#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g46 s PHE 2 N 0.00 1.82 0.08 2.03 -0.71 -1.26 -0.88 117.98 119.05 2g46 s PHE 2 Ca 0.00 -0.89 0.07 0.00 -1.04 0.00 0.00 56.93 55.07 2g46 s PHE 2 Cb 0.00 -1.36 -0.03 0.00 -1.21 0.00 0.00 43.02 40.42 2g46 s PHE 2 CO 0.00 -0.50 -0.19 -0.80 -1.34 0.00 0.00 175.22 172.38 2g46 s ASN 3 N 1.25 2.34 0.23 1.98 0.02 0.66 -4.96 114.94 116.47 2g46 s ASN 3 Ca -0.02 -0.61 -0.10 0.00 -1.02 0.00 0.00 52.86 51.12 2g46 s ASN 3 Cb -0.14 -0.15 0.36 0.00 0.02 0.00 0.00 41.25 41.35 2g46 s ASN 3 CO -0.05 0.07 1.63 -0.78 0.02 0.00 0.00 177.10 177.99 2g46 h ASP 4 N 4.41 -0.46 -0.44 -1.22 3.58 -2.00 0.41 116.42 120.69 2g46 h ASP 4 Ca -0.44 0.20 0.01 0.00 0.42 0.00 0.00 57.03 57.22 2g46 h ASP 4 Cb 1.18 0.37 -0.02 0.00 1.72 0.00 0.00 39.33 42.57 2g46 h ASP 4 CO 0.41 -0.20 0.28 0.03 -2.88 0.00 0.00 179.24 176.89 2g46 h ARG 5 N 0.06 0.56 -2.69 0.28 2.47 -1.96 -3.41 114.38 109.69 2g46 h ARG 5 Ca 0.37 -0.03 -0.08 0.00 -1.26 0.00 0.00 59.98 58.98 2g46 h ARG 5 Cb 0.62 -0.13 -0.18 0.00 -1.65 0.00 0.00 29.97 28.64 2g46 h ARG 5 CO -0.67 0.37 -0.04 0.14 0.56 0.00 0.00 179.97 180.33 2g46 s VAL 6 N -6.16 0.03 0.37 2.04 -7.23 0.13 -3.52 120.40 106.07 2g46 s VAL 6 Ca -0.13 -0.29 0.08 0.00 -1.81 0.00 0.00 61.98 59.84 2g46 s VAL 6 Cb 0.11 -0.88 -0.06 0.00 0.56 0.00 0.00 36.38 36.11 2g46 s VAL 6 CO 0.73 -0.16 0.01 -0.51 -0.31 0.00 0.00 175.10 174.86 2g46 s ILE 7 N -1.81 2.31 -0.13 -0.62 2.07 -0.92 -0.25 121.20 121.85 2g46 s ILE 7 Ca -0.09 -1.99 -0.21 0.00 -1.41 0.00 0.00 60.65 56.95 2g46 s ILE 7 Cb -0.02 -2.85 -0.03 0.00 0.13 0.00 0.00 42.46 39.69 2g46 s ILE 7 CO 0.03 -0.11 0.60 0.54 -1.91 0.00 0.00 174.94 174.08 2g46 s VAL 8 N -2.61 5.09 -0.06 4.00 0.11 -0.06 -1.00 120.40 125.87 2g46 s VAL 8 Ca 0.35 1.18 -0.05 0.00 -2.93 0.00 0.00 61.98 60.53 2g46 s VAL 8 Cb 0.04 -3.93 0.02 0.00 -1.53 0.00 0.00 36.38 30.98 2g46 s VAL 8 CO 0.19 0.23 0.17 -0.54 -3.33 0.00 0.00 175.10 171.81 2g46 s LYS 9 N 1.11 0.18 -0.66 1.54 1.02 -1.03 -4.87 119.74 117.03 2g46 s LYS 9 Ca 0.30 0.25 -0.09 0.00 0.02 0.00 0.00 55.97 56.45 2g46 s LYS 9 Cb -0.16 0.07 0.01 0.00 -0.52 0.00 0.00 37.83 37.23 2g46 s LYS 9 CO 0.13 -0.04 0.65 1.63 -0.92 0.00 0.00 175.35 176.80 2g46 n LYS 10 N 3.11 -1.69 -4.47 1.68 5.02 0.12 0.50 118.16 122.44 2g46 n LYS 10 Ca -0.14 1.44 -0.24 0.00 -2.02 0.00 0.00 58.31 57.36 2g46 n LYS 10 Cb 0.58 -4.41 -0.08 0.00 -0.02 0.00 0.00 35.03 31.10 2g46 n LYS 10 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2g46 s SER 11 N -2.71 2.52 0.24 4.39 1.04 -1.26 -5.01 113.70 112.91 2g46 s SER 11 Ca 0.10 -1.67 -0.03 0.00 0.48 0.00 0.00 55.95 54.84 2g46 s SER 11 Cb -0.02 0.49 0.28 0.00 0.10 0.00 0.00 66.02 66.86 2g46 s SER 11 CO 0.81 -0.94 1.72 1.55 0.98 0.00 0.00 173.24 177.36 2g46 h PRO 12 N 1.88 0.82 -0.15 4.02 0.13 -2.00 -2.70 132.00 134.01 2g46 h PRO 12 Ca -0.34 -0.24 -0.09 0.00 -0.87 0.00 0.00 66.00 64.46 2g46 h PRO 12 Cb 1.27 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2g46 h PRO 12 CO 0.54 0.85 -0.30 -0.07 -0.23 0.00 0.00 178.00 178.79 2g46 h LEU 13 N 0.76 0.28 0.00 1.56 -0.00 -2.03 -3.48 115.31 112.39 2g46 h LEU 13 Ca 0.14 -0.09 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 2g46 h LEU 13 Cb 0.51 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.10 2g46 h LEU 13 CO 0.03 0.58 0.00 0.61 -0.00 0.00 0.00 178.44 179.65 2g46 n GLY 14 N -0.43 1.76 0.00 0.83 0.00 -1.02 -5.16 105.19 101.18 2g46 n GLY 14 Ca -0.01 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2g46 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g46 n GLY 15 N 2.53 4.33 2.74 -0.02 0.00 -1.26 -4.90 105.19 108.61 2g46 n GLY 15 Ca 0.00 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 2g46 n GLY 15 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2g46 n TYR 16 N -0.70 2.76 -2.95 1.61 4.01 -1.26 0.14 117.16 120.78 2g46 n TYR 16 Ca 0.00 -2.78 0.00 0.00 -0.16 0.00 0.00 57.90 54.96 2g46 n TYR 16 Cb 0.00 -1.85 0.00 0.00 -0.31 0.00 0.00 39.34 37.18 2g46 n TYR 16 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2g46 n GLY 17 N 2.30 4.56 3.62 2.72 0.00 0.18 -4.15 105.19 114.42 2g46 n GLY 17 Ca 0.46 -2.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.05 2g46 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g46 s VAL 18 N 0.83 4.44 0.14 1.61 0.11 -1.15 -2.47 120.40 123.91 2g46 s VAL 18 Ca 0.00 -0.17 -0.15 0.00 -2.93 0.00 0.00 61.98 58.73 2g46 s VAL 18 Cb 0.00 -2.95 -0.07 0.00 -1.53 0.00 0.00 36.38 31.83 2g46 s VAL 18 CO 0.00 0.52 0.56 0.12 -3.33 0.00 0.00 175.10 172.96 2g46 s PHE 19 N -0.03 3.64 -0.88 1.54 5.36 -0.17 0.21 117.98 127.66 2g46 s PHE 19 Ca 0.04 1.10 -0.15 0.00 -0.96 0.00 0.00 56.93 56.97 2g46 s PHE 19 Cb -0.13 -2.40 0.20 0.00 -0.34 0.00 0.00 43.02 40.36 2g46 s PHE 19 CO 0.02 0.45 0.89 0.00 -1.46 0.00 0.00 175.22 175.12 2g46 s ALA 20 N -1.41 3.95 0.28 11.12 0.00 0.75 -2.17 121.76 134.28 2g46 s ALA 20 Ca 0.36 -3.23 0.36 0.00 0.00 0.00 0.00 51.96 49.46 2g46 s ALA 20 Cb -0.16 -3.66 1.84 0.00 0.00 0.00 0.00 23.12 21.14 2g46 s ALA 20 CO 0.19 -2.45 2.10 0.00 0.00 0.00 0.00 175.76 175.59 2g46 h ARG 21 N 7.95 0.00 -7.36 0.00 3.08 -1.80 -2.75 114.38 113.50 2g46 h ARG 21 Ca 0.13 0.00 -0.46 0.00 0.07 0.00 0.00 59.98 59.72 2g46 h ARG 21 Cb 1.02 0.00 0.11 0.00 0.08 0.00 0.00 29.97 31.19 2g46 h ARG 21 CO 0.86 0.00 0.21 0.15 -1.07 0.00 0.00 179.97 180.12 2g46 s LYS 22 N -3.86 1.25 0.00 0.04 1.02 -1.25 -3.92 119.74 113.03 2g46 s LYS 22 Ca -0.02 -0.95 0.00 0.00 0.02 0.00 0.00 55.97 55.02 2g46 s LYS 22 Cb 0.10 -2.17 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 2g46 s LYS 22 CO 0.40 -1.83 0.00 0.45 -0.92 0.00 0.00 175.35 173.45 2g46 n SER 23 N -3.17 -0.32 -4.86 2.83 2.88 0.97 -1.15 113.62 110.79 2g46 n SER 23 Ca 0.16 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.49 2g46 n SER 23 Cb 0.60 -0.05 -0.04 0.00 -0.75 0.00 0.00 64.21 63.97 2g46 n SER 23 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2g46 s PHE 24 N -2.03 2.99 0.00 0.66 0.08 -0.83 -4.96 117.98 113.90 2g46 s PHE 24 Ca 0.00 -0.23 0.00 0.00 0.12 0.00 0.00 56.93 56.82 2g46 s PHE 24 Cb 0.00 -1.69 0.00 0.00 -0.57 0.00 0.00 43.02 40.76 2g46 s PHE 24 CO 0.00 0.27 0.00 -1.91 -0.10 0.00 0.00 175.22 173.48 2g46 n GLU 25 N -1.34 3.85 -3.57 0.44 2.13 -1.26 -1.52 120.64 119.37 2g46 n GLU 25 Ca -0.04 0.00 -0.39 0.00 0.66 0.00 0.00 57.16 57.40 2g46 n GLU 25 Cb 0.59 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.25 2g46 n GLU 25 CO 0.00 0.00 0.00 0.21 -0.41 0.00 0.00 177.13 176.93 2g46 s LYS 26 N 3.79 3.39 0.00 5.31 2.20 -1.26 -2.36 119.74 130.80 2g46 s LYS 26 Ca 0.00 -3.10 0.00 0.00 -0.36 0.00 0.00 55.97 52.51 2g46 s LYS 26 Cb 0.00 -4.08 0.00 0.00 -1.51 0.00 0.00 37.83 32.24 2g46 s LYS 26 CO 0.00 -1.25 0.00 0.41 -0.36 0.00 0.00 175.35 174.15 2g46 n GLY 27 N 2.69 0.78 3.17 5.54 0.00 0.43 -4.84 105.19 112.96 2g46 n GLY 27 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.00 2g46 n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g46 s GLU 28 N 0.00 1.07 0.31 1.61 2.02 -1.22 -4.82 118.70 117.68 2g46 s GLU 28 Ca 0.00 -0.77 -0.28 0.00 0.02 0.00 0.00 54.97 53.94 2g46 s GLU 28 Cb 0.00 -1.10 -0.09 0.00 0.10 0.00 0.00 34.13 33.03 2g46 s GLU 28 CO 0.00 0.28 1.08 -1.17 0.02 0.00 0.00 175.26 175.47 2g46 s LEU 29 N -1.05 4.44 0.00 1.80 1.98 -1.26 0.57 118.68 125.15 2g46 s LEU 29 Ca 0.04 2.19 0.00 0.00 -2.89 0.00 0.00 54.13 53.46 2g46 s LEU 29 Cb -0.08 -3.79 0.00 0.00 0.66 0.00 0.00 46.19 42.98 2g46 s LEU 29 CO 0.01 -0.23 0.00 1.33 -1.89 0.00 0.00 176.35 175.57 2g46 n VAL 30 N 0.83 0.00 -3.58 1.68 0.24 0.11 -4.89 118.33 112.72 2g46 n VAL 30 Ca 0.01 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.23 2g46 n VAL 30 Cb 0.46 -0.05 -0.04 0.00 -1.47 0.00 0.00 33.84 32.74 2g46 n VAL 30 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2g46 s GLU 31 N -1.85 0.47 0.01 7.34 2.12 -1.24 -4.42 118.70 121.13 2g46 s GLU 31 Ca 0.00 -0.01 -0.10 0.00 0.36 0.00 0.00 54.97 55.22 2g46 s GLU 31 Cb 0.00 0.22 0.01 0.00 0.26 0.00 0.00 34.13 34.62 2g46 s GLU 31 CO 0.00 -0.17 0.20 -1.21 -0.54 0.00 0.00 175.26 173.54 2g46 s GLU 32 N -1.70 0.59 0.00 4.30 2.02 -1.26 -1.79 118.70 120.85 2g46 s GLU 32 Ca 0.04 -0.39 0.00 0.00 0.02 0.00 0.00 54.97 54.64 2g46 s GLU 32 Cb -0.01 0.25 0.00 0.00 0.10 0.00 0.00 34.13 34.47 2g46 s GLU 32 CO -0.03 -0.15 0.00 0.00 0.02 0.00 0.00 175.26 175.09 2g46 n LEU 34 N 0.00 0.00 -4.04 0.00 4.77 -1.26 -1.50 117.00 114.97 2g46 n LEU 34 Ca 0.00 -3.09 -0.10 0.00 -0.03 0.00 0.00 56.01 52.79 2g46 n LEU 34 Cb 0.00 0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.19 2g46 n LEU 34 CO 0.00 -0.53 0.11 0.00 -1.33 0.00 0.00 177.39 175.64 2g46 s ILE 36 N -3.93 4.50 -0.50 0.00 1.01 -1.08 -4.76 121.20 116.44 2g46 s ILE 36 Ca 0.26 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.51 2g46 s ILE 36 Cb 0.01 -3.02 0.13 0.00 0.01 0.00 0.00 42.46 39.59 2g46 s ILE 36 CO 0.11 0.40 0.26 -0.69 0.00 0.00 0.00 174.94 175.02 2g46 s VAL 37 N -1.11 2.21 0.51 2.92 1.01 -1.26 -0.21 120.40 124.47 2g46 s VAL 37 Ca 0.20 -3.12 0.03 0.00 0.00 0.00 0.00 61.98 59.09 2g46 s VAL 37 Cb -0.12 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.73 2g46 s VAL 37 CO 0.11 -0.84 0.14 -0.13 0.00 0.00 0.00 175.10 174.38 2g46 s ARG 38 N -0.14 2.21 0.74 2.72 1.81 -0.17 -4.98 118.95 121.13 2g46 s ARG 38 Ca 0.18 -2.24 -0.04 0.00 -1.72 0.00 0.00 55.73 51.90 2g46 s ARG 38 Cb -0.24 -1.74 0.11 0.00 -0.45 0.00 0.00 34.95 32.63 2g46 s ARG 38 CO -0.01 -0.42 1.03 -1.01 -0.68 0.00 0.00 175.30 174.20 2g46 s HIS 39 N -2.83 2.05 0.00 -0.53 3.76 -1.26 -1.44 115.29 115.04 2g46 s HIS 39 Ca 0.17 0.02 0.00 0.00 -0.15 0.00 0.00 55.06 55.10 2g46 s HIS 39 Cb 0.01 -3.20 0.00 0.00 1.11 0.00 0.00 32.58 30.50 2g46 s HIS 39 CO 0.10 -1.70 0.00 -1.71 -0.85 0.00 0.00 174.74 170.59 2g46 n ASN 40 N -2.95 0.00 0.00 1.40 2.85 -1.26 -4.19 115.26 111.11 2g46 n ASN 40 Ca 0.13 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.60 2g46 n ASN 40 Cb 0.60 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.62 2g46 n ASN 40 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 2g46 n ASP 41 N 0.00 0.00 -0.30 1.20 -0.08 -1.26 -2.73 116.55 113.38 2g46 n ASP 41 Ca 0.00 0.00 0.35 0.00 -1.51 0.00 0.00 54.79 53.63 2g46 n ASP 41 Cb 0.00 0.00 0.71 0.00 2.34 0.00 0.00 41.12 44.17 2g46 n ASP 41 CO 0.00 0.00 0.00 -2.24 0.12 0.00 0.00 177.20 175.08 2g46 h ASP 42 N 9.02 0.00 0.12 1.67 2.03 -2.00 0.16 116.42 127.43 2g46 h ASP 42 Ca 0.00 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.29 2g46 h ASP 42 Cb 0.00 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 2g46 h ASP 42 CO 0.00 0.00 -0.06 -0.25 -1.03 0.00 0.00 179.24 177.90 2g46 h TRP 43 N 0.00 -0.16 -0.04 4.15 2.91 -1.74 -1.25 115.95 119.83 2g46 h TRP 43 Ca 0.56 -0.00 0.01 0.00 1.13 0.00 0.00 58.89 60.59 2g46 h TRP 43 Cb 2.47 0.05 -0.00 0.00 -0.51 0.00 0.00 29.16 31.17 2g46 h TRP 43 CO 0.00 0.24 0.07 0.78 -1.03 0.00 0.00 178.44 178.50 2g46 h GLY 44 N -0.59 0.00 0.00 2.65 0.00 -0.75 -2.18 103.07 102.20 2g46 h GLY 44 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2g46 h GLY 44 CO 0.03 0.00 -0.05 -0.84 0.00 0.00 0.00 176.54 175.67 2g46 h THR 45 N 0.00 0.00 -0.67 4.70 2.02 -1.20 -3.02 112.91 114.73 2g46 h THR 45 Ca 0.02 -0.29 0.13 0.00 0.77 0.00 0.00 66.41 67.04 2g46 h THR 45 Cb 0.16 0.00 -0.13 0.00 -1.74 0.00 0.00 68.15 66.45 2g46 h THR 45 CO -0.00 0.00 -0.16 0.00 0.37 0.00 0.00 175.52 175.73 2g46 h ALA 46 N -1.71 0.45 -0.59 6.16 0.00 -1.21 0.29 119.26 122.65 2g46 h ALA 46 Ca 0.00 0.26 -0.33 0.00 0.00 0.00 0.00 54.91 54.84 2g46 h ALA 46 Cb 0.05 0.50 -0.18 0.00 0.00 0.00 0.00 17.79 18.17 2g46 h ALA 46 CO 0.00 -0.42 0.42 1.28 0.00 0.00 0.00 179.25 180.53 2g46 n LEU 47 N -5.45 5.51 -3.34 0.00 4.32 -0.83 -4.79 117.00 112.43 2g46 n LEU 47 Ca 0.09 -2.90 -0.29 0.00 -0.02 0.00 0.00 56.01 52.89 2g46 n LEU 47 Cb 0.35 -0.77 -0.03 0.00 -1.62 0.00 0.00 43.42 41.35 2g46 n LEU 47 CO 0.03 0.91 2.16 -1.84 -1.22 0.00 0.00 177.39 177.43 2g46 n GLU 48 N -0.38 1.68 0.03 3.23 -0.00 0.10 -3.70 120.64 121.60 2g46 n GLU 48 Ca 0.36 -1.54 0.00 0.00 -0.00 0.00 0.00 57.16 55.98 2g46 n GLU 48 Cb 1.09 -2.60 0.00 0.00 -0.00 0.00 0.00 31.44 29.92 2g46 n GLU 48 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.13 173.66 2g46 n ASP 49 N 5.62 -0.56 -2.19 -1.84 2.03 -1.26 -4.94 116.55 113.41 2g46 n ASP 49 Ca 0.44 0.13 -0.26 0.00 0.52 0.00 0.00 54.79 55.61 2g46 n ASP 49 Cb 0.23 0.90 0.12 0.00 -0.72 0.00 0.00 41.12 41.66 2g46 n ASP 49 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2g46 n TYR 50 N -2.53 2.89 -3.59 -0.67 4.01 -1.25 -4.91 117.16 111.11 2g46 n TYR 50 Ca 0.00 -2.24 -0.39 0.00 -0.16 0.00 0.00 57.90 55.11 2g46 n TYR 50 Cb 0.00 -1.11 -0.11 0.00 -0.31 0.00 0.00 39.34 37.81 2g46 n TYR 50 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2g46 s LEU 51 N -3.24 4.23 -0.57 7.72 2.96 -1.24 -2.22 118.68 126.31 2g46 s LEU 51 Ca 0.56 -0.33 -0.22 0.00 -0.22 0.00 0.00 54.13 53.91 2g46 s LEU 51 Cb 0.45 -2.09 0.06 0.00 0.50 0.00 0.00 46.19 45.11 2g46 s LEU 51 CO 0.05 -0.17 0.85 -0.36 -1.32 0.00 0.00 176.35 175.41 2g46 s PHE 52 N 1.70 2.84 0.05 5.38 0.40 0.90 -4.81 117.98 124.42 2g46 s PHE 52 Ca 0.06 -0.36 -0.18 0.00 -0.60 0.00 0.00 56.93 55.86 2g46 s PHE 52 Cb -0.17 -4.00 -0.06 0.00 0.51 0.00 0.00 43.02 39.30 2g46 s PHE 52 CO 0.09 -1.35 0.51 0.45 0.70 0.00 0.00 175.22 175.62 2g46 s SER 53 N 3.09 6.97 0.28 1.36 0.15 -1.26 -1.64 113.70 122.64 2g46 s SER 53 Ca 0.23 1.15 0.00 0.00 0.70 0.00 0.00 55.95 58.03 2g46 s SER 53 Cb -0.16 -2.32 -0.00 0.00 -1.71 0.00 0.00 66.02 61.83 2g46 s SER 53 CO 0.14 0.29 0.01 -1.14 1.20 0.00 0.00 173.24 173.75 2g46 n ARG 54 N 1.77 1.22 -2.65 5.44 0.63 -0.74 -4.96 116.66 117.37 2g46 n ARG 54 Ca -0.12 -2.05 -0.43 0.00 -0.92 0.00 0.00 57.85 54.33 2g46 n ARG 54 Cb 0.51 0.63 0.00 0.00 0.45 0.00 0.00 32.46 34.05 2g46 n ARG 54 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2g46 n LYS 55 N -0.68 3.24 0.00 -0.14 4.76 -1.26 -2.85 118.16 121.23 2g46 n LYS 55 Ca -0.10 -3.41 0.00 0.00 -2.87 0.00 0.00 58.31 51.92 2g46 n LYS 55 Cb 0.36 -3.37 0.00 0.00 -1.84 0.00 0.00 35.03 30.17 2g46 n LYS 55 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2g46 n ASN 56 N 7.61 0.00 -0.19 4.39 6.94 -1.26 -5.14 115.26 127.61 2g46 n ASN 56 Ca 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.02 2g46 n ASN 56 Cb 0.45 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.87 2g46 n ASN 56 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 2g46 n MET 57 N 0.00 0.00 -4.63 -3.83 0.00 -1.13 -4.96 117.12 102.56 2g46 n MET 57 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 57.70 57.47 2g46 n MET 57 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 33.22 33.07 2g46 n MET 57 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2g46 s SER 58 N 1.43 1.83 0.38 3.17 0.01 -0.52 -1.79 113.70 118.22 2g46 s SER 58 Ca 0.00 -0.34 0.04 0.00 1.31 0.00 0.00 55.95 56.96 2g46 s SER 58 Cb 0.00 -0.18 -0.04 0.00 0.21 0.00 0.00 66.02 66.01 2g46 s SER 58 CO 0.00 0.15 0.10 0.00 0.41 0.00 0.00 173.24 173.90 2g46 s ALA 59 N -0.50 2.78 0.41 1.44 0.00 -0.65 -1.00 121.76 124.23 2g46 s ALA 59 Ca 0.05 -1.45 0.07 0.00 0.00 0.00 0.00 51.96 50.63 2g46 s ALA 59 Cb -0.07 0.70 -0.05 0.00 0.00 0.00 0.00 23.12 23.70 2g46 s ALA 59 CO 0.00 -0.32 0.16 1.41 0.00 0.00 0.00 175.76 177.02 2g46 s MET 60 N -3.78 2.22 -0.02 0.00 1.75 0.71 -0.07 119.30 120.10 2g46 s MET 60 Ca 0.27 -1.83 -0.06 0.00 -1.25 0.00 0.00 55.69 52.82 2g46 s MET 60 Cb 0.04 -1.98 -0.29 0.00 2.84 0.00 0.00 34.83 35.45 2g46 s MET 60 CO 0.14 -0.09 0.77 0.00 -0.65 0.00 0.00 175.02 175.20 2g46 h ALA 61 N 1.47 0.24 -0.19 4.11 0.00 -1.75 -2.86 119.26 120.27 2g46 h ALA 61 Ca -0.43 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.35 2g46 h ALA 61 Cb 1.25 0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.40 2g46 h ALA 61 CO 0.70 1.11 0.00 -0.11 0.00 0.00 0.00 179.25 180.95 2g46 n LEU 62 N -3.50 0.00 0.00 0.00 7.94 -1.25 -4.09 117.00 116.11 2g46 n LEU 62 Ca -0.20 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.70 2g46 n LEU 62 Cb 1.06 0.00 0.00 0.00 0.53 0.00 0.00 43.42 45.01 2g46 n LEU 62 CO 0.51 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.40 2g46 n GLY 63 N 0.00 -1.83 2.05 -3.96 0.00 -1.16 -4.61 105.19 95.68 2g46 n GLY 63 Ca 0.00 -0.36 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 2g46 n GLY 63 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2g46 n PHE 64 N 0.00 1.03 0.01 1.61 3.72 -1.26 -4.22 117.46 118.35 2g46 n PHE 64 Ca 0.00 -1.73 -0.02 0.00 -0.05 0.00 0.00 57.45 55.65 2g46 n PHE 64 Cb 0.00 -1.15 -0.10 0.00 -0.94 0.00 0.00 39.48 37.29 2g46 n PHE 64 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2g46 n GLY 65 N 1.11 -1.14 0.11 1.37 0.00 -1.26 -4.27 105.19 101.12 2g46 n GLY 65 Ca 0.34 -0.12 -0.16 0.00 0.00 0.00 0.00 46.02 46.08 2g46 n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g46 n ALA 66 N -2.44 1.14 -0.35 4.61 0.00 -1.26 -4.13 120.51 118.08 2g46 n ALA 66 Ca -0.12 -0.66 0.25 0.00 0.00 0.00 0.00 53.44 52.92 2g46 n ALA 66 Cb 0.89 -0.76 0.52 0.00 0.00 0.00 0.00 19.45 20.11 2g46 n ALA 66 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.50 176.66 2g46 h ILE 67 N 0.04 0.41 -1.52 0.00 -0.00 -1.74 -3.42 117.51 111.28 2g46 h ILE 67 Ca -0.36 -0.12 -0.71 0.00 -0.00 0.00 0.00 64.86 63.67 2g46 h ILE 67 Cb 2.03 0.05 0.05 0.00 -0.00 0.00 0.00 36.82 38.95 2g46 h ILE 67 CO 0.09 0.06 0.40 0.49 -0.00 0.00 0.00 178.15 179.19 2g46 n PHE 68 N -4.71 1.36 -3.69 0.16 3.72 -1.26 -3.17 117.46 109.88 2g46 n PHE 68 Ca 0.29 0.73 -0.19 0.00 -0.05 0.00 0.00 57.45 58.22 2g46 n PHE 68 Cb 1.00 -2.29 0.01 0.00 -0.94 0.00 0.00 39.48 37.26 2g46 n PHE 68 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2g46 n ASN 69 N 2.48 2.24 -4.67 4.37 3.02 -1.26 -4.79 115.26 116.65 2g46 n ASN 69 Ca 0.19 -2.41 -0.39 0.00 -0.03 0.00 0.00 54.58 51.95 2g46 n ASN 69 Cb 0.16 -0.07 -0.07 0.00 -0.61 0.00 0.00 39.78 39.19 2g46 n ASN 69 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2g46 s HIS 70 N -2.03 3.37 0.06 3.10 2.46 -1.26 -3.72 115.29 117.26 2g46 s HIS 70 Ca 0.27 0.68 -0.07 0.00 0.47 0.00 0.00 55.06 56.40 2g46 s HIS 70 Cb -0.02 -2.59 -0.01 0.00 -0.13 0.00 0.00 32.58 29.83 2g46 s HIS 70 CO 0.17 -0.05 0.14 -1.12 -2.47 0.00 0.00 174.74 171.41 2g46 s SER 71 N 1.10 0.15 -0.22 9.88 0.01 -1.26 -5.03 113.70 118.33 2g46 s SER 71 Ca 0.21 -0.57 0.05 0.00 1.31 0.00 0.00 55.95 56.95 2g46 s SER 71 Cb -0.15 0.28 0.45 0.00 0.21 0.00 0.00 66.02 66.81 2g46 s SER 71 CO 0.09 -0.61 1.44 0.29 0.41 0.00 0.00 173.24 174.86 2g46 n LYS 72 N 0.38 2.44 -2.81 12.44 5.02 -1.26 -4.40 118.16 129.98 2g46 n LYS 72 Ca -0.17 -1.88 -0.10 0.00 -2.02 0.00 0.00 58.31 54.14 2g46 n LYS 72 Cb 0.60 -1.83 0.04 0.00 -0.02 0.00 0.00 35.03 33.83 2g46 n LYS 72 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2g46 n ASP 73 N -0.14 -2.36 -4.60 4.39 2.03 -1.26 -4.93 116.55 109.67 2g46 n ASP 73 Ca 0.29 -3.31 -0.43 0.00 0.52 0.00 0.00 54.79 51.86 2g46 n ASP 73 Cb 1.06 1.52 -0.03 0.00 -0.72 0.00 0.00 41.12 42.95 2g46 n ASP 73 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2g46 s PRO 74 N 0.32 3.15 0.18 -0.67 0.04 -1.26 -4.82 135.00 131.94 2g46 s PRO 74 Ca 0.31 2.00 0.23 0.00 0.04 0.00 0.00 61.00 63.58 2g46 s PRO 74 Cb 0.24 -4.36 0.07 0.00 0.04 0.00 0.00 34.50 30.49 2g46 s PRO 74 CO -0.19 -2.08 1.10 -0.91 0.04 0.00 0.00 177.00 174.96 2g46 h ASN 75 N 14.90 0.00 -2.73 6.66 4.21 -1.83 -3.44 115.58 133.35 2g46 h ASN 75 Ca -0.41 -0.07 -0.11 0.00 1.21 0.00 0.00 56.30 56.92 2g46 h ASN 75 Cb 1.24 0.00 -0.28 0.00 -1.12 0.00 0.00 38.32 38.16 2g46 h ASN 75 CO 0.96 0.03 -0.36 0.00 -1.29 0.00 0.00 177.43 176.77 2g46 s ALA 76 N -3.31 -1.08 0.36 -0.83 0.00 -1.26 -2.15 121.76 113.48 2g46 s ALA 76 Ca 0.01 1.46 0.00 0.00 0.00 0.00 0.00 51.96 53.44 2g46 s ALA 76 Cb 0.11 -1.19 0.02 0.00 0.00 0.00 0.00 23.12 22.05 2g46 s ALA 76 CO 0.78 -0.62 0.12 0.54 0.00 0.00 0.00 175.76 176.58 2g46 n ARG 77 N 5.09 0.61 -4.18 0.00 1.74 0.51 -4.29 116.66 116.13 2g46 n ARG 77 Ca -0.12 -0.35 -0.18 0.00 -0.77 0.00 0.00 57.85 56.42 2g46 n ARG 77 Cb 0.51 -0.07 -0.12 0.00 -1.02 0.00 0.00 32.46 31.76 2g46 n ARG 77 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 2g46 s HIS 78 N -0.04 1.25 -0.01 -1.55 -3.43 -1.26 -1.18 115.29 109.07 2g46 s HIS 78 Ca 0.08 -0.47 0.07 0.00 -0.80 0.00 0.00 55.06 53.94 2g46 s HIS 78 Cb -0.01 -0.70 -0.03 0.00 -1.43 0.00 0.00 32.58 30.42 2g46 s HIS 78 CO 0.05 0.07 -0.21 -2.00 -2.00 0.00 0.00 174.74 170.66 2g46 s GLU 79 N -1.86 2.18 -0.12 -0.38 2.56 -0.96 -4.87 118.70 115.24 2g46 s GLU 79 Ca -0.00 -0.90 0.01 0.00 0.00 0.00 0.00 54.97 54.08 2g46 s GLU 79 Cb -0.09 -2.17 -0.02 0.00 2.00 0.00 0.00 34.13 33.85 2g46 s GLU 79 CO 0.02 0.57 -0.14 -1.17 -0.56 0.00 0.00 175.26 173.98 2g46 s LEU 80 N -0.93 2.68 0.00 2.70 2.96 -1.26 0.02 118.68 124.85 2g46 s LEU 80 Ca 0.12 -0.33 -0.14 0.00 -0.22 0.00 0.00 54.13 53.56 2g46 s LEU 80 Cb -0.10 -1.59 0.22 0.00 0.50 0.00 0.00 46.19 45.21 2g46 s LEU 80 CO 0.01 0.19 0.49 0.35 -1.32 0.00 0.00 176.35 176.07 2g46 n THR 81 N 3.38 0.00 0.19 3.68 -2.24 -1.20 -4.70 114.28 113.39 2g46 n THR 81 Ca -0.18 0.00 0.18 0.00 -2.27 0.00 0.00 64.05 61.78 2g46 n THR 81 Cb 0.53 -0.56 0.75 0.00 -2.10 0.00 0.00 70.33 68.95 2g46 n THR 81 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2g46 h ALA 82 N -2.88 1.82 -3.31 6.98 0.00 -1.99 -3.42 119.26 116.46 2g46 h ALA 82 Ca -0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2g46 h ALA 82 Cb 0.75 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2g46 h ALA 82 CO 0.13 -0.56 0.00 0.41 0.00 0.00 0.00 179.25 179.23 2g46 n GLY 83 N -1.39 5.86 2.43 0.00 0.00 -1.26 -5.04 105.19 105.79 2g46 n GLY 83 Ca 0.04 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.77 2g46 n GLY 83 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g46 n LEU 84 N 0.00 7.28 -0.03 0.99 4.77 -1.26 -4.68 117.00 124.07 2g46 n LEU 84 Ca 0.00 -4.49 -0.03 0.00 -0.03 0.00 0.00 56.01 51.47 2g46 n LEU 84 Cb 0.00 -0.91 -0.01 0.00 -2.33 0.00 0.00 43.42 40.17 2g46 n LEU 84 CO 0.00 1.63 -0.20 0.29 -1.33 0.00 0.00 177.39 177.78 2g46 n LYS 85 N -0.80 0.21 -4.08 3.23 5.02 -1.26 -4.26 118.16 116.21 2g46 n LYS 85 Ca 0.58 0.28 -0.32 0.00 -2.02 0.00 0.00 58.31 56.84 2g46 n LYS 85 Cb 0.60 -1.08 -0.07 0.00 -0.02 0.00 0.00 35.03 34.46 2g46 n LYS 85 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 2g46 s ARG 86 N -1.63 2.99 0.22 1.97 0.52 -1.26 0.75 118.95 122.50 2g46 s ARG 86 Ca -0.08 -0.58 0.10 0.00 -0.52 0.00 0.00 55.73 54.65 2g46 s ARG 86 Cb 0.01 -2.80 -0.04 0.00 0.52 0.00 0.00 34.95 32.64 2g46 s ARG 86 CO 0.12 0.61 -0.09 -1.64 0.02 0.00 0.00 175.30 174.32 2g46 s MET 87 N -2.03 2.05 0.36 3.54 -1.94 -0.56 -3.23 119.30 117.49 2g46 s MET 87 Ca 0.26 -1.40 0.04 0.00 -1.71 0.00 0.00 55.69 52.87 2g46 s MET 87 Cb -0.12 -2.08 -0.05 0.00 2.01 0.00 0.00 34.83 34.58 2g46 s MET 87 CO 0.18 0.40 0.07 1.03 -0.01 0.00 0.00 175.02 176.68 2g46 s ARG 88 N -3.18 1.76 -0.35 2.03 0.52 0.10 -2.50 118.95 117.32 2g46 s ARG 88 Ca 0.27 -2.01 0.02 0.00 -0.52 0.00 0.00 55.73 53.49 2g46 s ARG 88 Cb -0.07 -0.85 0.15 0.00 0.52 0.00 0.00 34.95 34.70 2g46 s ARG 88 CO 0.16 -0.27 0.32 0.42 0.02 0.00 0.00 175.30 175.96 2g46 s ILE 89 N -3.25 -0.23 0.10 1.52 1.01 -0.74 -2.26 121.20 117.36 2g46 s ILE 89 Ca 0.32 -1.08 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 2g46 s ILE 89 Cb 0.07 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.67 2g46 s ILE 89 CO 0.15 -0.67 0.27 -0.36 0.00 0.00 0.00 174.94 174.34 2g46 s PHE 90 N 1.49 3.50 -0.37 3.97 0.08 -0.33 0.06 117.98 126.38 2g46 s PHE 90 Ca 0.16 0.35 -0.22 0.00 0.12 0.00 0.00 56.93 57.34 2g46 s PHE 90 Cb -0.17 -1.84 0.01 0.00 -0.57 0.00 0.00 43.02 40.45 2g46 s PHE 90 CO -0.07 0.53 0.71 0.95 -0.10 0.00 0.00 175.22 177.24 2g46 s THR 91 N -1.58 4.80 -0.72 0.64 -4.23 0.19 -0.37 115.64 114.37 2g46 s THR 91 Ca 0.37 0.70 0.25 0.00 -1.18 0.00 0.00 61.69 61.83 2g46 s THR 91 Cb -0.13 -4.16 0.25 0.00 1.34 0.00 0.00 72.50 69.81 2g46 s THR 91 CO 0.27 -0.40 1.75 2.30 -0.54 0.00 0.00 174.62 178.00 2g46 n ILE 92 N 5.72 0.62 -3.81 2.99 -5.35 -0.92 0.16 119.36 118.78 2g46 n ILE 92 Ca 0.01 -0.03 -0.10 0.00 -0.27 0.00 0.00 62.75 62.36 2g46 n ILE 92 Cb 0.48 -0.80 -0.07 0.00 -1.74 0.00 0.00 39.64 37.51 2g46 n ILE 92 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 2g46 s LYS 93 N -3.14 0.80 0.11 6.28 -2.85 -1.19 -4.57 119.74 115.18 2g46 s LYS 93 Ca 0.09 -0.70 -0.31 0.00 -1.00 0.00 0.00 55.97 54.05 2g46 s LYS 93 Cb 0.12 0.33 -0.10 0.00 -2.06 0.00 0.00 37.83 36.12 2g46 s LYS 93 CO 0.49 -0.25 1.87 -2.30 0.10 0.00 0.00 175.35 175.25 2g46 n PRO 94 N 0.37 2.83 -4.41 1.78 -0.02 -1.00 -4.43 135.00 130.13 2g46 n PRO 94 Ca -0.17 1.03 -0.31 0.00 -2.02 0.00 0.00 63.50 62.02 2g46 n PRO 94 Cb 0.60 -2.94 -0.10 0.00 -0.02 0.00 0.00 33.50 31.04 2g46 n PRO 94 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2g46 s ILE 95 N 3.01 3.58 0.18 4.25 1.01 -0.58 -4.95 121.20 127.71 2g46 s ILE 95 Ca 0.83 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 60.62 2g46 s ILE 95 Cb -0.47 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.39 2g46 s ILE 95 CO 0.38 0.33 0.29 0.00 0.00 0.00 0.00 174.94 175.93 2g46 s ALA 96 N -1.05 3.90 -0.17 9.38 0.00 -1.23 -0.02 121.76 132.56 2g46 s ALA 96 Ca 0.18 -1.13 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 2g46 s ALA 96 Cb -0.11 -1.70 -0.06 0.00 0.00 0.00 0.00 23.12 21.25 2g46 s ALA 96 CO 0.09 0.44 2.18 -0.89 0.00 0.00 0.00 175.76 177.58 2g46 n ILE 97 N -0.80 0.42 0.00 0.00 -0.00 -0.30 -2.76 119.36 115.92 2g46 n ILE 97 Ca -0.08 -0.40 0.00 0.00 -0.00 0.00 0.00 62.75 62.27 2g46 n ILE 97 Cb 0.55 -2.52 0.00 0.00 -0.00 0.00 0.00 39.64 37.67 2g46 n ILE 97 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 2g46 n GLY 98 N 5.55 1.78 3.74 7.39 0.00 -1.06 -4.93 105.19 117.65 2g46 n GLY 98 Ca 0.28 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.05 2g46 n GLY 98 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g46 s GLU 99 N -0.17 2.21 -0.07 1.61 0.41 -1.07 -4.98 118.70 116.64 2g46 s GLU 99 Ca 0.00 -1.88 0.01 0.00 -0.41 0.00 0.00 54.97 52.68 2g46 s GLU 99 Cb 0.00 -1.95 -0.03 0.00 -1.78 0.00 0.00 34.13 30.37 2g46 s GLU 99 CO 0.00 -0.14 -0.07 -2.00 -0.49 0.00 0.00 175.26 172.57 2g46 s GLU 100 N -3.91 2.77 -0.22 1.61 2.12 -1.26 -0.18 118.70 119.63 2g46 s GLU 100 Ca 0.39 -0.54 -0.05 0.00 0.36 0.00 0.00 54.97 55.13 2g46 s GLU 100 Cb 0.04 -2.60 -0.02 0.00 0.26 0.00 0.00 34.13 31.81 2g46 s GLU 100 CO 0.22 0.66 0.00 0.42 -0.54 0.00 0.00 175.26 176.02 2g46 s ILE 101 N -0.79 3.86 -0.09 -3.70 1.01 0.13 -4.66 121.20 116.96 2g46 s ILE 101 Ca 0.12 -0.34 -0.13 0.00 0.00 0.00 0.00 60.65 60.30 2g46 s ILE 101 Cb -0.11 -2.76 0.03 0.00 0.01 0.00 0.00 42.46 39.63 2g46 s ILE 101 CO 0.01 0.40 0.34 0.42 0.00 0.00 0.00 174.94 176.12 2g46 s THR 102 N 1.30 0.02 0.41 2.92 -4.23 -1.26 -2.93 115.64 111.87 2g46 s THR 102 Ca 0.04 -0.17 0.07 0.00 -1.18 0.00 0.00 61.69 60.45 2g46 s THR 102 Cb -0.15 -0.54 -0.04 0.00 1.34 0.00 0.00 72.50 73.11 2g46 s THR 102 CO 0.01 -0.10 0.24 0.27 -0.54 0.00 0.00 174.62 174.50 2g46 s ILE 103 N -0.38 2.44 0.00 2.99 -4.36 -1.24 -4.14 121.20 116.50 2g46 s ILE 103 Ca -0.05 -1.58 0.00 0.00 -0.26 0.00 0.00 60.65 58.76 2g46 s ILE 103 Cb -0.03 -3.00 0.00 0.00 1.25 0.00 0.00 42.46 40.68 2g46 s ILE 103 CO 0.02 -0.01 0.00 -0.24 0.24 0.00 0.00 174.94 174.95 2g46 n SER 104 N -1.33 0.00 0.05 4.36 2.88 -1.26 -4.46 113.62 113.85 2g46 n SER 104 Ca 0.00 -0.86 0.00 0.00 -1.33 0.00 0.00 58.87 56.68 2g46 n SER 104 Cb 0.64 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.10 2g46 n SER 104 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2g46 n TYR 105 N -1.06 -0.36 -4.49 0.66 4.01 -1.26 -5.08 117.16 109.58 2g46 n TYR 105 Ca 0.00 0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 2g46 n TYR 105 Cb 0.00 0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.13 2g46 n TYR 105 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2g46 n GLY 106 N 3.15 -1.50 5.00 2.72 0.00 -1.26 -4.80 105.19 108.50 2g46 n GLY 106 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 46.02 44.81 2g46 n GLY 106 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2g46 n ASP 107 N -0.98 0.00 0.00 1.61 2.03 -1.26 -2.71 116.55 115.24 2g46 n ASP 107 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2g46 n ASP 107 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2g46 n ASP 107 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2g46 n ASP 108 N 0.97 0.00 -4.42 1.67 8.00 -1.26 -4.85 116.55 116.67 2g46 n ASP 108 Ca 0.00 0.00 -0.49 0.00 0.71 0.00 0.00 54.79 55.01 2g46 n ASP 108 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.01 2g46 n ASP 108 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2g46 n TYR 109 N -1.40 1.30 0.00 1.24 4.01 -1.10 -4.37 117.16 116.84 2g46 n TYR 109 Ca 0.00 0.39 0.00 0.00 -0.16 0.00 0.00 57.90 58.13 2g46 n TYR 109 Cb 0.00 -2.46 0.00 0.00 -0.31 0.00 0.00 39.34 36.57 2g46 n TYR 109 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 2g46 n TRP 110 N 10.09 0.00 -2.36 -0.72 7.02 -1.26 -4.18 117.44 126.03 2g46 n TRP 110 Ca 0.48 0.00 -0.14 0.00 -1.02 0.00 0.00 57.50 56.82 2g46 n TRP 110 Cb 0.17 0.00 0.08 0.00 -2.42 0.00 0.00 31.31 29.13 2g46 n TRP 110 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 2g46 n LEU 111 N 0.00 0.00 0.00 -0.99 4.77 -1.26 -5.06 117.00 114.46 2g46 n LEU 111 Ca 0.00 -1.21 0.00 0.00 -0.03 0.00 0.00 56.01 54.77 2g46 n LEU 111 Cb 0.00 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.68 2g46 n LEU 111 CO 0.00 -0.82 0.00 -0.24 -1.33 0.00 0.00 177.39 175.00 2g46 n SER 112 N -3.01 0.00 -3.06 -1.43 2.88 -1.26 -4.00 113.62 103.74 2g46 n SER 112 Ca 0.10 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.46 2g46 n SER 112 Cb 0.35 0.01 -0.02 0.00 -0.75 0.00 0.00 64.21 63.80 2g46 n SER 112 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2g46 n ARG 113 N -2.29 1.26 0.27 -1.46 0.63 -1.26 -4.17 116.66 109.65 2g46 n ARG 113 Ca 0.00 -3.52 0.13 0.00 -0.92 0.00 0.00 57.85 53.55 2g46 n ARG 113 Cb 0.00 -1.69 0.78 0.00 0.45 0.00 0.00 32.46 32.01 2g46 n ARG 113 CO 0.00 0.00 0.00 -1.00 -2.51 0.00 0.00 177.63 174.12 2g46 h PRO 114 N 2.99 0.00 -5.75 -0.14 0.13 -2.01 -3.47 132.00 123.74 2g46 h PRO 114 Ca 0.07 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 65.06 2g46 h PRO 114 Cb 0.96 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.10 2g46 h PRO 114 CO 0.54 0.09 -0.74 0.54 -0.23 0.00 0.00 178.00 178.20 2g46 n ARG 115 N -3.69 -2.17 -2.13 0.86 5.12 -1.26 -4.97 116.66 108.41 2g46 n ARG 115 Ca -0.02 1.83 -0.27 0.00 -1.93 0.00 0.00 57.85 57.46 2g46 n ARG 115 Cb 0.19 -4.38 0.07 0.00 -1.16 0.00 0.00 32.46 27.19 2g46 n ARG 115 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2g46 s LEU 116 N -2.68 2.79 -1.55 0.55 0.20 -1.26 -3.89 118.68 112.84 2g46 s LEU 116 Ca 0.28 0.61 0.00 0.00 0.69 0.00 0.00 54.13 55.71 2g46 s LEU 116 Cb -0.06 -3.25 0.00 0.00 -0.43 0.00 0.00 46.19 42.46 2g46 s LEU 116 CO 0.81 -1.60 0.00 0.41 -0.29 0.00 0.00 176.35 175.68 2g46 n THR 117 N -2.98 -0.06 -3.61 3.68 -1.04 -1.26 -4.85 114.28 104.15 2g46 n THR 117 Ca 0.08 0.00 -0.05 0.00 -2.04 0.00 0.00 64.05 62.03 2g46 n THR 117 Cb 0.60 -1.47 -0.04 0.00 -1.82 0.00 0.00 70.33 67.60 2g46 n THR 117 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 2g46 s GLN 118 N -3.40 0.28 0.00 -2.82 2.00 -1.25 -5.31 119.66 109.15 2g46 s GLN 118 Ca 0.00 0.06 0.00 0.00 -2.00 0.00 0.00 55.36 53.42 2g46 s GLN 118 Cb 0.00 0.13 0.00 0.00 0.80 0.00 0.00 33.01 33.94 2g46 s GLN 118 CO 0.00 -0.09 0.00 -1.71 -0.50 0.00 0.00 175.29 172.99