#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ag4 s SER 2 N 0.00 -0.23 0.61 7.83 1.04 -1.26 -5.17 113.70 116.53 1ag4 s SER 2 Ca 0.00 -0.62 -0.06 0.00 0.48 0.00 0.00 55.95 55.75 1ag4 s SER 2 Cb 0.00 0.70 0.01 0.00 0.10 0.00 0.00 66.02 66.83 1ag4 s SER 2 CO 0.00 -1.30 0.93 -0.69 0.98 0.00 0.00 173.24 173.15 1ag4 s VAL 3 N -3.70 3.53 -0.23 5.02 1.01 -1.26 -5.07 120.40 119.70 1ag4 s VAL 3 Ca 0.12 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.11 1ag4 s VAL 3 Cb -0.05 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 32.94 1ag4 s VAL 3 CO 0.07 -0.44 -0.10 0.00 0.00 0.00 0.00 175.10 174.63 1ag4 s LYS 5 N 1.30 3.19 0.00 0.00 2.36 -1.26 -1.53 119.74 123.80 1ag4 s LYS 5 Ca 0.00 1.27 0.00 0.00 -2.55 0.00 0.00 55.97 54.70 1ag4 s LYS 5 Cb -0.16 -2.01 0.00 0.00 -1.05 0.00 0.00 37.83 34.61 1ag4 s LYS 5 CO -0.06 -0.92 0.00 0.41 1.55 0.00 0.00 175.35 176.32 1ag4 n GLY 6 N -0.80 -0.46 3.98 5.54 0.00 -0.84 -4.76 105.19 107.85 1ag4 n GLY 6 Ca 0.09 -0.74 -0.22 0.00 0.00 0.00 0.00 46.02 45.15 1ag4 n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ag4 s VAL 7 N 0.00 2.44 0.00 1.61 -7.23 -1.25 -4.40 120.40 111.57 1ag4 s VAL 7 Ca 0.00 -0.63 0.00 0.00 -1.81 0.00 0.00 61.98 59.54 1ag4 s VAL 7 Cb 0.00 -2.81 0.00 0.00 0.56 0.00 0.00 36.38 34.13 1ag4 s VAL 7 CO 0.00 0.00 0.00 -0.24 -0.31 0.00 0.00 175.10 174.55 1ag4 n SER 8 N -2.55 0.69 0.05 4.85 2.88 -1.26 -5.04 113.62 113.25 1ag4 n SER 8 Ca 0.11 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.62 1ag4 n SER 8 Cb 0.60 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 64.05 1ag4 n SER 8 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1ag4 h GLY 9 N 0.00 -0.65 -5.44 0.46 0.00 -2.06 -3.45 103.07 91.93 1ag4 h GLY 9 Ca 0.00 0.28 -0.18 0.00 0.00 0.00 0.00 47.33 47.43 1ag4 h GLY 9 CO 0.00 -0.24 -0.50 0.54 0.00 0.00 0.00 176.54 176.35 1ag4 s ASN 10 N -2.51 -0.20 0.27 0.19 2.20 -1.26 -5.14 114.94 108.49 1ag4 s ASN 10 Ca -0.03 0.39 -0.29 0.00 -0.94 0.00 0.00 52.86 51.99 1ag4 s ASN 10 Cb 0.01 0.39 -0.09 0.00 -2.00 0.00 0.00 41.25 39.55 1ag4 s ASN 10 CO 0.09 -0.07 0.98 -2.16 -2.94 0.00 0.00 177.10 173.00 1ag4 s PRO 11 N 0.16 4.73 0.28 3.55 0.04 -1.26 -5.06 135.00 137.43 1ag4 s PRO 11 Ca -0.00 1.54 -0.07 0.00 0.04 0.00 0.00 61.00 62.50 1ag4 s PRO 11 Cb -0.02 -3.14 -0.01 0.00 0.04 0.00 0.00 34.50 31.38 1ag4 s PRO 11 CO -0.00 0.37 0.42 0.00 0.04 0.00 0.00 177.00 177.83 1ag4 s ALA 12 N -1.28 0.37 -0.05 8.56 0.00 -1.26 -3.32 121.76 124.79 1ag4 s ALA 12 Ca 0.44 -1.26 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 1ag4 s ALA 12 Cb -0.26 1.15 0.00 0.00 0.00 0.00 0.00 23.12 24.01 1ag4 s ALA 12 CO 0.32 -0.79 0.01 1.63 0.00 0.00 0.00 175.76 176.93 1ag4 n LYS 13 N -0.43 -1.00 -3.18 0.00 4.01 -1.24 -2.01 118.16 114.31 1ag4 n LYS 13 Ca -0.00 1.20 -0.19 0.00 -0.51 0.00 0.00 58.31 58.81 1ag4 n LYS 13 Cb 0.62 -1.71 -0.01 0.00 -0.51 0.00 0.00 35.03 33.43 1ag4 n LYS 13 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ag4 n GLY 14 N 1.40 -0.48 3.38 0.72 0.00 -1.26 -4.92 105.19 104.03 1ag4 n GLY 14 Ca -0.01 0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 1ag4 n GLY 14 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ag4 s GLU 15 N -5.79 2.55 -0.03 1.61 2.02 -0.85 -4.14 118.70 114.07 1ag4 s GLU 15 Ca 0.31 -0.79 0.02 0.00 0.02 0.00 0.00 54.97 54.52 1ag4 s GLU 15 Cb -0.17 -2.30 0.01 0.00 0.10 0.00 0.00 34.13 31.78 1ag4 s GLU 15 CO 0.38 0.50 -0.06 0.08 0.02 0.00 0.00 175.26 176.18 1ag4 s VAL 16 N -0.44 0.57 -0.34 2.63 1.01 -0.64 -2.27 120.40 120.93 1ag4 s VAL 16 Ca 0.05 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 1ag4 s VAL 16 Cb -0.12 -0.56 0.02 0.00 0.00 0.00 0.00 36.38 35.73 1ag4 s VAL 16 CO 0.02 0.21 0.13 -0.36 0.00 0.00 0.00 175.10 175.10 1ag4 s PHE 17 N 0.53 3.22 0.64 5.22 0.40 -0.69 -1.75 117.98 125.55 1ag4 s PHE 17 Ca -0.07 -1.09 -0.09 0.00 -0.60 0.00 0.00 56.93 55.08 1ag4 s PHE 17 Cb -0.11 -2.33 0.00 0.00 0.51 0.00 0.00 43.02 41.10 1ag4 s PHE 17 CO 0.00 -0.64 0.99 -0.51 0.70 0.00 0.00 175.22 175.76 1ag4 s LEU 18 N 1.49 3.11 -0.20 -0.37 1.02 -0.07 -1.31 118.68 122.36 1ag4 s LEU 18 Ca 0.01 0.98 -0.04 0.00 0.02 0.00 0.00 54.13 55.10 1ag4 s LEU 18 Cb -0.19 -3.83 0.10 0.00 0.02 0.00 0.00 46.19 42.30 1ag4 s LEU 18 CO 0.04 -1.13 0.28 -0.31 0.02 0.00 0.00 176.35 175.25 1ag4 s TYR 19 N -3.16 -0.48 0.31 0.29 1.51 0.22 -1.57 117.35 114.48 1ag4 s TYR 19 Ca 0.55 0.61 -0.26 0.00 -1.01 0.00 0.00 57.07 56.96 1ag4 s TYR 19 Cb -0.11 -0.16 -0.14 0.00 -0.11 0.00 0.00 41.96 41.44 1ag4 s TYR 19 CO 0.49 -0.57 0.74 1.17 -1.11 0.00 0.00 175.55 176.27 1ag4 n LYS 20 N 5.34 0.77 -1.18 -0.62 4.81 -0.47 -2.37 118.16 124.45 1ag4 n LYS 20 Ca -0.05 0.27 0.15 0.00 -0.87 0.00 0.00 58.31 57.81 1ag4 n LYS 20 Cb 0.50 -1.53 -0.06 0.00 0.02 0.00 0.00 35.03 33.96 1ag4 n LYS 20 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1ag4 n HIS 21 N -0.18 -3.11 -1.91 5.64 8.25 -1.26 -3.15 115.22 119.50 1ag4 n HIS 21 Ca 0.12 1.66 -0.22 0.00 -0.26 0.00 0.00 57.72 59.02 1ag4 n HIS 21 Cb 0.33 -2.83 0.15 0.00 1.12 0.00 0.00 29.99 28.76 1ag4 n HIS 21 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1ag4 n VAL 22 N -3.96 0.00 -4.25 1.59 0.24 -1.26 -1.22 118.33 109.48 1ag4 n VAL 22 Ca -0.05 -0.89 -0.33 0.00 -2.04 0.00 0.00 64.34 61.03 1ag4 n VAL 22 Cb 0.55 -1.48 -0.07 0.00 -1.47 0.00 0.00 33.84 31.38 1ag4 n VAL 22 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1ag4 n ASN 23 N -3.53 -0.06 -3.91 -1.34 0.23 -1.11 -0.77 115.26 104.77 1ag4 n ASN 23 Ca 0.13 -1.26 -0.25 0.00 -0.53 0.00 0.00 54.58 52.67 1ag4 n ASN 23 Cb 0.46 -1.73 -0.08 0.00 -2.08 0.00 0.00 39.78 36.36 1ag4 n ASN 23 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1ag4 n PHE 24 N -4.66 -0.97 -3.25 -2.53 3.72 -1.26 -4.82 117.46 103.69 1ag4 n PHE 24 Ca -0.29 0.48 -0.37 0.00 -0.05 0.00 0.00 57.45 57.22 1ag4 n PHE 24 Cb 0.67 -2.13 -0.03 0.00 -0.94 0.00 0.00 39.48 37.06 1ag4 n PHE 24 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 1ag4 n GLN 25 N -3.75 3.55 -3.94 -1.08 7.27 0.05 -4.98 117.38 114.50 1ag4 n GLN 25 Ca -0.23 -4.58 0.00 0.00 0.07 0.00 0.00 57.00 52.26 1ag4 n GLN 25 Cb 0.53 -2.42 0.00 0.00 2.41 0.00 0.00 30.24 30.76 1ag4 n GLN 25 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1ag4 n GLY 26 N 1.36 -2.73 3.37 1.69 0.00 -1.19 -4.35 105.19 103.34 1ag4 n GLY 26 Ca 0.27 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.66 1ag4 n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ag4 n ASP 27 N 2.81 -2.17 -4.22 1.61 9.92 -1.26 -4.39 116.55 118.84 1ag4 n ASP 27 Ca 0.00 0.19 -0.27 0.00 -0.53 0.00 0.00 54.79 54.17 1ag4 n ASP 27 Cb 0.00 -1.13 -0.16 0.00 -0.64 0.00 0.00 41.12 39.19 1ag4 n ASP 27 CO 0.00 0.00 0.00 -0.94 0.13 0.00 0.00 177.20 176.39 1ag4 s SER 28 N -1.97 2.44 0.11 -2.24 1.04 -1.26 -1.36 113.70 110.46 1ag4 s SER 28 Ca 0.57 -0.38 0.08 0.00 0.48 0.00 0.00 55.95 56.70 1ag4 s SER 28 Cb -0.18 -0.31 -0.04 0.00 0.10 0.00 0.00 66.02 65.59 1ag4 s SER 28 CO 0.67 0.25 -0.16 0.26 0.98 0.00 0.00 173.24 175.24 1ag4 s TRP 29 N -0.44 2.59 -0.20 5.02 0.51 -0.61 -1.99 118.94 123.83 1ag4 s TRP 29 Ca 0.07 -0.23 0.00 0.00 -2.12 0.00 0.00 56.10 53.82 1ag4 s TRP 29 Cb -0.08 -1.37 0.02 0.00 -0.81 0.00 0.00 33.47 31.22 1ag4 s TRP 29 CO -0.00 0.39 -0.16 0.21 -0.51 0.00 0.00 176.95 176.87 1ag4 s LYS 30 N -2.13 2.95 -0.17 4.98 2.36 -0.58 -0.89 119.74 126.26 1ag4 s LYS 30 Ca 0.19 -0.87 0.00 0.00 -2.55 0.00 0.00 55.97 52.74 1ag4 s LYS 30 Cb -0.11 -2.68 0.04 0.00 -1.05 0.00 0.00 37.83 34.03 1ag4 s LYS 30 CO 0.11 -0.26 -0.09 0.08 1.55 0.00 0.00 175.35 176.75 1ag4 s VAL 31 N 1.30 1.39 -0.40 4.02 1.01 -0.71 -3.26 120.40 123.74 1ag4 s VAL 31 Ca 0.03 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.29 1ag4 s VAL 31 Cb -0.14 -1.48 0.46 0.00 0.00 0.00 0.00 36.38 35.22 1ag4 s VAL 31 CO -0.10 0.20 1.44 0.35 0.00 0.00 0.00 175.10 176.99 1ag4 n THR 32 N 4.78 2.86 0.00 3.92 -2.24 -1.26 -1.61 114.28 120.73 1ag4 n THR 32 Ca -0.14 -3.84 0.00 0.00 -2.27 0.00 0.00 64.05 57.81 1ag4 n THR 32 Cb 0.48 -1.14 0.00 0.00 -2.10 0.00 0.00 70.33 67.56 1ag4 n THR 32 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ag4 n GLY 33 N -0.77 1.89 2.91 3.38 0.00 -1.26 -4.86 105.19 106.48 1ag4 n GLY 33 Ca 0.50 0.12 -0.13 0.00 0.00 0.00 0.00 46.02 46.51 1ag4 n GLY 33 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ag4 s ASN 34 N 1.73 0.21 -0.29 1.61 0.02 -1.26 -1.24 114.94 115.73 1ag4 s ASN 34 Ca 0.00 -0.06 -0.01 0.00 -1.02 0.00 0.00 52.86 51.78 1ag4 s ASN 34 Cb 0.00 -0.02 0.13 0.00 0.02 0.00 0.00 41.25 41.39 1ag4 s ASN 34 CO 0.00 0.00 0.29 -0.69 0.02 0.00 0.00 177.10 176.72 1ag4 s VAL 35 N -0.12 -0.39 0.09 1.60 1.01 -0.71 -4.98 120.40 116.90 1ag4 s VAL 35 Ca -0.00 -0.49 0.03 0.00 0.00 0.00 0.00 61.98 61.52 1ag4 s VAL 35 Cb -0.01 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 1ag4 s VAL 35 CO -0.00 -0.47 0.09 -0.72 0.00 0.00 0.00 175.10 173.99 1ag4 s TYR 36 N 2.35 3.17 -0.10 5.22 -0.85 -1.26 -1.64 117.35 124.25 1ag4 s TYR 36 Ca 0.09 0.06 -0.04 0.00 -0.52 0.00 0.00 57.07 56.66 1ag4 s TYR 36 Cb -0.14 -1.60 0.01 0.00 0.38 0.00 0.00 41.96 40.62 1ag4 s TYR 36 CO -0.33 0.52 0.08 -0.25 -1.52 0.00 0.00 175.55 174.05 1ag4 n ASP 37 N 0.32 -5.32 -2.59 -0.18 8.00 -0.98 -4.85 116.55 110.95 1ag4 n ASP 37 Ca -0.09 1.04 -0.34 0.00 0.71 0.00 0.00 54.79 56.11 1ag4 n ASP 37 Cb 0.52 -3.16 0.04 0.00 -0.02 0.00 0.00 41.12 38.50 1ag4 n ASP 37 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1ag4 n PHE 38 N 1.84 3.11 0.09 1.24 1.16 -1.26 -4.64 117.46 119.00 1ag4 n PHE 38 Ca -0.13 -2.65 -0.23 0.00 -1.87 0.00 0.00 57.45 52.57 1ag4 n PHE 38 Cb 0.29 -0.91 -0.15 0.00 -1.61 0.00 0.00 39.48 37.10 1ag4 n PHE 38 CO 0.00 0.00 0.00 0.07 -1.87 0.00 0.00 176.76 174.96 1ag4 h ARG 39 N 2.59 0.42 -2.23 3.97 0.11 -1.93 -1.44 114.38 115.87 1ag4 h ARG 39 Ca 0.50 -0.72 -0.68 0.00 0.10 0.00 0.00 59.98 59.19 1ag4 h ARG 39 Cb 0.57 0.27 -0.36 0.00 1.11 0.00 0.00 29.97 31.55 1ag4 h ARG 39 CO 1.27 1.34 0.03 0.43 0.10 0.00 0.00 179.97 183.14 1ag4 n SER 40 N -3.77 5.66 -0.95 0.08 7.64 -1.26 -4.39 113.62 116.63 1ag4 n SER 40 Ca -0.20 -3.70 0.09 0.00 1.01 0.00 0.00 58.87 56.07 1ag4 n SER 40 Cb 1.03 -0.80 0.21 0.00 -1.01 0.00 0.00 64.21 63.64 1ag4 n SER 40 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1ag4 n VAL 41 N -0.20 0.83 -2.50 0.44 0.31 -1.26 -5.01 118.33 110.95 1ag4 n VAL 41 Ca 0.38 -0.92 -0.05 0.00 -0.01 0.00 0.00 64.34 63.74 1ag4 n VAL 41 Cb 0.35 0.64 0.01 0.00 -0.91 0.00 0.00 33.84 33.93 1ag4 n VAL 41 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 1ag4 n SER 42 N 1.07 -6.35 -1.33 4.52 7.64 -1.26 -4.71 113.62 113.20 1ag4 n SER 42 Ca 0.17 0.37 0.00 0.00 1.01 0.00 0.00 58.87 60.41 1ag4 n SER 42 Cb 0.51 -4.22 0.00 0.00 -1.01 0.00 0.00 64.21 59.49 1ag4 n SER 42 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ag4 n GLY 43 N -0.43 -0.35 0.00 0.23 0.00 -1.26 -4.98 105.19 98.40 1ag4 n GLY 43 Ca 0.08 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.88 1ag4 n GLY 43 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ag4 n LEU 44 N -0.66 0.00 -4.56 0.99 7.94 -1.26 -5.05 117.00 114.39 1ag4 n LEU 44 Ca 0.00 0.00 -0.52 0.00 -1.11 0.00 0.00 56.01 54.38 1ag4 n LEU 44 Cb 0.22 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.11 1ag4 n LEU 44 CO 0.00 0.00 0.77 -0.46 -1.11 0.00 0.00 177.39 176.59 1ag4 n ASN 45 N 0.00 1.17 0.00 1.96 6.94 -0.54 -0.74 115.26 124.05 1ag4 n ASN 45 Ca 0.00 1.13 0.00 0.00 -0.02 0.00 0.00 54.58 55.69 1ag4 n ASN 45 Cb 0.00 -1.14 0.00 0.00 -2.36 0.00 0.00 39.78 36.28 1ag4 n ASN 45 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1ag4 n ASP 46 N 2.19 0.00 -4.56 0.53 2.03 -1.26 -4.89 116.55 110.59 1ag4 n ASP 46 Ca 0.18 0.00 -0.39 0.00 0.52 0.00 0.00 54.79 55.10 1ag4 n ASP 46 Cb 0.19 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.55 1ag4 n ASP 46 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1ag4 s VAL 47 N -0.06 3.86 -0.29 5.18 -7.23 0.08 -1.25 120.40 120.69 1ag4 s VAL 47 Ca 0.00 -0.80 0.03 0.00 -1.81 0.00 0.00 61.98 59.40 1ag4 s VAL 47 Cb 0.00 -4.92 0.20 0.00 0.56 0.00 0.00 36.38 32.22 1ag4 s VAL 47 CO 0.00 -1.79 0.61 -0.69 -0.31 0.00 0.00 175.10 172.91 1ag4 s VAL 48 N 5.73 -0.98 0.28 1.32 1.01 -1.26 -4.52 120.40 121.99 1ag4 s VAL 48 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.48 1ag4 s VAL 48 Cb -0.01 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.39 1ag4 s VAL 48 CO -0.07 0.00 0.00 -1.20 0.00 0.00 0.00 175.10 173.83 1ag4 n SER 49 N 5.42 -0.14 -4.73 3.32 7.64 -1.22 -0.00 113.62 123.90 1ag4 n SER 49 Ca 0.03 0.48 -0.37 0.00 1.01 0.00 0.00 58.87 60.02 1ag4 n SER 49 Cb 0.53 0.39 -0.07 0.00 -1.01 0.00 0.00 64.21 64.05 1ag4 n SER 49 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1ag4 s SER 50 N -5.00 6.50 0.08 6.43 1.04 -0.36 -3.98 113.70 118.42 1ag4 s SER 50 Ca 0.00 0.59 0.02 0.00 0.48 0.00 0.00 55.95 57.04 1ag4 s SER 50 Cb 0.00 -2.21 -0.04 0.00 0.10 0.00 0.00 66.02 63.87 1ag4 s SER 50 CO 0.00 0.08 -0.07 -0.69 0.98 0.00 0.00 173.24 173.53 1ag4 s VAL 51 N 0.49 0.68 -0.09 5.02 1.01 -0.54 0.72 120.40 127.69 1ag4 s VAL 51 Ca 0.19 -1.68 -0.01 0.00 0.00 0.00 0.00 61.98 60.48 1ag4 s VAL 51 Cb -0.14 -1.37 0.03 0.00 0.00 0.00 0.00 36.38 34.91 1ag4 s VAL 51 CO 0.06 -0.71 -0.00 -0.54 0.00 0.00 0.00 175.10 173.90 1ag4 s LYS 52 N -3.13 0.70 0.15 2.72 1.02 -0.43 -0.92 119.74 119.85 1ag4 s LYS 52 Ca 0.05 0.02 -0.13 0.00 0.02 0.00 0.00 55.97 55.93 1ag4 s LYS 52 Cb 0.00 -1.15 -0.07 0.00 -0.52 0.00 0.00 37.83 36.10 1ag4 s LYS 52 CO -0.03 -0.33 0.54 0.08 -0.92 0.00 0.00 175.35 174.69 1ag4 s VAL 53 N 1.94 4.88 0.79 3.17 1.01 -0.42 -1.70 120.40 130.07 1ag4 s VAL 53 Ca 0.04 0.75 -0.12 0.00 0.00 0.00 0.00 61.98 62.66 1ag4 s VAL 53 Cb -0.13 -3.71 0.07 0.00 0.00 0.00 0.00 36.38 32.61 1ag4 s VAL 53 CO -0.06 0.20 1.14 -0.83 0.00 0.00 0.00 175.10 175.55 1ag4 s GLY 54 N -1.81 1.60 0.95 4.51 0.00 -0.96 -1.95 107.32 109.67 1ag4 s GLY 54 Ca 0.39 -0.48 -0.15 0.00 0.00 0.00 0.00 44.72 44.48 1ag4 s GLY 54 CO 0.19 -0.03 1.21 2.56 0.00 0.00 0.00 173.10 177.03 1ag4 s PRO 55 N -5.42 0.78 -0.35 2.90 0.04 -1.26 -1.18 135.00 130.51 1ag4 s PRO 55 Ca 0.61 -0.04 0.00 0.00 0.04 0.00 0.00 61.00 61.60 1ag4 s PRO 55 Cb -0.12 -1.83 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1ag4 s PRO 55 CO 0.51 -2.38 0.00 -1.71 0.04 0.00 0.00 177.00 173.46 1ag4 n ASN 56 N -3.82 -1.62 -4.38 6.66 2.85 -1.26 -3.73 115.26 109.95 1ag4 n ASN 56 Ca 0.11 0.31 -0.19 0.00 -0.11 0.00 0.00 54.58 54.70 1ag4 n ASN 56 Cb 0.60 -1.59 -0.10 0.00 1.24 0.00 0.00 39.78 39.93 1ag4 n ASN 56 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1ag4 s THR 57 N -1.92 0.92 -0.30 -0.44 2.01 -1.24 -4.27 115.64 110.40 1ag4 s THR 57 Ca 0.00 -2.01 -0.03 0.00 0.31 0.00 0.00 61.69 59.96 1ag4 s THR 57 Cb 0.00 -2.66 0.10 0.00 0.01 0.00 0.00 72.50 69.95 1ag4 s THR 57 CO 0.00 -0.05 0.13 -0.75 -0.69 0.00 0.00 174.62 173.26 1ag4 s LYS 58 N -3.94 0.33 -0.13 4.92 2.20 0.13 0.96 119.74 124.20 1ag4 s LYS 58 Ca 0.36 -0.70 -0.18 0.00 -0.36 0.00 0.00 55.97 55.09 1ag4 s LYS 58 Cb 0.08 -1.35 -0.04 0.00 -1.51 0.00 0.00 37.83 35.01 1ag4 s LYS 58 CO 0.14 -1.02 0.49 0.00 -0.36 0.00 0.00 175.35 174.59 1ag4 s ALA 59 N 1.93 3.48 -0.24 3.13 0.00 0.05 -1.34 121.76 128.77 1ag4 s ALA 59 Ca 0.10 -0.22 -0.01 0.00 0.00 0.00 0.00 51.96 51.83 1ag4 s ALA 59 Cb -0.17 -2.68 0.03 0.00 0.00 0.00 0.00 23.12 20.30 1ag4 s ALA 59 CO -0.32 -0.07 -0.08 -0.06 0.00 0.00 0.00 175.76 175.23 1ag4 s PHE 60 N 0.79 3.05 -0.02 0.00 0.40 -0.51 -0.01 117.98 121.68 1ag4 s PHE 60 Ca 0.26 -1.63 -0.05 0.00 -0.60 0.00 0.00 56.93 54.91 1ag4 s PHE 60 Cb -0.15 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.30 1ag4 s PHE 60 CO 0.10 -0.75 0.20 0.96 0.70 0.00 0.00 175.22 176.43 1ag4 s ILE 61 N 1.30 5.41 -0.35 0.64 -4.36 -0.74 -1.31 121.20 121.79 1ag4 s ILE 61 Ca -0.00 0.00 0.01 0.00 -0.26 0.00 0.00 60.65 60.39 1ag4 s ILE 61 Cb -0.17 -3.52 0.09 0.00 1.25 0.00 0.00 42.46 40.11 1ag4 s ILE 61 CO -0.05 0.39 0.09 -0.36 0.24 0.00 0.00 174.94 175.24 1ag4 s PHE 62 N -1.27 3.59 0.31 1.37 0.40 -0.68 -1.01 117.98 120.68 1ag4 s PHE 62 Ca 0.25 -2.57 -0.27 0.00 -0.60 0.00 0.00 56.93 53.75 1ag4 s PHE 62 Cb -0.13 -2.83 -0.14 0.00 0.51 0.00 0.00 43.02 40.43 1ag4 s PHE 62 CO 0.15 -0.93 0.91 1.17 0.70 0.00 0.00 175.22 177.22 1ag4 n LYS 63 N 4.45 1.13 -0.57 0.44 4.81 0.67 -3.54 118.16 125.54 1ag4 n LYS 63 Ca -0.02 0.40 0.07 0.00 -0.87 0.00 0.00 58.31 57.89 1ag4 n LYS 63 Cb 0.42 -1.75 -0.03 0.00 0.02 0.00 0.00 35.03 33.69 1ag4 n LYS 63 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ag4 n ASP 64 N 1.22 -3.32 -4.43 3.14 9.92 -1.26 -1.86 116.55 119.95 1ag4 n ASP 64 Ca 0.11 0.48 -0.45 0.00 -0.53 0.00 0.00 54.79 54.39 1ag4 n ASP 64 Cb 0.33 -1.91 -0.02 0.00 -0.64 0.00 0.00 41.12 38.88 1ag4 n ASP 64 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 1ag4 n ASP 65 N -3.11 -0.95 0.28 -2.24 9.92 -1.22 -4.22 116.55 115.02 1ag4 n ASP 65 Ca -0.02 1.05 0.14 0.00 -0.53 0.00 0.00 54.79 55.43 1ag4 n ASP 65 Cb 0.27 -1.03 0.76 0.00 -0.64 0.00 0.00 41.12 40.48 1ag4 n ASP 65 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1ag4 h ARG 66 N 1.05 0.00 -0.10 -1.24 1.12 -1.84 0.55 114.38 113.91 1ag4 h ARG 66 Ca -0.34 0.00 -0.22 0.00 -1.11 0.00 0.00 59.98 58.31 1ag4 h ARG 66 Cb 1.41 0.00 0.01 0.00 -0.01 0.00 0.00 29.97 31.38 1ag4 h ARG 66 CO 0.55 0.00 -0.82 0.35 -3.11 0.00 0.00 179.97 176.94 1ag4 h PHE 67 N 0.00 0.88 -4.65 2.20 3.57 -1.95 -3.47 116.94 113.52 1ag4 h PHE 67 Ca 0.00 -0.41 -0.28 0.00 3.53 0.00 0.00 57.97 60.81 1ag4 h PHE 67 Cb 0.49 -0.13 -0.15 0.00 2.79 0.00 0.00 35.95 38.96 1ag4 h PHE 67 CO 0.00 1.22 -0.59 -0.80 -2.23 0.00 0.00 178.31 175.90 1ag4 s ASN 68 N -7.09 0.44 0.00 0.41 0.01 0.18 -5.07 114.94 103.82 1ag4 s ASN 68 Ca -0.08 -1.46 0.00 0.00 -0.71 0.00 0.00 52.86 50.61 1ag4 s ASN 68 Cb 0.09 0.41 0.00 0.00 0.41 0.00 0.00 41.25 42.16 1ag4 s ASN 68 CO 0.89 -0.88 0.00 0.61 -1.51 0.00 0.00 177.10 176.20 1ag4 n GLY 69 N -0.34 0.31 3.31 0.66 0.00 -1.26 -3.44 105.19 104.44 1ag4 n GLY 69 Ca 0.03 -1.30 -0.09 0.00 0.00 0.00 0.00 46.02 44.65 1ag4 n GLY 69 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ag4 s ASN 70 N -4.00 0.06 0.07 1.61 3.84 -0.78 -4.95 114.94 110.80 1ag4 s ASN 70 Ca 0.00 -0.87 0.06 0.00 0.21 0.00 0.00 52.86 52.26 1ag4 s ASN 70 Cb 0.00 0.42 -0.03 0.00 -0.55 0.00 0.00 41.25 41.09 1ag4 s ASN 70 CO 0.00 -0.87 -0.16 0.72 -2.79 0.00 0.00 177.10 174.00 1ag4 s PHE 71 N -3.96 1.36 -0.03 0.43 -0.12 -1.26 -0.24 117.98 114.16 1ag4 s PHE 71 Ca 0.17 -0.43 -0.07 0.00 -0.05 0.00 0.00 56.93 56.54 1ag4 s PHE 71 Cb 0.04 -0.76 0.01 0.00 -0.63 0.00 0.00 43.02 41.67 1ag4 s PHE 71 CO -0.01 0.09 0.16 0.96 -0.05 0.00 0.00 175.22 176.37 1ag4 s ILE 72 N -1.18 0.05 -0.03 -4.49 -4.36 -0.18 -4.96 121.20 106.04 1ag4 s ILE 72 Ca 0.01 -0.40 -0.00 0.00 -0.26 0.00 0.00 60.65 59.99 1ag4 s ILE 72 Cb -0.10 -0.36 -0.04 0.00 1.25 0.00 0.00 42.46 43.21 1ag4 s ILE 72 CO 0.03 -0.22 0.02 0.00 0.24 0.00 0.00 174.94 175.01 1ag4 s ARG 73 N -0.78 2.93 -0.35 0.37 1.70 -1.26 -1.79 118.95 119.76 1ag4 s ARG 73 Ca -0.09 -0.51 0.00 0.00 -0.47 0.00 0.00 55.73 54.67 1ag4 s ARG 73 Cb -0.05 -2.76 0.11 0.00 -0.57 0.00 0.00 34.95 31.68 1ag4 s ARG 73 CO 0.01 0.66 0.14 -0.51 -1.08 0.00 0.00 175.30 174.52 1ag4 s LEU 74 N -1.40 2.33 0.93 -1.89 1.43 0.99 -4.95 118.68 116.12 1ag4 s LEU 74 Ca 0.18 -1.95 -0.12 0.00 -1.03 0.00 0.00 54.13 51.21 1ag4 s LEU 74 Cb -0.12 -0.90 0.15 0.00 0.03 0.00 0.00 46.19 45.35 1ag4 s LEU 74 CO 0.09 -0.37 1.10 -1.83 0.23 0.00 0.00 176.35 175.57 1ag4 s GLU 75 N 1.22 1.01 0.13 1.70 -1.05 -1.26 -0.77 118.70 119.68 1ag4 s GLU 75 Ca 0.12 0.55 0.00 0.00 -0.15 0.00 0.00 54.97 55.49 1ag4 s GLU 75 Cb -0.20 -1.80 0.00 0.00 -0.44 0.00 0.00 34.13 31.69 1ag4 s GLU 75 CO -0.16 -2.34 0.00 -0.85 0.95 0.00 0.00 175.26 172.85 1ag4 n GLU 76 N -3.91 -1.12 -0.15 -4.83 0.28 0.27 -4.76 120.64 106.42 1ag4 n GLU 76 Ca 0.06 0.74 -0.10 0.00 -0.16 0.00 0.00 57.16 57.70 1ag4 n GLU 76 Cb 0.57 -1.37 0.09 0.00 1.43 0.00 0.00 31.44 32.16 1ag4 n GLU 76 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1ag4 n SER 77 N -4.42 -2.32 -3.63 -1.84 3.41 -0.32 -4.57 113.62 99.92 1ag4 n SER 77 Ca 0.00 -0.41 -0.01 0.00 -0.26 0.00 0.00 58.87 58.19 1ag4 n SER 77 Cb 0.56 -0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 64.18 1ag4 n SER 77 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1ag4 s SER 78 N -2.39 -0.00 -0.35 4.04 1.04 -0.82 -4.82 113.70 110.40 1ag4 s SER 78 Ca 0.22 -0.00 -0.00 0.00 0.48 0.00 0.00 55.95 56.65 1ag4 s SER 78 Cb -0.03 0.00 0.12 0.00 0.10 0.00 0.00 66.02 66.21 1ag4 s SER 78 CO 0.18 -0.01 0.17 -1.58 0.98 0.00 0.00 173.24 172.99 1ag4 s GLN 79 N -2.01 0.71 -1.18 4.02 0.74 -1.26 -1.30 119.66 119.38 1ag4 s GLN 79 Ca 0.12 -1.27 -0.07 0.00 0.05 0.00 0.00 55.36 54.19 1ag4 s GLN 79 Cb 0.00 -1.72 0.24 0.00 1.10 0.00 0.00 33.01 32.64 1ag4 s GLN 79 CO -0.03 -1.10 1.64 0.28 -0.55 0.00 0.00 175.29 175.53 1ag4 n VAL 80 N 4.37 4.80 -0.02 1.34 0.31 -0.10 -4.79 118.33 124.24 1ag4 n VAL 80 Ca 0.04 -5.16 0.06 0.00 -0.01 0.00 0.00 64.34 59.27 1ag4 n VAL 80 Cb 0.39 -2.25 0.44 0.00 -0.91 0.00 0.00 33.84 31.51 1ag4 n VAL 80 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ag4 h THR 81 N 3.65 1.05 -4.24 2.52 1.03 -1.81 -1.44 112.91 113.67 1ag4 h THR 81 Ca 0.29 -0.18 -0.52 0.00 -0.01 0.00 0.00 66.41 66.00 1ag4 h THR 81 Cb 0.65 0.48 -0.28 0.00 -1.07 0.00 0.00 68.15 67.93 1ag4 h THR 81 CO 1.44 0.10 -0.82 -1.81 -0.01 0.00 0.00 175.52 174.41 1ag4 s ASP 82 N -6.56 1.90 -0.10 0.00 1.11 -1.26 -2.75 116.67 109.01 1ag4 s ASP 82 Ca -0.08 -0.33 0.13 0.00 0.18 0.00 0.00 52.55 52.46 1ag4 s ASP 82 Cb 0.18 -0.20 0.23 0.00 1.07 0.00 0.00 42.92 44.20 1ag4 s ASP 82 CO 0.74 0.18 1.12 0.18 1.18 0.00 0.00 175.17 178.56 1ag4 n LEU 83 N 2.53 1.67 -0.20 1.23 4.77 -1.26 -4.79 117.00 120.95 1ag4 n LEU 83 Ca -0.15 -2.53 -0.06 0.00 -0.03 0.00 0.00 56.01 53.24 1ag4 n LEU 83 Cb 0.54 -0.30 0.03 0.00 -2.33 0.00 0.00 43.42 41.37 1ag4 n LEU 83 CO 0.24 0.63 1.12 0.71 -1.33 0.00 0.00 177.39 178.76 1ag4 h THR 84 N 2.34 1.15 -0.19 -5.08 1.35 -1.90 -1.28 112.91 109.30 1ag4 h THR 84 Ca -0.01 -0.27 -0.02 0.00 -0.55 0.00 0.00 66.41 65.56 1ag4 h THR 84 Cb 1.15 0.29 -0.01 0.00 -1.73 0.00 0.00 68.15 67.85 1ag4 h THR 84 CO 0.00 0.14 0.02 0.71 -0.25 0.00 0.00 175.52 176.15 1ag4 h THR 85 N 0.79 1.11 -0.25 6.82 1.35 -1.94 -1.04 112.91 119.74 1ag4 h THR 85 Ca 0.21 -0.41 -0.14 0.00 -0.55 0.00 0.00 66.41 65.52 1ag4 h THR 85 Cb -0.09 0.94 -0.00 0.00 -1.73 0.00 0.00 68.15 67.27 1ag4 h THR 85 CO -0.05 0.14 -0.41 -0.09 -0.25 0.00 0.00 175.52 174.86 1ag4 h ARG 86 N 0.27 0.71 0.00 4.72 9.65 -1.62 -3.44 114.38 124.67 1ag4 h ARG 86 Ca 0.07 -0.44 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 1ag4 h ARG 86 Cb 0.15 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 28.77 1ag4 h ARG 86 CO 0.00 1.06 0.00 -1.71 2.80 0.00 0.00 179.97 182.12 1ag4 n ASN 87 N -4.19 0.00 -2.17 -3.80 5.15 -0.65 -4.95 115.26 104.66 1ag4 n ASN 87 Ca -0.05 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.93 1ag4 n ASN 87 Cb 0.54 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.79 1ag4 n ASN 87 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1ag4 n LEU 88 N 0.00 -5.70 -4.18 1.20 7.94 -0.44 -4.79 117.00 111.02 1ag4 n LEU 88 Ca 0.00 2.97 -0.35 0.00 -1.11 0.00 0.00 56.01 57.52 1ag4 n LEU 88 Cb 0.00 -3.07 0.08 0.00 0.53 0.00 0.00 43.42 40.97 1ag4 n LEU 88 CO 0.00 -2.12 -0.89 -0.46 -1.11 0.00 0.00 177.39 172.80 1ag4 n ASN 89 N 1.92 -3.83 -1.70 1.96 2.04 -1.25 -4.60 115.26 109.78 1ag4 n ASN 89 Ca 0.00 0.18 0.00 0.00 -0.44 0.00 0.00 54.58 54.32 1ag4 n ASN 89 Cb 0.00 -0.91 0.00 0.00 -2.53 0.00 0.00 39.78 36.34 1ag4 n ASN 89 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 1ag4 n ASP 90 N 1.16 -8.95 -0.86 0.53 8.00 0.99 -4.80 116.55 112.62 1ag4 n ASP 90 Ca 0.01 1.28 -0.05 0.00 0.71 0.00 0.00 54.79 56.74 1ag4 n ASP 90 Cb 0.58 -4.83 0.01 0.00 -0.02 0.00 0.00 41.12 36.86 1ag4 n ASP 90 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ag4 n ALA 91 N -0.16 -0.21 -1.00 2.24 0.00 -0.38 -4.82 120.51 116.19 1ag4 n ALA 91 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1ag4 n ALA 91 Cb 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.20 1ag4 n ALA 91 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1ag4 n ILE 92 N -3.43 0.00 0.00 0.00 3.06 -1.26 -4.95 119.36 112.79 1ag4 n ILE 92 Ca -0.02 0.45 0.00 0.00 -2.50 0.00 0.00 62.75 60.68 1ag4 n ILE 92 Cb 0.52 -1.09 0.00 0.00 0.54 0.00 0.00 39.64 39.61 1ag4 n ILE 92 CO 0.00 0.00 0.00 -1.20 -2.50 0.00 0.00 176.55 172.85 1ag4 n SER 93 N 0.00 0.00 -3.87 9.51 7.64 -1.26 -4.17 113.62 121.47 1ag4 n SER 93 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.77 1ag4 n SER 93 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 1ag4 n SER 93 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1ag4 s SER 94 N -4.00 0.00 -0.03 6.43 0.01 -1.23 -2.33 113.70 112.55 1ag4 s SER 94 Ca 0.00 -0.07 0.02 0.00 1.31 0.00 0.00 55.95 57.21 1ag4 s SER 94 Cb 0.00 0.20 0.01 0.00 0.21 0.00 0.00 66.02 66.44 1ag4 s SER 94 CO 0.00 -0.22 -0.08 0.27 0.41 0.00 0.00 173.24 173.62 1ag4 s ILE 95 N -0.78 0.75 0.08 1.44 -4.36 -0.65 -1.69 121.20 115.99 1ag4 s ILE 95 Ca -0.09 -0.32 0.10 0.00 -0.26 0.00 0.00 60.65 60.08 1ag4 s ILE 95 Cb -0.05 -0.69 -0.03 0.00 1.25 0.00 0.00 42.46 42.94 1ag4 s ILE 95 CO 0.01 0.25 -0.26 -0.63 0.24 0.00 0.00 174.94 174.54 1ag4 s ILE 96 N 0.37 2.14 -0.21 8.37 1.01 -0.43 -1.74 121.20 130.72 1ag4 s ILE 96 Ca -0.06 -1.53 -0.01 0.00 0.00 0.00 0.00 60.65 59.05 1ag4 s ILE 96 Cb -0.10 -1.86 0.01 0.00 0.01 0.00 0.00 42.46 40.52 1ag4 s ILE 96 CO 0.01 0.23 -0.13 0.68 0.00 0.00 0.00 174.94 175.73 1ag4 s VAL 97 N -0.92 2.57 -0.03 2.92 -7.23 -0.37 -1.43 120.40 115.92 1ag4 s VAL 97 Ca 0.12 -0.85 -0.00 0.00 -1.81 0.00 0.00 61.98 59.44 1ag4 s VAL 97 Cb -0.10 -2.17 0.03 0.00 0.56 0.00 0.00 36.38 34.70 1ag4 s VAL 97 CO 0.04 0.43 0.05 0.00 -0.31 0.00 0.00 175.10 175.30 1ag4 s ALA 98 N 1.34 0.04 0.86 1.32 0.00 -0.45 -4.76 121.76 120.12 1ag4 s ALA 98 Ca 0.04 0.36 -0.12 0.00 0.00 0.00 0.00 51.96 52.24 1ag4 s ALA 98 Cb -0.14 -0.28 0.11 0.00 0.00 0.00 0.00 23.12 22.81 1ag4 s ALA 98 CO -0.09 -0.12 1.13 0.95 0.00 0.00 0.00 175.76 177.63 1ag4 s THR 99 N 1.11 2.31 0.26 0.00 -4.23 -1.26 0.21 115.64 114.04 1ag4 s THR 99 Ca -0.09 0.10 -0.28 0.00 -1.18 0.00 0.00 61.69 60.24 1ag4 s THR 99 Cb -0.13 -2.89 -0.09 0.00 1.34 0.00 0.00 72.50 70.73 1ag4 s THR 99 CO -0.03 -0.13 0.92 0.12 -0.54 0.00 0.00 174.62 174.96 1ag4 s PHE 100 N -3.29 3.89 0.07 3.99 5.36 -1.26 -4.69 117.98 122.05 1ag4 s PHE 100 Ca 0.63 1.84 -0.25 0.00 -0.96 0.00 0.00 56.93 58.19 1ag4 s PHE 100 Cb -0.14 -2.94 0.06 0.00 -0.34 0.00 0.00 43.02 39.67 1ag4 s PHE 100 CO 0.53 0.39 0.60 -1.21 -1.46 0.00 0.00 175.22 174.06 1ag4 s GLU 101 N -1.46 1.15 0.39 10.12 8.01 -1.26 -5.09 118.70 130.56 1ag4 s GLU 101 Ca 0.43 -0.21 -0.23 0.00 0.01 0.00 0.00 54.97 54.98 1ag4 s GLU 101 Cb -0.23 0.53 -0.14 0.00 -4.31 0.00 0.00 34.13 29.98 1ag4 s GLU 101 CO 0.29 -0.44 0.46 -1.13 0.01 0.00 0.00 175.26 174.44 1ag4 n SER 102 N 0.19 -1.27 0.00 -0.19 3.41 -1.26 -5.27 113.62 109.22 1ag4 n SER 102 Ca -0.18 0.92 0.00 0.00 -0.26 0.00 0.00 58.87 59.35 1ag4 n SER 102 Cb 0.62 -1.05 0.00 0.00 -0.26 0.00 0.00 64.21 63.51 1ag4 n SER 102 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88