#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1go0 n SER -1 N 0.00 -0.63 -4.05 1.61 7.64 -1.26 -4.95 113.62 111.98 1go0 n SER -1 Ca 0.00 -3.28 -0.28 0.00 1.01 0.00 0.00 58.87 56.33 1go0 n SER -1 Cb 0.00 0.49 -0.04 0.00 -1.01 0.00 0.00 64.21 63.66 1go0 n SER -1 CO 0.00 0.00 0.00 0.55 -3.01 0.00 0.00 175.04 172.58 1go0 n VAL 1 N 0.45 -2.45 -1.78 0.44 3.14 -1.26 -4.81 118.33 112.06 1go0 n VAL 1 Ca 0.17 -0.45 -0.42 0.00 -2.96 0.00 0.00 64.34 60.67 1go0 n VAL 1 Cb 0.67 -2.22 -0.03 0.00 -1.06 0.00 0.00 33.84 31.20 1go0 n VAL 1 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1go0 s ASP 2 N -4.28 6.51 0.10 6.55 1.01 -1.26 -4.89 116.67 120.42 1go0 s ASP 2 Ca 0.07 2.55 -0.21 0.00 0.71 0.00 0.00 52.55 55.67 1go0 s ASP 2 Cb -0.04 -2.53 -0.11 0.00 1.01 0.00 0.00 42.92 41.25 1go0 s ASP 2 CO 0.92 -1.01 1.74 0.15 0.21 0.00 0.00 175.17 177.18 1go0 h PHE 3 N 10.08 0.13 -0.27 4.23 3.57 -1.99 -1.98 116.94 130.70 1go0 h PHE 3 Ca -0.46 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.03 1go0 h PHE 3 Cb 1.22 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 1go0 h PHE 3 CO 0.92 0.11 0.15 0.00 -2.23 0.00 0.00 178.31 177.26 1go0 h ALA 4 N 1.02 0.35 -0.06 2.41 0.00 -1.99 0.45 119.26 121.44 1go0 h ALA 4 Ca 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1go0 h ALA 4 Cb 0.01 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1go0 h ALA 4 CO -0.01 -0.12 0.03 0.35 0.00 0.00 0.00 179.25 179.50 1go0 h PHE 5 N 0.33 0.08 -0.62 0.00 3.57 -1.95 -0.80 116.94 117.56 1go0 h PHE 5 Ca 0.10 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.54 1go0 h PHE 5 Cb 0.05 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 1go0 h PHE 5 CO -0.04 0.13 0.16 0.93 -2.23 0.00 0.00 178.31 177.27 1go0 h GLU 6 N 0.02 0.96 -0.14 1.11 4.39 -1.27 -0.85 114.58 118.79 1go0 h GLU 6 Ca 0.02 -0.20 -0.04 0.00 0.34 0.00 0.00 59.36 59.48 1go0 h GLU 6 Cb 0.07 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1go0 h GLU 6 CO -0.00 0.84 -0.07 1.25 -1.16 0.00 0.00 179.01 179.87 1go0 h LEU 7 N 0.92 0.30 -1.02 1.33 5.85 -0.63 0.37 115.31 122.43 1go0 h LEU 7 Ca 0.20 -0.41 -0.09 0.00 0.84 0.00 0.00 57.88 58.42 1go0 h LEU 7 Cb 0.31 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1go0 h LEU 7 CO -0.00 0.65 -0.24 0.08 -0.34 0.00 0.00 178.44 178.58 1go0 h ARG 8 N -0.05 0.42 -0.64 1.25 0.11 -1.09 -0.76 114.38 113.61 1go0 h ARG 8 Ca 0.03 -0.15 -0.08 0.00 0.10 0.00 0.00 59.98 59.89 1go0 h ARG 8 Cb 0.54 -0.03 -0.02 0.00 1.11 0.00 0.00 29.97 31.56 1go0 h ARG 8 CO 0.02 0.63 0.10 -0.22 0.10 0.00 0.00 179.97 180.60 1go0 h LYS 9 N 0.37 1.06 -0.64 0.08 3.64 -1.03 -0.21 116.57 119.83 1go0 h LYS 9 Ca 0.06 -0.29 -0.04 0.00 -1.27 0.00 0.00 60.65 59.11 1go0 h LYS 9 Cb 0.63 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1go0 h LYS 9 CO 0.04 0.98 0.25 0.00 -2.27 0.00 0.00 179.45 178.46 1go0 h ALA 10 N 1.03 1.23 -0.64 5.00 0.00 -0.31 0.29 119.26 125.86 1go0 h ALA 10 Ca 0.19 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1go0 h ALA 10 Cb 0.44 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1go0 h ALA 10 CO 0.01 0.56 0.08 0.37 0.00 0.00 0.00 179.25 180.27 1go0 h GLN 11 N 0.93 1.07 0.01 0.00 -0.00 -0.65 -0.64 115.11 115.83 1go0 h GLN 11 Ca 0.22 -0.30 -0.00 0.00 -0.00 0.00 0.00 58.65 58.57 1go0 h GLN 11 Cb 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 27.48 27.55 1go0 h GLN 11 CO -0.02 1.00 -0.01 0.22 0.00 0.00 0.00 178.83 180.02 1go0 h ASP 12 N 1.00 -0.02 -1.32 -0.69 1.82 -0.28 -3.38 116.42 113.55 1go0 h ASP 12 Ca 0.19 -0.74 -0.61 0.00 -0.39 0.00 0.00 57.03 55.48 1go0 h ASP 12 Cb 0.47 0.00 -0.39 0.00 0.68 0.00 0.00 39.33 40.09 1go0 h ASP 12 CO 0.02 0.75 -0.33 1.07 -1.61 0.00 0.00 179.24 179.14 1go0 n THR 13 N -4.73 2.72 0.00 2.25 5.66 0.94 -4.98 114.28 116.15 1go0 n THR 13 Ca -0.09 -4.45 0.00 0.00 -3.05 0.00 0.00 64.05 56.46 1go0 n THR 13 Cb 0.37 -1.22 0.00 0.00 -1.55 0.00 0.00 70.33 67.93 1go0 n THR 13 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1go0 n GLY 14 N -0.60 2.52 3.43 1.09 0.00 -0.26 -4.04 105.19 107.33 1go0 n GLY 14 Ca 0.45 0.04 0.01 0.00 0.00 0.00 0.00 46.02 46.52 1go0 n GLY 14 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1go0 s LYS 15 N 4.44 0.56 -0.11 1.61 2.36 0.65 -4.90 119.74 124.36 1go0 s LYS 15 Ca 0.00 1.25 0.02 0.00 -2.55 0.00 0.00 55.97 54.69 1go0 s LYS 15 Cb 0.00 0.71 0.01 0.00 -1.05 0.00 0.00 37.83 37.50 1go0 s LYS 15 CO 0.00 -0.38 -0.18 0.42 1.55 0.00 0.00 175.35 176.77 1go0 s ILE 16 N 2.87 1.65 -0.07 5.43 -1.09 -1.26 -1.94 121.20 126.79 1go0 s ILE 16 Ca 0.05 -0.75 -0.19 0.00 -2.23 0.00 0.00 60.65 57.53 1go0 s ILE 16 Cb -0.13 -1.48 -0.05 0.00 -1.58 0.00 0.00 42.46 39.22 1go0 s ILE 16 CO -0.20 0.47 0.53 -0.69 -1.23 0.00 0.00 174.94 173.82 1go0 s VAL 17 N 0.81 5.09 -0.10 2.92 1.01 0.27 -4.91 120.40 125.48 1go0 s VAL 17 Ca -0.10 1.08 0.02 0.00 0.00 0.00 0.00 61.98 62.98 1go0 s VAL 17 Cb -0.16 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.37 1go0 s VAL 17 CO 0.01 0.36 -0.15 -0.04 0.00 0.00 0.00 175.10 175.28 1go0 s MET 18 N 0.30 2.17 0.00 2.72 -1.94 -1.26 0.01 119.30 121.29 1go0 s MET 18 Ca 0.29 -0.54 0.00 0.00 -1.71 0.00 0.00 55.69 53.72 1go0 s MET 18 Cb -0.16 -1.84 0.00 0.00 2.01 0.00 0.00 34.83 34.83 1go0 s MET 18 CO 0.13 -0.06 0.00 0.41 -0.01 0.00 0.00 175.02 175.50 1go0 n GLY 19 N 4.18 -0.53 1.68 -0.03 0.00 -0.64 -4.97 105.19 104.88 1go0 n GLY 19 Ca -0.19 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1go0 n GLY 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1go0 n ALA 20 N 0.00 0.00 -0.16 4.61 0.00 -1.26 -1.21 120.51 122.49 1go0 n ALA 20 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1go0 n ALA 20 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.49 1go0 n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1go0 h ARG 21 N 0.00 0.97 -0.94 0.00 -0.00 -1.97 -2.38 114.38 110.06 1go0 h ARG 21 Ca 0.00 -0.35 -0.01 0.00 -0.50 0.00 0.00 59.98 59.12 1go0 h ARG 21 Cb 0.00 -0.06 -0.05 0.00 0.00 0.00 0.00 29.97 29.86 1go0 h ARG 21 CO 0.00 1.02 0.56 -0.22 0.00 0.00 0.00 179.97 181.33 1go0 h LYS 22 N 0.86 1.28 -0.32 0.04 1.63 -1.93 -2.29 116.57 115.83 1go0 h LYS 22 Ca 0.13 -0.12 -0.09 0.00 -0.85 0.00 0.00 60.65 59.72 1go0 h LYS 22 Cb 0.67 -0.27 -0.02 0.00 -0.60 0.00 0.00 32.23 32.02 1go0 h LYS 22 CO 0.05 0.90 -0.19 1.03 -3.45 0.00 0.00 179.45 177.79 1go0 h SER 23 N 1.30 0.59 -0.96 4.20 0.87 -1.84 -2.84 113.55 114.87 1go0 h SER 23 Ca 0.34 -0.19 0.03 0.00 -1.23 0.00 0.00 61.79 60.73 1go0 h SER 23 Cb -0.05 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.70 1go0 h SER 23 CO -0.06 0.79 0.63 0.40 -0.53 0.00 0.00 176.83 178.06 1go0 h ILE 24 N 0.53 1.20 -0.74 2.23 2.04 -0.90 -1.58 117.51 120.29 1go0 h ILE 24 Ca 0.08 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1go0 h ILE 24 Cb 0.63 -0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 36.52 1go0 h ILE 24 CO 0.04 0.23 0.49 -0.61 0.00 0.00 0.00 178.15 178.30 1go0 h GLN 25 N 1.24 0.97 -0.26 2.37 4.15 -1.32 0.23 115.11 122.48 1go0 h GLN 25 Ca 0.37 -0.06 -0.13 0.00 0.77 0.00 0.00 58.65 59.60 1go0 h GLN 25 Cb -0.05 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.41 1go0 h GLN 25 CO -0.10 0.64 -0.36 1.88 -1.93 0.00 0.00 178.83 178.96 1go0 h TYR 26 N 1.00 0.69 -0.29 3.99 -1.99 -1.32 -2.26 116.97 116.79 1go0 h TYR 26 Ca 0.27 -0.19 -0.12 0.00 2.00 0.00 0.00 58.73 60.69 1go0 h TYR 26 Cb -0.11 -0.15 -0.01 0.00 2.00 0.00 0.00 36.73 38.46 1go0 h TYR 26 CO -0.00 0.87 -0.32 0.00 -0.00 0.00 0.00 178.16 178.71 1go0 h ALA 27 N 1.11 0.89 -0.09 3.88 0.00 -0.49 0.30 119.26 124.86 1go0 h ALA 27 Ca 0.05 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1go0 h ALA 27 Cb 0.85 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1go0 h ALA 27 CO 0.07 0.63 -0.01 0.87 0.00 0.00 0.00 179.25 180.81 1go0 h LYS 28 N 0.53 0.17 0.00 0.00 1.57 -0.29 -3.33 116.57 115.22 1go0 h LYS 28 Ca 0.06 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 1go0 h LYS 28 Cb 0.81 -0.01 -0.12 0.00 0.08 0.00 0.00 32.23 32.99 1go0 h LYS 28 CO 0.07 0.46 -0.49 0.00 -0.57 0.00 0.00 179.45 178.91 1go0 n MET 29 N -4.81 0.00 0.00 3.15 0.00 -0.88 -4.98 117.12 109.60 1go0 n MET 29 Ca -0.06 -1.03 0.00 0.00 0.00 0.00 0.00 57.70 56.61 1go0 n MET 29 Cb 0.22 -0.11 0.00 0.00 0.00 0.00 0.00 33.22 33.33 1go0 n MET 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1go0 n GLY 30 N 0.13 2.31 2.47 3.17 0.00 0.11 -4.98 105.19 108.40 1go0 n GLY 30 Ca -0.03 -1.88 -0.02 0.00 0.00 0.00 0.00 46.02 44.09 1go0 n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1go0 n GLY 31 N 5.00 1.40 3.76 -0.02 0.00 -1.25 -4.96 105.19 109.11 1go0 n GLY 31 Ca 0.00 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 1go0 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1go0 s ALA 32 N 0.11 3.52 0.17 4.61 0.00 -1.26 -4.93 121.76 123.99 1go0 s ALA 32 Ca 0.09 1.24 -0.08 0.00 0.00 0.00 0.00 51.96 53.20 1go0 s ALA 32 Cb 0.36 -3.49 0.05 0.00 0.00 0.00 0.00 23.12 20.04 1go0 s ALA 32 CO -0.10 -0.63 1.56 -0.22 0.00 0.00 0.00 175.76 176.37 1go0 h LYS 33 N 4.04 0.92 -3.55 0.00 1.63 -1.48 -3.43 116.57 114.71 1go0 h LYS 33 Ca -0.48 -0.40 -0.22 0.00 -0.85 0.00 0.00 60.65 58.70 1go0 h LYS 33 Cb 1.22 -0.02 -0.28 0.00 -0.60 0.00 0.00 32.23 32.54 1go0 h LYS 33 CO 0.70 1.06 -0.65 -1.17 -3.45 0.00 0.00 179.45 175.94 1go0 s LEU 34 N -8.98 1.61 -0.10 5.20 2.96 -0.52 -4.09 118.68 114.76 1go0 s LEU 34 Ca -0.11 0.13 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 1go0 s LEU 34 Cb 0.12 0.21 0.01 0.00 0.50 0.00 0.00 46.19 47.03 1go0 s LEU 34 CO 0.86 -0.04 -0.15 -0.63 -1.32 0.00 0.00 176.35 175.07 1go0 s ILE 35 N 0.22 1.48 -0.13 6.68 1.01 -0.33 0.79 121.20 130.91 1go0 s ILE 35 Ca -0.02 -0.64 -0.01 0.00 0.00 0.00 0.00 60.65 59.99 1go0 s ILE 35 Cb -0.02 -1.35 -0.02 0.00 0.01 0.00 0.00 42.46 41.08 1go0 s ILE 35 CO -0.01 0.44 -0.10 -0.63 0.00 0.00 0.00 174.94 174.64 1go0 s ILE 36 N 0.93 3.33 -0.04 2.92 1.01 0.91 0.16 121.20 130.43 1go0 s ILE 36 Ca -0.08 -0.57 0.06 0.00 0.00 0.00 0.00 60.65 60.06 1go0 s ILE 36 Cb -0.15 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.90 1go0 s ILE 36 CO -0.01 0.52 -0.21 0.68 0.00 0.00 0.00 174.94 175.93 1go0 s VAL 37 N 0.21 1.71 0.38 2.92 -7.23 -0.29 -0.37 120.40 117.72 1go0 s VAL 37 Ca -0.06 -0.89 -0.27 0.00 -1.81 0.00 0.00 61.98 58.95 1go0 s VAL 37 Cb -0.15 -1.44 -0.10 0.00 0.56 0.00 0.00 36.38 35.25 1go0 s VAL 37 CO 0.04 0.48 1.38 0.00 -0.31 0.00 0.00 175.10 176.69 1go0 s ALA 38 N -0.18 3.43 0.18 1.32 0.00 -0.59 0.04 121.76 125.96 1go0 s ALA 38 Ca -0.00 1.38 -0.13 0.00 0.00 0.00 0.00 51.96 53.21 1go0 s ALA 38 Cb -0.11 -3.53 0.08 0.00 0.00 0.00 0.00 23.12 19.55 1go0 s ALA 38 CO 0.02 -0.88 1.78 0.00 0.00 0.00 0.00 175.76 176.68 1go0 h ARG 39 N 2.95 0.83 -1.29 0.00 2.47 -0.83 -2.41 114.38 116.09 1go0 h ARG 39 Ca -0.50 -0.10 -0.27 0.00 -1.26 0.00 0.00 59.98 57.85 1go0 h ARG 39 Cb 1.24 -0.16 -0.13 0.00 -1.65 0.00 0.00 29.97 29.27 1go0 h ARG 39 CO 0.64 0.64 0.34 0.09 0.56 0.00 0.00 179.97 182.23 1go0 n ASN 40 N -4.58 4.93 -4.92 7.04 4.13 -1.11 -4.88 115.26 115.86 1go0 n ASN 40 Ca 0.04 -2.87 -0.26 0.00 1.68 0.00 0.00 54.58 53.17 1go0 n ASN 40 Cb 0.09 -0.87 0.00 0.00 -1.54 0.00 0.00 39.78 37.47 1go0 n ASN 40 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1go0 s ALA 41 N -1.58 3.48 0.24 5.41 0.00 -0.91 -4.51 121.76 123.90 1go0 s ALA 41 Ca 0.27 -0.68 -0.30 0.00 0.00 0.00 0.00 51.96 51.25 1go0 s ALA 41 Cb 0.22 -2.45 -0.10 0.00 0.00 0.00 0.00 23.12 20.79 1go0 s ALA 41 CO 0.02 -0.38 1.41 1.03 0.00 0.00 0.00 175.76 177.83 1go0 s ARG 42 N -4.69 4.30 0.38 0.00 0.52 -1.26 -4.83 118.95 113.37 1go0 s ARG 42 Ca 0.47 2.24 0.12 0.00 -0.52 0.00 0.00 55.73 58.05 1go0 s ARG 42 Cb -0.10 -3.13 0.92 0.00 0.52 0.00 0.00 34.95 33.16 1go0 s ARG 42 CO 0.42 -0.37 1.88 -1.35 0.02 0.00 0.00 175.30 175.90 1go0 h PRO 43 N 5.04 0.56 -0.70 3.54 0.11 -1.95 0.44 132.00 139.04 1go0 h PRO 43 Ca -0.46 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.65 1go0 h PRO 43 Cb 1.22 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 1go0 h PRO 43 CO 0.77 0.37 0.43 -0.44 -0.21 0.00 0.00 178.00 178.92 1go0 h ASP 44 N 0.58 0.69 -0.02 -2.05 3.32 -1.99 0.17 116.42 117.11 1go0 h ASP 44 Ca 0.44 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.48 1go0 h ASP 44 Cb 0.83 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.24 1go0 h ASP 44 CO -0.18 0.47 -0.03 0.40 -1.72 0.00 0.00 179.24 178.18 1go0 h ILE 45 N 0.83 1.42 0.37 0.35 1.08 -1.45 -2.94 117.51 117.16 1go0 h ILE 45 Ca 0.29 -1.28 -0.02 0.00 -0.39 0.00 0.00 64.86 63.46 1go0 h ILE 45 Cb 0.05 2.23 0.00 0.00 -3.07 0.00 0.00 36.82 36.04 1go0 h ILE 45 CO -0.12 0.34 -0.18 0.11 -0.69 0.00 0.00 178.15 177.61 1go0 h LYS 46 N -0.45 -0.48 -0.70 2.37 1.57 -0.68 -1.37 116.57 116.83 1go0 h LYS 46 Ca 0.00 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 1go0 h LYS 46 Cb 0.57 0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.96 1go0 h LYS 46 CO 0.01 -0.25 0.37 1.49 -0.57 0.00 0.00 179.45 180.50 1go0 h GLU 47 N -0.63 0.97 0.18 3.15 4.81 -0.82 0.11 114.58 122.36 1go0 h GLU 47 Ca -0.05 -0.11 -0.01 0.00 -0.13 0.00 0.00 59.36 59.06 1go0 h GLU 47 Cb 0.46 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1go0 h GLU 47 CO 0.08 0.72 -0.09 0.22 -0.73 0.00 0.00 179.01 179.22 1go0 h ASP 48 N 0.97 -0.21 0.02 1.04 3.58 -1.44 -2.00 116.42 118.38 1go0 h ASP 48 Ca 0.25 -0.18 -0.00 0.00 0.42 0.00 0.00 57.03 57.51 1go0 h ASP 48 Cb 0.04 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.15 1go0 h ASP 48 CO -0.04 0.07 -0.01 0.40 -2.88 0.00 0.00 179.24 176.78 1go0 h ILE 49 N -0.49 1.22 -0.70 2.25 2.04 -1.05 -1.43 117.51 119.35 1go0 h ILE 49 Ca -0.03 -0.71 0.05 0.00 1.00 0.00 0.00 64.86 65.17 1go0 h ILE 49 Cb 0.38 1.70 -0.05 0.00 -0.74 0.00 0.00 36.82 38.10 1go0 h ILE 49 CO 0.04 0.18 0.41 -0.33 0.00 0.00 0.00 178.15 178.46 1go0 h GLU 50 N -0.33 0.75 0.03 2.37 5.08 -0.85 0.19 114.58 121.82 1go0 h GLU 50 Ca -0.00 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1go0 h GLU 50 Cb 0.32 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1go0 h GLU 50 CO 0.00 0.49 -0.02 -0.92 -1.00 0.00 0.00 179.01 177.57 1go0 h TYR 51 N 0.77 -0.04 -0.78 4.33 3.20 -1.37 -0.88 116.97 122.20 1go0 h TYR 51 Ca 0.30 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.18 1go0 h TYR 51 Cb 0.14 0.01 -0.04 0.00 1.54 0.00 0.00 36.73 38.39 1go0 h TYR 51 CO -0.06 0.39 0.52 1.88 -1.64 0.00 0.00 178.16 179.25 1go0 h TYR 52 N -0.48 0.98 -0.25 -3.82 -1.99 -0.97 -0.78 116.97 109.65 1go0 h TYR 52 Ca -0.00 0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.69 1go0 h TYR 52 Cb 0.45 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 38.84 1go0 h TYR 52 CO 0.07 0.62 -0.07 0.00 -0.00 0.00 0.00 178.16 178.79 1go0 h ALA 53 N 1.29 0.35 -0.65 3.88 0.00 -0.68 -2.70 119.26 120.74 1go0 h ALA 53 Ca 0.29 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1go0 h ALA 53 Cb -0.12 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1go0 h ALA 53 CO -0.06 0.16 0.42 -0.09 0.00 0.00 0.00 179.25 179.67 1go0 h ARG 54 N 0.24 0.81 -0.23 0.00 9.65 -0.71 0.44 114.38 124.58 1go0 h ARG 54 Ca 0.06 -0.05 -0.07 0.00 -1.10 0.00 0.00 59.98 58.82 1go0 h ARG 54 Cb 0.54 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 28.92 1go0 h ARG 54 CO 0.03 0.54 -0.16 1.37 2.80 0.00 0.00 179.97 184.54 1go0 h LEU 55 N 0.84 0.39 0.00 3.80 8.10 -1.16 -1.19 115.31 126.09 1go0 h LEU 55 Ca 0.25 -0.10 0.00 0.00 0.11 0.00 0.00 57.88 58.14 1go0 h LEU 55 Cb -0.04 -0.10 0.00 0.00 -0.44 0.00 0.00 40.66 40.08 1go0 h LEU 55 CO -0.08 0.58 0.00 -1.20 -4.11 0.00 0.00 178.44 173.63 1go0 n SER 56 N -4.20 0.00 -0.10 0.17 7.64 -0.73 -4.88 113.62 111.52 1go0 n SER 56 Ca -0.00 0.45 -0.01 0.00 1.01 0.00 0.00 58.87 60.32 1go0 n SER 56 Cb 0.33 -0.48 -0.00 0.00 -1.01 0.00 0.00 64.21 63.05 1go0 n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1go0 n GLY 57 N 1.08 0.39 3.60 0.23 0.00 -0.32 -5.03 105.19 105.15 1go0 n GLY 57 Ca 0.07 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.74 1go0 n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1go0 s ILE 58 N -2.04 5.12 0.05 -0.61 1.01 0.14 -4.98 121.20 119.88 1go0 s ILE 58 Ca 0.00 0.66 -0.31 0.00 0.00 0.00 0.00 60.65 61.00 1go0 s ILE 58 Cb 0.00 -3.77 -0.07 0.00 0.01 0.00 0.00 42.46 38.62 1go0 s ILE 58 CO 0.00 0.09 1.55 -2.84 0.00 0.00 0.00 174.94 173.75 1go0 s PRO 59 N 2.19 4.23 -0.10 2.79 0.02 -1.26 -3.76 135.00 139.11 1go0 s PRO 59 Ca 0.18 2.20 -0.05 0.00 0.02 0.00 0.00 61.00 63.35 1go0 s PRO 59 Cb -0.16 -3.56 -0.04 0.00 0.02 0.00 0.00 34.50 30.76 1go0 s PRO 59 CO 0.10 -0.67 0.09 0.08 -0.33 0.00 0.00 177.00 176.27 1go0 s VAL 60 N 2.45 5.03 -0.06 3.83 1.01 -1.26 -1.19 120.40 130.22 1go0 s VAL 60 Ca 0.70 0.00 0.05 0.00 0.00 0.00 0.00 61.98 62.73 1go0 s VAL 60 Cb -0.37 -3.18 -0.00 0.00 0.00 0.00 0.00 36.38 32.83 1go0 s VAL 60 CO 0.30 0.59 -0.20 -0.47 0.00 0.00 0.00 175.10 175.32 1go0 s TYR 61 N -0.99 2.04 -0.24 5.22 5.04 0.12 -4.85 117.35 123.69 1go0 s TYR 61 Ca 0.15 -0.66 -0.23 0.00 -2.44 0.00 0.00 57.07 53.89 1go0 s TYR 61 Cb -0.12 -1.37 -0.01 0.00 0.35 0.00 0.00 41.96 40.81 1go0 s TYR 61 CO 0.04 -0.24 0.75 -1.21 -1.34 0.00 0.00 175.55 173.55 1go0 s GLU 62 N 0.11 4.17 0.11 4.97 8.01 -1.26 -1.14 118.70 133.66 1go0 s GLU 62 Ca -0.08 0.79 -0.31 0.00 0.01 0.00 0.00 54.97 55.38 1go0 s GLU 62 Cb -0.14 -3.64 -0.08 0.00 -4.31 0.00 0.00 34.13 25.96 1go0 s GLU 62 CO 0.04 -0.45 1.47 0.12 0.01 0.00 0.00 175.26 176.45 1go0 s PHE 63 N 2.61 3.07 -1.24 1.61 5.36 0.11 -4.88 117.98 124.61 1go0 s PHE 63 Ca 0.32 0.78 -0.10 0.00 -0.96 0.00 0.00 56.93 56.97 1go0 s PHE 63 Cb -0.15 -3.78 -0.07 0.00 -0.34 0.00 0.00 43.02 38.68 1go0 s PHE 63 CO 0.08 -2.84 2.44 -0.85 -1.46 0.00 0.00 175.22 172.60 1go0 n GLU 64 N 4.28 2.75 -3.42 10.12 0.28 -1.26 -2.31 120.64 131.08 1go0 n GLU 64 Ca 0.13 -1.91 0.00 0.00 -0.16 0.00 0.00 57.16 55.21 1go0 n GLU 64 Cb 0.41 -2.73 0.00 0.00 1.43 0.00 0.00 31.44 30.55 1go0 n GLU 64 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1go0 n GLY 65 N 3.80 -1.16 4.01 -1.84 0.00 -1.26 -5.03 105.19 103.72 1go0 n GLY 65 Ca 0.59 -0.95 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 1go0 n GLY 65 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1go0 s THR 66 N -3.00 3.00 0.39 2.61 -1.32 -1.26 -1.46 115.64 114.60 1go0 s THR 66 Ca 0.00 -1.00 0.07 0.00 -1.21 0.00 0.00 61.69 59.55 1go0 s THR 66 Cb 0.00 -3.00 0.23 0.00 -1.51 0.00 0.00 72.50 68.22 1go0 s THR 66 CO 0.00 0.00 2.01 0.77 -2.21 0.00 0.00 174.62 175.19 1go0 h SER 67 N 0.64 0.45 -0.18 8.08 4.64 -1.79 -0.89 113.55 124.50 1go0 h SER 67 Ca -0.40 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 60.87 1go0 h SER 67 Cb 1.28 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 1go0 h SER 67 CO 0.45 0.39 0.06 0.58 -0.87 0.00 0.00 176.83 177.44 1go0 h VAL 68 N 0.51 1.18 -0.73 0.95 2.07 -1.88 0.26 116.25 118.61 1go0 h VAL 68 Ca 0.13 -0.55 -0.06 0.00 0.82 0.00 0.00 66.70 67.05 1go0 h VAL 68 Cb 0.06 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1go0 h VAL 68 CO -0.02 0.17 0.24 -0.33 0.02 0.00 0.00 177.57 177.65 1go0 h GLU 69 N 0.12 1.12 -0.17 1.57 5.08 -1.87 -1.21 114.58 119.23 1go0 h GLU 69 Ca 0.06 -0.24 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 1go0 h GLU 69 Cb 0.21 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1go0 h GLU 69 CO -0.00 0.95 0.10 1.25 -1.00 0.00 0.00 179.01 180.31 1go0 h LEU 70 N 1.07 0.20 -0.62 1.33 5.85 -0.91 -0.30 115.31 121.94 1go0 h LEU 70 Ca 0.24 -0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.96 1go0 h LEU 70 Cb 0.29 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1go0 h LEU 70 CO -0.01 0.20 0.33 1.23 -0.34 0.00 0.00 178.44 179.85 1go0 h GLY 71 N 0.19 0.90 1.17 3.75 0.00 -0.20 -1.16 103.07 107.72 1go0 h GLY 71 Ca 0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 1go0 h GLY 71 CO -0.01 0.14 0.37 -0.84 0.00 0.00 0.00 176.54 176.20 1go0 h THR 72 N 0.62 1.24 -0.13 4.70 2.02 -0.88 0.26 112.91 120.75 1go0 h THR 72 Ca 0.28 -0.65 -0.04 0.00 0.77 0.00 0.00 66.41 66.77 1go0 h THR 72 Cb 0.18 0.26 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 1go0 h THR 72 CO -0.18 0.28 -0.07 0.25 0.37 0.00 0.00 175.52 176.17 1go0 h LEU 73 N 1.07 0.29 0.20 2.58 5.85 -0.00 -3.32 115.31 121.97 1go0 h LEU 73 Ca 0.26 -0.43 -0.29 0.00 0.84 0.00 0.00 57.88 58.26 1go0 h LEU 73 Cb 0.09 -0.08 0.03 0.00 0.37 0.00 0.00 40.66 41.08 1go0 h LEU 73 CO -0.04 0.65 -1.27 -0.07 -0.34 0.00 0.00 178.44 177.37 1go0 h LEU 74 N -0.08 0.78 0.00 2.25 4.07 -1.20 -3.48 115.31 117.65 1go0 h LEU 74 Ca 0.03 -0.90 0.00 0.00 0.08 0.00 0.00 57.88 57.09 1go0 h LEU 74 Cb 0.55 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1go0 h LEU 74 CO 0.02 1.62 0.00 0.61 -1.08 0.00 0.00 178.44 179.61 1go0 n GLY 75 N 1.62 1.74 3.11 0.83 0.00 0.69 -5.08 105.19 108.10 1go0 n GLY 75 Ca -0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 1go0 n GLY 75 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1go0 s ARG 76 N -0.21 2.06 0.00 1.61 6.06 0.18 -4.98 118.95 123.67 1go0 s ARG 76 Ca 0.00 -1.94 -0.02 0.00 -2.50 0.00 0.00 55.73 51.27 1go0 s ARG 76 Cb 0.00 -3.58 -0.07 0.00 0.06 0.00 0.00 34.95 31.36 1go0 s ARG 76 CO 0.00 -1.08 2.11 -0.35 -2.50 0.00 0.00 175.30 173.48 1go0 n PRO 77 N 4.38 1.09 -2.01 5.12 -0.04 -1.26 -3.44 135.00 138.84 1go0 n PRO 77 Ca -0.00 -0.27 0.01 0.00 -0.04 0.00 0.00 63.50 63.20 1go0 n PRO 77 Cb 0.41 -1.35 0.03 0.00 -0.04 0.00 0.00 33.50 32.54 1go0 n PRO 77 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1go0 n HIS 78 N 1.91 0.20 -3.43 0.54 8.25 -1.26 -5.05 115.22 116.38 1go0 n HIS 78 Ca 0.11 -1.18 -0.19 0.00 -0.26 0.00 0.00 57.72 56.20 1go0 n HIS 78 Cb 0.52 0.09 0.01 0.00 1.12 0.00 0.00 29.99 31.74 1go0 n HIS 78 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1go0 n THR 79 N -0.16 -6.20 -2.11 1.59 -2.24 -1.22 -4.84 114.28 99.10 1go0 n THR 79 Ca -0.01 0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.41 1go0 n THR 79 Cb 0.94 -4.64 -0.03 0.00 -2.10 0.00 0.00 70.33 64.51 1go0 n THR 79 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1go0 s VAL 80 N -2.65 3.61 0.02 2.28 0.11 -1.21 -4.82 120.40 117.73 1go0 s VAL 80 Ca 0.11 0.89 -0.07 0.00 -2.93 0.00 0.00 61.98 59.98 1go0 s VAL 80 Cb -0.02 -3.57 -0.30 0.00 -1.53 0.00 0.00 36.38 30.96 1go0 s VAL 80 CO 0.84 -0.04 0.92 -1.28 -3.33 0.00 0.00 175.10 172.21 1go0 h SER 81 N 8.59 0.52 -4.72 3.54 0.87 -1.80 -3.40 113.55 117.16 1go0 h SER 81 Ca -0.38 -0.65 -0.12 0.00 -1.23 0.00 0.00 61.79 59.40 1go0 h SER 81 Cb 1.17 -0.17 -0.21 0.00 -0.44 0.00 0.00 62.40 62.75 1go0 h SER 81 CO 0.93 1.53 -0.27 0.00 -0.53 0.00 0.00 176.83 178.49 1go0 s ALA 82 N -2.62 -0.82 -0.01 6.23 0.00 -0.35 -1.55 121.76 122.65 1go0 s ALA 82 Ca -0.09 0.50 0.02 0.00 0.00 0.00 0.00 51.96 52.39 1go0 s ALA 82 Cb 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1go0 s ALA 82 CO 0.88 -0.24 -0.05 -0.48 0.00 0.00 0.00 175.76 175.87 1go0 s LEU 83 N -0.96 1.86 -0.30 0.00 0.05 0.50 -1.62 118.68 118.21 1go0 s LEU 83 Ca -0.10 -0.11 -0.08 0.00 0.05 0.00 0.00 54.13 53.89 1go0 s LEU 83 Cb -0.04 -0.32 -0.00 0.00 -2.05 0.00 0.00 46.19 43.77 1go0 s LEU 83 CO 0.03 0.04 0.12 0.00 -0.55 0.00 0.00 176.35 176.00 1go0 s ALA 84 N 0.08 3.18 -1.31 1.48 0.00 0.10 -0.06 121.76 125.24 1go0 s ALA 84 Ca -0.01 -1.41 -0.16 0.00 0.00 0.00 0.00 51.96 50.39 1go0 s ALA 84 Cb -0.05 -2.27 0.10 0.00 0.00 0.00 0.00 23.12 20.90 1go0 s ALA 84 CO -0.00 -0.90 1.76 0.28 0.00 0.00 0.00 175.76 176.90 1go0 n VAL 85 N 4.93 3.97 -0.02 0.00 0.31 0.24 -0.57 118.33 127.19 1go0 n VAL 85 Ca -0.14 -4.09 -0.13 0.00 -0.01 0.00 0.00 64.34 59.97 1go0 n VAL 85 Cb 0.49 -2.42 -0.09 0.00 -0.91 0.00 0.00 33.84 30.91 1go0 n VAL 85 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1go0 h VAL 86 N 4.96 1.33 -3.44 2.52 2.07 -1.64 -1.34 116.25 120.71 1go0 h VAL 86 Ca 0.44 -1.05 -0.62 0.00 0.82 0.00 0.00 66.70 66.28 1go0 h VAL 86 Cb 0.81 1.94 -0.40 0.00 -1.52 0.00 0.00 31.29 32.12 1go0 h VAL 86 CO 1.50 0.29 -0.74 -1.81 0.02 0.00 0.00 177.57 176.82 1go0 s ASP 87 N -5.75 4.39 0.17 0.57 1.11 -0.82 -3.16 116.67 113.18 1go0 s ASP 87 Ca -0.15 -1.88 -0.07 0.00 0.18 0.00 0.00 52.55 50.64 1go0 s ASP 87 Cb 0.03 -1.26 0.05 0.00 1.07 0.00 0.00 42.92 42.81 1go0 s ASP 87 CO 0.69 -0.39 1.49 -0.65 1.18 0.00 0.00 175.17 177.49 1go0 h PRO 88 N 7.84 0.72 0.00 8.23 0.11 -1.82 0.18 132.00 147.27 1go0 h PRO 88 Ca -0.09 -0.42 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1go0 h PRO 88 Cb 1.02 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1go0 h PRO 88 CO 0.49 1.05 0.00 0.41 -0.21 0.00 0.00 178.00 179.74 1go0 n GLY 89 N 0.21 3.10 0.19 -0.55 0.00 -1.26 -2.06 105.19 104.82 1go0 n GLY 89 Ca -0.03 -0.19 0.02 0.00 0.00 0.00 0.00 46.02 45.82 1go0 n GLY 89 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1go0 h GLU 90 N 0.00 0.02 -6.70 1.61 4.22 -1.90 -3.44 114.58 108.39 1go0 h GLU 90 Ca 0.00 -0.01 -0.52 0.00 0.08 0.00 0.00 59.36 58.91 1go0 h GLU 90 Cb 0.00 -0.00 0.07 0.00 0.50 0.00 0.00 28.75 29.32 1go0 h GLU 90 CO 0.00 0.40 0.98 0.45 -2.18 0.00 0.00 179.01 178.66 1go0 n SER 91 N -4.09 3.99 -1.92 1.04 2.88 -0.88 -4.89 113.62 109.76 1go0 n SER 91 Ca -0.02 1.09 -0.19 0.00 -1.33 0.00 0.00 58.87 58.42 1go0 n SER 91 Cb 0.41 -1.59 0.18 0.00 -0.75 0.00 0.00 64.21 62.47 1go0 n SER 91 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1go0 n ARG 92 N 3.43 2.15 0.29 -1.46 5.12 -1.26 -4.56 116.66 120.37 1go0 n ARG 92 Ca 0.14 -3.09 0.14 0.00 -1.93 0.00 0.00 57.85 53.11 1go0 n ARG 92 Cb 0.36 -2.08 0.88 0.00 -1.16 0.00 0.00 32.46 30.46 1go0 n ARG 92 CO 0.00 0.00 0.00 0.97 -1.93 0.00 0.00 177.63 176.67 1go0 h ILE 93 N 1.01 0.57 0.00 0.55 6.09 -1.90 0.08 117.51 123.91 1go0 h ILE 93 Ca 0.51 -0.06 0.00 0.00 -1.37 0.00 0.00 64.86 63.94 1go0 h ILE 93 Cb 2.44 1.04 0.00 0.00 0.47 0.00 0.00 36.82 40.77 1go0 h ILE 93 CO 0.91 0.01 0.00 0.00 -3.07 0.00 0.00 178.15 176.00 1go0 n LEU 94 N -3.87 0.39 -0.13 2.19 -0.00 -1.26 -1.81 117.00 112.51 1go0 n LEU 94 Ca -0.03 0.64 -0.03 0.00 -0.00 0.00 0.00 56.01 56.59 1go0 n LEU 94 Cb 0.10 -0.64 0.18 0.00 -0.00 0.00 0.00 43.42 43.06 1go0 n LEU 94 CO 0.28 -0.63 0.95 0.00 -0.00 0.00 0.00 177.39 177.99 1go0 h ALA 95 N 2.16 1.18 0.00 1.47 0.00 -1.28 0.39 119.26 123.18 1go0 h ALA 95 Ca 0.00 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 1go0 h ALA 95 Cb 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1go0 h ALA 95 CO 0.00 0.55 -0.63 -0.07 0.00 0.00 0.00 179.25 179.10 1go0 h LEU 96 N 0.80 0.00 -5.06 0.00 3.38 -1.55 -3.32 115.31 109.55 1go0 h LEU 96 Ca 0.17 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.59 1go0 h LEU 96 Cb 0.33 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 40.67 1go0 h LEU 96 CO 0.00 0.63 -0.82 0.61 0.09 0.00 0.00 178.44 178.96 1go0 n GLY 97 N 0.38 4.99 0.00 0.83 0.00 -0.87 -4.75 105.19 105.77 1go0 n GLY 97 Ca -0.01 -2.45 0.00 0.00 0.00 0.00 0.00 46.02 43.56 1go0 n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1go0 n GLY 98 N -0.24 0.00 3.64 -0.02 0.00 0.07 -4.61 105.19 104.02 1go0 n GLY 98 Ca 0.30 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 1go0 n GLY 98 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1go0 s LYS 99 N 0.00 0.53 0.00 1.61 2.47 -1.26 -4.80 119.74 118.30 1go0 s LYS 99 Ca 0.00 0.95 0.00 0.00 -1.56 0.00 0.00 55.97 55.36 1go0 s LYS 99 Cb 0.00 0.14 0.00 0.00 -1.46 0.00 0.00 37.83 36.51 1go0 s LYS 99 CO 0.00 -0.12 0.00 -1.91 0.16 0.00 0.00 175.35 173.48