#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2gw4 s MET 1 N 0.00 2.61 0.14 -0.52 -1.94 -1.26 -5.05 119.30 113.28 2gw4 s MET 1 Ca 0.00 -1.92 -0.35 0.00 -1.71 0.00 0.00 55.69 51.71 2gw4 s MET 1 Cb 0.00 -3.97 -0.15 0.00 2.01 0.00 0.00 34.83 32.72 2gw4 s MET 1 CO 0.00 -1.21 1.44 0.45 -0.01 0.00 0.00 175.02 175.69 2gw4 n SER 2 N 4.67 2.39 -0.94 3.03 2.88 -1.26 -4.90 113.62 119.48 2gw4 n SER 2 Ca -0.04 1.11 0.09 0.00 -1.33 0.00 0.00 58.87 58.69 2gw4 n SER 2 Cb 0.41 -1.32 0.21 0.00 -0.75 0.00 0.00 64.21 62.75 2gw4 n SER 2 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2gw4 n LEU 3 N 2.86 3.26 -4.72 2.46 4.77 -1.26 -4.99 117.00 119.38 2gw4 n LEU 3 Ca 0.17 -1.82 -0.43 0.00 -0.03 0.00 0.00 56.01 53.90 2gw4 n LEU 3 Cb 0.25 -0.29 -0.02 0.00 -2.33 0.00 0.00 43.42 41.03 2gw4 n LEU 3 CO 0.63 0.78 1.16 -0.38 -1.33 0.00 0.00 177.39 178.24 2gw4 n ILE 4 N 1.06 1.07 -2.73 -0.08 5.41 -1.26 -4.97 119.36 117.85 2gw4 n ILE 4 Ca 0.17 -0.27 -0.26 0.00 1.00 0.00 0.00 62.75 63.39 2gw4 n ILE 4 Cb 0.51 -1.80 0.01 0.00 -0.71 0.00 0.00 39.64 37.65 2gw4 n ILE 4 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2gw4 s LYS 5 N -0.57 3.28 0.60 0.38 1.02 -1.26 -4.98 119.74 118.21 2gw4 s LYS 5 Ca 0.65 -0.05 0.35 0.00 0.02 0.00 0.00 55.97 56.94 2gw4 s LYS 5 Cb -0.55 -2.42 1.95 0.00 -0.52 0.00 0.00 37.83 36.29 2gw4 s LYS 5 CO 0.50 -0.30 2.24 -1.35 -0.92 0.00 0.00 175.35 175.52 2gw4 h PRO 6 N 0.22 0.00 -4.54 -1.68 0.11 -1.93 -3.40 132.00 120.78 2gw4 h PRO 6 Ca -0.47 0.00 -0.55 0.00 0.11 0.00 0.00 66.00 65.09 2gw4 h PRO 6 Cb 1.23 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.99 2gw4 h PRO 6 CO 0.60 0.03 -0.82 -1.21 -0.21 0.00 0.00 178.00 176.39 2gw4 s GLU 7 N -4.28 1.87 0.10 1.05 2.02 -1.26 -3.87 118.70 114.33 2gw4 s GLU 7 Ca -0.04 -0.43 0.03 0.00 0.02 0.00 0.00 54.97 54.54 2gw4 s GLU 7 Cb 0.13 -1.67 -0.04 0.00 0.10 0.00 0.00 34.13 32.66 2gw4 s GLU 7 CO 0.50 -0.10 -0.08 -1.64 0.02 0.00 0.00 175.26 173.96 2gw4 s MET 8 N 1.11 0.83 0.28 1.61 -1.94 -0.50 -5.00 119.30 115.70 2gw4 s MET 8 Ca -0.05 -1.24 0.07 0.00 -1.71 0.00 0.00 55.69 52.76 2gw4 s MET 8 Cb -0.14 -0.36 -0.03 0.00 2.01 0.00 0.00 34.83 36.31 2gw4 s MET 8 CO -0.02 0.03 0.24 0.15 -0.01 0.00 0.00 175.02 175.41 2gw4 s LYS 9 N -3.29 2.86 -0.02 2.03 1.02 -1.26 -0.91 119.74 120.17 2gw4 s LYS 9 Ca 0.08 -1.14 0.01 0.00 0.02 0.00 0.00 55.97 54.94 2gw4 s LYS 9 Cb 0.01 -2.54 0.01 0.00 -0.52 0.00 0.00 37.83 34.79 2gw4 s LYS 9 CO -0.02 0.28 -0.01 0.42 -0.92 0.00 0.00 175.35 175.09 2gw4 s ILE 10 N -2.20 0.21 -0.04 2.17 1.01 0.19 -4.84 121.20 117.71 2gw4 s ILE 10 Ca 0.36 -0.01 0.05 0.00 0.00 0.00 0.00 60.65 61.05 2gw4 s ILE 10 Cb -0.07 -0.25 -0.01 0.00 0.01 0.00 0.00 42.46 42.14 2gw4 s ILE 10 CO 0.26 0.11 -0.18 -0.54 0.00 0.00 0.00 174.94 174.59 2gw4 s LYS 11 N 0.54 1.80 -0.02 2.79 -0.14 -1.26 -0.63 119.74 122.82 2gw4 s LYS 11 Ca -0.05 -0.66 -0.08 0.00 -1.36 0.00 0.00 55.97 53.81 2gw4 s LYS 11 Cb -0.08 -1.60 0.01 0.00 -1.68 0.00 0.00 37.83 34.47 2gw4 s LYS 11 CO -0.01 0.30 0.18 -1.17 -0.76 0.00 0.00 175.35 173.89 2gw4 s LEU 12 N -0.11 1.36 -0.07 3.17 0.20 0.11 -4.98 118.68 118.37 2gw4 s LEU 12 Ca -0.01 -0.02 -0.02 0.00 0.69 0.00 0.00 54.13 54.77 2gw4 s LEU 12 Cb -0.11 0.78 0.03 0.00 -0.43 0.00 0.00 46.19 46.46 2gw4 s LEU 12 CO 0.02 -0.32 0.04 -0.22 -0.29 0.00 0.00 176.35 175.58 2gw4 s LEU 13 N -1.04 0.35 -0.15 -0.68 2.96 -1.26 -0.48 118.68 118.38 2gw4 s LEU 13 Ca -0.11 -0.06 -0.00 0.00 -0.22 0.00 0.00 54.13 53.73 2gw4 s LEU 13 Cb -0.06 -0.27 -0.01 0.00 0.50 0.00 0.00 46.19 46.35 2gw4 s LEU 13 CO 0.02 -0.24 -0.13 -0.32 -1.32 0.00 0.00 176.35 174.36 2gw4 s MET 14 N 2.09 3.33 -0.14 1.98 -2.45 0.40 -4.99 119.30 119.50 2gw4 s MET 14 Ca 0.05 -0.70 0.00 0.00 -1.25 0.00 0.00 55.69 53.79 2gw4 s MET 14 Cb -0.13 -2.66 -0.01 0.00 1.25 0.00 0.00 34.83 33.29 2gw4 s MET 14 CO -0.04 0.11 -0.14 -1.21 1.05 0.00 0.00 175.02 174.79 2gw4 s GLU 15 N 0.60 3.29 0.32 4.11 2.02 -1.26 -0.90 118.70 126.88 2gw4 s GLU 15 Ca -0.08 -0.72 -0.05 0.00 0.02 0.00 0.00 54.97 54.14 2gw4 s GLU 15 Cb -0.16 -2.62 -0.00 0.00 0.10 0.00 0.00 34.13 31.45 2gw4 s GLU 15 CO 0.03 0.12 0.46 0.20 0.02 0.00 0.00 175.26 176.09 2gw4 s GLY 16 N 0.58 1.29 -0.25 -1.39 0.00 -0.37 -5.02 107.32 102.15 2gw4 s GLY 16 Ca -0.09 -1.40 -0.08 0.00 0.00 0.00 0.00 44.72 43.16 2gw4 s GLY 16 CO 0.03 -0.94 0.53 0.21 0.00 0.00 0.00 173.10 172.93 2gw4 s ASN 17 N -3.19 -0.69 -0.15 1.64 3.84 -1.26 -1.43 114.94 113.71 2gw4 s ASN 17 Ca 0.29 1.21 0.01 0.00 0.21 0.00 0.00 52.86 54.58 2gw4 s ASN 17 Cb -0.00 1.81 0.02 0.00 -0.55 0.00 0.00 41.25 42.53 2gw4 s ASN 17 CO 0.17 -0.23 -0.17 -0.69 -2.79 0.00 0.00 177.10 173.40 2gw4 s VAL 18 N 2.75 1.74 -1.39 -5.21 1.01 -0.55 -4.72 120.40 114.03 2gw4 s VAL 18 Ca -0.02 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 2gw4 s VAL 18 Cb -0.12 -1.59 0.09 0.00 0.00 0.00 0.00 36.38 34.76 2gw4 s VAL 18 CO -0.16 0.49 0.60 0.59 0.00 0.00 0.00 175.10 176.62 2gw4 n ASN 19 N 4.53 -3.74 0.00 3.32 4.13 -1.26 -0.65 115.26 121.59 2gw4 n ASN 19 Ca -0.19 -0.56 0.00 0.00 1.68 0.00 0.00 54.58 55.52 2gw4 n ASN 19 Cb 0.50 -3.07 0.00 0.00 -1.54 0.00 0.00 39.78 35.67 2gw4 n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2gw4 n GLY 20 N -1.27 1.29 3.57 7.41 0.00 -1.26 -5.03 105.19 109.90 2gw4 n GLY 20 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2gw4 n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2gw4 s HIS 21 N -2.34 3.11 0.24 1.61 5.04 0.17 -5.04 115.29 118.08 2gw4 s HIS 21 Ca 0.00 0.37 -0.21 0.00 -1.54 0.00 0.00 55.06 53.68 2gw4 s HIS 21 Cb 0.00 -3.32 -0.09 0.00 0.04 0.00 0.00 32.58 29.21 2gw4 s HIS 21 CO 0.00 -0.73 0.77 -1.14 -2.34 0.00 0.00 174.74 171.30 2gw4 s GLN 22 N 2.94 4.32 0.17 2.88 -0.44 -1.26 -1.48 119.66 126.80 2gw4 s GLN 22 Ca 0.28 0.97 -0.21 0.00 -2.50 0.00 0.00 55.36 53.89 2gw4 s GLN 22 Cb -0.14 -2.88 0.05 0.00 -1.64 0.00 0.00 33.01 28.41 2gw4 s GLN 22 CO 0.17 0.38 0.57 -0.59 0.50 0.00 0.00 175.29 176.32 2gw4 s PHE 23 N -1.53 -0.39 -0.03 1.67 -0.71 -0.51 -4.13 117.98 112.35 2gw4 s PHE 23 Ca 0.44 0.12 0.01 0.00 -1.04 0.00 0.00 56.93 56.47 2gw4 s PHE 23 Cb -0.17 0.51 0.01 0.00 -1.21 0.00 0.00 43.02 42.16 2gw4 s PHE 23 CO 0.22 -0.88 -0.04 0.08 -1.34 0.00 0.00 175.22 173.26 2gw4 s VAL 24 N -3.79 0.42 -0.05 -2.49 1.01 -0.59 -1.24 120.40 113.67 2gw4 s VAL 24 Ca 0.03 -0.11 0.03 0.00 0.00 0.00 0.00 61.98 61.93 2gw4 s VAL 24 Cb -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 36.38 35.95 2gw4 s VAL 24 CO -0.09 0.17 -0.11 -0.63 0.00 0.00 0.00 175.10 174.43 2gw4 s ILE 25 N 0.59 1.03 -0.05 2.22 1.01 -0.08 -0.33 121.20 125.59 2gw4 s ILE 25 Ca -0.07 -0.45 -0.00 0.00 0.00 0.00 0.00 60.65 60.13 2gw4 s ILE 25 Cb -0.10 -0.93 -0.03 0.00 0.01 0.00 0.00 42.46 41.40 2gw4 s ILE 25 CO -0.00 0.32 -0.01 -1.61 0.00 0.00 0.00 174.94 173.64 2gw4 s GLU 26 N 0.47 2.88 0.02 2.79 2.02 0.06 -0.46 118.70 126.47 2gw4 s GLU 26 Ca -0.10 -0.50 0.05 0.00 0.02 0.00 0.00 54.97 54.44 2gw4 s GLU 26 Cb -0.13 -2.72 -0.02 0.00 0.10 0.00 0.00 34.13 31.36 2gw4 s GLU 26 CO 0.02 0.67 -0.14 0.20 0.02 0.00 0.00 175.26 176.03 2gw4 s GLY 27 N -1.13 0.75 -0.09 -1.39 0.00 0.37 -0.71 107.32 105.11 2gw4 s GLY 27 Ca 0.16 -0.73 -0.02 0.00 0.00 0.00 0.00 44.72 44.13 2gw4 s GLY 27 CO 0.05 -0.66 0.01 -0.35 0.00 0.00 0.00 173.10 172.15 2gw4 s ASP 28 N -0.76 1.77 0.00 1.64 2.15 -0.47 -0.71 116.67 120.28 2gw4 s ASP 28 Ca 0.04 -0.19 0.00 0.00 0.43 0.00 0.00 52.55 52.82 2gw4 s ASP 28 Cb -0.07 -0.43 0.00 0.00 -0.30 0.00 0.00 42.92 42.12 2gw4 s ASP 28 CO 0.00 -0.22 0.00 0.61 -0.17 0.00 0.00 175.17 175.39 2gw4 n GLY 29 N 5.15 4.13 3.76 2.66 0.00 0.20 -0.32 105.19 120.77 2gw4 n GLY 29 Ca -0.07 -1.11 -0.03 0.00 0.00 0.00 0.00 46.02 44.82 2gw4 n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2gw4 s LYS 30 N 0.96 1.14 0.10 1.61 0.00 -0.65 -0.64 119.74 122.26 2gw4 s LYS 30 Ca 0.00 -0.65 -0.25 0.00 0.00 0.00 0.00 55.97 55.07 2gw4 s LYS 30 Cb 0.00 0.37 0.09 0.00 0.00 0.00 0.00 37.83 38.29 2gw4 s LYS 30 CO 0.00 -0.52 1.11 0.20 0.00 0.00 0.00 175.35 176.14 2gw4 s GLY 31 N -3.03 -0.11 -0.49 0.59 0.00 -0.09 -1.36 107.32 102.83 2gw4 s GLY 31 Ca 0.14 0.03 0.03 0.00 0.00 0.00 0.00 44.72 44.92 2gw4 s GLY 31 CO 0.02 2.00 0.24 0.30 0.00 0.00 0.00 173.10 175.66 2gw4 s HIS 32 N -2.44 3.34 0.25 1.90 3.76 0.63 -1.42 115.29 121.32 2gw4 s HIS 32 Ca 0.20 -3.05 -0.04 0.00 -0.15 0.00 0.00 55.06 52.01 2gw4 s HIS 32 Cb -0.00 -2.91 0.51 0.00 1.11 0.00 0.00 32.58 31.28 2gw4 s HIS 32 CO 0.02 -0.80 1.65 -1.35 -0.85 0.00 0.00 174.74 173.41 2gw4 h PRO 33 N 6.85 0.17 0.00 8.40 0.11 -1.78 -0.78 132.00 144.97 2gw4 h PRO 33 Ca -0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.03 2gw4 h PRO 33 Cb 0.93 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.00 2gw4 h PRO 33 CO 0.66 0.12 0.00 1.19 -0.21 0.00 0.00 178.00 179.76 2gw4 n PHE 34 N -5.26 0.19 0.91 0.65 3.01 -1.26 -2.46 117.46 113.25 2gw4 n PHE 34 Ca 0.16 0.06 0.10 0.00 1.01 0.00 0.00 57.45 58.78 2gw4 n PHE 34 Cb 0.52 -0.60 -0.11 0.00 -0.01 0.00 0.00 39.48 39.28 2gw4 n PHE 34 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 2gw4 n GLU 35 N -1.66 0.06 -2.51 -1.08 1.02 -0.42 -4.98 120.64 111.07 2gw4 n GLU 35 Ca 0.06 -0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.07 2gw4 n GLU 35 Cb 0.32 -1.50 0.01 0.00 -0.02 0.00 0.00 31.44 30.24 2gw4 n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2gw4 n GLY 36 N 1.48 -0.01 3.17 0.62 0.00 -0.51 -5.03 105.19 104.91 2gw4 n GLY 36 Ca 0.03 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.50 2gw4 n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2gw4 s LYS 37 N -4.94 1.11 0.08 1.61 1.02 -1.11 -5.03 119.74 112.48 2gw4 s LYS 37 Ca 0.11 -0.76 -0.18 0.00 0.02 0.00 0.00 55.97 55.15 2gw4 s LYS 37 Cb -0.05 -1.14 0.04 0.00 -0.52 0.00 0.00 37.83 36.16 2gw4 s LYS 37 CO 0.13 0.29 0.44 1.14 -0.92 0.00 0.00 175.35 176.43 2gw4 s GLN 38 N -0.99 1.03 0.05 1.68 -2.07 -1.26 -0.27 119.66 117.83 2gw4 s GLN 38 Ca 0.04 -0.48 -0.06 0.00 -1.82 0.00 0.00 55.36 53.04 2gw4 s GLN 38 Cb -0.08 0.46 -0.01 0.00 -1.09 0.00 0.00 33.01 32.29 2gw4 s GLN 38 CO 0.01 -0.38 0.12 -1.54 -1.32 0.00 0.00 175.29 172.17 2gw4 s SER 39 N -2.36 0.18 -0.10 12.60 1.04 -0.47 -5.00 113.70 119.60 2gw4 s SER 39 Ca -0.02 -0.60 -0.21 0.00 0.48 0.00 0.00 55.95 55.61 2gw4 s SER 39 Cb 0.00 0.26 0.05 0.00 0.10 0.00 0.00 66.02 66.43 2gw4 s SER 39 CO -0.07 -0.58 0.51 -0.32 0.98 0.00 0.00 173.24 173.76 2gw4 s MET 40 N -3.06 0.77 -0.28 4.02 0.00 -1.26 -1.64 119.30 117.85 2gw4 s MET 40 Ca -0.01 0.30 -0.11 0.00 0.00 0.00 0.00 55.69 55.86 2gw4 s MET 40 Cb 0.01 0.36 -0.05 0.00 0.00 0.00 0.00 34.83 35.16 2gw4 s MET 40 CO -0.07 -0.19 0.20 -0.51 0.00 0.00 0.00 175.02 174.46 2gw4 s ASP 41 N -0.67 6.04 -0.09 1.11 1.01 0.56 -4.93 116.67 119.70 2gw4 s ASP 41 Ca -0.08 0.02 -0.00 0.00 0.71 0.00 0.00 52.55 53.20 2gw4 s ASP 41 Cb -0.03 -2.13 -0.03 0.00 1.01 0.00 0.00 42.92 41.75 2gw4 s ASP 41 CO 0.05 -0.06 -0.08 -0.76 0.21 0.00 0.00 175.17 174.54 2gw4 s LEU 42 N 1.75 3.10 -0.06 1.23 1.43 -1.26 -1.37 118.68 123.50 2gw4 s LEU 42 Ca 0.08 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 2gw4 s LEU 42 Cb -0.16 -1.69 0.02 0.00 0.03 0.00 0.00 46.19 44.39 2gw4 s LEU 42 CO 0.11 0.29 -0.08 -0.69 0.23 0.00 0.00 176.35 176.21 2gw4 s VAL 43 N -0.41 0.81 -0.28 -1.59 1.01 0.11 -4.98 120.40 115.08 2gw4 s VAL 43 Ca 0.06 -0.28 -0.29 0.00 0.00 0.00 0.00 61.98 61.47 2gw4 s VAL 43 Cb -0.12 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.48 2gw4 s VAL 43 CO 0.02 0.29 1.12 -0.69 0.00 0.00 0.00 175.10 175.84 2gw4 s VAL 44 N 0.84 4.46 -0.12 2.92 1.01 -1.26 -0.76 120.40 127.48 2gw4 s VAL 44 Ca -0.12 1.70 0.16 0.00 0.00 0.00 0.00 61.98 63.72 2gw4 s VAL 44 Cb -0.15 -4.32 -0.23 0.00 0.00 0.00 0.00 36.38 31.68 2gw4 s VAL 44 CO 0.01 -0.39 0.42 0.29 0.00 0.00 0.00 175.10 175.43 2gw4 n LYS 45 N 6.81 0.66 -3.87 2.72 4.76 0.55 -4.86 118.16 124.94 2gw4 n LYS 45 Ca 0.13 0.12 -0.11 0.00 -2.87 0.00 0.00 58.31 55.57 2gw4 n LYS 45 Cb 0.47 -1.66 -0.11 0.00 -1.84 0.00 0.00 35.03 31.88 2gw4 n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2gw4 s GLU 46 N -2.66 0.29 0.00 1.97 2.02 -1.07 -4.88 118.70 114.37 2gw4 s GLU 46 Ca -0.07 -0.17 0.00 0.00 0.02 0.00 0.00 54.97 54.75 2gw4 s GLU 46 Cb 0.08 0.12 0.00 0.00 0.10 0.00 0.00 34.13 34.43 2gw4 s GLU 46 CO 0.83 -0.06 0.00 0.41 0.02 0.00 0.00 175.26 176.46 2gw4 n GLY 47 N 2.21 0.69 3.75 -1.39 0.00 -1.26 -1.54 105.19 107.64 2gw4 n GLY 47 Ca -0.18 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 2gw4 n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2gw4 s ALA 48 N -2.00 3.34 0.16 4.61 0.00 -1.26 -3.37 121.76 123.24 2gw4 s ALA 48 Ca 0.00 0.70 -0.15 0.00 0.00 0.00 0.00 51.96 52.51 2gw4 s ALA 48 Cb 0.00 -3.27 -0.07 0.00 0.00 0.00 0.00 23.12 19.78 2gw4 s ALA 48 CO 0.00 0.04 0.57 -1.25 0.00 0.00 0.00 175.76 175.12 2gw4 s PRO 49 N -0.92 4.01 0.23 0.00 0.04 -1.26 -5.11 135.00 131.99 2gw4 s PRO 49 Ca 0.44 0.54 -0.30 0.00 0.04 0.00 0.00 61.00 61.71 2gw4 s PRO 49 Cb -0.27 -2.91 -0.10 0.00 0.04 0.00 0.00 34.50 31.26 2gw4 s PRO 49 CO 0.34 0.46 1.49 -0.51 0.04 0.00 0.00 177.00 178.81 2gw4 s LEU 50 N -2.00 4.38 -0.11 -3.56 1.43 -1.22 -4.91 118.68 112.69 2gw4 s LEU 50 Ca 0.39 2.68 0.09 0.00 -1.03 0.00 0.00 54.13 56.26 2gw4 s LEU 50 Cb -0.15 -3.62 0.47 0.00 0.03 0.00 0.00 46.19 42.92 2gw4 s LEU 50 CO 0.19 -0.75 1.26 -0.81 0.23 0.00 0.00 176.35 176.48 2gw4 n PRO 51 N 2.75 3.04 -4.14 1.29 -0.04 -1.26 -4.92 135.00 131.71 2gw4 n PRO 51 Ca 0.09 -1.81 -0.10 0.00 -0.04 0.00 0.00 63.50 61.63 2gw4 n PRO 51 Cb 0.40 -1.82 -0.10 0.00 -0.04 0.00 0.00 33.50 31.94 2gw4 n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2gw4 s PHE 52 N -1.91 0.90 -0.01 0.54 -0.12 -1.26 -5.11 117.98 111.01 2gw4 s PHE 52 Ca 0.32 -1.23 -0.30 0.00 -0.05 0.00 0.00 56.93 55.68 2gw4 s PHE 52 Cb 0.23 -0.45 -0.08 0.00 -0.63 0.00 0.00 43.02 42.08 2gw4 s PHE 52 CO 0.12 -0.58 2.03 0.00 -0.05 0.00 0.00 175.22 176.73 2gw4 s ALA 53 N -4.07 3.41 0.48 1.99 0.00 -1.26 -4.86 121.76 117.44 2gw4 s ALA 53 Ca 0.28 1.22 0.14 0.00 0.00 0.00 0.00 51.96 53.60 2gw4 s ALA 53 Cb 0.07 -3.89 1.14 0.00 0.00 0.00 0.00 23.12 20.43 2gw4 s ALA 53 CO 0.05 -1.82 2.08 -0.92 0.00 0.00 0.00 175.76 175.14 2gw4 h TYR 54 N 11.53 0.21 -0.78 0.00 5.03 -1.99 -2.65 116.97 128.31 2gw4 h TYR 54 Ca -0.48 0.01 0.20 0.00 2.58 0.00 0.00 58.73 61.03 2gw4 h TYR 54 Cb 1.24 -0.07 -0.04 0.00 1.55 0.00 0.00 36.73 39.41 2gw4 h TYR 54 CO 0.96 0.12 0.54 -0.44 -1.32 0.00 0.00 178.16 178.02 2gw4 h ASP 55 N 0.22 0.18 0.42 -2.11 3.32 -2.02 -0.56 116.42 115.87 2gw4 h ASP 55 Ca 0.12 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.18 2gw4 h ASP 55 Cb 0.20 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2gw4 h ASP 55 CO -0.02 0.08 0.00 0.16 -1.72 0.00 0.00 179.24 177.74 2gw4 h ILE 56 N 0.19 0.00 0.00 0.35 3.07 -1.87 -2.96 117.51 116.28 2gw4 h ILE 56 Ca 0.39 -0.21 -0.22 0.00 1.55 0.00 0.00 64.86 66.36 2gw4 h ILE 56 Cb 1.24 1.20 -0.04 0.00 -0.27 0.00 0.00 36.82 38.95 2gw4 h ILE 56 CO -0.07 0.00 -1.63 0.18 -1.05 0.00 0.00 178.15 175.58 2gw4 n LEU 57 N -3.07 0.75 -0.34 0.16 4.77 -0.22 -4.63 117.00 114.42 2gw4 n LEU 57 Ca -0.01 0.34 0.16 0.00 -0.03 0.00 0.00 56.01 56.46 2gw4 n LEU 57 Cb 0.17 0.15 0.36 0.00 -2.33 0.00 0.00 43.42 41.76 2gw4 n LEU 57 CO 0.23 0.26 1.16 0.71 -1.33 0.00 0.00 177.39 178.42 2gw4 h THR 58 N 0.00 0.58 0.00 -5.08 1.35 -1.53 -0.16 112.91 108.07 2gw4 h THR 58 Ca -0.24 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.41 2gw4 h THR 58 Cb 1.77 -0.09 0.00 0.00 -1.73 0.00 0.00 68.15 68.10 2gw4 h THR 58 CO 0.05 0.11 0.00 0.35 -0.25 0.00 0.00 175.52 175.79 2gw4 n THR 59 N -4.86 0.36 1.47 6.82 -2.24 -1.26 -5.17 114.28 109.39 2gw4 n THR 59 Ca 0.25 0.09 0.14 0.00 -2.27 0.00 0.00 64.05 62.26 2gw4 n THR 59 Cb 0.69 -0.73 0.50 0.00 -2.10 0.00 0.00 70.33 68.68 2gw4 n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50