#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dp3 n SER 10 N 0.00 0.19 -4.60 1.69 2.88 -1.26 -4.72 113.62 107.79 3dp3 n SER 10 Ca 0.00 0.02 -0.37 0.00 -1.33 0.00 0.00 58.87 57.20 3dp3 n SER 10 Cb 0.00 -0.06 -0.10 0.00 -0.75 0.00 0.00 64.21 63.30 3dp3 n SER 10 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 3dp3 s GLN 11 N -2.00 3.95 -0.07 -1.46 -0.21 -1.26 -3.71 119.66 114.90 3dp3 s GLN 11 Ca 0.00 -0.33 0.04 0.00 0.02 0.00 0.00 55.36 55.09 3dp3 s GLN 11 Cb 0.00 -3.50 0.00 0.00 1.00 0.00 0.00 33.01 30.51 3dp3 s GLN 11 CO 0.00 -0.02 -0.19 -0.06 -2.12 0.00 0.00 175.29 172.89 3dp3 s PHE 12 N 1.27 2.02 0.56 0.91 0.40 -0.72 -5.00 117.98 117.42 3dp3 s PHE 12 Ca 0.07 -0.73 0.07 0.00 -0.60 0.00 0.00 56.93 55.73 3dp3 s PHE 12 Cb -0.14 -1.38 0.10 0.00 0.51 0.00 0.00 43.02 42.11 3dp3 s PHE 12 CO 0.06 -0.29 0.77 1.19 0.70 0.00 0.00 175.22 177.64 3dp3 n PHE 13 N 3.45 -2.51 -0.28 0.36 3.01 -1.26 -0.37 117.46 119.86 3dp3 n PHE 13 Ca -0.20 -1.84 0.15 0.00 1.01 0.00 0.00 57.45 56.57 3dp3 n PHE 13 Cb 0.52 -0.54 0.42 0.00 -0.01 0.00 0.00 39.48 39.88 3dp3 n PHE 13 CO 0.00 0.00 0.00 0.97 1.01 0.00 0.00 176.76 178.74 3dp3 h ILE 14 N -0.07 0.74 -0.73 4.37 6.09 -1.91 -0.54 117.51 125.45 3dp3 h ILE 14 Ca -0.26 -0.21 -0.01 0.00 -1.37 0.00 0.00 64.86 63.01 3dp3 h ILE 14 Cb 1.12 0.09 -0.03 0.00 0.47 0.00 0.00 36.82 38.47 3dp3 h ILE 14 CO 0.34 0.11 0.41 -0.33 -3.07 0.00 0.00 178.15 175.61 3dp3 h GLU 15 N 0.60 1.02 -0.20 2.19 3.07 -1.94 -0.89 114.58 118.42 3dp3 h GLU 15 Ca 0.49 -0.12 -0.13 0.00 -0.50 0.00 0.00 59.36 59.10 3dp3 h GLU 15 Cb 0.94 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 3dp3 h GLU 15 CO -0.23 0.75 -0.38 0.45 -1.40 0.00 0.00 179.01 178.20 3dp3 h HIS 16 N 1.01 0.77 -0.84 4.33 3.86 -1.52 -3.03 115.15 119.73 3dp3 h HIS 16 Ca 0.26 -0.28 0.03 0.00 -1.16 0.00 0.00 60.37 59.23 3dp3 h HIS 16 Cb 0.03 -0.15 -0.05 0.00 1.06 0.00 0.00 27.41 28.30 3dp3 h HIS 16 CO -0.00 1.03 0.54 0.82 0.86 0.00 0.00 177.93 181.17 3dp3 h ILE 17 N 0.30 1.13 0.00 2.45 2.04 -0.98 -1.24 117.51 121.20 3dp3 h ILE 17 Ca 0.01 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 3dp3 h ILE 17 Cb 0.98 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3dp3 h ILE 17 CO 0.09 0.19 -0.05 -0.07 0.00 0.00 0.00 178.15 178.30 3dp3 h LEU 18 N 1.04 0.00 0.00 1.44 3.38 -1.13 -0.78 115.31 119.27 3dp3 h LEU 18 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3dp3 h LEU 18 Cb 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3dp3 h LEU 18 CO -0.12 0.05 -0.16 1.56 0.09 0.00 0.00 178.44 179.86 3dp3 h GLN 19 N 0.00 0.00 0.00 1.13 4.20 -1.11 -3.38 115.11 115.95 3dp3 h GLN 19 Ca -0.00 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.35 3dp3 h GLN 19 Cb 0.10 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.82 3dp3 h GLN 19 CO 0.01 0.00 -2.29 -0.89 -0.67 0.00 0.00 178.83 174.98 3dp3 n ILE 20 N -2.69 1.29 -3.25 2.54 2.08 -0.85 -4.48 119.36 114.01 3dp3 n ILE 20 Ca 0.04 -0.44 -0.38 0.00 0.56 0.00 0.00 62.75 62.54 3dp3 n ILE 20 Cb 0.49 -1.47 -0.06 0.00 -0.75 0.00 0.00 39.64 37.85 3dp3 n ILE 20 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 3dp3 s LEU 21 N -6.64 4.46 0.34 1.39 1.43 -0.36 -4.86 118.68 114.44 3dp3 s LEU 21 Ca -0.31 1.27 0.24 0.00 -1.03 0.00 0.00 54.13 54.30 3dp3 s LEU 21 Cb 0.09 -3.11 0.49 0.00 0.03 0.00 0.00 46.19 43.69 3dp3 s LEU 21 CO 0.48 0.20 1.63 1.55 0.23 0.00 0.00 176.35 180.44 3dp3 h PRO 22 N 4.13 0.00 -6.85 1.29 0.13 -1.88 -3.44 132.00 125.39 3dp3 h PRO 22 Ca -0.49 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.08 3dp3 h PRO 22 Cb 1.21 0.00 0.13 0.00 0.13 0.00 0.00 31.00 32.46 3dp3 h PRO 22 CO 0.64 0.00 0.50 0.72 -0.23 0.00 0.00 178.00 179.63 3dp3 n HIS 23 N -2.75 2.13 -4.30 1.56 8.25 -1.26 -5.03 115.22 113.83 3dp3 n HIS 23 Ca 0.04 0.49 -0.19 0.00 -0.26 0.00 0.00 57.72 57.80 3dp3 n HIS 23 Cb 0.49 -2.37 -0.08 0.00 1.12 0.00 0.00 29.99 29.15 3dp3 n HIS 23 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3dp3 s ARG 24 N -2.27 1.73 0.31 -0.41 1.81 -1.26 -4.68 118.95 114.19 3dp3 s ARG 24 Ca 0.62 -2.01 -0.29 0.00 -1.72 0.00 0.00 55.73 52.33 3dp3 s ARG 24 Cb -0.50 0.25 -0.11 0.00 -0.45 0.00 0.00 34.95 34.15 3dp3 s ARG 24 CO 0.57 -0.62 1.50 -0.47 -0.68 0.00 0.00 175.30 175.60 3dp3 s TYR 25 N -3.47 2.80 -0.68 -0.53 6.14 -1.26 0.98 117.35 121.32 3dp3 s TYR 25 Ca 0.39 1.02 -0.02 0.00 0.64 0.00 0.00 57.07 59.10 3dp3 s TYR 25 Cb 0.03 -3.96 0.44 0.00 0.42 0.00 0.00 41.96 38.89 3dp3 s TYR 25 CO 0.26 -3.02 2.04 -0.35 0.64 0.00 0.00 175.55 175.12 3dp3 n PRO 26 N 1.56 2.69 -0.05 4.97 -0.04 -1.26 -4.93 135.00 137.95 3dp3 n PRO 26 Ca 0.05 -3.31 0.01 0.00 -0.04 0.00 0.00 63.50 60.22 3dp3 n PRO 26 Cb 0.39 -2.29 0.02 0.00 -0.04 0.00 0.00 33.50 31.58 3dp3 n PRO 26 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3dp3 n MET 27 N -0.89 1.67 -3.16 0.54 2.81 0.28 -4.94 117.12 113.43 3dp3 n MET 27 Ca 0.62 -1.34 -0.44 0.00 -1.81 0.00 0.00 57.70 54.74 3dp3 n MET 27 Cb 0.63 -0.89 -0.06 0.00 -0.71 0.00 0.00 33.22 32.19 3dp3 n MET 27 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 3dp3 s LEU 28 N -0.91 5.10 -0.43 4.03 2.96 -0.87 -4.64 118.68 123.91 3dp3 s LEU 28 Ca 0.05 -1.06 0.04 0.00 -0.22 0.00 0.00 54.13 52.94 3dp3 s LEU 28 Cb 0.04 -2.40 0.49 0.00 0.50 0.00 0.00 46.19 44.82 3dp3 s LEU 28 CO 0.00 -0.94 1.61 0.18 -1.32 0.00 0.00 176.35 175.89 3dp3 n LEU 29 N 6.17 5.83 -3.65 -0.68 4.77 -1.26 -4.89 117.00 123.29 3dp3 n LEU 29 Ca -0.07 -4.26 -0.22 0.00 -0.03 0.00 0.00 56.01 51.42 3dp3 n LEU 29 Cb 0.45 -0.67 -0.18 0.00 -2.33 0.00 0.00 43.42 40.69 3dp3 n LEU 29 CO 0.55 1.60 -0.34 -0.69 -1.33 0.00 0.00 177.39 177.18 3dp3 s VAL 30 N -4.24 -0.09 -0.08 4.08 1.01 -1.26 -4.62 120.40 115.21 3dp3 s VAL 30 Ca 0.55 0.20 0.14 0.00 0.00 0.00 0.00 61.98 62.87 3dp3 s VAL 30 Cb 0.45 -0.32 -0.20 0.00 0.00 0.00 0.00 36.38 36.31 3dp3 s VAL 30 CO 0.02 0.01 0.68 0.47 0.00 0.00 0.00 175.10 176.28 3dp3 n ASP 31 N 5.29 0.81 -3.60 3.32 8.00 -0.08 -4.95 116.55 125.34 3dp3 n ASP 31 Ca -0.05 0.38 -0.13 0.00 0.71 0.00 0.00 54.79 55.70 3dp3 n ASP 31 Cb 0.50 0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.61 3dp3 n ASP 31 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3dp3 s ARG 32 N -2.70 0.76 -0.25 -1.24 3.52 -1.01 -3.21 118.95 114.82 3dp3 s ARG 32 Ca -0.04 0.57 -0.07 0.00 -0.13 0.00 0.00 55.73 56.05 3dp3 s ARG 32 Cb 0.08 0.36 -0.03 0.00 -1.56 0.00 0.00 34.95 33.81 3dp3 s ARG 32 CO 0.82 -0.16 0.07 0.42 -0.81 0.00 0.00 175.30 175.65 3dp3 s ILE 33 N -0.29 4.33 -0.64 4.11 -1.09 0.50 -1.27 121.20 126.85 3dp3 s ILE 33 Ca -0.02 -0.17 0.20 0.00 -2.23 0.00 0.00 60.65 58.43 3dp3 s ILE 33 Cb -0.03 -3.03 -0.24 0.00 -1.58 0.00 0.00 42.46 37.58 3dp3 s ILE 33 CO 0.01 0.34 0.71 0.35 -1.23 0.00 0.00 174.94 175.12 3dp3 n THR 34 N 4.93 0.00 -3.65 2.92 -2.24 -0.46 -1.76 114.28 114.02 3dp3 n THR 34 Ca -0.16 -0.17 -0.09 0.00 -2.27 0.00 0.00 64.05 61.36 3dp3 n THR 34 Cb 0.51 0.70 -0.08 0.00 -2.10 0.00 0.00 70.33 69.37 3dp3 n THR 34 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3dp3 s GLU 35 N -3.02 0.68 -0.18 -0.78 2.12 -0.79 -4.68 118.70 112.05 3dp3 s GLU 35 Ca 0.03 1.10 -0.06 0.00 0.36 0.00 0.00 54.97 56.39 3dp3 s GLU 35 Cb 0.14 0.17 0.09 0.00 0.26 0.00 0.00 34.13 34.79 3dp3 s GLU 35 CO 0.81 -0.14 0.38 -1.17 -0.54 0.00 0.00 175.26 174.61 3dp3 s LEU 36 N 1.31 -0.57 -0.30 2.70 0.20 -1.25 -0.66 118.68 120.11 3dp3 s LEU 36 Ca -0.08 0.90 0.01 0.00 0.69 0.00 0.00 54.13 55.65 3dp3 s LEU 36 Cb -0.05 1.21 0.07 0.00 -0.43 0.00 0.00 46.19 46.98 3dp3 s LEU 36 CO -0.14 -0.23 -0.01 -1.10 -0.29 0.00 0.00 176.35 174.57 3dp3 s GLN 37 N 2.57 2.19 0.07 1.98 -0.21 -0.56 -4.75 119.66 120.95 3dp3 s GLN 37 Ca -0.01 -1.43 -0.37 0.00 0.02 0.00 0.00 55.36 53.56 3dp3 s GLN 37 Cb -0.12 -3.13 -0.18 0.00 1.00 0.00 0.00 33.01 30.58 3dp3 s GLN 37 CO -0.12 -0.69 1.18 0.00 -2.12 0.00 0.00 175.29 173.54 3dp3 n ALA 38 N 4.50 -2.12 -0.81 6.09 0.00 -1.26 -0.77 120.51 126.14 3dp3 n ALA 38 Ca -0.10 0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3dp3 n ALA 38 Cb 0.42 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.95 3dp3 n ALA 38 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dp3 n ASN 39 N 2.03 -2.11 0.01 0.00 3.02 -1.26 -4.78 115.26 112.17 3dp3 n ASN 39 Ca 0.19 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.74 3dp3 n ASN 39 Cb 0.15 -1.98 -0.00 0.00 -0.61 0.00 0.00 39.78 37.34 3dp3 n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dp3 n GLN 40 N -1.31 0.00 -3.65 3.52 6.02 0.05 -4.70 117.38 117.31 3dp3 n GLN 40 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.89 3dp3 n GLN 40 Cb 0.14 -0.12 -0.03 0.00 1.02 0.00 0.00 30.24 31.24 3dp3 n GLN 40 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 3dp3 s LYS 41 N -1.23 1.33 -0.03 -1.09 -2.85 -1.04 -0.82 119.74 114.01 3dp3 s LYS 41 Ca -0.00 -0.75 -0.02 0.00 -1.00 0.00 0.00 55.97 54.20 3dp3 s LYS 41 Cb 0.00 0.54 0.01 0.00 -2.06 0.00 0.00 37.83 36.31 3dp3 s LYS 41 CO 0.00 -0.57 0.06 -1.50 0.10 0.00 0.00 175.35 173.45 3dp3 s ILE 42 N -3.83 -0.01 -0.11 3.79 2.07 0.50 -1.50 121.20 122.11 3dp3 s ILE 42 Ca 0.06 0.02 0.02 0.00 -1.41 0.00 0.00 60.65 59.34 3dp3 s ILE 42 Cb -0.01 -0.10 0.01 0.00 0.13 0.00 0.00 42.46 42.49 3dp3 s ILE 42 CO -0.06 0.01 -0.17 -0.69 -1.91 0.00 0.00 174.94 172.12 3dp3 s VAL 43 N 0.16 1.63 0.36 4.00 1.01 0.16 -1.55 120.40 126.17 3dp3 s VAL 43 Ca -0.01 -0.73 -0.04 0.00 0.00 0.00 0.00 61.98 61.20 3dp3 s VAL 43 Cb -0.02 -1.47 0.01 0.00 0.00 0.00 0.00 36.38 34.90 3dp3 s VAL 43 CO -0.00 0.47 0.53 0.00 0.00 0.00 0.00 175.10 176.10 3dp3 s ALA 44 N 0.90 0.55 0.20 5.51 0.00 -0.71 -1.36 121.76 126.87 3dp3 s ALA 44 Ca -0.08 -1.41 -0.22 0.00 0.00 0.00 0.00 51.96 50.25 3dp3 s ALA 44 Cb -0.15 1.07 0.05 0.00 0.00 0.00 0.00 23.12 24.09 3dp3 s ALA 44 CO -0.01 -0.82 0.64 1.52 0.00 0.00 0.00 175.76 177.09 3dp3 s TYR 45 N -2.87 -0.41 -0.05 0.00 -0.85 -0.40 0.62 117.35 113.40 3dp3 s TYR 45 Ca 0.28 0.11 0.02 0.00 -0.52 0.00 0.00 57.07 56.96 3dp3 s TYR 45 Cb -0.01 0.61 0.02 0.00 0.38 0.00 0.00 41.96 42.96 3dp3 s TYR 45 CO 0.19 -0.99 -0.07 0.21 -1.52 0.00 0.00 175.55 173.37 3dp3 s LYS 46 N -3.81 1.07 0.29 -3.49 2.20 0.19 -0.91 119.74 115.28 3dp3 s LYS 46 Ca 0.05 -0.21 -0.28 0.00 -0.36 0.00 0.00 55.97 55.17 3dp3 s LYS 46 Cb -0.03 -0.99 -0.09 0.00 -1.51 0.00 0.00 37.83 35.21 3dp3 s LYS 46 CO -0.06 -0.03 0.96 -0.80 -0.36 0.00 0.00 175.35 175.07 3dp3 s ASN 47 N 0.75 7.43 -0.22 1.43 0.01 -1.26 -1.64 114.94 121.44 3dp3 s ASN 47 Ca -0.12 1.93 -0.05 0.00 -0.71 0.00 0.00 52.86 53.91 3dp3 s ASN 47 Cb -0.14 -2.60 -0.02 0.00 0.41 0.00 0.00 41.25 38.90 3dp3 s ASN 47 CO 0.01 0.00 0.01 -0.63 -1.51 0.00 0.00 177.10 174.99 3dp3 s ILE 48 N -1.39 3.94 0.12 0.60 -1.09 -0.40 -4.93 121.20 118.04 3dp3 s ILE 48 Ca 0.46 -0.31 0.07 0.00 -2.23 0.00 0.00 60.65 58.64 3dp3 s ILE 48 Cb -0.23 -2.80 -0.04 0.00 -1.58 0.00 0.00 42.46 37.81 3dp3 s ILE 48 CO 0.29 0.40 -0.16 0.28 -1.23 0.00 0.00 174.94 174.52 3dp3 s THR 49 N 1.30 1.43 0.32 2.92 -1.32 -1.26 -0.08 115.64 118.95 3dp3 s THR 49 Ca 0.04 -1.69 0.22 0.00 -1.21 0.00 0.00 61.69 59.06 3dp3 s THR 49 Cb -0.15 -1.54 0.22 0.00 -1.51 0.00 0.00 72.50 69.52 3dp3 s THR 49 CO 0.01 -0.34 1.93 0.15 -2.21 0.00 0.00 174.62 174.16 3dp3 h PHE 50 N 3.62 0.00 0.00 9.09 3.57 -1.96 -3.25 116.94 128.01 3dp3 h PHE 50 Ca -0.41 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.04 3dp3 h PHE 50 Cb 1.20 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.92 3dp3 h PHE 50 CO 0.65 0.22 -0.06 -1.71 -2.23 0.00 0.00 178.31 175.19 3dp3 n ASN 51 N -3.68 3.90 -4.23 0.41 5.15 -1.26 -4.75 115.26 110.80 3dp3 n ASN 51 Ca -0.01 -2.10 -0.30 0.00 -0.60 0.00 0.00 54.58 51.57 3dp3 n ASN 51 Cb 0.34 -0.91 -0.16 0.00 -0.53 0.00 0.00 39.78 38.52 3dp3 n ASN 51 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 3dp3 s GLU 52 N 0.90 2.27 0.25 1.20 2.02 -1.23 -5.05 118.70 119.06 3dp3 s GLU 52 Ca 0.18 -0.82 -0.04 0.00 0.02 0.00 0.00 54.97 54.32 3dp3 s GLU 52 Cb 0.09 -1.96 0.43 0.00 0.10 0.00 0.00 34.13 32.78 3dp3 s GLU 52 CO 0.00 0.36 1.80 0.22 0.02 0.00 0.00 175.26 177.66 3dp3 h ASP 53 N 6.05 0.64 -1.08 -0.19 3.58 -1.94 -2.40 116.42 121.09 3dp3 h ASP 53 Ca -0.33 0.06 0.31 0.00 0.42 0.00 0.00 57.03 57.49 3dp3 h ASP 53 Cb 1.17 -0.06 -0.04 0.00 1.72 0.00 0.00 39.33 42.11 3dp3 h ASP 53 CO 0.47 0.35 0.77 -0.37 -2.88 0.00 0.00 179.24 177.59 3dp3 h VAL 54 N 0.75 0.46 0.00 2.25 -1.51 -1.96 0.20 116.25 116.44 3dp3 h VAL 54 Ca 0.41 -0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.88 3dp3 h VAL 54 Cb 0.43 0.45 0.00 0.00 -2.13 0.00 0.00 31.29 30.04 3dp3 h VAL 54 CO -0.27 0.00 0.00 -0.26 -1.23 0.00 0.00 177.57 175.81 3dp3 h PHE 55 N 0.01 0.00 0.00 5.19 -1.00 -1.70 -2.22 116.94 117.22 3dp3 h PHE 55 Ca 0.52 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.26 3dp3 h PHE 55 Cb 2.04 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 41.60 3dp3 h PHE 55 CO -0.00 0.00 -0.17 -0.91 -1.61 0.00 0.00 178.31 175.62 3dp3 h ASN 56 N 0.00 0.00 0.00 2.17 2.35 -0.77 -3.23 115.58 116.10 3dp3 h ASN 56 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3dp3 h ASN 56 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 3dp3 h ASN 56 CO 0.00 0.17 -0.00 0.61 -1.65 0.00 0.00 177.43 176.56 3dp3 n GLY 57 N -1.03 2.11 2.42 2.83 0.00 -0.94 -4.31 105.19 106.26 3dp3 n GLY 57 Ca -0.02 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.77 3dp3 n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3dp3 n HIS 58 N -0.45 -1.55 -4.24 1.61 -0.00 -0.88 -4.60 115.22 105.11 3dp3 n HIS 58 Ca 0.00 -2.85 -0.14 0.00 -0.00 0.00 0.00 57.72 54.73 3dp3 n HIS 58 Cb 0.30 0.42 -0.10 0.00 -0.00 0.00 0.00 29.99 30.61 3dp3 n HIS 58 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3dp3 s PHE 59 N -0.27 1.24 0.16 1.57 0.40 0.46 -1.33 117.98 120.22 3dp3 s PHE 59 Ca 0.33 -0.77 -0.34 0.00 -0.60 0.00 0.00 56.93 55.56 3dp3 s PHE 59 Cb 0.14 -0.63 -0.15 0.00 0.51 0.00 0.00 43.02 42.88 3dp3 s PHE 59 CO -0.15 0.07 1.36 -2.30 0.70 0.00 0.00 175.22 174.89 3dp3 n PRO 60 N -0.18 1.59 -0.90 0.24 -0.02 -1.26 0.00 135.00 134.46 3dp3 n PRO 60 Ca -0.10 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 3dp3 n PRO 60 Cb 0.61 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.88 3dp3 n PRO 60 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3dp3 n ASN 61 N 2.48 -4.37 -2.95 2.55 3.02 -1.26 -4.83 115.26 109.90 3dp3 n ASN 61 Ca 0.15 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.58 3dp3 n ASN 61 Cb 0.26 -2.92 -0.01 0.00 -0.61 0.00 0.00 39.78 36.50 3dp3 n ASN 61 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 3dp3 n LYS 62 N -0.06 0.57 -1.93 3.52 3.00 0.10 -5.12 118.16 118.25 3dp3 n LYS 62 Ca 0.00 -2.35 -0.42 0.00 -0.00 0.00 0.00 58.31 55.53 3dp3 n LYS 62 Cb 0.34 -1.46 -0.03 0.00 0.00 0.00 0.00 35.03 33.88 3dp3 n LYS 62 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 3dp3 s PRO 63 N 0.32 4.10 -0.08 1.64 0.04 -1.21 -0.40 135.00 139.41 3dp3 s PRO 63 Ca 0.32 2.23 -0.03 0.00 0.04 0.00 0.00 61.00 63.56 3dp3 s PRO 63 Cb 0.11 -4.04 0.04 0.00 0.04 0.00 0.00 34.50 30.65 3dp3 s PRO 63 CO -0.15 -0.95 0.10 0.42 0.04 0.00 0.00 177.00 176.46 3dp3 s ILE 64 N 4.37 -0.15 0.08 0.56 1.01 -0.44 -4.54 121.20 122.08 3dp3 s ILE 64 Ca 0.77 0.29 -0.31 0.00 0.00 0.00 0.00 60.65 61.41 3dp3 s ILE 64 Cb -0.35 -0.28 -0.10 0.00 0.01 0.00 0.00 42.46 41.75 3dp3 s ILE 64 CO 0.32 0.08 1.89 0.33 0.00 0.00 0.00 174.94 177.57 3dp3 n PHE 65 N 5.30 2.56 -1.65 3.97 7.35 0.26 -4.63 117.46 130.63 3dp3 n PHE 65 Ca -0.04 -0.23 -0.47 0.00 -0.76 0.00 0.00 57.45 55.95 3dp3 n PHE 65 Cb 0.50 -2.76 -0.04 0.00 0.35 0.00 0.00 39.48 37.53 3dp3 n PHE 65 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 3dp3 n PRO 66 N 6.42 1.90 -0.37 -7.13 -0.02 -1.26 -4.58 135.00 129.97 3dp3 n PRO 66 Ca 0.19 0.68 0.04 0.00 -2.02 0.00 0.00 63.50 62.39 3dp3 n PRO 66 Cb 0.38 -2.40 0.19 0.00 -0.02 0.00 0.00 33.50 31.66 3dp3 n PRO 66 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3dp3 h GLY 67 N 5.26 1.57 1.99 -1.23 0.00 -1.99 -0.91 103.07 107.76 3dp3 h GLY 67 Ca -0.45 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.37 3dp3 h GLY 67 CO 0.84 0.29 -0.19 -0.39 0.00 0.00 0.00 176.54 177.08 3dp3 h VAL 68 N 1.13 1.14 0.00 4.60 -1.51 -2.00 -1.66 116.25 117.96 3dp3 h VAL 68 Ca 0.45 -0.67 -0.09 0.00 -1.23 0.00 0.00 66.70 65.16 3dp3 h VAL 68 Cb 0.26 1.35 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 3dp3 h VAL 68 CO -0.20 0.19 -0.42 -0.07 -1.23 0.00 0.00 177.57 175.84 3dp3 h LEU 69 N 0.01 0.00 -0.41 4.19 3.38 -1.54 -1.51 115.31 119.43 3dp3 h LEU 69 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3dp3 h LEU 69 Cb 0.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3dp3 h LEU 69 CO 0.03 0.42 0.04 0.40 0.09 0.00 0.00 178.44 179.41 3dp3 h ILE 70 N 0.00 1.25 -0.27 1.22 2.04 -0.93 0.57 117.51 121.39 3dp3 h ILE 70 Ca -0.00 -0.94 -0.05 0.00 1.00 0.00 0.00 64.86 64.86 3dp3 h ILE 70 Cb 1.08 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 3dp3 h ILE 70 CO 0.05 0.32 -0.04 0.58 0.00 0.00 0.00 178.15 179.06 3dp3 h VAL 71 N 0.54 1.19 -0.37 1.67 2.07 -1.25 -0.69 116.25 119.41 3dp3 h VAL 71 Ca 0.12 -0.78 -0.13 0.00 0.82 0.00 0.00 66.70 66.73 3dp3 h VAL 71 Cb 0.42 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3dp3 h VAL 71 CO 0.01 0.26 -0.29 -0.08 0.02 0.00 0.00 177.57 177.50 3dp3 h GLU 72 N 0.41 0.85 -0.52 1.57 4.57 -0.85 0.54 114.58 121.15 3dp3 h GLU 72 Ca 0.09 -0.42 -0.04 0.00 -1.18 0.00 0.00 59.36 57.81 3dp3 h GLU 72 Cb 0.34 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.91 3dp3 h GLU 72 CO 0.01 1.06 0.15 0.78 -1.18 0.00 0.00 179.01 179.83 3dp3 h GLY 73 N 0.65 0.83 1.10 1.92 0.00 -0.33 0.95 103.07 108.20 3dp3 h GLY 73 Ca 0.07 -0.46 -0.15 0.00 0.00 0.00 0.00 47.33 46.80 3dp3 h GLY 73 CO 0.08 0.43 -0.32 -0.33 0.00 0.00 0.00 176.54 176.39 3dp3 h MET 74 N 0.75 0.93 -0.34 4.80 2.86 -0.87 -1.80 114.93 121.26 3dp3 h MET 74 Ca 0.17 -0.46 -0.00 0.00 -2.06 0.00 0.00 59.70 57.35 3dp3 h MET 74 Cb 0.25 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 3dp3 h MET 74 CO -0.01 1.12 0.20 0.00 1.06 0.00 0.00 176.91 179.29 3dp3 h ALA 75 N 0.79 0.44 -0.83 6.32 0.00 -0.11 -0.43 119.26 125.44 3dp3 h ALA 75 Ca 0.07 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dp3 h ALA 75 Cb 0.91 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 3dp3 h ALA 75 CO 0.08 -0.05 0.55 1.96 0.00 0.00 0.00 179.25 181.79 3dp3 h GLN 76 N 0.44 1.09 -0.50 0.00 4.20 -0.74 0.39 115.11 119.99 3dp3 h GLN 76 Ca 0.12 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 58.74 3dp3 h GLN 76 Cb 0.02 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.53 3dp3 h GLN 76 CO -0.02 0.72 0.21 0.77 -0.67 0.00 0.00 178.83 179.84 3dp3 h SER 77 N 1.12 0.68 -0.52 1.46 0.02 -0.87 -1.17 113.55 114.26 3dp3 h SER 77 Ca 0.30 -0.15 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 3dp3 h SER 77 Cb -0.13 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.21 3dp3 h SER 77 CO -0.07 0.64 0.32 1.23 -1.14 0.00 0.00 176.83 177.82 3dp3 h GLY 78 N 0.66 0.73 1.00 -3.77 0.00 -0.43 -1.79 103.07 99.48 3dp3 h GLY 78 Ca 0.17 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.26 3dp3 h GLY 78 CO -0.02 0.22 0.58 -1.33 0.00 0.00 0.00 176.54 176.00 3dp3 h GLY 79 N 0.65 1.24 1.66 4.60 0.00 -0.50 0.89 103.07 111.61 3dp3 h GLY 79 Ca 0.20 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 3dp3 h GLY 79 CO -0.08 0.45 -0.19 -2.75 0.00 0.00 0.00 176.54 173.97 3dp3 h PHE 80 N 1.19 0.44 0.39 5.60 3.04 -0.93 -0.80 116.94 125.85 3dp3 h PHE 80 Ca 0.32 -0.08 -0.02 0.00 3.98 0.00 0.00 57.97 62.18 3dp3 h PHE 80 Cb -0.13 -0.11 0.00 0.00 2.56 0.00 0.00 35.95 38.27 3dp3 h PHE 80 CO -0.01 0.58 -0.19 1.25 -2.02 0.00 0.00 178.31 177.92 3dp3 h LEU 81 N 0.37 -0.44 -0.00 0.59 5.85 -0.40 -1.24 115.31 120.04 3dp3 h LEU 81 Ca 0.06 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3dp3 h LEU 81 Cb 0.55 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 3dp3 h LEU 81 CO 0.04 -0.09 -0.31 0.00 -0.34 0.00 0.00 178.44 177.74 3dp3 h ALA 82 N -0.37 -0.44 -0.02 1.25 0.00 -0.76 0.37 119.26 119.28 3dp3 h ALA 82 Ca -0.05 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.87 3dp3 h ALA 82 Cb 0.54 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 3dp3 h ALA 82 CO 0.09 -0.82 -0.18 0.35 0.00 0.00 0.00 179.25 178.69 3dp3 h PHE 83 N -0.46 -0.47 0.00 0.00 3.57 -1.17 -1.72 116.94 116.69 3dp3 h PHE 83 Ca 0.06 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 3dp3 h PHE 83 Cb 0.55 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 3dp3 h PHE 83 CO -0.34 -0.26 -0.15 1.79 -2.23 0.00 0.00 178.31 177.13 3dp3 h THR 84 N -0.28 0.79 -0.40 4.41 1.35 -1.02 -1.30 112.91 116.46 3dp3 h THR 84 Ca 0.06 -0.57 -0.11 0.00 -0.55 0.00 0.00 66.41 65.25 3dp3 h THR 84 Cb 0.37 1.34 -0.02 0.00 -1.73 0.00 0.00 68.15 68.11 3dp3 h THR 84 CO -0.19 0.14 -0.20 0.28 -0.25 0.00 0.00 175.52 175.31 3dp3 h SER 85 N 0.00 0.78 0.26 5.36 0.02 -0.04 0.16 113.55 120.09 3dp3 h SER 85 Ca -0.00 -0.27 -0.34 0.00 -0.84 0.00 0.00 61.79 60.34 3dp3 h SER 85 Cb 0.32 -0.21 0.04 0.00 0.14 0.00 0.00 62.40 62.69 3dp3 h SER 85 CO 0.02 0.96 -1.50 -0.07 -1.14 0.00 0.00 176.83 175.11 3dp3 h LEU 86 N 0.68 0.85 -0.45 5.07 -0.00 -0.82 -3.42 115.31 117.21 3dp3 h LEU 86 Ca 0.10 -0.92 0.00 0.00 -0.00 0.00 0.00 57.88 57.06 3dp3 h LEU 86 Cb 0.70 -0.28 0.00 0.00 -0.00 0.00 0.00 40.66 41.08 3dp3 h LEU 86 CO 0.05 1.72 0.00 0.79 -0.00 0.00 0.00 178.44 181.00 3dp3 n TRP 87 N -3.71 0.00 -4.51 1.13 8.01 -0.55 -5.13 117.44 112.68 3dp3 n TRP 87 Ca -0.17 -0.01 0.00 0.00 -1.31 0.00 0.00 57.50 56.01 3dp3 n TRP 87 Cb 1.11 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.41 3dp3 n TRP 87 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3dp3 n GLY 88 N -0.01 -0.98 3.56 6.99 0.00 0.56 -4.29 105.19 111.02 3dp3 n GLY 88 Ca 0.00 -1.15 -0.37 0.00 0.00 0.00 0.00 46.02 44.50 3dp3 n GLY 88 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3dp3 s PHE 89 N 0.00 2.19 -0.43 1.61 5.36 -1.26 -4.45 117.98 121.00 3dp3 s PHE 89 Ca 0.00 -0.11 0.02 0.00 -0.96 0.00 0.00 56.93 55.88 3dp3 s PHE 89 Cb 0.00 -4.45 0.14 0.00 -0.34 0.00 0.00 43.02 38.38 3dp3 s PHE 89 CO 0.00 -1.97 0.27 0.34 -1.46 0.00 0.00 175.22 172.40 3dp3 s ASP 90 N 5.88 3.17 0.29 6.13 -1.08 -1.26 -5.00 116.67 124.80 3dp3 s ASP 90 Ca 0.52 -2.66 0.02 0.00 -0.52 0.00 0.00 52.55 49.92 3dp3 s ASP 90 Cb -0.05 -0.79 0.59 0.00 -1.46 0.00 0.00 42.92 41.20 3dp3 s ASP 90 CO 0.01 -0.25 1.84 -0.65 0.52 0.00 0.00 175.17 176.64 3dp3 h PRO 91 N 6.54 0.93 -0.42 4.34 0.11 -1.90 -0.50 132.00 141.11 3dp3 h PRO 91 Ca 0.07 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 3dp3 h PRO 91 Cb 0.92 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.80 3dp3 h PRO 91 CO 0.42 0.62 0.17 1.49 -0.21 0.00 0.00 178.00 180.48 3dp3 h GLU 92 N 0.96 0.63 0.00 1.05 4.81 -1.94 -2.46 114.58 117.63 3dp3 h GLU 92 Ca 0.50 -0.11 -0.14 0.00 -0.13 0.00 0.00 59.36 59.47 3dp3 h GLU 92 Cb 0.52 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 3dp3 h GLU 92 CO -0.26 0.59 -0.67 0.82 -0.73 0.00 0.00 179.01 178.76 3dp3 h ILE 93 N 0.54 1.43 -0.88 2.32 2.04 -1.88 -3.12 117.51 117.96 3dp3 h ILE 93 Ca 0.14 -2.32 0.06 0.00 1.00 0.00 0.00 64.86 63.74 3dp3 h ILE 93 Cb 0.19 2.27 -0.06 0.00 -0.74 0.00 0.00 36.82 38.48 3dp3 h ILE 93 CO -0.01 0.65 0.58 0.00 0.00 0.00 0.00 178.15 179.37 3dp3 h ALA 94 N 1.33 1.52 0.00 1.87 0.00 -0.66 -1.35 119.26 121.98 3dp3 h ALA 94 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3dp3 h ALA 94 Cb 1.21 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3dp3 h ALA 94 CO 0.09 0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.32 3dp3 n LYS 95 N -4.48 0.11 -0.12 0.00 5.02 -0.97 -2.49 118.16 115.22 3dp3 n LYS 95 Ca 0.13 0.50 0.06 0.00 -2.02 0.00 0.00 58.31 56.97 3dp3 n LYS 95 Cb 0.19 -1.79 0.12 0.00 -0.02 0.00 0.00 35.03 33.53 3dp3 n LYS 95 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3dp3 n THR 96 N -2.02 0.68 -4.45 -0.18 -2.24 -0.51 -4.89 114.28 100.68 3dp3 n THR 96 Ca 0.01 -0.84 -0.23 0.00 -2.27 0.00 0.00 64.05 60.72 3dp3 n THR 96 Cb 0.11 0.74 -0.10 0.00 -2.10 0.00 0.00 70.33 68.97 3dp3 n THR 96 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3dp3 s LYS 97 N -0.98 1.61 -0.01 -0.78 -0.14 -1.04 0.28 119.74 118.68 3dp3 s LYS 97 Ca 0.20 -1.75 -0.13 0.00 -1.36 0.00 0.00 55.97 52.93 3dp3 s LYS 97 Cb 0.11 -1.58 0.02 0.00 -1.68 0.00 0.00 37.83 34.70 3dp3 s LYS 97 CO 0.16 0.26 0.28 0.96 -0.76 0.00 0.00 175.35 176.24 3dp3 s ILE 98 N -2.66 0.06 -0.23 2.17 -4.36 -0.44 -4.58 121.20 111.17 3dp3 s ILE 98 Ca 0.28 -0.53 0.01 0.00 -0.26 0.00 0.00 60.65 60.16 3dp3 s ILE 98 Cb -0.03 -0.60 0.05 0.00 1.25 0.00 0.00 42.46 43.13 3dp3 s ILE 98 CO 0.13 -0.29 -0.09 0.68 0.24 0.00 0.00 174.94 175.61 3dp3 s VAL 99 N -1.42 1.77 -0.00 8.37 -7.23 -1.26 -1.20 120.40 119.43 3dp3 s VAL 99 Ca -0.13 -1.26 -0.25 0.00 -1.81 0.00 0.00 61.98 58.53 3dp3 s VAL 99 Cb -0.05 -1.91 -0.04 0.00 0.56 0.00 0.00 36.38 34.93 3dp3 s VAL 99 CO 0.03 0.04 0.78 -0.31 -0.31 0.00 0.00 175.10 175.33 3dp3 s TYR 100 N 1.31 3.67 -0.33 2.82 2.02 -0.42 -4.85 117.35 121.56 3dp3 s TYR 100 Ca -0.05 1.44 -0.18 0.00 -0.37 0.00 0.00 57.07 57.91 3dp3 s TYR 100 Cb -0.18 -2.87 -0.01 0.00 -0.40 0.00 0.00 41.96 38.50 3dp3 s TYR 100 CO -0.07 0.16 0.53 -0.06 -1.57 0.00 0.00 175.55 174.54 3dp3 s PHE 101 N 0.42 3.19 -0.07 2.71 0.08 -1.26 -0.34 117.98 122.71 3dp3 s PHE 101 Ca 0.41 0.28 -0.15 0.00 0.12 0.00 0.00 56.93 57.59 3dp3 s PHE 101 Cb -0.20 -2.91 -0.29 0.00 -0.57 0.00 0.00 43.02 39.05 3dp3 s PHE 101 CO 0.22 -0.50 0.66 0.52 -0.10 0.00 0.00 175.22 176.02 3dp3 h MET 102 N 8.38 0.32 -4.05 0.44 2.86 -1.28 -3.49 114.93 118.10 3dp3 h MET 102 Ca -0.28 -0.54 -0.11 0.00 -2.06 0.00 0.00 59.70 56.71 3dp3 h MET 102 Cb 1.13 0.20 -0.14 0.00 0.06 0.00 0.00 31.60 32.84 3dp3 h MET 102 CO 0.77 1.26 -0.54 0.95 1.06 0.00 0.00 176.91 180.41 3dp3 s THR 103 N -2.51 0.18 -0.02 2.22 -4.23 -1.12 -5.00 115.64 105.17 3dp3 s THR 103 Ca -0.17 -1.53 0.01 0.00 -1.18 0.00 0.00 61.69 58.81 3dp3 s THR 103 Cb 0.04 -1.47 0.01 0.00 1.34 0.00 0.00 72.50 72.43 3dp3 s THR 103 CO 0.81 -0.82 -0.03 -0.63 -0.54 0.00 0.00 174.62 173.42 3dp3 s ILE 104 N -3.90 0.31 0.08 2.99 1.01 -1.26 -1.89 121.20 118.55 3dp3 s ILE 104 Ca 0.07 -0.07 -0.06 0.00 0.00 0.00 0.00 60.65 60.58 3dp3 s ILE 104 Cb 0.07 -0.33 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 3dp3 s ILE 104 CO -0.10 0.14 0.13 -1.81 0.00 0.00 0.00 174.94 173.30 3dp3 s ASP 105 N 0.50 0.22 -1.53 3.58 1.11 0.41 -4.94 116.67 116.02 3dp3 s ASP 105 Ca -0.05 -0.78 -0.03 0.00 0.18 0.00 0.00 52.55 51.86 3dp3 s ASP 105 Cb -0.09 0.31 0.03 0.00 1.07 0.00 0.00 42.92 44.24 3dp3 s ASP 105 CO -0.01 -0.71 0.30 0.29 1.18 0.00 0.00 175.17 176.22 3dp3 n LYS 106 N -0.03 -2.16 -3.51 8.23 5.02 -1.26 -1.24 118.16 123.22 3dp3 n LYS 106 Ca -0.14 0.26 -0.37 0.00 -2.02 0.00 0.00 58.31 56.03 3dp3 n LYS 106 Cb 0.62 -4.21 -0.06 0.00 -0.02 0.00 0.00 35.03 31.36 3dp3 n LYS 106 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3dp3 s VAL 107 N -4.02 5.04 -0.01 -0.18 0.11 -1.26 -4.00 120.40 116.07 3dp3 s VAL 107 Ca 0.13 0.76 -0.01 0.00 -2.93 0.00 0.00 61.98 59.93 3dp3 s VAL 107 Cb -0.07 -3.70 0.01 0.00 -1.53 0.00 0.00 36.38 31.09 3dp3 s VAL 107 CO 0.95 0.51 0.03 -0.54 -3.33 0.00 0.00 175.10 172.71 3dp3 s LYS 108 N -1.29 0.02 -0.22 1.54 1.02 -1.01 -4.96 119.74 114.85 3dp3 s LYS 108 Ca 0.26 0.06 -0.04 0.00 0.02 0.00 0.00 55.97 56.28 3dp3 s LYS 108 Cb -0.16 -0.02 -0.01 0.00 -0.52 0.00 0.00 37.83 37.13 3dp3 s LYS 108 CO 0.15 -0.02 -0.05 -0.06 -0.92 0.00 0.00 175.35 174.44 3dp3 s PHE 109 N 0.15 2.95 -0.26 3.18 0.40 -1.26 -1.55 117.98 121.59 3dp3 s PHE 109 Ca -0.01 -0.97 -0.02 0.00 -0.60 0.00 0.00 56.93 55.33 3dp3 s PHE 109 Cb -0.02 -2.10 -0.16 0.00 0.51 0.00 0.00 43.02 41.25 3dp3 s PHE 109 CO -0.00 -0.56 -0.25 0.54 0.70 0.00 0.00 175.22 175.65 3dp3 n ARG 110 N 4.79 0.64 -4.38 0.44 1.74 -0.43 -4.99 116.66 114.47 3dp3 n ARG 110 Ca -0.18 0.18 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 3dp3 n ARG 110 Cb 0.51 -1.52 -0.16 0.00 -1.02 0.00 0.00 32.46 30.27 3dp3 n ARG 110 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3dp3 s ILE 111 N -2.52 0.79 0.62 0.55 1.01 -1.20 -5.05 121.20 115.40 3dp3 s ILE 111 Ca -0.36 -0.33 -0.18 0.00 0.00 0.00 0.00 60.65 59.79 3dp3 s ILE 111 Cb 0.10 -0.73 -0.02 0.00 0.01 0.00 0.00 42.46 41.82 3dp3 s ILE 111 CO 0.58 0.26 1.21 -2.16 0.00 0.00 0.00 174.94 174.83 3dp3 s PRO 112 N 0.45 2.81 -0.13 2.79 0.04 -1.26 -4.80 135.00 134.90 3dp3 s PRO 112 Ca -0.07 1.82 -0.04 0.00 0.04 0.00 0.00 61.00 62.75 3dp3 s PRO 112 Cb -0.11 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 3dp3 s PRO 112 CO 0.01 -1.33 0.00 0.08 0.04 0.00 0.00 177.00 175.80 3dp3 s VAL 113 N -1.66 4.30 0.18 -0.36 1.01 -1.26 -5.04 120.40 117.57 3dp3 s VAL 113 Ca 0.77 -0.23 -0.00 0.00 0.00 0.00 0.00 61.98 62.52 3dp3 s VAL 113 Cb -0.30 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 3dp3 s VAL 113 CO 0.36 0.54 0.08 0.42 0.00 0.00 0.00 175.10 176.50 3dp3 s THR 114 N -0.22 0.20 0.18 3.92 -4.23 -1.26 -0.57 115.64 113.65 3dp3 s THR 114 Ca 0.06 -1.96 -0.33 0.00 -1.18 0.00 0.00 61.69 58.27 3dp3 s THR 114 Cb -0.12 -2.29 -0.15 0.00 1.34 0.00 0.00 72.50 71.28 3dp3 s THR 114 CO 0.02 -0.24 1.35 -2.65 -0.54 0.00 0.00 174.62 172.55 3dp3 n PRO 115 N -0.22 1.63 0.00 3.99 -0.02 -1.26 -1.54 135.00 137.57 3dp3 n PRO 115 Ca -0.02 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 3dp3 n PRO 115 Cb 0.65 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 3dp3 n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dp3 n GLY 116 N 2.38 0.96 3.86 -1.23 0.00 0.88 -4.92 105.19 107.12 3dp3 n GLY 116 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 3dp3 n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dp3 s ASP 117 N -1.82 6.72 -0.53 1.61 -0.00 -0.59 -4.91 116.67 117.14 3dp3 s ASP 117 Ca 0.00 1.17 -0.07 0.00 -0.00 0.00 0.00 52.55 53.65 3dp3 s ASP 117 Cb 0.00 -2.33 0.14 0.00 -0.00 0.00 0.00 42.92 40.73 3dp3 s ASP 117 CO 0.00 -0.18 0.39 -0.60 -0.00 0.00 0.00 175.17 174.78 3dp3 s ARG 118 N -2.99 2.54 -0.43 8.23 3.52 -1.26 -1.27 118.95 127.28 3dp3 s ARG 118 Ca 0.52 -2.02 -0.29 0.00 -0.13 0.00 0.00 55.73 53.81 3dp3 s ARG 118 Cb -0.10 -3.88 0.02 0.00 -1.56 0.00 0.00 34.95 29.42 3dp3 s ARG 118 CO 0.19 -1.18 1.18 -1.17 -0.81 0.00 0.00 175.30 173.50 3dp3 s LEU 119 N 0.89 3.69 -0.25 -0.88 2.96 -0.65 -4.46 118.68 119.97 3dp3 s LEU 119 Ca 0.10 0.65 -0.09 0.00 -0.22 0.00 0.00 54.13 54.57 3dp3 s LEU 119 Cb -0.23 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.87 3dp3 s LEU 119 CO -0.03 -1.21 0.13 -0.70 -1.32 0.00 0.00 176.35 173.23 3dp3 s GLU 120 N 4.38 3.89 -0.12 1.98 2.12 0.38 -0.64 118.70 130.69 3dp3 s GLU 120 Ca 0.50 -0.36 -0.16 0.00 0.36 0.00 0.00 54.97 55.31 3dp3 s GLU 120 Cb -0.09 -3.48 -0.05 0.00 0.26 0.00 0.00 34.13 30.77 3dp3 s GLU 120 CO 0.29 -0.07 0.40 0.71 -0.54 0.00 0.00 175.26 176.04 3dp3 s TYR 121 N 1.39 3.52 -0.35 5.30 1.51 0.20 0.20 117.35 129.11 3dp3 s TYR 121 Ca 0.06 0.79 0.03 0.00 -1.01 0.00 0.00 57.07 56.94 3dp3 s TYR 121 Cb -0.15 -2.44 0.10 0.00 -0.11 0.00 0.00 41.96 39.36 3dp3 s TYR 121 CO 0.06 0.25 0.09 -1.01 -1.11 0.00 0.00 175.55 173.82 3dp3 s HIS 122 N 0.37 3.20 0.07 2.71 3.76 0.16 -1.73 115.29 123.84 3dp3 s HIS 122 Ca 0.22 -2.73 0.06 0.00 -0.15 0.00 0.00 55.06 52.47 3dp3 s HIS 122 Cb -0.14 -2.62 -0.04 0.00 1.11 0.00 0.00 32.58 30.89 3dp3 s HIS 122 CO 0.08 -0.91 -0.11 -0.51 -0.85 0.00 0.00 174.74 172.44 3dp3 s LEU 123 N 0.93 2.98 0.01 0.89 2.01 -0.59 -0.66 118.68 124.25 3dp3 s LEU 123 Ca 0.11 -0.35 0.01 0.00 0.01 0.00 0.00 54.13 53.92 3dp3 s LEU 123 Cb -0.19 -1.76 -0.01 0.00 0.01 0.00 0.00 46.19 44.23 3dp3 s LEU 123 CO -0.11 0.22 -0.04 -0.70 1.01 0.00 0.00 176.35 176.73 3dp3 s GLU 124 N -1.89 0.29 -0.15 1.70 2.12 0.70 -0.37 118.70 121.10 3dp3 s GLU 124 Ca 0.19 -0.33 -0.29 0.00 0.36 0.00 0.00 54.97 54.90 3dp3 s GLU 124 Cb -0.11 -0.15 -0.02 0.00 0.26 0.00 0.00 34.13 34.12 3dp3 s GLU 124 CO 0.11 0.03 1.30 0.08 -0.54 0.00 0.00 175.26 176.24 3dp3 s VAL 125 N -0.62 4.21 -0.09 3.70 1.01 -0.00 -1.31 120.40 127.29 3dp3 s VAL 125 Ca -0.05 1.46 0.06 0.00 0.00 0.00 0.00 61.98 63.45 3dp3 s VAL 125 Cb -0.05 -3.94 -0.24 0.00 0.00 0.00 0.00 36.38 32.15 3dp3 s VAL 125 CO -0.00 -0.12 0.47 0.18 0.00 0.00 0.00 175.10 175.62 3dp3 n LEU 126 N 6.57 1.55 -3.59 3.92 4.77 0.28 -4.95 117.00 125.56 3dp3 n LEU 126 Ca 0.14 0.28 -0.12 0.00 -0.03 0.00 0.00 56.01 56.28 3dp3 n LEU 126 Cb 0.45 -0.32 -0.06 0.00 -2.33 0.00 0.00 43.42 41.15 3dp3 n LEU 126 CO 0.56 0.59 0.65 -0.75 -1.33 0.00 0.00 177.39 177.11 3dp3 s LYS 127 N -2.57 0.71 -0.22 3.23 2.20 -0.76 -4.99 119.74 117.35 3dp3 s LYS 127 Ca -0.13 0.39 -0.04 0.00 -0.36 0.00 0.00 55.97 55.83 3dp3 s LYS 127 Cb 0.07 0.34 0.09 0.00 -1.51 0.00 0.00 37.83 36.82 3dp3 s LYS 127 CO 0.79 -0.18 0.17 -1.58 -0.36 0.00 0.00 175.35 174.20 3dp3 s HIS 128 N -0.61 -0.06 -0.39 4.03 5.65 -1.26 0.01 115.29 122.66 3dp3 s HIS 128 Ca -0.02 -0.16 0.02 0.00 0.25 0.00 0.00 55.06 55.15 3dp3 s HIS 128 Cb -0.02 -0.56 0.12 0.00 -1.18 0.00 0.00 32.58 30.94 3dp3 s HIS 128 CO 0.02 -0.64 0.15 0.15 -0.65 0.00 0.00 174.74 173.76 3dp3 s LYS 129 N 2.24 1.23 7.00 2.88 3.01 -0.64 -5.02 119.74 130.44 3dp3 s LYS 129 Ca 0.06 -1.76 0.00 0.00 -1.01 0.00 0.00 55.97 53.26 3dp3 s LYS 129 Cb -0.16 -2.54 0.00 0.00 -1.01 0.00 0.00 37.83 34.12 3dp3 s LYS 129 CO -0.17 -1.05 0.00 0.41 0.51 0.00 0.00 175.35 175.05 3dp3 n GLY 130 N 4.07 1.54 0.23 -3.33 0.00 -1.26 -2.63 105.19 103.81 3dp3 n GLY 130 Ca 0.04 -0.50 0.14 0.00 0.00 0.00 0.00 46.02 45.70 3dp3 n GLY 130 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3dp3 n MET 131 N 12.34 1.12 -3.52 1.61 2.81 -1.26 -4.85 117.12 125.38 3dp3 n MET 131 Ca 0.00 -0.47 -0.37 0.00 -1.81 0.00 0.00 57.70 55.06 3dp3 n MET 131 Cb 0.00 -1.49 -0.08 0.00 -0.71 0.00 0.00 33.22 30.94 3dp3 n MET 131 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3dp3 s ILE 132 N -2.20 5.28 -0.11 2.02 -1.09 -1.08 0.52 121.20 124.54 3dp3 s ILE 132 Ca 0.36 0.52 0.03 0.00 -2.23 0.00 0.00 60.65 59.33 3dp3 s ILE 132 Cb 0.21 -3.64 0.01 0.00 -1.58 0.00 0.00 42.46 37.46 3dp3 s ILE 132 CO 0.41 0.34 -0.20 0.26 -1.23 0.00 0.00 174.94 174.51 3dp3 s TRP 133 N 0.84 2.33 -0.28 3.97 0.52 0.50 -1.62 118.94 125.20 3dp3 s TRP 133 Ca 0.15 -1.06 -0.02 0.00 0.02 0.00 0.00 56.10 55.19 3dp3 s TRP 133 Cb -0.14 -1.60 0.03 0.00 -1.15 0.00 0.00 33.47 30.61 3dp3 s TRP 133 CO 0.05 -0.48 -0.02 -1.14 0.02 0.00 0.00 176.95 175.38 3dp3 s GLN 134 N 0.68 2.71 0.25 4.98 0.74 0.10 0.10 119.66 129.22 3dp3 s GLN 134 Ca -0.12 -1.07 0.11 0.00 0.05 0.00 0.00 55.36 54.33 3dp3 s GLN 134 Cb -0.16 -3.12 -0.05 0.00 1.10 0.00 0.00 33.01 30.78 3dp3 s GLN 134 CO 0.03 -0.49 -0.17 0.14 -0.55 0.00 0.00 175.29 174.24 3dp3 s VAL 135 N 1.32 2.66 0.19 1.34 -7.23 0.11 0.10 120.40 118.89 3dp3 s VAL 135 Ca -0.02 -2.16 -0.21 0.00 -1.81 0.00 0.00 61.98 57.78 3dp3 s VAL 135 Cb -0.18 -2.36 0.05 0.00 0.56 0.00 0.00 36.38 34.45 3dp3 s VAL 135 CO -0.02 -0.29 0.60 -0.83 -0.31 0.00 0.00 175.10 174.24 3dp3 s GLY 136 N -3.25 -0.40 0.00 2.32 0.00 -0.43 0.13 107.32 105.69 3dp3 s GLY 136 Ca 0.27 0.18 0.00 0.00 0.00 0.00 0.00 44.72 45.17 3dp3 s GLY 136 CO 0.14 0.01 0.00 0.61 0.00 0.00 0.00 173.10 173.86 3dp3 n GLY 137 N -0.38 -0.53 3.20 0.20 0.00 -0.75 -0.22 105.19 106.72 3dp3 n GLY 137 Ca -0.13 -0.73 -0.12 0.00 0.00 0.00 0.00 46.02 45.04 3dp3 n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dp3 s THR 138 N -3.98 0.13 -0.10 2.61 -4.23 0.16 -2.22 115.64 108.03 3dp3 s THR 138 Ca 0.00 -1.97 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 3dp3 s THR 138 Cb 0.00 -2.34 -0.01 0.00 1.34 0.00 0.00 72.50 71.48 3dp3 s THR 138 CO 0.00 -0.18 -0.18 0.00 -0.54 0.00 0.00 174.62 173.72 3dp3 s ALA 139 N -4.05 2.45 0.08 3.99 0.00 -0.46 0.38 121.76 124.15 3dp3 s ALA 139 Ca 0.33 -0.95 0.05 0.00 0.00 0.00 0.00 51.96 51.39 3dp3 s ALA 139 Cb 0.07 -0.98 -0.03 0.00 0.00 0.00 0.00 23.12 22.18 3dp3 s ALA 139 CO 0.08 0.35 -0.13 -0.65 0.00 0.00 0.00 175.76 175.41 3dp3 s GLN 140 N 0.05 0.84 -0.08 0.00 -0.21 0.13 -0.81 119.66 119.58 3dp3 s GLN 140 Ca -0.07 -1.04 -0.01 0.00 0.02 0.00 0.00 55.36 54.26 3dp3 s GLN 140 Cb -0.15 -0.73 0.03 0.00 1.00 0.00 0.00 33.01 33.15 3dp3 s GLN 140 CO 0.05 0.15 -0.03 0.08 -2.12 0.00 0.00 175.29 173.41 3dp3 s VAL 141 N -1.72 0.64 -1.41 1.09 1.01 -0.27 -0.47 120.40 119.26 3dp3 s VAL 141 Ca 0.01 -0.06 -0.05 0.00 0.00 0.00 0.00 61.98 61.88 3dp3 s VAL 141 Cb -0.07 -0.72 0.03 0.00 0.00 0.00 0.00 36.38 35.62 3dp3 s VAL 141 CO 0.02 0.30 0.73 -0.67 0.00 0.00 0.00 175.10 175.48 3dp3 n ASP 142 N 4.90 -2.17 0.00 3.32 4.64 -1.26 -1.69 116.55 124.29 3dp3 n ASP 142 Ca -0.12 -0.85 0.00 0.00 -1.38 0.00 0.00 54.79 52.44 3dp3 n ASP 142 Cb 0.50 -3.75 0.00 0.00 -1.04 0.00 0.00 41.12 36.83 3dp3 n ASP 142 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 3dp3 n GLY 143 N -1.68 2.23 3.89 0.27 0.00 -1.26 -5.00 105.19 103.64 3dp3 n GLY 143 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 3dp3 n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dp3 s LYS 144 N -0.01 3.45 -0.22 1.61 1.02 -0.68 -5.06 119.74 119.85 3dp3 s LYS 144 Ca 0.00 -0.17 -0.29 0.00 0.02 0.00 0.00 55.97 55.53 3dp3 s LYS 144 Cb 0.00 -3.16 -0.01 0.00 -0.52 0.00 0.00 37.83 34.13 3dp3 s LYS 144 CO 0.00 0.75 1.35 0.08 -0.92 0.00 0.00 175.35 176.61 3dp3 s VAL 145 N -1.11 4.09 -0.09 3.17 1.01 -1.26 -1.11 120.40 125.09 3dp3 s VAL 145 Ca 0.19 1.28 0.19 0.00 0.00 0.00 0.00 61.98 63.63 3dp3 s VAL 145 Cb -0.12 -3.99 -0.28 0.00 0.00 0.00 0.00 36.38 31.98 3dp3 s VAL 145 CO 0.08 -0.30 0.44 1.33 0.00 0.00 0.00 175.10 176.66 3dp3 n VAL 146 N 5.88 0.00 -3.52 2.92 0.24 0.01 -4.50 118.33 119.36 3dp3 n VAL 146 Ca 0.15 -0.40 -0.14 0.00 -2.04 0.00 0.00 64.34 61.92 3dp3 n VAL 146 Cb 0.45 0.15 -0.04 0.00 -1.47 0.00 0.00 33.84 32.93 3dp3 n VAL 146 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dp3 s ALA 147 N -3.26 -1.46 0.09 2.33 0.00 -1.08 -1.31 121.76 117.07 3dp3 s ALA 147 Ca -0.06 0.63 0.04 0.00 0.00 0.00 0.00 51.96 52.57 3dp3 s ALA 147 Cb 0.12 0.51 -0.03 0.00 0.00 0.00 0.00 23.12 23.72 3dp3 s ALA 147 CO 0.78 -0.58 -0.11 -1.21 0.00 0.00 0.00 175.76 174.63 3dp3 s GLU 148 N -2.77 0.83 -0.23 0.00 2.02 -0.60 -1.35 118.70 116.60 3dp3 s GLU 148 Ca -0.04 -1.08 -0.29 0.00 0.02 0.00 0.00 54.97 53.58 3dp3 s GLU 148 Cb -0.00 -0.63 0.16 0.00 0.10 0.00 0.00 34.13 33.76 3dp3 s GLU 148 CO -0.04 0.12 1.19 0.00 0.02 0.00 0.00 175.26 176.55 3dp3 s ALA 149 N -2.00 -2.04 0.03 5.21 0.00 -0.94 -2.40 121.76 119.63 3dp3 s ALA 149 Ca 0.02 1.75 0.08 0.00 0.00 0.00 0.00 51.96 53.82 3dp3 s ALA 149 Cb -0.06 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 3dp3 s ALA 149 CO 0.01 -0.27 -0.24 -1.21 0.00 0.00 0.00 175.76 174.05 3dp3 s GLU 150 N -1.02 1.68 -0.06 0.00 2.02 -0.37 -1.81 118.70 119.13 3dp3 s GLU 150 Ca 0.04 -1.01 -0.10 0.00 0.02 0.00 0.00 54.97 53.92 3dp3 s GLU 150 Cb -0.01 -1.79 0.02 0.00 0.10 0.00 0.00 34.13 32.45 3dp3 s GLU 150 CO -0.04 0.47 0.26 -0.51 0.02 0.00 0.00 175.26 175.46 3dp3 s LEU 151 N -1.11 1.05 -0.04 1.80 1.02 0.12 -0.44 118.68 121.07 3dp3 s LEU 151 Ca 0.10 0.28 0.06 0.00 0.02 0.00 0.00 54.13 54.58 3dp3 s LEU 151 Cb -0.09 0.97 -0.01 0.00 0.02 0.00 0.00 46.19 47.08 3dp3 s LEU 151 CO 0.01 -0.24 -0.22 -0.75 0.02 0.00 0.00 176.35 175.18 3dp3 s LYS 152 N -0.54 2.13 0.17 1.70 2.20 -0.79 0.07 119.74 124.68 3dp3 s LYS 152 Ca -0.06 -0.78 0.02 0.00 -0.36 0.00 0.00 55.97 54.78 3dp3 s LYS 152 Cb -0.04 -1.87 -0.05 0.00 -1.51 0.00 0.00 37.83 34.37 3dp3 s LYS 152 CO 0.02 0.36 0.00 0.00 -0.36 0.00 0.00 175.35 175.37 3dp3 s ALA 153 N -0.18 1.34 -0.03 3.13 0.00 0.12 -0.75 121.76 125.39 3dp3 s ALA 153 Ca -0.01 -1.58 0.06 0.00 0.00 0.00 0.00 51.96 50.43 3dp3 s ALA 153 Cb -0.12 0.54 -0.01 0.00 0.00 0.00 0.00 23.12 23.52 3dp3 s ALA 153 CO 0.02 -0.32 -0.22 1.41 0.00 0.00 0.00 175.76 176.66 3dp3 s MET 154 N -3.91 1.91 -0.10 0.00 1.75 0.54 -0.37 119.30 119.11 3dp3 s MET 154 Ca 0.24 -0.77 -0.16 0.00 -1.25 0.00 0.00 55.69 53.74 3dp3 s MET 154 Cb 0.06 -1.77 -0.05 0.00 2.84 0.00 0.00 34.83 35.92 3dp3 s MET 154 CO 0.04 0.42 0.41 0.42 -0.65 0.00 0.00 175.02 175.65 3dp3 s ILE 155 N -0.36 5.19 0.18 10.11 -1.09 0.18 -1.30 121.20 134.11 3dp3 s ILE 155 Ca 0.04 0.82 -0.05 0.00 -2.23 0.00 0.00 60.65 59.23 3dp3 s ILE 155 Cb -0.10 -3.74 -0.02 0.00 -1.58 0.00 0.00 42.46 37.01 3dp3 s ILE 155 CO 0.00 0.40 0.22 0.00 -1.23 0.00 0.00 174.94 174.33 3dp3 s ALA 156 N 0.20 0.50 -0.05 9.38 0.00 -0.34 -4.84 121.76 126.60 3dp3 s ALA 156 Ca 0.23 -1.25 -0.24 0.00 0.00 0.00 0.00 51.96 50.70 3dp3 s ALA 156 Cb -0.15 1.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 3dp3 s ALA 156 CO 0.09 -0.63 0.73 -2.00 0.00 0.00 0.00 175.76 173.95 3dp3 s GLU 157 N -4.05 4.45 1.33 0.00 2.56 -1.26 -1.33 118.70 120.40 3dp3 s GLU 157 Ca 0.26 0.94 -0.20 0.00 0.00 0.00 0.00 54.97 55.97 3dp3 s GLU 157 Cb 0.05 -3.44 0.34 0.00 2.00 0.00 0.00 34.13 33.07 3dp3 s GLU 157 CO 0.05 0.07 0.97 0.50 -0.56 0.00 0.00 175.26 176.29 3dp3 s ARG 158 N 0.76 -2.25 0.00 4.30 6.06 0.14 -4.81 118.95 123.16 3dp3 s ARG 158 Ca 0.39 0.32 0.00 0.00 -2.50 0.00 0.00 55.73 53.94 3dp3 s ARG 158 Cb -0.18 -1.44 0.00 0.00 0.06 0.00 0.00 34.95 33.39 3dp3 s ARG 158 CO 0.19 -4.47 0.00 -0.85 -2.50 0.00 0.00 175.30 167.67