#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gpx n LYS 2 N 0.00 1.84 -4.00 1.43 3.00 -1.26 -2.68 118.16 116.49 1gpx n LYS 2 Ca 0.00 0.67 -0.12 0.00 -0.00 0.00 0.00 58.31 58.86 1gpx n LYS 2 Cb 0.00 -2.45 -0.13 0.00 0.00 0.00 0.00 35.03 32.46 1gpx n LYS 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1gpx s VAL 3 N 3.00 0.23 -0.06 3.15 1.01 -0.42 0.27 120.40 127.57 1gpx s VAL 3 Ca 0.91 -0.53 0.02 0.00 0.00 0.00 0.00 61.98 62.37 1gpx s VAL 3 Cb -0.80 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 35.32 1gpx s VAL 3 CO 0.52 -0.20 -0.10 -0.69 0.00 0.00 0.00 175.10 174.63 1gpx s VAL 4 N -0.74 0.93 -0.08 2.92 1.01 -0.99 0.14 120.40 123.59 1gpx s VAL 4 Ca -0.06 -0.36 -0.04 0.00 0.00 0.00 0.00 61.98 61.52 1gpx s VAL 4 Cb -0.05 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 1gpx s VAL 4 CO -0.00 0.31 0.08 -0.31 0.00 0.00 0.00 175.10 175.18 1gpx s TYR 5 N 0.69 3.38 0.24 5.22 2.02 0.85 -0.67 117.35 129.09 1gpx s TYR 5 Ca -0.13 0.34 0.12 0.00 -0.37 0.00 0.00 57.07 57.02 1gpx s TYR 5 Cb -0.15 -1.84 -0.05 0.00 -0.40 0.00 0.00 41.96 39.52 1gpx s TYR 5 CO 0.02 0.60 -0.21 0.08 -1.57 0.00 0.00 175.55 174.47 1gpx s VAL 6 N -1.03 2.39 0.14 0.71 1.01 -1.20 0.29 120.40 122.72 1gpx s VAL 6 Ca 0.17 -2.25 0.08 0.00 0.00 0.00 0.00 61.98 59.98 1gpx s VAL 6 Cb -0.12 -2.22 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 1gpx s VAL 6 CO 0.06 -0.30 -0.10 -0.55 0.00 0.00 0.00 175.10 174.21 1gpx s SER 7 N -3.17 4.29 0.23 3.32 0.15 0.29 -1.01 113.70 117.79 1gpx s SER 7 Ca 0.26 -0.49 0.14 0.00 0.70 0.00 0.00 55.95 56.56 1gpx s SER 7 Cb -0.06 -0.76 0.77 0.00 -1.71 0.00 0.00 66.02 64.26 1gpx s SER 7 CO 0.13 0.14 1.41 0.00 1.20 0.00 0.00 173.24 176.11 1gpx n HIS 8 N 0.37 0.48 1.11 3.44 1.44 -1.23 0.12 115.22 120.95 1gpx n HIS 8 Ca -0.12 0.25 0.12 0.00 -2.01 0.00 0.00 57.72 55.96 1gpx n HIS 8 Cb 0.54 -0.86 0.17 0.00 0.12 0.00 0.00 29.99 29.96 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 -2.00 2.05 0.00 4.39 5.68 -1.26 -4.85 116.55 120.56 1gpx n ASP 9 Ca -0.01 -1.54 0.00 0.00 -0.50 0.00 0.00 54.79 52.74 1gpx n ASP 9 Cb 0.08 0.21 0.00 0.00 -1.14 0.00 0.00 41.12 40.27 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 1.35 2.58 3.60 6.12 0.00 0.12 -5.06 105.19 113.90 1gpx n GLY 10 Ca 0.12 -0.66 -0.49 0.00 0.00 0.00 0.00 46.02 45.00 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 0.64 -4.42 2.61 -1.04 -1.26 -4.37 114.28 106.44 1gpx n THR 11 Ca 0.00 -0.16 -0.21 0.00 -2.04 0.00 0.00 64.05 61.64 1gpx n THR 11 Cb 0.00 -0.95 -0.10 0.00 -1.82 0.00 0.00 70.33 67.46 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 -0.11 1.52 0.04 -2.82 0.52 -1.26 0.10 118.95 116.95 1gpx s ARG 12 Ca 0.76 -1.73 -0.01 0.00 -0.52 0.00 0.00 55.73 54.23 1gpx s ARG 12 Cb -0.84 -1.31 -0.03 0.00 0.52 0.00 0.00 34.95 33.28 1gpx s ARG 12 CO 0.50 0.15 -0.02 0.50 0.02 0.00 0.00 175.30 176.45 1gpx s ARG 13 N -3.65 0.52 -0.07 3.54 3.52 0.84 -4.91 118.95 118.74 1gpx s ARG 13 Ca 0.27 -1.01 0.01 0.00 -0.13 0.00 0.00 55.73 54.87 1gpx s ARG 13 Cb 0.00 0.18 0.02 0.00 -1.56 0.00 0.00 34.95 33.59 1gpx s ARG 13 CO 0.11 -0.09 -0.09 -1.21 -0.81 0.00 0.00 175.30 173.21 1gpx s GLU 14 N -3.11 1.38 0.14 5.12 8.01 -1.26 0.29 118.70 129.28 1gpx s GLU 14 Ca -0.01 -0.27 0.11 0.00 0.01 0.00 0.00 54.97 54.81 1gpx s GLU 14 Cb 0.02 -1.28 -0.04 0.00 -4.31 0.00 0.00 34.13 28.52 1gpx s GLU 14 CO -0.07 -0.08 -0.26 -0.51 0.01 0.00 0.00 175.26 174.35 1gpx s LEU 15 N 1.02 2.34 -0.71 1.80 1.43 0.36 -4.96 118.68 119.97 1gpx s LEU 15 Ca -0.08 -0.77 -0.11 0.00 -1.03 0.00 0.00 54.13 52.14 1gpx s LEU 15 Cb -0.15 -1.18 0.18 0.00 0.03 0.00 0.00 46.19 45.08 1gpx s LEU 15 CO -0.00 0.16 0.61 -0.62 0.23 0.00 0.00 176.35 176.72 1gpx s ASP 16 N -2.16 6.19 0.40 2.29 -1.08 -1.26 -1.31 116.67 119.74 1gpx s ASP 16 Ca 0.15 -2.55 0.06 0.00 -0.52 0.00 0.00 52.55 49.68 1gpx s ASP 16 Cb -0.10 -2.10 0.00 0.00 -1.46 0.00 0.00 42.92 39.27 1gpx s ASP 16 CO 0.07 -0.56 0.56 -0.69 0.52 0.00 0.00 175.17 175.06 1gpx s VAL 17 N 0.39 3.56 0.00 1.11 1.01 -1.09 -4.87 120.40 120.51 1gpx s VAL 17 Ca 0.15 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1gpx s VAL 17 Cb -0.17 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 32.98 1gpx s VAL 17 CO -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 175.10 174.94 1gpx n ALA 18 N -1.83 0.00 -3.26 5.51 0.00 -1.26 0.26 120.51 119.93 1gpx n ALA 18 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.13 1gpx n ALA 18 Cb 0.58 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.90 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 0.60 4.56 0.00 0.00 -4.77 -1.23 -0.56 116.67 115.27 1gpx s ASP 19 Ca 0.00 -0.29 0.00 0.00 -3.30 0.00 0.00 52.55 48.96 1gpx s ASP 19 Cb 0.00 -1.78 0.00 0.00 -1.09 0.00 0.00 42.92 40.05 1gpx s ASP 19 CO 0.00 0.03 0.00 0.61 0.70 0.00 0.00 175.17 176.51 1gpx n GLY 20 N 4.44 0.77 4.00 2.12 0.00 -1.07 -5.00 105.19 110.45 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 -2.00 2.93 0.26 1.61 1.01 -1.25 -4.85 120.40 118.11 1gpx s VAL 21 Ca 0.00 -0.91 0.12 0.00 0.00 0.00 0.00 61.98 61.19 1gpx s VAL 21 Cb 0.00 -3.01 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 1gpx s VAL 21 CO 0.00 -0.00 -0.20 -0.94 0.00 0.00 0.00 175.10 173.96 1gpx s SER 22 N -4.37 3.47 0.40 3.32 1.04 -1.26 0.25 113.70 116.56 1gpx s SER 22 Ca 0.55 -1.01 0.18 0.00 0.48 0.00 0.00 55.95 56.15 1gpx s SER 22 Cb -0.10 -0.28 1.08 0.00 0.10 0.00 0.00 66.02 66.82 1gpx s SER 22 CO 0.34 0.03 1.81 -0.07 0.98 0.00 0.00 173.24 176.33 1gpx h LEU 23 N 2.39 0.44 0.33 2.42 3.38 -1.65 -2.30 115.31 120.33 1gpx h LEU 23 Ca -0.40 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 1gpx h LEU 23 Cb 1.25 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.99 1gpx h LEU 23 CO 0.59 0.13 -0.16 -0.03 0.09 0.00 0.00 178.44 179.06 1gpx h MET 24 N 0.42 -0.43 -0.03 1.13 4.05 -1.00 -3.05 114.93 116.02 1gpx h MET 24 Ca 0.54 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.99 1gpx h MET 24 Cb 1.34 0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 32.23 1gpx h MET 24 CO -0.24 -0.27 -0.02 0.94 0.23 0.00 0.00 176.91 177.56 1gpx n GLN 25 N -5.07 -0.01 -0.19 0.39 7.27 -0.88 0.40 117.38 119.29 1gpx n GLN 25 Ca -0.06 0.91 -0.03 0.00 0.07 0.00 0.00 57.00 57.89 1gpx n GLN 25 Cb 0.18 -1.36 0.03 0.00 2.41 0.00 0.00 30.24 31.50 1gpx n GLN 25 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1gpx h ALA 26 N -0.85 0.16 0.88 1.69 0.00 -1.69 -1.72 119.26 117.74 1gpx h ALA 26 Ca 0.00 0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1gpx h ALA 26 Cb 0.01 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1gpx h ALA 26 CO -0.03 -0.56 -0.47 0.00 0.00 0.00 0.00 179.25 178.19 1gpx h ALA 27 N 1.27 -1.26 -0.50 0.00 0.00 -0.48 -1.66 119.26 116.63 1gpx h ALA 27 Ca 0.25 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1gpx h ALA 27 Cb 0.50 0.54 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1gpx h ALA 27 CO -0.63 -1.22 -0.29 0.28 0.00 0.00 0.00 179.25 177.39 1gpx n VAL 28 N -5.63 -0.34 -0.06 0.00 0.31 1.31 0.19 118.33 114.11 1gpx n VAL 28 Ca -0.16 1.20 -0.11 0.00 -0.01 0.00 0.00 64.34 65.27 1gpx n VAL 28 Cb 0.50 -1.49 -0.05 0.00 -0.91 0.00 0.00 33.84 31.90 1gpx n VAL 28 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1gpx h SER 29 N 0.00 0.28 0.00 4.52 0.87 -1.34 0.15 113.55 118.02 1gpx h SER 29 Ca 0.08 -0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.46 1gpx h SER 29 Cb 0.20 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1gpx h SER 29 CO -0.47 0.38 0.01 0.59 -0.53 0.00 0.00 176.83 176.81 1gpx n ASN 30 N -4.82 0.08 0.00 6.23 3.02 0.49 -4.74 115.26 115.52 1gpx n ASN 30 Ca -0.04 0.53 0.00 0.00 -0.03 0.00 0.00 54.58 55.04 1gpx n ASN 30 Cb 0.13 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 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 -1.46 1.95 0.63 7.41 0.00 0.47 -4.84 105.19 109.35 1gpx n GLY 31 Ca -0.00 0.00 0.46 0.00 0.00 0.00 0.00 46.02 46.48 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 0.15 -2.29 -0.61 2.04 -1.50 0.29 117.51 115.59 1gpx h ILE 32 Ca 0.00 -0.00 -0.71 0.00 1.00 0.00 0.00 64.86 65.15 1gpx h ILE 32 Cb 0.00 0.13 -0.34 0.00 -0.74 0.00 0.00 36.82 35.87 1gpx h ILE 32 CO 0.00 0.00 0.27 -1.22 0.00 0.00 0.00 178.15 177.20 1gpx n TYR 33 N -4.09 3.34 0.16 1.37 4.01 -1.26 -4.78 117.16 115.90 1gpx n TYR 33 Ca 0.38 -3.22 0.17 0.00 -0.16 0.00 0.00 57.90 55.07 1gpx n TYR 33 Cb 1.71 -0.88 0.62 0.00 -0.31 0.00 0.00 39.34 40.49 1gpx n TYR 33 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1gpx h ASP 34 N 3.72 0.00 -3.11 7.72 2.03 -1.28 -3.33 116.42 122.16 1gpx h ASP 34 Ca 0.34 0.00 -0.55 0.00 -0.73 0.00 0.00 57.03 56.09 1gpx h ASP 34 Cb 0.42 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 38.84 1gpx h ASP 34 CO 1.02 0.00 0.99 -0.51 -1.03 0.00 0.00 179.24 179.71 1gpx s ILE 35 N -4.33 3.98 -0.06 4.15 2.07 -1.26 -5.01 121.20 120.74 1gpx s ILE 35 Ca -0.03 0.86 -0.03 0.00 -1.41 0.00 0.00 60.65 60.04 1gpx s ILE 35 Cb 0.11 -4.73 -0.04 0.00 0.13 0.00 0.00 42.46 37.93 1gpx s ILE 35 CO 0.37 -1.38 0.10 -0.69 -1.91 0.00 0.00 174.94 171.43 1gpx s VAL 36 N 5.06 4.97 0.00 4.00 1.01 -1.25 -4.65 120.40 129.54 1gpx s VAL 36 Ca 0.43 -0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.25 1gpx s VAL 36 Cb -0.08 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.09 1gpx s VAL 36 CO 0.25 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.44 1gpx n GLY 37 N 1.59 4.47 0.78 4.51 0.00 -1.26 -4.93 105.19 110.35 1gpx n GLY 37 Ca -0.16 -1.22 0.08 0.00 0.00 0.00 0.00 46.02 44.72 1gpx n GLY 37 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gpx n ASP 38 N 0.00 2.85 -0.12 1.61 8.00 -0.99 -4.51 116.55 123.39 1gpx n ASP 38 Ca 0.00 -1.84 -0.13 0.00 0.71 0.00 0.00 54.79 53.53 1gpx n ASP 38 Cb 0.00 -0.17 -0.02 0.00 -0.02 0.00 0.00 41.12 40.90 1gpx n ASP 38 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1gpx n GLY 40 N 0.16 -0.49 1.67 0.00 0.00 -1.26 0.31 105.19 105.58 1gpx n GLY 40 Ca -0.02 0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.67 0.71 0.00 -0.02 0.00 -1.26 -4.94 105.19 99.01 1gpx n GLY 41 Ca -0.03 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.25 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 1.67 0.00 -1.60 1.61 2.88 0.90 -5.06 113.62 114.03 1gpx n SER 42 Ca 0.00 -0.92 -0.02 0.00 -1.33 0.00 0.00 58.87 56.60 1gpx n SER 42 Cb 0.48 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.95 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 0.00 -0.60 -2.08 -1.46 0.00 -1.24 -4.97 120.51 110.16 1gpx n ALA 43 Ca 0.00 0.01 0.04 0.00 0.00 0.00 0.00 53.44 53.49 1gpx n ALA 43 Cb 0.23 -1.03 0.07 0.00 0.00 0.00 0.00 19.45 18.72 1gpx n ALA 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1gpx n SER 44 N -1.58 1.11 -4.58 0.00 7.64 -1.26 -4.70 113.62 110.25 1gpx n SER 44 Ca -0.02 -2.55 -0.33 0.00 1.01 0.00 0.00 58.87 56.99 1gpx n SER 44 Cb 0.52 -0.35 -0.11 0.00 -1.01 0.00 0.00 64.21 63.26 1gpx n SER 44 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gpx n ALA 46 N 1.87 2.21 -0.05 0.00 0.00 -1.26 -4.17 120.51 119.11 1gpx n ALA 46 Ca -0.17 -1.09 -0.05 0.00 0.00 0.00 0.00 53.44 52.14 1gpx n ALA 46 Cb 0.53 -0.43 -0.07 0.00 0.00 0.00 0.00 19.45 19.47 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 0.54 0.63 0.24 0.00 -2.24 -1.26 -4.49 114.28 107.69 1gpx n THR 47 Ca 0.11 -0.39 -0.06 0.00 -2.27 0.00 0.00 64.05 61.45 1gpx n THR 47 Cb 0.41 -0.76 0.03 0.00 -2.10 0.00 0.00 70.33 67.92 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 0.35 2.60 -3.75 0.00 -0.00 -1.26 0.33 115.22 113.50 1gpx n HIS 49 Ca 0.13 0.29 -0.10 0.00 0.46 0.00 0.00 57.72 58.50 1gpx n HIS 49 Cb 0.70 -2.56 -0.06 0.00 -0.12 0.00 0.00 29.99 27.95 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 0.15 0.10 -0.06 3.57 -7.23 0.49 -4.02 120.40 113.40 1gpx s VAL 50 Ca 0.67 -0.86 0.05 0.00 -1.81 0.00 0.00 61.98 60.03 1gpx s VAL 50 Cb -0.55 -1.21 -0.01 0.00 0.56 0.00 0.00 36.38 35.17 1gpx s VAL 50 CO 0.47 -0.47 -0.21 -0.31 -0.31 0.00 0.00 175.10 174.26 1gpx s TYR 51 N -3.63 2.12 0.34 2.82 1.51 0.91 0.90 117.35 122.32 1gpx s TYR 51 Ca 0.03 -0.65 -0.04 0.00 -1.01 0.00 0.00 57.07 55.39 1gpx s TYR 51 Cb 0.03 -1.41 -0.05 0.00 -0.11 0.00 0.00 41.96 40.42 1gpx s TYR 51 CO -0.10 -0.22 0.60 0.08 -1.11 0.00 0.00 175.55 174.80 1gpx s VAL 52 N -0.01 5.01 0.00 0.71 1.01 -1.18 0.13 120.40 126.07 1gpx s VAL 52 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 61.98 61.92 1gpx s VAL 52 Cb -0.13 -3.78 0.00 0.00 0.00 0.00 0.00 36.38 32.46 1gpx s VAL 52 CO 0.04 -0.47 0.00 -0.46 0.00 0.00 0.00 175.10 174.20 1gpx n ASN 53 N -1.36 0.00 -0.25 3.32 0.23 -0.02 -4.88 115.26 112.30 1gpx n ASN 53 Ca -0.02 0.00 0.10 0.00 -0.53 0.00 0.00 54.58 54.13 1gpx n ASN 53 Cb 0.55 0.00 -0.06 0.00 -2.08 0.00 0.00 39.78 38.19 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 0.91 -0.12 -3.83 0.00 -1.26 -4.38 120.64 111.95 1gpx n GLU 54 Ca 0.00 -0.51 -0.17 0.00 0.00 0.00 0.00 57.16 56.48 1gpx n GLU 54 Cb 0.00 -1.43 -0.12 0.00 0.00 0.00 0.00 31.44 29.89 1gpx n GLU 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1gpx n ALA 55 N -0.72 1.46 1.70 -1.84 0.00 -1.26 -4.46 120.51 115.40 1gpx n ALA 55 Ca 0.06 -1.08 0.13 0.00 0.00 0.00 0.00 53.44 52.55 1gpx n ALA 55 Cb 0.38 -0.08 0.62 0.00 0.00 0.00 0.00 19.45 20.37 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 -3.22 0.05 -0.06 0.00 3.01 -1.26 -4.00 117.46 111.97 1gpx n PHE 56 Ca -0.44 -0.02 -0.08 0.00 1.01 0.00 0.00 57.45 57.92 1gpx n PHE 56 Cb 0.98 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 40.37 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 1.09 0.98 0.00 4.37 1.35 -1.78 -3.14 112.91 115.79 1gpx h THR 57 Ca 0.00 -1.75 0.00 0.00 -0.55 0.00 0.00 66.41 64.11 1gpx h THR 57 Cb 0.24 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 1gpx h THR 57 CO 0.00 0.33 0.00 -0.90 -0.25 0.00 0.00 175.52 174.70 1gpx n ASP 58 N -4.67 0.25 -0.05 5.36 5.75 -1.26 -2.34 116.55 119.58 1gpx n ASP 58 Ca -0.07 0.60 -0.07 0.00 -0.01 0.00 0.00 54.79 55.25 1gpx n ASP 58 Cb 0.28 -0.64 -0.06 0.00 -1.03 0.00 0.00 41.12 39.67 1gpx n ASP 58 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 1gpx h LYS 59 N 0.00 -0.01 -6.96 0.11 1.79 -1.70 -3.46 116.57 106.34 1gpx h LYS 59 Ca 0.00 0.00 -0.49 0.00 -2.18 0.00 0.00 60.65 57.98 1gpx h LYS 59 Cb 0.07 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.74 1gpx h LYS 59 CO 0.00 0.47 0.19 0.54 -1.08 0.00 0.00 179.45 179.57 1gpx s VAL 60 N -1.95 4.74 0.86 0.50 0.11 -0.99 -5.04 120.40 118.63 1gpx s VAL 60 Ca -0.09 0.72 -0.11 0.00 -2.93 0.00 0.00 61.98 59.56 1gpx s VAL 60 Cb -0.01 -3.75 0.11 0.00 -1.53 0.00 0.00 36.38 31.19 1gpx s VAL 60 CO 0.34 -0.63 1.14 -2.16 -3.33 0.00 0.00 175.10 170.46 1gpx s PRO 61 N -4.08 1.44 0.00 1.54 0.04 -1.26 -4.86 135.00 127.81 1gpx s PRO 61 Ca 0.53 1.50 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1gpx s PRO 61 Cb -0.10 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.66 1gpx s PRO 61 CO 0.34 -2.31 0.00 0.00 0.04 0.00 0.00 177.00 175.07 1gpx n ALA 62 N -3.87 0.00 -2.61 8.56 0.00 -1.26 -4.94 120.51 116.39 1gpx n ALA 62 Ca 0.12 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.33 1gpx n ALA 62 Cb 0.52 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.91 1gpx n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gpx s ALA 63 N -3.93 3.47 0.00 0.00 0.00 -1.26 -5.03 121.76 115.01 1gpx s ALA 63 Ca 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 51.96 50.28 1gpx s ALA 63 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 23.12 22.21 1gpx s ALA 63 CO 0.00 0.13 0.00 0.27 0.00 0.00 0.00 175.76 176.16 1gpx n ASN 64 N -1.12 0.02 0.14 0.00 0.23 -1.26 -4.96 115.26 108.31 1gpx n ASN 64 Ca -0.05 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.00 1gpx n ASN 64 Cb 0.60 0.00 0.17 0.00 -2.08 0.00 0.00 39.78 38.47 1gpx n ASN 64 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 1gpx h GLU 65 N 0.00 0.00 0.06 -3.83 4.11 -2.01 -3.22 114.58 109.69 1gpx h GLU 65 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 1gpx h GLU 65 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1gpx h GLU 65 CO 0.00 0.60 -0.03 -0.09 0.07 0.00 0.00 179.01 179.56 1gpx h ARG 66 N 0.00 -0.08 -0.28 1.06 2.43 -1.94 -2.46 114.38 113.10 1gpx h ARG 66 Ca -0.01 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1gpx h ARG 66 Cb 1.15 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.71 1gpx h ARG 66 CO 0.08 0.16 0.00 -1.91 -1.51 0.00 0.00 179.97 176.79 1gpx n GLU 67 N -5.02 0.63 -0.07 0.20 2.13 -1.22 -3.45 120.64 113.84 1gpx n GLU 67 Ca -0.08 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.52 1gpx n GLU 67 Cb 0.15 -1.14 -0.12 0.00 0.27 0.00 0.00 31.44 30.60 1gpx n GLU 67 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1gpx n ILE 68 N -0.19 1.61 -0.06 6.31 -0.00 -0.93 -3.72 119.36 122.39 1gpx n ILE 68 Ca 0.00 -0.30 -0.02 0.00 -0.00 0.00 0.00 62.75 62.42 1gpx n ILE 68 Cb 0.07 -1.89 -0.01 0.00 -0.00 0.00 0.00 39.64 37.81 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 -0.15 0.00 -0.18 7.39 0.00 -1.70 -2.34 103.07 106.09 1gpx h GLY 69 Ca -0.43 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.10 1gpx h GLY 69 CO -0.13 0.00 0.30 0.00 0.00 0.00 0.00 176.54 176.71 1gpx h MET 70 N -0.97 0.33 -0.72 4.80 -0.00 -1.83 1.81 114.93 118.34 1gpx h MET 70 Ca 0.00 -0.02 -0.03 0.00 -0.00 0.00 0.00 59.70 59.65 1gpx h MET 70 Cb 0.26 -0.07 -0.03 0.00 -0.00 0.00 0.00 31.60 31.75 1gpx h MET 70 CO 0.00 0.22 0.31 1.25 -0.00 0.00 0.00 176.91 178.69 1gpx h LEU 71 N 0.34 0.96 -2.33 -0.10 6.46 -1.70 -0.56 115.31 118.38 1gpx h LEU 71 Ca 0.51 -0.13 -0.09 0.00 -0.12 0.00 0.00 57.88 58.05 1gpx h LEU 71 Cb 0.94 -0.25 -0.05 0.00 -0.73 0.00 0.00 40.66 40.57 1gpx h LEU 71 CO -0.54 0.84 0.12 1.21 -0.62 0.00 0.00 178.44 179.45 1gpx n GLU 72 N -4.31 1.26 0.00 1.25 2.13 0.60 -4.59 120.64 116.99 1gpx n GLU 72 Ca 0.07 -0.57 0.00 0.00 0.66 0.00 0.00 57.16 57.32 1gpx n GLU 72 Cb 0.16 -1.24 0.00 0.00 0.27 0.00 0.00 31.44 30.63 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 -0.88 4.89 -0.71 0.00 -7.23 -1.26 -4.89 120.40 110.32 1gpx s VAL 74 Ca 0.00 1.93 -0.15 0.00 -1.81 0.00 0.00 61.98 61.96 1gpx s VAL 74 Cb 0.00 -4.26 -0.18 0.00 0.56 0.00 0.00 36.38 32.50 1gpx s VAL 74 CO 0.00 0.15 1.91 1.07 -0.31 0.00 0.00 175.10 177.92 1gpx n THR 75 N 4.00 0.00 -1.96 5.32 5.66 -1.26 -4.70 114.28 121.33 1gpx n THR 75 Ca 0.05 -0.39 -0.36 0.00 -3.05 0.00 0.00 64.05 60.30 1gpx n THR 75 Cb 0.51 -0.91 0.04 0.00 -1.55 0.00 0.00 70.33 68.41 1gpx n THR 75 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1gpx n ALA 76 N 11.60 6.17 -4.06 1.79 0.00 -1.26 -4.57 120.51 130.18 1gpx n ALA 76 Ca 0.39 -4.07 -0.45 0.00 0.00 0.00 0.00 53.44 49.32 1gpx n ALA 76 Cb 0.38 -1.63 0.02 0.00 0.00 0.00 0.00 19.45 18.21 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 -0.58 -0.31 -0.66 0.00 0.28 -1.26 -4.71 120.64 113.40 1gpx n GLU 77 Ca 0.52 0.08 -0.21 0.00 -0.16 0.00 0.00 57.16 57.39 1gpx n GLU 77 Cb 0.39 -2.30 -0.00 0.00 1.43 0.00 0.00 31.44 30.96 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 -4.80 -1.55 0.00 -1.84 7.94 -1.26 -4.97 117.00 110.52 1gpx n LEU 78 Ca -0.12 0.40 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 1gpx n LEU 78 Cb 0.55 -0.45 0.00 0.00 0.53 0.00 0.00 43.42 44.05 1gpx n LEU 78 CO 0.72 -2.22 0.00 0.29 -1.11 0.00 0.00 177.39 175.07 1gpx n LYS 79 N 0.70 0.00 0.08 1.96 5.02 -1.26 -5.01 118.16 119.65 1gpx n LYS 79 Ca 0.05 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.23 1gpx n LYS 79 Cb 0.21 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.09 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 0.14 -0.30 1.97 0.13 -2.02 -3.31 132.00 128.61 1gpx h PRO 80 Ca 0.00 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1gpx h PRO 80 Cb 0.00 0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.22 1gpx h PRO 80 CO 0.00 1.08 0.00 0.27 -0.23 0.00 0.00 178.00 179.12 1gpx n ASN 81 N -3.42 3.19 -4.75 1.44 6.94 -1.26 -4.96 115.26 112.43 1gpx n ASN 81 Ca -0.06 -1.93 -0.41 0.00 -0.02 0.00 0.00 54.58 52.16 1gpx n ASN 81 Cb 0.99 -0.19 -0.02 0.00 -2.36 0.00 0.00 39.78 38.20 1gpx n ASN 81 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 1gpx s SER 82 N -1.42 6.51 0.25 0.53 0.01 -1.25 -3.10 113.70 115.24 1gpx s SER 82 Ca 0.33 2.82 -0.15 0.00 1.31 0.00 0.00 55.95 60.26 1gpx s SER 82 Cb 0.20 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1gpx s SER 82 CO 0.28 -0.80 0.54 -0.13 0.41 0.00 0.00 173.24 173.53 1gpx s ARG 83 N -0.60 1.58 0.20 12.44 1.81 0.26 -4.89 118.95 129.74 1gpx s ARG 83 Ca 0.60 -1.14 -0.11 0.00 -1.72 0.00 0.00 55.73 53.36 1gpx s ARG 83 Cb -0.45 0.51 -0.07 0.00 -0.45 0.00 0.00 34.95 34.49 1gpx s ARG 83 CO 0.47 -0.67 0.54 -0.51 -0.68 0.00 0.00 175.30 174.45 1gpx s LEU 84 N -2.98 4.22 0.58 2.53 1.43 -1.26 0.18 118.68 123.39 1gpx s LEU 84 Ca 0.18 0.96 0.33 0.00 -1.03 0.00 0.00 54.13 54.57 1gpx s LEU 84 Cb -0.02 -3.54 1.40 0.00 0.03 0.00 0.00 46.19 44.07 1gpx s LEU 84 CO 0.07 -0.01 1.69 0.28 0.23 0.00 0.00 176.35 178.61 1gpx h SER 85 N 2.88 0.00 -1.00 2.29 0.02 0.52 0.65 113.55 118.92 1gpx h SER 85 Ca -0.47 0.00 -0.67 0.00 -0.84 0.00 0.00 61.79 59.81 1gpx h SER 85 Cb 1.18 0.00 -0.31 0.00 0.14 0.00 0.00 62.40 63.41 1gpx h SER 85 CO 0.68 0.00 0.68 0.00 -1.14 0.00 0.00 176.83 177.05 1gpx n GLN 87 N -0.88 0.00 -2.77 0.00 1.13 0.22 -3.96 117.38 111.12 1gpx n GLN 87 Ca 0.60 0.00 -0.35 0.00 -1.94 0.00 0.00 57.00 55.32 1gpx n GLN 87 Cb 0.68 -0.77 -0.06 0.00 0.11 0.00 0.00 30.24 30.20 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 -1.74 4.25 0.12 5.09 -1.09 -1.26 -5.00 121.20 121.57 1gpx s ILE 88 Ca 0.00 1.58 0.07 0.00 -2.23 0.00 0.00 60.65 60.07 1gpx s ILE 88 Cb 0.00 -3.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.10 1gpx s ILE 88 CO 0.00 -0.13 -0.07 -0.63 -1.23 0.00 0.00 174.94 172.88 1gpx s ILE 89 N -1.93 3.47 -0.31 2.92 -1.09 -1.26 -2.91 121.20 120.08 1gpx s ILE 89 Ca 0.58 -1.31 -0.05 0.00 -2.23 0.00 0.00 60.65 57.63 1gpx s ILE 89 Cb -0.14 -2.66 0.03 0.00 -1.58 0.00 0.00 42.46 38.11 1gpx s ILE 89 CO 0.18 0.05 0.07 -0.04 -1.23 0.00 0.00 174.94 173.97 1gpx s MET 90 N -2.41 2.74 0.44 2.79 -1.94 0.70 -4.87 119.30 116.74 1gpx s MET 90 Ca 0.23 -1.09 0.08 0.00 -1.71 0.00 0.00 55.69 53.20 1gpx s MET 90 Cb -0.11 -3.36 0.01 0.00 2.01 0.00 0.00 34.83 33.39 1gpx s MET 90 CO 0.15 -0.58 0.57 0.95 -0.01 0.00 0.00 175.02 176.11 1gpx s THR 91 N 1.40 2.88 -1.48 2.05 -4.23 -1.25 -2.59 115.64 112.43 1gpx s THR 91 Ca -0.01 -1.03 0.20 0.00 -1.18 0.00 0.00 61.69 59.67 1gpx s THR 91 Cb -0.19 -2.91 0.38 0.00 1.34 0.00 0.00 72.50 71.11 1gpx s THR 91 CO 0.02 0.00 1.64 -0.81 -0.54 0.00 0.00 174.62 174.92 1gpx n PRO 92 N -1.86 0.32 -0.05 3.99 -0.04 -1.26 -3.06 135.00 133.04 1gpx n PRO 92 Ca 0.08 0.09 -0.04 0.00 -0.04 0.00 0.00 63.50 63.59 1gpx n PRO 92 Cb 0.60 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 1gpx n PRO 92 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1gpx n GLU 93 N -1.26 2.30 -2.11 0.54 0.28 -1.26 -4.64 120.64 114.50 1gpx n GLU 93 Ca 0.10 -0.01 -0.38 0.00 -0.16 0.00 0.00 57.16 56.71 1gpx n GLU 93 Cb 0.15 -1.25 0.01 0.00 1.43 0.00 0.00 31.44 31.78 1gpx n GLU 93 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1gpx n LEU 94 N -2.34 7.39 -4.88 -1.84 4.77 -1.17 -4.98 117.00 113.95 1gpx n LEU 94 Ca -0.15 -4.91 -0.32 0.00 -0.03 0.00 0.00 56.01 50.60 1gpx n LEU 94 Cb 0.80 -1.17 -0.05 0.00 -2.33 0.00 0.00 43.42 40.66 1gpx n LEU 94 CO 0.21 1.90 -0.18 1.51 -1.33 0.00 0.00 177.39 179.50 1gpx s ASP 95 N -0.71 6.15 0.00 -1.43 -4.77 -1.25 -4.41 116.67 110.24 1gpx s ASP 95 Ca 0.49 0.23 0.00 0.00 -3.30 0.00 0.00 52.55 49.97 1gpx s ASP 95 Cb 0.31 -1.86 0.00 0.00 -1.09 0.00 0.00 42.92 40.28 1gpx s ASP 95 CO -0.24 0.21 0.00 0.61 0.70 0.00 0.00 175.17 176.45 1gpx n GLY 96 N 0.60 1.41 3.65 2.12 0.00 0.76 -4.72 105.19 109.01 1gpx n GLY 96 Ca -0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 1gpx n GLY 96 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1gpx s ILE 97 N -2.00 4.43 -0.14 -0.61 -1.16 -0.77 -4.89 121.20 116.05 1gpx s ILE 97 Ca 0.00 1.68 -0.27 0.00 -0.51 0.00 0.00 60.65 61.55 1gpx s ILE 97 Cb 0.00 -4.24 -0.01 0.00 0.61 0.00 0.00 42.46 38.82 1gpx s ILE 97 CO 0.00 -0.32 0.90 -0.69 -2.81 0.00 0.00 174.94 172.03 1gpx s VAL 98 N 3.64 4.84 0.53 4.00 1.01 -1.26 -2.35 120.40 130.82 1gpx s VAL 98 Ca 0.49 1.81 0.07 0.00 0.00 0.00 0.00 61.98 64.35 1gpx s VAL 98 Cb -0.16 -4.21 0.07 0.00 0.00 0.00 0.00 36.38 32.08 1gpx s VAL 98 CO 0.14 0.02 0.59 0.52 0.00 0.00 0.00 175.10 176.37 1gpx n VAL 99 N 4.62 0.00 -3.61 2.92 0.31 0.16 -0.84 118.33 121.89 1gpx n VAL 99 Ca 0.06 -1.91 -0.14 0.00 -0.01 0.00 0.00 64.34 62.35 1gpx n VAL 99 Cb 0.49 -0.33 -0.07 0.00 -0.91 0.00 0.00 33.84 33.02 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 -4.20 -0.66 0.17 4.52 1.01 0.35 -3.21 116.67 114.65 1gpx s ASP 100 Ca 0.45 1.15 -0.10 0.00 0.71 0.00 0.00 52.55 54.76 1gpx s ASP 100 Cb -0.04 1.13 -0.07 0.00 1.01 0.00 0.00 42.92 44.96 1gpx s ASP 100 CO 0.28 -0.31 0.49 -0.69 0.21 0.00 0.00 175.17 175.16 1gpx s VAL 101 N -0.03 4.98 0.06 -1.27 1.01 -0.18 0.31 120.40 125.28 1gpx s VAL 101 Ca -0.02 0.48 -0.31 0.00 0.00 0.00 0.00 61.98 62.13 1gpx s VAL 101 Cb -0.04 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.62 1gpx s VAL 101 CO 0.02 0.08 1.61 -2.16 0.00 0.00 0.00 175.10 174.64 1gpx s PRO 102 N -2.44 4.21 -0.89 2.72 0.04 -1.26 -3.54 135.00 133.85 1gpx s PRO 102 Ca 0.42 2.27 -0.01 0.00 0.04 0.00 0.00 61.00 63.72 1gpx s PRO 102 Cb -0.13 -3.57 0.24 0.00 0.04 0.00 0.00 34.50 31.08 1gpx s PRO 102 CO 0.21 -0.70 0.88 -0.40 0.04 0.00 0.00 177.00 177.03 1gpx n ASP 103 N 5.48 4.46 0.00 6.66 5.75 -1.26 -4.63 116.55 133.01 1gpx n ASP 103 Ca 0.15 -3.22 0.00 0.00 -0.01 0.00 0.00 54.79 51.71 1gpx n ASP 103 Cb 0.41 -1.02 0.00 0.00 -1.03 0.00 0.00 41.12 39.48 1gpx n ASP 103 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gpx n ARG 104 N 1.92 0.00 -3.41 0.11 3.00 -1.26 -4.64 116.66 112.38 1gpx n ARG 104 Ca 0.24 0.13 -0.44 0.00 -0.01 0.00 0.00 57.85 57.77 1gpx n ARG 104 Cb 0.37 -0.87 -0.09 0.00 0.00 0.00 0.00 32.46 31.87 1gpx n ARG 104 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 1gpx s GLN 105 N -0.86 2.98 0.00 5.56 -1.52 -1.26 -5.08 119.66 119.48 1gpx s GLN 105 Ca 0.00 -1.17 0.00 0.00 -1.95 0.00 0.00 55.36 52.24 1gpx s GLN 105 Cb 0.00 -4.06 0.00 0.00 -0.22 0.00 0.00 33.01 28.73 1gpx s GLN 105 CO 0.00 -0.91 0.00 1.87 -0.25 0.00 0.00 175.29 176.00