2nm2 s PRO 103 N -3.47 3.15 -0.85 3.52 0.04 -1.25 -4.88 135.00 131.25 2nm2 s PRO 103 Ca 0.47 1.14 -0.25 0.00 0.04 0.00 0.00 61.00 62.41 2nm2 s PRO 103 Cb 0.40 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.91 2nm2 s PRO 103 CO 0.00 -0.94 1.80 -1.25 0.04 0.00 0.00 177.00 176.65 2nm2 s PRO 104 N -4.36 2.78 -0.23 0.56 0.04 -1.26 -4.84 135.00 127.69 2nm2 s PRO 104 Ca 0.62 -0.23 -0.03 0.00 0.04 0.00 0.00 61.00 61.40 2nm2 s PRO 104 Cb -0.16 -4.91 0.12 0.00 0.04 0.00 0.00 34.50 29.59 2nm2 s PRO 104 CO 0.43 -2.97 0.33 0.42 0.04 0.00 0.00 177.00 175.25 2nm2 s ILE 105 N 8.74 -0.51 -0.33 0.56 1.01 -1.26 -5.11 121.20 124.30 2nm2 s ILE 105 Ca 0.63 -0.07 -0.34 0.00 0.00 0.00 0.00 60.65 60.87 2nm2 s ILE 105 Cb -0.07 -0.76 -0.10 0.00 0.01 0.00 0.00 42.46 41.54 2nm2 s ILE 105 CO 0.03 -0.13 2.19 -2.65 0.00 0.00 0.00 174.94 174.38 2nm2 n PRO 106 N 5.35 1.20 0.00 2.79 -0.02 -1.26 -4.79 135.00 138.27 2nm2 n PRO 106 Ca -0.04 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.76 2nm2 n PRO 106 Cb 0.50 -2.57 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2nm2 n PRO 106 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nm2 n GLY 107 N 6.45 3.70 3.81 -1.23 0.00 -1.26 -5.11 105.19 111.54 2nm2 n GLY 107 Ca 0.40 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 2nm2 n GLY 107 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2nm2 s HIS 108 N -2.00 3.52 -0.24 1.61 3.76 -1.26 -5.05 115.29 115.64 2nm2 s HIS 108 Ca 0.00 0.49 -0.31 0.00 -0.15 0.00 0.00 55.06 55.09 2nm2 s HIS 108 Cb 0.00 -2.08 0.16 0.00 1.11 0.00 0.00 32.58 31.77 2nm2 s HIS 108 CO 0.00 0.52 1.25 1.52 -0.85 0.00 0.00 174.74 177.18 2nm2 s TYR 109 N -0.37 -0.12 -0.74 1.40 1.13 -1.26 -5.05 117.35 112.34 2nm2 s TYR 109 Ca 0.13 0.17 0.26 0.00 -1.41 0.00 0.00 57.07 56.22 2nm2 s TYR 109 Cb -0.12 0.49 0.67 0.00 -1.10 0.00 0.00 41.96 41.91 2nm2 s TYR 109 CO 0.02 -0.14 1.62 -0.25 -2.51 0.00 0.00 175.55 174.30 2nm2 n ASP 110 N 0.37 0.69 0.00 -0.18 8.00 -1.26 -5.00 116.55 119.17 2nm2 n ASP 110 Ca -0.02 0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.86 2nm2 n ASP 110 Cb 0.58 -0.39 0.00 0.00 -0.02 0.00 0.00 41.12 41.29 2nm2 n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2nm2 n GLY 111 N 1.34 3.63 3.45 0.44 0.00 -1.26 -4.59 105.19 108.20 2nm2 n GLY 111 Ca 0.05 -0.90 -0.09 0.00 0.00 0.00 0.00 46.02 45.08 2nm2 n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2nm2 s VAL 112 N -2.00 0.04 -4.05 1.61 -7.23 -0.97 -4.91 120.40 102.89 2nm2 s VAL 112 Ca 0.00 -1.10 0.00 0.00 -1.81 0.00 0.00 61.98 59.07 2nm2 s VAL 112 Cb 0.00 -1.74 0.00 0.00 0.56 0.00 0.00 36.38 35.20 2nm2 s VAL 112 CO 0.00 -0.19 0.00 0.61 -0.31 0.00 0.00 175.10 175.21 2nm2 n GLY 113 N -0.29 -0.55 3.23 2.32 0.00 -1.26 0.20 105.19 108.84 2nm2 n GLY 113 Ca -0.08 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 2nm2 n GLY 113 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2nm2 s ILE 114 N -3.97 0.22 -0.00 -0.61 -5.25 -1.21 -5.04 121.20 105.34 2nm2 s ILE 114 Ca 0.00 -1.98 0.02 0.00 -0.99 0.00 0.00 60.65 57.69 2nm2 s ILE 114 Cb 0.00 -2.43 -0.00 0.00 2.95 0.00 0.00 42.46 42.98 2nm2 s ILE 114 CO 0.00 -0.12 -0.06 -0.70 -1.79 0.00 0.00 174.94 172.27 2nm2 s GLU 115 N -4.09 0.48 0.01 0.37 2.12 -1.26 -3.04 118.70 113.30 2nm2 s GLU 115 Ca 0.35 -0.21 0.01 0.00 0.36 0.00 0.00 54.97 55.48 2nm2 s GLU 115 Cb 0.07 -0.46 -0.01 0.00 0.26 0.00 0.00 34.13 33.99 2nm2 s GLU 115 CO 0.10 0.12 -0.05 0.96 -0.54 0.00 0.00 175.26 175.86 2nm2 s ILE 116 N -0.12 0.33 -0.14 -3.70 -4.36 -1.06 -5.05 121.20 107.09 2nm2 s ILE 116 Ca 0.02 -0.56 0.01 0.00 -0.26 0.00 0.00 60.65 59.87 2nm2 s ILE 116 Cb -0.02 -0.35 0.00 0.00 1.25 0.00 0.00 42.46 43.34 2nm2 s ILE 116 CO -0.00 -0.16 -0.18 -0.69 0.24 0.00 0.00 174.94 174.15 2nm2 s VAL 117 N -0.70 2.46 0.13 8.37 1.01 -1.26 -2.47 120.40 127.94 2nm2 s VAL 117 Ca -0.05 -0.85 0.10 0.00 0.00 0.00 0.00 61.98 61.19 2nm2 s VAL 117 Cb -0.05 -2.02 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2nm2 s VAL 117 CO -0.00 0.53 -0.25 -0.13 0.00 0.00 0.00 175.10 175.25 2nm2 s ARG 118 N 0.74 1.32 0.46 2.72 1.81 0.69 -4.97 118.95 121.72 2nm2 s ARG 118 Ca -0.07 -1.31 0.06 0.00 -1.72 0.00 0.00 55.73 52.69 2nm2 s ARG 118 Cb -0.16 -1.72 -0.03 0.00 -0.45 0.00 0.00 34.95 32.60 2nm2 s ARG 118 CO 0.01 0.40 0.22 -1.83 -0.68 0.00 0.00 175.30 173.41 2nm2 s GLU 119 N -2.09 2.24 0.11 3.54 -1.05 -1.26 0.10 118.70 120.30 2nm2 s GLU 119 Ca 0.12 -1.94 -0.12 0.00 -0.15 0.00 0.00 54.97 52.88 2nm2 s GLU 119 Cb -0.10 -1.97 -0.06 0.00 -0.44 0.00 0.00 34.13 31.56 2nm2 s GLU 119 CO 0.06 -0.26 0.48 1.21 0.95 0.00 0.00 175.26 177.69 2nm2 s ASN 120 N -4.00 6.74 0.00 0.83 3.84 0.13 -4.85 114.94 117.63 2nm2 s ASN 120 Ca 0.35 0.94 0.00 0.00 0.21 0.00 0.00 52.86 54.37 2nm2 s ASN 120 Cb 0.02 -2.24 0.00 0.00 -0.55 0.00 0.00 41.25 38.48 2nm2 s ASN 120 CO 0.20 0.14 0.33 0.29 -2.79 0.00 0.00 177.10 175.27