#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gpx s LYS 2 N 0.00 4.24 0.09 1.43 2.20 -1.26 0.19 119.74 126.63 1gpx s LYS 2 Ca 0.00 1.32 0.08 0.00 -0.36 0.00 0.00 55.97 57.01 1gpx s LYS 2 Cb 0.00 -3.65 -0.03 0.00 -1.51 0.00 0.00 37.83 32.64 1gpx s LYS 2 CO 0.00 -0.65 -0.21 0.08 -0.36 0.00 0.00 175.35 174.20 1gpx s VAL 3 N 3.23 1.75 -0.06 4.02 1.01 0.20 0.42 120.40 130.98 1gpx s VAL 3 Ca 0.44 -1.47 0.01 0.00 0.00 0.00 0.00 61.98 60.96 1gpx s VAL 3 Cb -0.15 -1.57 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1gpx s VAL 3 CO 0.07 0.03 -0.09 -0.69 0.00 0.00 0.00 175.10 174.42 1gpx s VAL 4 N -1.05 0.88 -0.06 2.92 1.01 0.41 0.26 120.40 124.75 1gpx s VAL 4 Ca 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 61.98 61.74 1gpx s VAL 4 Cb -0.10 -0.84 -0.03 0.00 0.00 0.00 0.00 36.38 35.41 1gpx s VAL 4 CO 0.04 0.30 -0.01 -0.31 0.00 0.00 0.00 175.10 175.12 1gpx s TYR 5 N 0.88 3.11 -0.09 5.22 2.02 0.73 0.14 117.35 129.35 1gpx s TYR 5 Ca -0.11 0.14 0.04 0.00 -0.37 0.00 0.00 57.07 56.77 1gpx s TYR 5 Cb -0.15 -1.75 0.00 0.00 -0.40 0.00 0.00 41.96 39.66 1gpx s TYR 5 CO 0.01 0.45 -0.21 0.08 -1.57 0.00 0.00 175.55 174.31 1gpx s VAL 6 N -0.91 1.83 0.00 0.71 1.01 -0.91 0.13 120.40 122.26 1gpx s VAL 6 Ca 0.14 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1gpx s VAL 6 Cb -0.11 -1.60 0.00 0.00 0.00 0.00 0.00 36.38 34.67 1gpx s VAL 6 CO 0.04 0.51 0.00 -1.54 0.00 0.00 0.00 175.10 174.11 1gpx n SER 7 N 3.61 0.00 -0.00 3.32 3.41 0.45 0.25 113.62 124.66 1gpx n SER 7 Ca -0.20 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.46 1gpx n SER 7 Cb 0.53 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.42 1gpx n SER 7 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1gpx n HIS 8 N -0.00 0.00 0.71 7.33 1.44 -1.24 -3.47 115.22 119.99 1gpx n HIS 8 Ca 0.00 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.83 1gpx n HIS 8 Cb 0.00 -0.01 0.14 0.00 0.12 0.00 0.00 29.99 30.24 1gpx n HIS 8 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 1gpx n ASP 9 N -1.27 3.16 0.00 4.39 5.68 -1.26 -4.94 116.55 122.30 1gpx n ASP 9 Ca 0.02 -1.98 0.00 0.00 -0.50 0.00 0.00 54.79 52.32 1gpx n ASP 9 Cb 0.17 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.05 1gpx n ASP 9 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1gpx n GLY 10 N 1.39 1.81 3.59 6.12 0.00 -1.26 -5.06 105.19 111.78 1gpx n GLY 10 Ca 0.16 -0.11 -0.47 0.00 0.00 0.00 0.00 46.02 45.60 1gpx n GLY 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1gpx n THR 11 N 0.00 1.20 -4.21 2.61 -1.04 -1.26 -4.52 114.28 107.06 1gpx n THR 11 Ca 0.00 -0.30 -0.18 0.00 -2.04 0.00 0.00 64.05 61.53 1gpx n THR 11 Cb 0.00 -0.97 -0.11 0.00 -1.82 0.00 0.00 70.33 67.43 1gpx n THR 11 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1gpx s ARG 12 N -0.69 0.93 -0.09 -2.82 0.52 -1.25 0.17 118.95 115.71 1gpx s ARG 12 Ca 0.69 -1.12 -0.01 0.00 -0.52 0.00 0.00 55.73 54.77 1gpx s ARG 12 Cb -0.78 -0.85 0.03 0.00 0.52 0.00 0.00 34.95 33.87 1gpx s ARG 12 CO 0.54 0.17 -0.04 -0.98 0.02 0.00 0.00 175.30 175.01 1gpx s ARG 13 N -2.29 1.03 -0.22 3.54 1.70 0.35 -4.88 118.95 118.19 1gpx s ARG 13 Ca 0.04 -0.07 -0.16 0.00 -0.47 0.00 0.00 55.73 55.07 1gpx s ARG 13 Cb -0.07 -1.22 -0.04 0.00 -0.57 0.00 0.00 34.95 33.05 1gpx s ARG 13 CO 0.02 -0.26 0.39 -1.21 -1.08 0.00 0.00 175.30 173.17 1gpx s GLU 14 N 1.72 4.14 0.06 3.89 0.41 -1.26 0.26 118.70 127.92 1gpx s GLU 14 Ca 0.03 0.17 0.04 0.00 -0.41 0.00 0.00 54.97 54.80 1gpx s GLU 14 Cb -0.13 -3.56 -0.04 0.00 -1.78 0.00 0.00 34.13 28.62 1gpx s GLU 14 CO -0.06 -0.09 -0.03 -0.51 -0.49 0.00 0.00 175.26 174.08 1gpx s LEU 15 N 1.48 3.35 -0.91 1.80 1.43 0.72 -4.93 118.68 121.62 1gpx s LEU 15 Ca 0.18 -0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.02 1gpx s LEU 15 Cb -0.15 -2.04 0.23 0.00 0.03 0.00 0.00 46.19 44.26 1gpx s LEU 15 CO 0.08 0.21 0.84 -1.81 0.23 0.00 0.00 176.35 175.90 1gpx s ASP 16 N -2.00 6.56 0.49 2.29 1.01 -1.26 0.60 116.67 124.36 1gpx s ASP 16 Ca 0.22 -3.23 0.07 0.00 0.71 0.00 0.00 52.55 50.33 1gpx s ASP 16 Cb -0.11 -2.10 0.04 0.00 1.01 0.00 0.00 42.92 41.76 1gpx s ASP 16 CO 0.14 -0.37 0.67 -0.69 0.21 0.00 0.00 175.17 175.13 1gpx s VAL 17 N -0.65 2.70 0.00 -1.27 1.01 0.52 -4.87 120.40 117.83 1gpx s VAL 17 Ca 0.24 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.28 1gpx s VAL 17 Cb -0.11 -2.75 0.00 0.00 0.00 0.00 0.00 36.38 33.52 1gpx s VAL 17 CO -0.09 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.01 1gpx n ALA 18 N -2.05 0.00 -2.80 5.51 0.00 -1.26 0.19 120.51 120.10 1gpx n ALA 18 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.19 1gpx n ALA 18 Cb 0.60 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.97 1gpx n ALA 18 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1gpx s ASP 19 N 1.00 5.95 0.00 0.00 -4.77 -1.23 -0.55 116.67 117.06 1gpx s ASP 19 Ca 0.00 0.23 0.00 0.00 -3.30 0.00 0.00 52.55 49.48 1gpx s ASP 19 Cb 0.00 -1.97 0.00 0.00 -1.09 0.00 0.00 42.92 39.86 1gpx s ASP 19 CO 0.00 0.26 0.00 0.61 0.70 0.00 0.00 175.17 176.74 1gpx n GLY 20 N 2.96 0.38 4.01 2.12 0.00 -1.20 -5.03 105.19 108.44 1gpx n GLY 20 Ca -0.18 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 1gpx n GLY 20 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gpx s VAL 21 N -2.04 2.73 0.52 1.61 1.01 -1.26 -4.88 120.40 118.09 1gpx s VAL 21 Ca 0.00 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 60.96 1gpx s VAL 21 Cb 0.00 -2.75 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 1gpx s VAL 21 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 175.10 174.16 1gpx s SER 22 N -4.43 4.16 0.23 3.32 1.04 -1.26 0.26 113.70 117.02 1gpx s SER 22 Ca 0.56 -1.68 0.25 0.00 0.48 0.00 0.00 55.95 55.56 1gpx s SER 22 Cb -0.08 0.62 0.87 0.00 0.10 0.00 0.00 66.02 67.52 1gpx s SER 22 CO 0.34 -0.90 1.76 0.18 0.98 0.00 0.00 173.24 175.60 1gpx n LEU 23 N -1.30 0.78 0.00 2.42 4.77 -1.19 -4.05 117.00 118.44 1gpx n LEU 23 Ca -0.21 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1gpx n LEU 23 Cb 0.67 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 1gpx n LEU 23 CO 0.37 -0.31 0.00 0.80 -1.33 0.00 0.00 177.39 176.92 1gpx n MET 24 N -2.27 0.00 -0.12 3.23 1.56 -0.82 -3.46 117.12 115.23 1gpx n MET 24 Ca 0.04 0.20 0.22 0.00 -0.27 0.00 0.00 57.70 57.89 1gpx n MET 24 Cb 0.36 -0.66 0.33 0.00 2.15 0.00 0.00 33.22 35.40 1gpx n MET 24 CO 0.00 0.00 0.00 0.94 -0.73 0.00 0.00 175.97 176.18 1gpx n GLN 25 N -2.09 0.01 -0.09 2.12 0.00 -1.26 0.28 117.38 116.36 1gpx n GLN 25 Ca 0.00 0.91 -0.16 0.00 -0.00 0.00 0.00 57.00 57.74 1gpx n GLN 25 Cb 0.00 -2.28 -0.09 0.00 0.00 0.00 0.00 30.24 27.87 1gpx n GLN 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1gpx h ALA 26 N 0.40 0.17 -0.47 1.69 0.00 -1.76 -3.16 119.26 116.13 1gpx h ALA 26 Ca 0.38 -0.93 0.01 0.00 0.00 0.00 0.00 54.91 54.36 1gpx h ALA 26 Cb 2.52 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 20.86 1gpx h ALA 26 CO -0.00 0.55 0.30 0.00 0.00 0.00 0.00 179.25 180.10 1gpx h ALA 27 N -0.56 0.59 -0.62 0.00 0.00 0.20 0.76 119.26 119.63 1gpx h ALA 27 Ca -0.22 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.72 1gpx h ALA 27 Cb 1.05 -0.18 -0.09 0.00 0.00 0.00 0.00 17.79 18.57 1gpx h ALA 27 CO -0.13 0.03 -0.50 0.28 0.00 0.00 0.00 179.25 178.92 1gpx h VAL 28 N 0.62 0.00 -0.31 0.00 2.07 0.40 1.63 116.25 120.66 1gpx h VAL 28 Ca 0.17 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.71 1gpx h VAL 28 Cb -0.06 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.69 1gpx h VAL 28 CO -0.04 0.00 0.21 0.28 0.02 0.00 0.00 177.57 178.03 1gpx h SER 29 N -0.17 0.31 0.00 0.57 0.02 -1.43 0.66 113.55 113.52 1gpx h SER 29 Ca 0.10 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1gpx h SER 29 Cb 0.44 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1gpx h SER 29 CO -0.67 0.22 0.00 0.59 -1.14 0.00 0.00 176.83 175.83 1gpx n ASN 30 N -4.49 0.04 -0.60 3.07 3.02 0.50 -4.80 115.26 112.00 1gpx n ASN 30 Ca 0.02 -1.74 -0.08 0.00 -0.03 0.00 0.00 54.58 52.76 1gpx n ASN 30 Cb 0.11 -0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.23 1gpx n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gpx n GLY 31 N 0.36 0.76 0.18 7.41 0.00 0.23 -4.81 105.19 109.32 1gpx n GLY 31 Ca 0.00 -0.02 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 1gpx n GLY 31 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1gpx h ILE 32 N 0.00 1.37 -1.99 -0.61 2.04 -0.05 -3.26 117.51 115.01 1gpx h ILE 32 Ca -0.16 -1.97 -0.74 0.00 1.00 0.00 0.00 64.86 62.98 1gpx h ILE 32 Cb 1.08 1.98 -0.30 0.00 -0.74 0.00 0.00 36.82 38.84 1gpx h ILE 32 CO 0.23 0.59 0.73 -1.22 0.00 0.00 0.00 178.15 178.48 1gpx n TYR 33 N -3.88 3.05 -0.89 1.37 4.01 -1.25 -4.78 117.16 114.78 1gpx n TYR 33 Ca -0.03 -2.55 -0.10 0.00 -0.16 0.00 0.00 57.90 55.06 1gpx n TYR 33 Cb 0.63 -1.00 -0.14 0.00 -0.31 0.00 0.00 39.34 38.52 1gpx n TYR 33 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1gpx n ASP 34 N -0.43 5.02 -1.33 7.72 5.75 -1.23 -4.81 116.55 127.24 1gpx n ASP 34 Ca 0.50 -2.42 0.00 0.00 -0.01 0.00 0.00 54.79 52.85 1gpx n ASP 34 Cb 0.31 -1.32 0.00 0.00 -1.03 0.00 0.00 41.12 39.07 1gpx n ASP 34 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 1gpx n ILE 35 N 2.39 0.00 0.00 2.12 -5.35 -1.26 -5.06 119.36 112.20 1gpx n ILE 35 Ca 0.36 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.84 1gpx n ILE 35 Cb 0.83 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 1gpx n ILE 35 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 1gpx n VAL 36 N 0.00 0.00 -1.93 7.28 0.31 -1.26 -4.99 118.33 117.74 1gpx n VAL 36 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 1gpx n VAL 36 Cb 0.00 -0.14 0.19 0.00 -0.91 0.00 0.00 33.84 32.98 1gpx n VAL 36 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1gpx s GLY 37 N -0.06 1.79 0.31 2.92 0.00 -1.26 -5.09 107.32 105.92 1gpx s GLY 37 Ca 0.00 -1.21 0.11 0.00 0.00 0.00 0.00 44.72 43.61 1gpx s GLY 37 CO 0.00 -0.44 -0.14 0.51 0.00 0.00 0.00 173.10 173.03 1gpx s ASP 38 N -4.90 3.71 -0.07 1.64 -4.77 -1.26 -4.91 116.67 106.12 1gpx s ASP 38 Ca 0.74 -1.08 0.09 0.00 -3.30 0.00 0.00 52.55 49.00 1gpx s ASP 38 Cb -0.04 -0.35 -0.13 0.00 -1.09 0.00 0.00 42.92 41.31 1gpx s ASP 38 CO 0.53 -0.07 0.10 0.00 0.70 0.00 0.00 175.17 176.43 1gpx n GLY 40 N 2.22 -0.38 1.96 0.00 0.00 -1.26 0.30 105.19 108.03 1gpx n GLY 40 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1gpx n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpx n GLY 41 N -0.43 0.41 0.01 -0.02 0.00 -1.26 -4.94 105.19 98.97 1gpx n GLY 41 Ca -0.01 -0.87 -0.02 0.00 0.00 0.00 0.00 46.02 45.12 1gpx n GLY 41 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1gpx n SER 42 N 1.96 4.00 -2.08 1.61 2.88 0.86 -5.07 113.62 117.79 1gpx n SER 42 Ca 0.00 -0.01 -0.05 0.00 -1.33 0.00 0.00 58.87 57.48 1gpx n SER 42 Cb 0.50 0.19 0.02 0.00 -0.75 0.00 0.00 64.21 64.17 1gpx n SER 42 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gpx n ALA 43 N -2.40 -1.19 -1.73 -1.46 0.00 -1.23 -4.98 120.51 107.52 1gpx n ALA 43 Ca -0.05 0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.48 1gpx n ALA 43 Cb 0.57 -2.21 0.06 0.00 0.00 0.00 0.00 19.45 17.87 1gpx n ALA 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1gpx n SER 44 N -2.05 1.01 -4.67 0.00 2.88 -1.26 -4.88 113.62 104.66 1gpx n SER 44 Ca -0.02 -2.51 -0.23 0.00 -1.33 0.00 0.00 58.87 54.78 1gpx n SER 44 Cb 0.54 -0.31 -0.07 0.00 -0.75 0.00 0.00 64.21 63.62 1gpx n SER 44 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1gpx n ALA 46 N -0.96 2.71 -1.35 0.00 0.00 -1.26 -4.62 120.51 115.03 1gpx n ALA 46 Ca -0.06 -0.49 -0.06 0.00 0.00 0.00 0.00 53.44 52.83 1gpx n ALA 46 Cb 0.59 -0.36 0.21 0.00 0.00 0.00 0.00 19.45 19.89 1gpx n ALA 46 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1gpx n THR 47 N 0.06 2.63 0.20 0.00 -2.24 -1.26 -4.07 114.28 109.60 1gpx n THR 47 Ca 0.05 -2.48 0.02 0.00 -2.27 0.00 0.00 64.05 59.37 1gpx n THR 47 Cb 0.24 -0.34 0.01 0.00 -2.10 0.00 0.00 70.33 68.13 1gpx n THR 47 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1gpx n HIS 49 N -0.19 1.22 -4.12 0.00 -0.00 -1.26 -1.32 115.22 109.55 1gpx n HIS 49 Ca 0.02 0.88 -0.08 0.00 0.46 0.00 0.00 57.72 59.00 1gpx n HIS 49 Cb 0.10 -2.23 -0.10 0.00 -0.12 0.00 0.00 29.99 27.65 1gpx n HIS 49 CO 0.00 0.00 0.00 0.14 0.46 0.00 0.00 176.34 176.94 1gpx s VAL 50 N 0.94 0.28 -0.18 3.57 -7.23 -0.02 -4.19 120.40 113.56 1gpx s VAL 50 Ca 0.92 -1.86 -0.00 0.00 -1.81 0.00 0.00 61.98 59.23 1gpx s VAL 50 Cb -1.18 -1.67 0.01 0.00 0.56 0.00 0.00 36.38 34.09 1gpx s VAL 50 CO 0.58 -0.85 -0.15 -0.31 -0.31 0.00 0.00 175.10 174.06 1gpx s TYR 51 N -3.89 2.82 0.63 2.82 2.02 0.74 -1.27 117.35 121.22 1gpx s TYR 51 Ca 0.12 -1.28 -0.01 0.00 -0.37 0.00 0.00 57.07 55.53 1gpx s TYR 51 Cb 0.07 -1.95 0.07 0.00 -0.40 0.00 0.00 41.96 39.75 1gpx s TYR 51 CO -0.06 -0.64 0.89 0.08 -1.57 0.00 0.00 175.55 174.25 1gpx s VAL 52 N 1.18 2.43 0.00 0.71 1.01 -1.26 0.25 120.40 124.73 1gpx s VAL 52 Ca 0.02 -0.57 0.00 0.00 0.00 0.00 0.00 61.98 61.43 1gpx s VAL 52 Cb -0.14 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1gpx s VAL 52 CO -0.06 0.00 0.00 -0.46 0.00 0.00 0.00 175.10 174.58 1gpx n ASN 53 N -2.60 0.00 -0.01 3.32 0.23 -0.38 -4.84 115.26 110.98 1gpx n ASN 53 Ca 0.10 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 54.24 1gpx n ASN 53 Cb 0.60 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.17 1gpx n ASN 53 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1gpx n GLU 54 N 0.00 0.72 -0.11 -3.83 0.28 -1.26 -4.43 120.64 112.00 1gpx n GLU 54 Ca 0.00 -0.10 -0.14 0.00 -0.16 0.00 0.00 57.16 56.75 1gpx n GLU 54 Cb 0.00 -1.42 -0.13 0.00 1.43 0.00 0.00 31.44 31.32 1gpx n GLU 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1gpx n ALA 55 N -1.87 1.48 0.73 -1.84 0.00 -1.26 -4.43 120.51 113.32 1gpx n ALA 55 Ca -0.01 -1.16 0.13 0.00 0.00 0.00 0.00 53.44 52.40 1gpx n ALA 55 Cb 0.41 -0.11 0.34 0.00 0.00 0.00 0.00 19.45 20.09 1gpx n ALA 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1gpx n PHE 56 N -3.04 0.49 0.09 0.00 3.01 -1.26 -3.06 117.46 113.69 1gpx n PHE 56 Ca -0.40 0.14 -0.03 0.00 1.01 0.00 0.00 57.45 58.18 1gpx n PHE 56 Cb 1.04 -0.66 -0.06 0.00 -0.01 0.00 0.00 39.48 39.79 1gpx n PHE 56 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1gpx h THR 57 N 0.00 1.27 0.00 4.37 1.35 -1.79 -2.21 112.91 115.89 1gpx h THR 57 Ca 0.00 -2.82 -0.13 0.00 -0.55 0.00 0.00 66.41 62.91 1gpx h THR 57 Cb 0.66 2.62 -0.02 0.00 -1.73 0.00 0.00 68.15 69.68 1gpx h THR 57 CO 0.00 0.72 -1.26 -2.24 -0.25 0.00 0.00 175.52 172.49 1gpx h ASP 58 N 0.00 0.00 0.00 5.36 2.03 -1.77 -3.37 116.42 118.67 1gpx h ASP 58 Ca -0.02 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.28 1gpx h ASP 58 Cb 1.61 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.11 1gpx h ASP 58 CO 0.10 0.44 -0.00 0.11 -1.03 0.00 0.00 179.24 178.86 1gpx h LYS 59 N 0.00 -0.01 -6.13 4.15 1.79 -1.59 -3.46 116.57 111.32 1gpx h LYS 59 Ca -0.12 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.85 1gpx h LYS 59 Cb 1.44 0.00 0.25 0.00 -1.58 0.00 0.00 32.23 32.34 1gpx h LYS 59 CO 0.04 0.77 -2.15 1.33 -1.08 0.00 0.00 179.45 178.35 1gpx n VAL 60 N -4.66 0.00 -0.98 0.50 0.24 -0.83 -4.88 118.33 107.72 1gpx n VAL 60 Ca -0.08 -0.20 -0.30 0.00 -2.04 0.00 0.00 64.34 61.73 1gpx n VAL 60 Cb 0.37 -0.11 0.17 0.00 -1.47 0.00 0.00 33.84 32.80 1gpx n VAL 60 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1gpx s PRO 61 N -2.27 0.71 -0.38 7.34 0.04 -1.26 -4.95 135.00 134.24 1gpx s PRO 61 Ca 0.41 0.94 -0.28 0.00 0.04 0.00 0.00 61.00 62.10 1gpx s PRO 61 Cb -0.02 -1.74 0.02 0.00 0.04 0.00 0.00 34.50 32.80 1gpx s PRO 61 CO 0.71 -2.65 1.07 0.00 0.04 0.00 0.00 177.00 176.17 1gpx s ALA 62 N -2.78 3.38 0.88 8.56 0.00 -1.26 -4.95 121.76 125.58 1gpx s ALA 62 Ca 0.65 -0.25 -0.11 0.00 0.00 0.00 0.00 51.96 52.25 1gpx s ALA 62 Cb -0.20 -3.72 0.12 0.00 0.00 0.00 0.00 23.12 19.31 1gpx s ALA 62 CO 0.59 -1.74 1.09 0.00 0.00 0.00 0.00 175.76 175.70 1gpx s ALA 63 N 3.87 1.64 0.00 0.00 0.00 -1.26 -5.07 121.76 120.94 1gpx s ALA 63 Ca 0.45 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.45 1gpx s ALA 63 Cb -0.11 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1gpx s ALA 63 CO 0.21 -2.28 0.00 0.27 0.00 0.00 0.00 175.76 173.95 1gpx n ASN 64 N -3.85 0.00 0.16 0.00 6.94 -1.26 -4.91 115.26 112.34 1gpx n ASN 64 Ca 0.08 0.00 0.02 0.00 -0.02 0.00 0.00 54.58 54.66 1gpx n ASN 64 Cb 0.55 0.00 0.25 0.00 -2.36 0.00 0.00 39.78 38.21 1gpx n ASN 64 CO 0.00 0.00 0.00 1.05 -1.03 0.00 0.00 177.26 177.28 1gpx h GLU 65 N 0.00 0.00 -0.23 -3.83 4.11 -2.00 -3.15 114.58 109.48 1gpx h GLU 65 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.41 1gpx h GLU 65 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1gpx h GLU 65 CO 0.00 0.49 0.06 -0.09 0.07 0.00 0.00 179.01 179.55 1gpx h ARG 66 N 0.00 0.37 0.00 1.06 9.65 -1.93 -0.13 114.38 123.39 1gpx h ARG 66 Ca -0.00 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.79 1gpx h ARG 66 Cb 1.02 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.55 1gpx h ARG 66 CO 0.06 0.47 0.08 1.49 2.80 0.00 0.00 179.97 184.87 1gpx h GLU 67 N 0.20 0.00 0.00 0.20 4.22 -1.90 0.27 114.58 117.57 1gpx h GLU 67 Ca 0.07 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.51 1gpx h GLU 67 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1gpx h GLU 67 CO -0.00 0.00 -0.10 -0.89 -2.18 0.00 0.00 179.01 175.84 1gpx n ILE 68 N -2.40 0.23 -0.05 2.32 -0.00 -0.23 -4.03 119.36 115.20 1gpx n ILE 68 Ca -0.02 0.45 -0.14 0.00 -0.00 0.00 0.00 62.75 63.04 1gpx n ILE 68 Cb 0.12 -1.64 -0.12 0.00 -0.00 0.00 0.00 39.64 37.99 1gpx n ILE 68 CO 0.00 0.00 0.00 1.23 -0.00 0.00 0.00 176.55 177.78 1gpx h GLY 69 N -0.16 0.06 -0.11 7.39 0.00 -1.04 0.14 103.07 109.35 1gpx h GLY 69 Ca 0.00 -0.11 0.22 0.00 0.00 0.00 0.00 47.33 47.44 1gpx h GLY 69 CO 0.00 0.10 0.49 1.98 0.00 0.00 0.00 176.54 179.11 1gpx h MET 70 N -0.78 0.51 0.00 4.80 -1.53 -0.66 0.62 114.93 117.89 1gpx h MET 70 Ca -0.01 -0.03 -0.19 0.00 -3.44 0.00 0.00 59.70 56.03 1gpx h MET 70 Cb 0.95 -0.11 -0.02 0.00 -0.55 0.00 0.00 31.60 31.86 1gpx h MET 70 CO 0.02 0.34 -0.88 1.25 0.14 0.00 0.00 176.91 177.78 1gpx h LEU 71 N 0.53 0.03 -0.89 3.39 6.46 -1.23 -3.04 115.31 120.55 1gpx h LEU 71 Ca 0.58 -0.03 0.00 0.00 -0.12 0.00 0.00 57.88 58.32 1gpx h LEU 71 Cb 1.07 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 40.99 1gpx h LEU 71 CO -0.48 0.89 0.00 1.21 -0.62 0.00 0.00 178.44 179.44 1gpx n GLU 72 N -3.52 1.56 -0.13 1.25 2.13 0.19 -4.21 120.64 117.91 1gpx n GLU 72 Ca -0.01 -0.85 -0.06 0.00 0.66 0.00 0.00 57.16 56.90 1gpx n GLU 72 Cb 0.83 -1.20 0.00 0.00 0.27 0.00 0.00 31.44 31.35 1gpx n GLU 72 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1gpx s VAL 74 N -6.08 4.92 -0.80 0.00 -7.23 -1.26 -4.95 120.40 105.00 1gpx s VAL 74 Ca -0.15 0.76 -0.27 0.00 -1.81 0.00 0.00 61.98 60.52 1gpx s VAL 74 Cb 0.15 -4.03 -0.17 0.00 0.56 0.00 0.00 36.38 32.89 1gpx s VAL 74 CO 0.69 -0.20 2.54 0.41 -0.31 0.00 0.00 175.10 178.23 1gpx n THR 75 N 5.46 -0.03 -2.31 5.32 -1.04 -1.25 -4.69 114.28 115.73 1gpx n THR 75 Ca -0.01 -0.37 -0.12 0.00 -2.04 0.00 0.00 64.05 61.52 1gpx n THR 75 Cb 0.49 -1.39 0.04 0.00 -1.82 0.00 0.00 70.33 67.65 1gpx n THR 75 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gpx n ALA 76 N 12.60 3.90 -4.07 2.41 0.00 -1.26 -4.81 120.51 129.28 1gpx n ALA 76 Ca 0.54 -3.30 -0.45 0.00 0.00 0.00 0.00 53.44 50.23 1gpx n ALA 76 Cb 0.25 -0.55 0.02 0.00 0.00 0.00 0.00 19.45 19.17 1gpx n ALA 76 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1gpx n GLU 77 N -0.64 -0.27 -0.68 0.00 0.28 -1.26 -4.51 120.64 113.56 1gpx n GLU 77 Ca 0.27 0.06 -0.27 0.00 -0.16 0.00 0.00 57.16 57.06 1gpx n GLU 77 Cb 0.90 -2.29 -0.04 0.00 1.43 0.00 0.00 31.44 31.43 1gpx n GLU 77 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1gpx n LEU 78 N -4.85 0.47 0.00 -1.84 7.94 -1.26 -4.92 117.00 112.54 1gpx n LEU 78 Ca -0.12 0.46 0.00 0.00 -1.11 0.00 0.00 56.01 55.24 1gpx n LEU 78 Cb 0.54 -0.35 0.00 0.00 0.53 0.00 0.00 43.42 44.14 1gpx n LEU 78 CO 0.72 -0.33 0.00 0.29 -1.11 0.00 0.00 177.39 176.95 1gpx n LYS 79 N 1.70 0.56 0.05 1.96 5.02 -1.26 -4.96 118.16 121.24 1gpx n LYS 79 Ca 0.13 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.37 1gpx n LYS 79 Cb -0.02 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 34.89 1gpx n LYS 79 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1gpx h PRO 80 N 0.00 0.00 -0.01 1.97 0.13 -2.02 -3.32 132.00 128.76 1gpx h PRO 80 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1gpx h PRO 80 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1gpx h PRO 80 CO 0.00 0.78 -0.51 0.27 -0.23 0.00 0.00 178.00 178.31 1gpx n ASN 81 N -3.24 1.15 -4.61 1.44 6.94 -1.26 -4.99 115.26 110.70 1gpx n ASN 81 Ca -0.04 -1.07 -0.53 0.00 -0.02 0.00 0.00 54.58 52.92 1gpx n ASN 81 Cb 0.93 0.73 -0.06 0.00 -2.36 0.00 0.00 39.78 39.02 1gpx n ASN 81 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1gpx n SER 82 N -0.73 1.73 -4.08 0.53 7.64 -1.25 -4.26 113.62 113.20 1gpx n SER 82 Ca 0.05 1.11 -0.09 0.00 1.01 0.00 0.00 58.87 60.95 1gpx n SER 82 Cb 0.28 -1.18 -0.09 0.00 -1.01 0.00 0.00 64.21 62.21 1gpx n SER 82 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1gpx s ARG 83 N 0.88 0.93 0.21 1.43 3.52 -0.40 -4.85 118.95 120.67 1gpx s ARG 83 Ca 0.86 -1.31 -0.30 0.00 -0.13 0.00 0.00 55.73 54.85 1gpx s ARG 83 Cb -0.97 0.28 -0.08 0.00 -1.56 0.00 0.00 34.95 32.61 1gpx s ARG 83 CO 0.49 -0.28 1.11 -1.17 -0.81 0.00 0.00 175.30 174.65 1gpx s LEU 84 N -3.00 4.50 0.63 -0.88 0.20 -1.26 -0.84 118.68 118.03 1gpx s LEU 84 Ca 0.19 2.15 0.32 0.00 0.69 0.00 0.00 54.13 57.48 1gpx s LEU 84 Cb 0.06 -3.61 1.80 0.00 -0.43 0.00 0.00 46.19 44.01 1gpx s LEU 84 CO -0.01 -0.21 2.08 0.77 -0.29 0.00 0.00 176.35 178.69 1gpx h SER 85 N 4.79 0.00 -0.62 3.68 4.64 -1.51 0.29 113.55 124.82 1gpx h SER 85 Ca -0.45 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 60.57 1gpx h SER 85 Cb 1.21 0.00 -0.18 0.00 -0.31 0.00 0.00 62.40 63.12 1gpx h SER 85 CO 0.71 0.00 0.22 0.00 -0.87 0.00 0.00 176.83 176.89 1gpx n GLN 87 N -1.03 0.00 -2.79 0.00 1.13 0.10 -4.41 117.38 110.39 1gpx n GLN 87 Ca 0.43 0.00 -0.36 0.00 -1.94 0.00 0.00 57.00 55.13 1gpx n GLN 87 Cb 1.29 -0.78 -0.07 0.00 0.11 0.00 0.00 30.24 30.79 1gpx n GLN 87 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1gpx s ILE 88 N -1.73 4.25 0.24 5.09 1.01 -1.19 -4.91 121.20 123.96 1gpx s ILE 88 Ca 0.00 1.70 0.09 0.00 0.00 0.00 0.00 60.65 62.44 1gpx s ILE 88 Cb 0.00 -3.87 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 1gpx s ILE 88 CO 0.00 -0.01 0.04 -0.63 0.00 0.00 0.00 174.94 174.34 1gpx s ILE 89 N -1.80 3.71 -0.29 2.92 -1.09 -1.26 -3.16 121.20 120.23 1gpx s ILE 89 Ca 0.54 -1.71 -0.05 0.00 -2.23 0.00 0.00 60.65 57.20 1gpx s ILE 89 Cb -0.16 -2.96 0.02 0.00 -1.58 0.00 0.00 42.46 37.78 1gpx s ILE 89 CO 0.20 -0.31 0.05 -0.32 -1.23 0.00 0.00 174.94 173.33 1gpx s MET 90 N -3.55 2.99 0.43 2.79 1.75 0.73 -4.78 119.30 119.65 1gpx s MET 90 Ca 0.31 -0.91 0.03 0.00 -1.25 0.00 0.00 55.69 53.86 1gpx s MET 90 Cb -0.07 -3.28 0.00 0.00 2.84 0.00 0.00 34.83 34.31 1gpx s MET 90 CO 0.21 -0.45 0.62 0.95 -0.65 0.00 0.00 175.02 175.69 1gpx s THR 91 N 1.45 3.77 0.31 10.11 -4.23 -1.26 -3.20 115.64 122.58 1gpx s THR 91 Ca 0.02 -0.70 0.11 0.00 -1.18 0.00 0.00 61.69 59.93 1gpx s THR 91 Cb -0.17 -3.36 0.02 0.00 1.34 0.00 0.00 72.50 70.33 1gpx s THR 91 CO 0.01 -0.21 1.69 1.55 -0.54 0.00 0.00 174.62 177.12 1gpx h PRO 92 N 0.51 0.00 0.19 3.99 0.13 -1.96 -3.22 132.00 131.64 1gpx h PRO 92 Ca -0.45 -0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.37 1gpx h PRO 92 Cb 1.26 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.41 1gpx h PRO 92 CO 0.54 0.53 -1.49 1.05 -0.23 0.00 0.00 178.00 178.40 1gpx h GLU 93 N 0.00 0.39 -3.11 0.86 -0.00 -1.97 -3.37 114.58 107.38 1gpx h GLU 93 Ca -0.01 -0.67 -0.66 0.00 -0.00 0.00 0.00 59.36 58.03 1gpx h GLU 93 Cb 0.93 0.25 0.02 0.00 -0.00 0.00 0.00 28.75 29.95 1gpx h GLU 93 CO 0.07 1.32 3.73 1.28 -0.00 0.00 0.00 179.01 185.41 1gpx n LEU 94 N -3.77 8.39 -4.91 3.06 4.77 -1.22 -4.92 117.00 118.40 1gpx n LEU 94 Ca -0.21 -4.26 -0.27 0.00 -0.03 0.00 0.00 56.01 51.24 1gpx n LEU 94 Cb 1.01 -1.54 -0.04 0.00 -2.33 0.00 0.00 43.42 40.53 1gpx n LEU 94 CO 0.51 1.91 -0.13 -0.62 -1.33 0.00 0.00 177.39 177.72 1gpx s ASP 95 N 2.34 6.18 0.00 -1.43 2.15 -1.26 -4.44 116.67 120.21 1gpx s ASP 95 Ca 0.66 0.14 0.00 0.00 0.43 0.00 0.00 52.55 53.78 1gpx s ASP 95 Cb 0.17 -1.83 0.00 0.00 -0.30 0.00 0.00 42.92 40.97 1gpx s ASP 95 CO -0.06 0.09 0.00 0.61 -0.17 0.00 0.00 175.17 175.64 1gpx n GLY 96 N -0.28 1.17 3.70 2.66 0.00 0.17 -4.87 105.19 107.73 1gpx n GLY 96 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 1gpx n GLY 96 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1gpx n ILE 97 N -1.65 0.25 -3.71 -0.61 0.00 -0.49 -4.77 119.36 108.37 1gpx n ILE 97 Ca 0.00 -0.04 -0.38 0.00 0.00 0.00 0.00 62.75 62.33 1gpx n ILE 97 Cb 0.00 -2.04 -0.12 0.00 0.00 0.00 0.00 39.64 37.48 1gpx n ILE 97 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1gpx s VAL 98 N 2.22 4.38 0.50 9.51 1.01 -1.26 0.15 120.40 136.91 1gpx s VAL 98 Ca 0.80 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 62.43 1gpx s VAL 98 Cb -0.51 -3.19 0.07 0.00 0.00 0.00 0.00 36.38 32.75 1gpx s VAL 98 CO 0.36 0.14 0.56 0.52 0.00 0.00 0.00 175.10 176.69 1gpx n VAL 99 N 4.94 0.00 -3.63 2.92 0.31 0.37 -1.25 118.33 121.98 1gpx n VAL 99 Ca -0.15 -1.79 -0.13 0.00 -0.01 0.00 0.00 64.34 62.27 1gpx n VAL 99 Cb 0.49 -0.37 -0.07 0.00 -0.91 0.00 0.00 33.84 32.99 1gpx n VAL 99 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1gpx s ASP 100 N -4.02 -0.67 -0.39 4.52 1.01 0.71 -2.13 116.67 115.69 1gpx s ASP 100 Ca 0.43 1.29 -0.17 0.00 0.71 0.00 0.00 52.55 54.80 1gpx s ASP 100 Cb -0.03 1.30 0.01 0.00 1.01 0.00 0.00 42.92 45.20 1gpx s ASP 100 CO 0.27 -0.23 0.42 -0.69 0.21 0.00 0.00 175.17 175.15 1gpx s VAL 101 N 0.31 5.11 -0.71 -1.27 1.01 0.70 0.26 120.40 125.81 1gpx s VAL 101 Ca 0.01 -0.17 -0.26 0.00 0.00 0.00 0.00 61.98 61.56 1gpx s VAL 101 Cb -0.05 -3.97 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 1gpx s VAL 101 CO -0.01 -0.30 1.67 -2.16 0.00 0.00 0.00 175.10 174.29 1gpx s PRO 102 N 2.12 2.85 -0.71 2.72 0.04 -1.26 -3.65 135.00 137.11 1gpx s PRO 102 Ca 0.13 0.14 -0.03 0.00 0.04 0.00 0.00 61.00 61.28 1gpx s PRO 102 Cb -0.17 -4.46 0.18 0.00 0.04 0.00 0.00 34.50 30.10 1gpx s PRO 102 CO 0.13 -2.59 0.55 -0.51 0.04 0.00 0.00 177.00 174.62 1gpx s ASP 103 N 6.56 5.49 -0.22 6.66 1.11 -1.26 -4.87 116.67 130.13 1gpx s ASP 103 Ca 0.56 -3.12 0.14 0.00 0.18 0.00 0.00 52.55 50.32 1gpx s ASP 103 Cb -0.10 -1.88 0.55 0.00 1.07 0.00 0.00 42.92 42.56 1gpx s ASP 103 CO 0.15 -0.32 1.48 -2.11 1.18 0.00 0.00 175.17 175.55 1gpx n ARG 104 N 3.14 2.78 -0.87 8.23 -4.01 -1.26 -4.88 116.66 119.79 1gpx n ARG 104 Ca 0.12 -2.95 -0.41 0.00 -1.04 0.00 0.00 57.85 53.57 1gpx n ARG 104 Cb 0.38 -1.89 -0.10 0.00 -3.04 0.00 0.00 32.46 27.82 1gpx n ARG 104 CO 0.00 0.00 0.00 0.94 -3.04 0.00 0.00 177.63 175.53 1gpx n GLN 105 N -0.61 0.59 0.00 2.89 -0.06 -1.26 -5.05 117.38 113.88 1gpx n GLN 105 Ca 0.26 -1.41 0.14 0.00 -2.00 0.00 0.00 57.00 54.00 1gpx n GLN 105 Cb 0.99 -2.80 0.51 0.00 -4.06 0.00 0.00 30.24 24.87 1gpx n GLN 105 CO 0.00 0.00 0.00 0.91 -0.20 0.00 0.00 177.06 177.77