#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g4d s TYR 21 N 0.00 2.54 -0.00 4.31 1.51 -1.26 -3.09 117.35 121.36 2g4d s TYR 21 Ca 0.00 -0.26 0.03 0.00 -1.01 0.00 0.00 57.07 55.83 2g4d s TYR 21 Cb 0.00 -1.20 -0.01 0.00 -0.11 0.00 0.00 41.96 40.64 2g4d s TYR 21 CO 0.00 0.56 -0.10 -1.50 -1.11 0.00 0.00 175.55 173.40 2g4d s ILE 22 N -1.91 0.77 -0.28 2.71 2.07 0.43 -4.89 121.20 120.09 2g4d s ILE 22 Ca 0.26 -0.48 -0.17 0.00 -1.41 0.00 0.00 60.65 58.85 2g4d s ILE 22 Cb -0.08 -0.66 -0.03 0.00 0.13 0.00 0.00 42.46 41.83 2g4d s ILE 22 CO 0.15 0.17 0.46 -1.59 -1.91 0.00 0.00 174.94 172.22 2g4d s LYS 23 N -0.36 3.96 0.05 3.50 0.00 -1.26 -0.80 119.74 124.83 2g4d s LYS 23 Ca 0.03 0.12 0.07 0.00 0.00 0.00 0.00 55.97 56.19 2g4d s LYS 23 Cb -0.04 -3.68 -0.03 0.00 0.00 0.00 0.00 37.83 34.07 2g4d s LYS 23 CO -0.00 -0.38 -0.15 -0.51 0.00 0.00 0.00 175.35 174.30 2g4d s LEU 24 N 2.23 2.75 -0.24 2.77 1.43 0.84 -1.25 118.68 127.20 2g4d s LEU 24 Ca 0.18 -0.40 0.02 0.00 -1.03 0.00 0.00 54.13 52.90 2g4d s LEU 24 Cb -0.16 -1.60 0.06 0.00 0.03 0.00 0.00 46.19 44.52 2g4d s LEU 24 CO 0.10 0.24 -0.08 -0.75 0.23 0.00 0.00 176.35 176.09 2g4d s LYS 25 N -1.62 1.94 -0.46 1.70 2.20 -0.06 -0.67 119.74 122.76 2g4d s LYS 25 Ca 0.16 -1.14 -0.19 0.00 -0.36 0.00 0.00 55.97 54.44 2g4d s LYS 25 Cb -0.11 -2.72 0.04 0.00 -1.51 0.00 0.00 37.83 33.54 2g4d s LYS 25 CO 0.07 -0.57 0.57 0.08 -0.36 0.00 0.00 175.35 175.14 2g4d s VAL 26 N 1.26 4.93 0.07 4.02 1.01 -0.16 -0.68 120.40 130.86 2g4d s VAL 26 Ca -0.07 -0.29 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2g4d s VAL 26 Cb -0.19 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 2g4d s VAL 26 CO -0.06 -0.63 0.13 -0.63 0.00 0.00 0.00 175.10 173.92 2g4d s ILE 27 N 2.51 4.89 0.51 2.22 1.01 0.10 -1.45 121.20 131.00 2g4d s ILE 27 Ca 0.16 -0.60 0.04 0.00 0.00 0.00 0.00 60.65 60.25 2g4d s ILE 27 Cb -0.17 -3.36 0.00 0.00 0.01 0.00 0.00 42.46 38.94 2g4d s ILE 27 CO 0.14 0.14 0.22 -0.83 0.00 0.00 0.00 174.94 174.61 2g4d s GLY 28 N -2.41 2.60 0.32 6.18 0.00 -0.88 -1.16 107.32 111.97 2g4d s GLY 28 Ca 0.31 -1.09 0.01 0.00 0.00 0.00 0.00 44.72 43.95 2g4d s GLY 28 CO 0.24 -2.03 1.94 -1.61 0.00 0.00 0.00 173.10 171.64 2g4d h GLN 29 N 1.09 0.82 0.00 2.90 4.15 -1.91 0.16 115.11 122.31 2g4d h GLN 29 Ca -0.40 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 58.92 2g4d h GLN 29 Cb 1.30 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.83 2g4d h GLN 29 CO 0.66 0.62 0.00 -0.40 -1.93 0.00 0.00 178.83 177.78 2g4d n ASP 30 N -4.37 0.00 -0.14 -0.69 3.85 -1.26 -4.84 116.55 109.11 2g4d n ASP 30 Ca 0.05 -0.85 -0.02 0.00 -0.71 0.00 0.00 54.79 53.27 2g4d n ASP 30 Cb 0.12 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 39.88 2g4d n ASP 30 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 2g4d n SER 31 N -0.88 -4.67 -4.73 -1.12 7.64 0.55 -4.98 113.62 105.44 2g4d n SER 31 Ca 0.12 0.04 -0.42 0.00 1.01 0.00 0.00 58.87 59.63 2g4d n SER 31 Cb 0.06 -2.32 -0.03 0.00 -1.01 0.00 0.00 64.21 60.90 2g4d n SER 31 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2g4d s SER 32 N -2.13 7.06 -0.13 6.43 1.04 -1.26 -4.73 113.70 119.98 2g4d s SER 32 Ca 0.00 2.17 0.03 0.00 0.48 0.00 0.00 55.95 58.63 2g4d s SER 32 Cb 0.00 -2.59 0.01 0.00 0.10 0.00 0.00 66.02 63.53 2g4d s SER 32 CO 0.00 -0.43 -0.22 -1.83 0.98 0.00 0.00 173.24 171.74 2g4d s GLU 33 N 0.35 2.93 -0.17 4.02 -1.05 -1.26 -2.08 118.70 121.44 2g4d s GLU 33 Ca 0.56 -0.83 -0.06 0.00 -0.15 0.00 0.00 54.97 54.49 2g4d s GLU 33 Cb -0.32 -2.33 -0.04 0.00 -0.44 0.00 0.00 34.13 31.00 2g4d s GLU 33 CO 0.33 0.03 0.04 0.42 0.95 0.00 0.00 175.26 177.03 2g4d s ILE 34 N 0.71 4.57 0.05 1.83 1.01 -0.53 -4.93 121.20 123.91 2g4d s ILE 34 Ca -0.10 -0.11 -0.09 0.00 0.00 0.00 0.00 60.65 60.34 2g4d s ILE 34 Cb -0.16 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 2g4d s ILE 34 CO 0.01 0.48 0.36 -1.00 0.00 0.00 0.00 174.94 174.78 2g4d s HIS 35 N 0.30 3.59 0.00 3.97 3.76 -1.26 -0.99 115.29 124.67 2g4d s HIS 35 Ca 0.02 0.73 0.01 0.00 -0.15 0.00 0.00 55.06 55.67 2g4d s HIS 35 Cb -0.13 -2.11 -0.00 0.00 1.11 0.00 0.00 32.58 31.45 2g4d s HIS 35 CO 0.01 0.56 -0.03 -0.06 -0.85 0.00 0.00 174.74 174.37 2g4d s PHE 36 N -1.34 0.24 -0.32 1.40 0.40 0.15 -4.99 117.98 113.52 2g4d s PHE 36 Ca 0.30 -0.11 -0.04 0.00 -0.60 0.00 0.00 56.93 56.48 2g4d s PHE 36 Cb -0.14 -0.15 0.05 0.00 0.51 0.00 0.00 43.02 43.28 2g4d s PHE 36 CO 0.17 -0.03 0.06 0.21 0.70 0.00 0.00 175.22 176.33 2g4d s LYS 37 N -0.28 2.52 0.23 0.44 2.20 -1.26 -0.11 119.74 123.47 2g4d s LYS 37 Ca -0.01 -1.24 0.08 0.00 -0.36 0.00 0.00 55.97 54.44 2g4d s LYS 37 Cb -0.02 -3.34 -0.05 0.00 -1.51 0.00 0.00 37.83 32.91 2g4d s LYS 37 CO -0.00 -0.66 -0.14 0.14 -0.36 0.00 0.00 175.35 174.33 2g4d s VAL 38 N 1.33 1.86 -0.21 4.02 -7.23 0.02 -4.93 120.40 115.25 2g4d s VAL 38 Ca -0.03 -2.23 -0.10 0.00 -1.81 0.00 0.00 61.98 57.81 2g4d s VAL 38 Cb -0.20 -2.16 -0.05 0.00 0.56 0.00 0.00 36.38 34.54 2g4d s VAL 38 CO 0.01 -0.51 0.14 -1.59 -0.31 0.00 0.00 175.10 172.83 2g4d s LYS 39 N -3.63 4.16 0.16 4.82 0.00 -1.26 0.16 119.74 124.16 2g4d s LYS 39 Ca 0.25 -0.23 -0.10 0.00 0.00 0.00 0.00 55.97 55.89 2g4d s LYS 39 Cb -0.01 -3.45 0.20 0.00 0.00 0.00 0.00 37.83 34.58 2g4d s LYS 39 CO 0.09 0.25 1.04 -1.33 0.00 0.00 0.00 175.35 175.40 2g4d n MET 40 N 3.68 -0.13 -1.76 1.78 2.81 -1.18 -1.65 117.12 120.68 2g4d n MET 40 Ca -0.16 1.04 -0.34 0.00 -1.81 0.00 0.00 57.70 56.43 2g4d n MET 40 Cb 0.52 -1.54 -0.03 0.00 -0.71 0.00 0.00 33.22 31.46 2g4d n MET 40 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 2g4d n THR 41 N -5.02 4.32 -3.80 2.03 5.66 -1.26 -2.59 114.28 113.62 2g4d n THR 41 Ca 0.08 -3.70 -0.13 0.00 -3.05 0.00 0.00 64.05 57.24 2g4d n THR 41 Cb 0.29 -1.83 -0.14 0.00 -1.55 0.00 0.00 70.33 67.10 2g4d n THR 41 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2g4d s THR 42 N -1.76 -0.03 0.22 1.09 2.01 -0.66 -5.08 115.64 111.43 2g4d s THR 42 Ca 0.56 0.11 -0.32 0.00 0.31 0.00 0.00 61.69 62.35 2g4d s THR 42 Cb 0.28 -0.13 -0.12 0.00 0.01 0.00 0.00 72.50 72.54 2g4d s THR 42 CO -0.16 0.04 1.67 1.41 -0.69 0.00 0.00 174.62 176.89 2g4d n HIS 43 N 3.66 2.67 1.96 4.92 8.25 -1.26 -4.36 115.22 131.06 2g4d n HIS 43 Ca -0.20 0.13 0.08 0.00 -0.26 0.00 0.00 57.72 57.47 2g4d n HIS 43 Cb 0.55 -2.63 0.45 0.00 1.12 0.00 0.00 29.99 29.48 2g4d n HIS 43 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2g4d n LEU 44 N 3.48 0.09 0.25 2.41 4.77 0.18 -3.76 117.00 124.42 2g4d n LEU 44 Ca 0.15 -0.04 0.15 0.00 -0.03 0.00 0.00 56.01 56.24 2g4d n LEU 44 Cb 0.34 -0.01 0.85 0.00 -2.33 0.00 0.00 43.42 42.27 2g4d n LEU 44 CO 0.64 0.02 1.13 0.50 -1.33 0.00 0.00 177.39 178.35 2g4d h LYS 45 N 0.12 0.00 0.00 3.23 3.64 -1.58 -1.36 116.57 120.61 2g4d h LYS 45 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2g4d h LYS 45 Cb 0.03 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2g4d h LYS 45 CO 0.00 0.00 -0.02 0.87 -2.27 0.00 0.00 179.45 178.03 2g4d h LYS 46 N 0.00 0.00 -0.96 1.90 1.57 -1.87 -1.82 116.57 115.39 2g4d h LYS 46 Ca 0.04 0.00 0.24 0.00 -1.87 0.00 0.00 60.65 59.06 2g4d h LYS 46 Cb 0.20 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.39 2g4d h LYS 46 CO -0.00 0.63 0.51 1.25 -0.57 0.00 0.00 179.45 181.27 2g4d h LEU 47 N -1.00 0.52 -0.32 2.94 6.46 -1.72 1.32 115.31 123.50 2g4d h LEU 47 Ca -0.00 0.15 -0.09 0.00 -0.12 0.00 0.00 57.88 57.82 2g4d h LEU 47 Cb 0.64 0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 40.64 2g4d h LEU 47 CO -0.00 0.04 -0.13 0.11 -0.62 0.00 0.00 178.44 177.84 2g4d h LYS 48 N 0.49 0.66 -0.44 1.25 1.57 -1.34 -1.37 116.57 117.39 2g4d h LYS 48 Ca 0.61 -0.28 -0.09 0.00 -1.87 0.00 0.00 60.65 59.02 2g4d h LYS 48 Cb 1.18 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.45 2g4d h LYS 48 CO -0.51 0.87 -0.09 0.93 -0.57 0.00 0.00 179.45 180.08 2g4d h GLU 49 N 0.43 0.77 -0.20 3.15 5.08 0.10 -1.82 114.58 122.09 2g4d h GLU 49 Ca 0.08 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 2g4d h GLU 49 Cb 0.66 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2g4d h GLU 49 CO 0.04 0.84 0.01 1.03 -1.00 0.00 0.00 179.01 179.94 2g4d h SER 50 N 0.70 0.34 -0.06 1.42 0.87 0.15 -2.64 113.55 114.33 2g4d h SER 50 Ca 0.12 -0.29 0.03 0.00 -1.23 0.00 0.00 61.79 60.42 2g4d h SER 50 Cb 0.57 -0.09 -0.04 0.00 -0.44 0.00 0.00 62.40 62.40 2g4d h SER 50 CO 0.03 0.55 -0.15 0.22 -0.53 0.00 0.00 176.83 176.95 2g4d h TYR 51 N 0.12 -0.38 -0.78 2.24 3.20 -1.08 -1.18 116.97 119.11 2g4d h TYR 51 Ca 0.06 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.05 2g4d h TYR 51 Cb 0.37 0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.76 2g4d h TYR 51 CO 0.03 -0.22 0.51 0.00 -1.64 0.00 0.00 178.16 176.84 2g4d h GLN 53 N 0.68 0.29 0.00 0.00 4.20 -0.94 0.65 115.11 119.98 2g4d h GLN 53 Ca 0.36 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.96 2g4d h GLN 53 Cb 0.50 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.27 2g4d h GLN 53 CO -0.14 0.58 0.00 0.54 -0.67 0.00 0.00 178.83 179.15 2g4d n ARG 54 N -4.69 0.03 -0.00 1.46 5.12 -0.53 -0.16 116.66 117.88 2g4d n ARG 54 Ca -0.06 0.33 0.03 0.00 -1.93 0.00 0.00 57.85 56.22 2g4d n ARG 54 Cb 0.27 -1.50 -0.04 0.00 -1.16 0.00 0.00 32.46 30.03 2g4d n ARG 54 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 2g4d n GLN 55 N -1.36 2.52 -3.22 5.56 1.13 -0.82 -5.04 117.38 116.15 2g4d n GLN 55 Ca 0.01 -0.03 -0.15 0.00 -1.94 0.00 0.00 57.00 54.89 2g4d n GLN 55 Cb 0.03 -0.95 0.07 0.00 0.11 0.00 0.00 30.24 29.49 2g4d n GLN 55 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g4d n GLY 56 N 1.70 -0.23 3.05 1.08 0.00 0.22 -5.04 105.19 105.97 2g4d n GLY 56 Ca -0.00 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 2g4d n GLY 56 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2g4d s VAL 57 N -3.29 0.37 0.60 1.61 -7.23 -0.64 -5.02 120.40 106.79 2g4d s VAL 57 Ca 0.09 -1.25 -0.20 0.00 -1.81 0.00 0.00 61.98 58.82 2g4d s VAL 57 Cb -0.04 -0.78 -0.03 0.00 0.56 0.00 0.00 36.38 36.09 2g4d s VAL 57 CO 0.60 -0.58 1.29 -2.84 -0.31 0.00 0.00 175.10 173.26 2g4d s PRO 58 N -2.20 2.87 0.18 4.82 0.02 -1.26 -4.59 135.00 134.84 2g4d s PRO 58 Ca -0.06 2.06 -0.16 0.00 0.02 0.00 0.00 61.00 62.85 2g4d s PRO 58 Cb -0.05 -2.02 0.13 0.00 0.02 0.00 0.00 34.50 32.58 2g4d s PRO 58 CO -0.02 -1.35 1.66 0.52 -0.33 0.00 0.00 177.00 177.48 2g4d h MET 59 N 0.97 -0.01 -0.61 5.54 2.86 -1.95 -0.21 114.93 121.52 2g4d h MET 59 Ca -0.51 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 2g4d h MET 59 Cb 1.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.98 2g4d h MET 59 CO 0.55 -0.01 0.00 0.27 1.06 0.00 0.00 176.91 178.79 2g4d n ASN 60 N -5.34 0.62 -0.03 1.22 0.23 -1.26 -2.61 115.26 108.09 2g4d n ASN 60 Ca 0.03 -1.05 0.05 0.00 -0.53 0.00 0.00 54.58 53.08 2g4d n ASN 60 Cb 0.25 -0.26 -0.14 0.00 -2.08 0.00 0.00 39.78 37.54 2g4d n ASN 60 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2g4d n SER 61 N 0.28 0.84 -4.40 0.53 2.88 -0.09 -4.95 113.62 108.71 2g4d n SER 61 Ca 0.00 0.00 -0.20 0.00 -1.33 0.00 0.00 58.87 57.34 2g4d n SER 61 Cb 0.14 1.61 -0.10 0.00 -0.75 0.00 0.00 64.21 65.11 2g4d n SER 61 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2g4d s LEU 62 N -4.50 2.17 -0.04 2.46 1.43 -1.07 -3.45 118.68 115.67 2g4d s LEU 62 Ca -0.07 -1.30 0.02 0.00 -1.03 0.00 0.00 54.13 51.74 2g4d s LEU 62 Cb 0.10 -0.34 0.01 0.00 0.03 0.00 0.00 46.19 45.99 2g4d s LEU 62 CO 0.74 -0.55 -0.08 -0.13 0.23 0.00 0.00 176.35 176.56 2g4d s ARG 63 N -3.87 1.09 -0.30 1.70 1.81 -0.02 -4.95 118.95 114.39 2g4d s ARG 63 Ca 0.33 -0.24 -0.08 0.00 -1.72 0.00 0.00 55.73 54.02 2g4d s ARG 63 Cb 0.07 -0.99 -0.00 0.00 -0.45 0.00 0.00 34.95 33.58 2g4d s ARG 63 CO 0.13 -0.00 0.12 -0.06 -0.68 0.00 0.00 175.30 174.80 2g4d s PHE 64 N 0.65 3.16 -0.06 -0.53 0.40 -1.26 -0.98 117.98 119.36 2g4d s PHE 64 Ca -0.10 -0.75 0.03 0.00 -0.60 0.00 0.00 56.93 55.50 2g4d s PHE 64 Cb -0.13 -2.31 -0.03 0.00 0.51 0.00 0.00 43.02 41.06 2g4d s PHE 64 CO 0.01 -0.51 -0.13 -0.51 0.70 0.00 0.00 175.22 174.79 2g4d s LEU 65 N 1.56 2.82 -0.25 -0.37 1.02 -0.40 0.15 118.68 123.22 2g4d s LEU 65 Ca 0.04 -0.17 -0.02 0.00 0.02 0.00 0.00 54.13 54.00 2g4d s LEU 65 Cb -0.17 -1.58 0.02 0.00 0.02 0.00 0.00 46.19 44.48 2g4d s LEU 65 CO 0.04 0.33 -0.06 0.12 0.02 0.00 0.00 176.35 176.81 2g4d s PHE 66 N -0.66 3.05 -1.30 0.29 5.36 0.25 -1.29 117.98 123.68 2g4d s PHE 66 Ca 0.10 -1.49 -0.14 0.00 -0.96 0.00 0.00 56.93 54.44 2g4d s PHE 66 Cb -0.11 -2.06 0.01 0.00 -0.34 0.00 0.00 43.02 40.51 2g4d s PHE 66 CO 0.01 -0.71 0.53 0.39 -1.46 0.00 0.00 175.22 173.98 2g4d n GLU 67 N 4.68 -1.70 0.00 10.12 1.02 -1.26 -0.26 120.64 133.24 2g4d n GLU 67 Ca -0.17 0.31 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 2g4d n GLU 67 Cb 0.47 -3.85 0.00 0.00 -0.02 0.00 0.00 31.44 28.05 2g4d n GLU 67 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g4d n GLY 68 N -2.00 2.75 3.72 0.62 0.00 -1.26 -4.99 105.19 104.02 2g4d n GLY 68 Ca -0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.43 2g4d n GLY 68 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2g4d s GLN 69 N 0.00 4.36 -0.05 1.61 -0.44 0.65 -4.97 119.66 120.81 2g4d s GLN 69 Ca 0.00 0.55 -0.30 0.00 -2.50 0.00 0.00 55.36 53.11 2g4d s GLN 69 Cb 0.00 -3.44 -0.05 0.00 -1.64 0.00 0.00 33.01 27.87 2g4d s GLN 69 CO 0.00 0.13 1.58 0.50 0.50 0.00 0.00 175.29 178.00 2g4d s ARG 70 N 0.70 4.20 -0.29 1.67 6.06 -1.26 0.85 118.95 130.87 2g4d s ARG 70 Ca 0.29 2.12 -0.26 0.00 -2.50 0.00 0.00 55.73 55.38 2g4d s ARG 70 Cb -0.16 -3.88 0.01 0.00 0.06 0.00 0.00 34.95 30.98 2g4d s ARG 70 CO 0.12 -0.79 0.91 0.42 -2.50 0.00 0.00 175.30 173.46 2g4d s ILE 71 N 3.65 4.70 0.49 4.11 1.01 0.41 -4.91 121.20 130.66 2g4d s ILE 71 Ca 0.70 1.51 -0.00 0.00 0.00 0.00 0.00 60.65 62.86 2g4d s ILE 71 Cb -0.32 -4.24 0.01 0.00 0.01 0.00 0.00 42.46 37.91 2g4d s ILE 71 CO 0.28 -0.28 0.72 0.00 0.00 0.00 0.00 174.94 175.66 2g4d s ALA 72 N 3.17 3.73 0.22 9.38 0.00 -1.26 -4.65 121.76 132.34 2g4d s ALA 72 Ca 0.38 -1.07 -0.08 0.00 0.00 0.00 0.00 51.96 51.18 2g4d s ALA 72 Cb -0.14 -2.18 0.33 0.00 0.00 0.00 0.00 23.12 21.13 2g4d s ALA 72 CO 0.12 -0.52 1.73 -0.44 0.00 0.00 0.00 175.76 176.65 2g4d h ASP 73 N 0.25 0.16 -0.69 0.00 5.19 -1.96 -2.35 116.42 117.02 2g4d h ASP 73 Ca -0.45 0.10 -0.45 0.00 -0.62 0.00 0.00 57.03 55.61 2g4d h ASP 73 Cb 1.26 0.10 -0.20 0.00 0.18 0.00 0.00 39.33 40.67 2g4d h ASP 73 CO 0.57 0.08 0.58 -0.46 -3.12 0.00 0.00 179.24 176.88 2g4d n ASN 74 N -5.05 6.30 -4.80 6.45 6.94 -1.26 -1.80 115.26 122.04 2g4d n ASN 74 Ca 0.10 -3.31 -0.36 0.00 -0.02 0.00 0.00 54.58 50.99 2g4d n ASN 74 Cb 0.33 -0.97 -0.07 0.00 -2.36 0.00 0.00 39.78 36.71 2g4d n ASN 74 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 2g4d s HIS 75 N -2.56 3.44 0.02 -2.53 3.76 -0.89 -4.93 115.29 111.61 2g4d s HIS 75 Ca 0.44 0.40 0.07 0.00 -0.15 0.00 0.00 55.06 55.82 2g4d s HIS 75 Cb 0.35 -1.90 -0.02 0.00 1.11 0.00 0.00 32.58 32.11 2g4d s HIS 75 CO 0.01 0.62 -0.22 0.95 -0.85 0.00 0.00 174.74 175.25 2g4d s THR 76 N -0.90 1.75 0.49 1.30 -4.23 -1.26 -0.64 115.64 112.15 2g4d s THR 76 Ca 0.14 -1.13 0.28 0.00 -1.18 0.00 0.00 61.69 59.79 2g4d s THR 76 Cb -0.12 -1.50 0.46 0.00 1.34 0.00 0.00 72.50 72.69 2g4d s THR 76 CO 0.03 0.33 1.84 -0.65 -0.54 0.00 0.00 174.62 175.63 2g4d h PRO 77 N 5.11 0.15 -0.11 3.99 0.11 -1.72 0.42 132.00 139.94 2g4d h PRO 77 Ca -0.42 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.65 2g4d h PRO 77 Cb 1.15 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2g4d h PRO 77 CO 0.45 0.10 -0.06 -0.22 -0.21 0.00 0.00 178.00 178.05 2g4d h LYS 78 N 0.15 0.24 -0.18 1.05 3.11 -1.80 0.73 116.57 119.86 2g4d h LYS 78 Ca 0.50 -0.11 -0.00 0.00 -2.81 0.00 0.00 60.65 58.23 2g4d h LYS 78 Cb 1.72 -0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.93 2g4d h LYS 78 CO -0.10 0.60 0.11 1.49 -2.81 0.00 0.00 179.45 178.74 2g4d h GLU 79 N -0.13 0.25 0.00 1.90 4.81 -1.25 -1.61 114.58 118.55 2g4d h GLU 79 Ca 0.02 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2g4d h GLU 79 Cb 0.53 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.86 2g4d h GLU 79 CO 0.02 0.20 0.00 -0.07 -0.73 0.00 0.00 179.01 178.43 2g4d h LEU 80 N 0.22 0.00 -0.77 1.64 3.38 -1.21 -3.47 115.31 115.11 2g4d h LEU 80 Ca 0.07 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.88 2g4d h LEU 80 Cb 0.01 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.81 2g4d h LEU 80 CO -0.01 0.00 -0.26 0.61 0.09 0.00 0.00 178.44 178.86 2g4d n GLY 81 N 0.03 0.34 3.79 0.83 0.00 0.36 -5.00 105.19 105.54 2g4d n GLY 81 Ca 0.02 -0.33 -0.35 0.00 0.00 0.00 0.00 46.02 45.36 2g4d n GLY 81 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2g4d s MET 82 N -5.43 3.96 0.39 1.61 -1.94 0.23 -5.01 119.30 113.12 2g4d s MET 82 Ca 0.21 1.44 0.08 0.00 -1.71 0.00 0.00 55.69 55.71 2g4d s MET 82 Cb -0.09 -2.30 -0.07 0.00 2.01 0.00 0.00 34.83 34.38 2g4d s MET 82 CO 0.26 -0.30 0.06 -1.21 -0.01 0.00 0.00 175.02 173.82 2g4d s GLU 83 N -2.89 2.05 0.22 2.03 2.02 -1.26 -4.78 118.70 116.08 2g4d s GLU 83 Ca 0.63 -1.96 -0.32 0.00 0.02 0.00 0.00 54.97 53.34 2g4d s GLU 83 Cb -0.19 -1.80 -0.13 0.00 0.10 0.00 0.00 34.13 32.11 2g4d s GLU 83 CO 0.24 -0.03 1.48 -1.91 0.02 0.00 0.00 175.26 175.06 2g4d n GLU 84 N -1.04 2.14 -2.29 1.61 4.07 -1.26 -2.28 120.64 121.59 2g4d n GLU 84 Ca -0.04 0.76 -0.10 0.00 -0.06 0.00 0.00 57.16 57.73 2g4d n GLU 84 Cb 0.65 -2.47 0.00 0.00 -0.06 0.00 0.00 31.44 29.56 2g4d n GLU 84 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 2g4d n GLU 85 N 2.53 -1.13 -2.78 5.31 4.07 -0.38 -4.95 120.64 123.30 2g4d n GLU 85 Ca 0.13 0.44 -0.26 0.00 -0.06 0.00 0.00 57.16 57.41 2g4d n GLU 85 Cb 0.31 -4.41 0.00 0.00 -0.06 0.00 0.00 31.44 27.28 2g4d n GLU 85 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 2g4d s ASP 86 N -2.65 6.11 -0.04 4.31 1.01 -0.97 -4.87 116.67 119.57 2g4d s ASP 86 Ca 0.04 0.73 -0.00 0.00 0.71 0.00 0.00 52.55 54.02 2g4d s ASP 86 Cb -0.02 -2.03 -0.03 0.00 1.01 0.00 0.00 42.92 41.85 2g4d s ASP 86 CO 0.04 -0.62 0.00 -0.69 0.21 0.00 0.00 175.17 174.12 2g4d s VAL 87 N -2.68 4.23 -0.18 -1.27 1.01 -1.26 -0.89 120.40 119.36 2g4d s VAL 87 Ca 0.47 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.02 2g4d s VAL 87 Cb -0.10 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.47 2g4d s VAL 87 CO 0.42 0.48 -0.14 -0.63 0.00 0.00 0.00 175.10 175.23 2g4d s ILE 88 N -0.99 1.78 0.06 2.22 1.01 0.15 -4.50 121.20 120.93 2g4d s ILE 88 Ca 0.17 -0.92 -0.20 0.00 0.00 0.00 0.00 60.65 59.70 2g4d s ILE 88 Cb -0.11 -1.73 -0.07 0.00 0.01 0.00 0.00 42.46 40.56 2g4d s ILE 88 CO 0.07 0.35 0.58 -1.61 0.00 0.00 0.00 174.94 174.33 2g4d s GLU 89 N 1.37 4.24 -0.14 2.79 2.02 -0.41 -0.72 118.70 127.85 2g4d s GLU 89 Ca 0.02 0.76 -0.02 0.00 0.02 0.00 0.00 54.97 55.74 2g4d s GLU 89 Cb -0.15 -3.26 -0.02 0.00 0.10 0.00 0.00 34.13 30.80 2g4d s GLU 89 CO -0.10 0.59 -0.06 0.08 0.02 0.00 0.00 175.26 175.79 2g4d s VAL 90 N -0.97 3.70 0.22 2.63 1.01 -0.31 -1.27 120.40 125.41 2g4d s VAL 90 Ca 0.30 -0.43 0.11 0.00 0.00 0.00 0.00 61.98 61.95 2g4d s VAL 90 Cb -0.19 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.55 2g4d s VAL 90 CO 0.19 0.51 -0.18 -0.31 0.00 0.00 0.00 175.10 175.31 2g4d s TYR 91 N 0.22 2.40 0.27 5.22 1.51 -0.16 -4.30 117.35 122.51 2g4d s TYR 91 Ca -0.04 -0.31 0.06 0.00 -1.01 0.00 0.00 57.07 55.77 2g4d s TYR 91 Cb -0.14 -1.14 -0.03 0.00 -0.11 0.00 0.00 41.96 40.54 2g4d s TYR 91 CO 0.03 0.57 0.33 -0.65 -1.11 0.00 0.00 175.55 174.72 2g4d s GLN 92 N -2.99 3.19 0.40 -0.62 -1.52 -1.26 -0.84 119.66 116.01 2g4d s GLN 92 Ca 0.25 -0.93 -0.27 0.00 -1.95 0.00 0.00 55.36 52.46 2g4d s GLN 92 Cb -0.07 -2.75 -0.10 0.00 -0.22 0.00 0.00 33.01 29.86 2g4d s GLN 92 CO 0.13 0.33 1.37 -1.91 -0.25 0.00 0.00 175.29 174.96 2g4d n GLU 93 N -1.38 2.25 -5.02 2.91 2.13 -1.22 -4.89 120.64 115.41 2g4d n GLU 93 Ca -0.07 0.79 -0.32 0.00 0.66 0.00 0.00 57.16 58.23 2g4d n GLU 93 Cb 0.58 -2.51 -0.15 0.00 0.27 0.00 0.00 31.44 29.63 2g4d n GLU 93 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2g4d s GLN 94 N -2.17 2.71 0.11 5.31 -0.21 -1.26 -5.13 119.66 119.03 2g4d s GLN 94 Ca 0.58 -0.78 0.01 0.00 0.02 0.00 0.00 55.36 55.19 2g4d s GLN 94 Cb -0.50 -2.34 -0.04 0.00 1.00 0.00 0.00 33.01 31.13 2g4d s GLN 94 CO 0.60 0.43 -0.04 0.95 -2.12 0.00 0.00 175.29 175.11 2g4d s THR 95 N -0.26 0.60 -0.19 -0.19 -4.23 -1.26 -5.16 115.64 104.95 2g4d s THR 95 Ca 0.00 -1.93 -0.30 0.00 -1.18 0.00 0.00 61.69 58.29 2g4d s THR 95 Cb -0.13 -1.76 0.14 0.00 1.34 0.00 0.00 72.50 72.09 2g4d s THR 95 CO 0.03 -0.80 1.05 -0.83 -0.54 0.00 0.00 174.62 173.53 2g4d s GLY 96 N -3.05 -0.20 0.00 3.99 0.00 -1.26 -5.33 107.32 101.47 2g4d s GLY 96 Ca 0.14 2.19 0.08 0.00 0.00 0.00 0.00 44.72 47.13 2g4d s GLY 96 CO -0.04 1.10 0.74 0.61 0.00 0.00 0.00 173.10 175.52