#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2glm s GLN 9 N 0.00 1.25 0.00 1.96 2.00 -1.26 -5.04 119.66 118.57 2glm s GLN 9 Ca 0.00 -0.67 0.00 0.00 -2.00 0.00 0.00 55.36 52.69 2glm s GLN 9 Cb 0.00 -2.08 0.00 0.00 0.80 0.00 0.00 33.01 31.73 2glm s GLN 9 CO 0.00 -1.88 0.15 0.43 -0.50 0.00 0.00 175.29 173.49 2glm n SER 10 N -3.29 0.30 -3.92 6.67 7.64 -1.26 -4.72 113.62 115.04 2glm n SER 10 Ca 0.14 -0.63 -0.27 0.00 1.01 0.00 0.00 58.87 59.12 2glm n SER 10 Cb 0.60 0.42 -0.17 0.00 -1.01 0.00 0.00 64.21 64.05 2glm n SER 10 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2glm s GLN 11 N -0.42 1.65 0.07 1.43 0.74 -1.26 -2.02 119.66 119.85 2glm s GLN 11 Ca 0.00 -0.30 0.05 0.00 0.05 0.00 0.00 55.36 55.16 2glm s GLN 11 Cb 0.00 -1.67 -0.03 0.00 1.10 0.00 0.00 33.01 32.41 2glm s GLN 11 CO 0.00 -0.26 -0.15 -0.06 -0.55 0.00 0.00 175.29 174.27 2glm s PHE 12 N 1.67 1.26 0.35 1.67 0.40 -0.05 -5.01 117.98 118.29 2glm s PHE 12 Ca 0.05 -0.45 0.08 0.00 -0.60 0.00 0.00 56.93 56.02 2glm s PHE 12 Cb -0.13 -0.71 -0.05 0.00 0.51 0.00 0.00 43.02 42.64 2glm s PHE 12 CO -0.09 0.07 0.09 -0.06 0.70 0.00 0.00 175.22 175.94 2glm s PHE 13 N -1.23 2.62 0.53 0.36 0.40 -1.26 -1.17 117.98 118.24 2glm s PHE 13 Ca -0.01 -0.45 0.44 0.00 -0.60 0.00 0.00 56.93 56.31 2glm s PHE 13 Cb -0.10 -1.64 1.64 0.00 0.51 0.00 0.00 43.02 43.43 2glm s PHE 13 CO 0.02 0.37 1.64 0.97 0.70 0.00 0.00 175.22 178.92 2glm h ILE 14 N 1.63 0.13 0.00 0.64 6.09 -1.87 1.05 117.51 125.18 2glm h ILE 14 Ca -0.43 -0.01 -0.05 0.00 -1.37 0.00 0.00 64.86 63.01 2glm h ILE 14 Cb 1.25 0.11 -0.01 0.00 0.47 0.00 0.00 36.82 38.65 2glm h ILE 14 CO 0.66 0.00 -0.22 -0.33 -3.07 0.00 0.00 178.15 175.20 2glm h GLU 15 N 0.02 0.00 0.10 2.19 3.07 -1.94 -0.27 114.58 117.75 2glm h GLU 15 Ca 0.82 0.00 -0.36 0.00 -0.50 0.00 0.00 59.36 59.32 2glm h GLU 15 Cb 3.19 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 31.07 2glm h GLU 15 CO -0.08 0.22 -2.02 0.72 -1.40 0.00 0.00 179.01 176.44 2glm n HIS 16 N -3.56 1.12 -0.27 4.33 8.25 0.35 -3.83 115.22 121.61 2glm n HIS 16 Ca -0.01 0.25 -0.02 0.00 -0.26 0.00 0.00 57.72 57.68 2glm n HIS 16 Cb 0.36 -1.15 0.09 0.00 1.12 0.00 0.00 29.99 30.42 2glm n HIS 16 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2glm h ILE 17 N 0.06 1.10 0.00 1.59 2.04 -1.18 -1.27 117.51 119.84 2glm h ILE 17 Ca -0.43 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 2glm h ILE 17 Cb 2.02 0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 38.19 2glm h ILE 17 CO 0.07 0.17 -0.09 -0.07 0.00 0.00 0.00 178.15 178.23 2glm h LEU 18 N 0.92 0.00 0.00 1.44 3.38 -1.19 -1.01 115.31 118.85 2glm h LEU 18 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.28 2glm h LEU 18 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2glm h LEU 18 CO -0.12 0.09 -0.44 1.56 0.09 0.00 0.00 178.44 179.62 2glm h GLN 19 N 0.00 0.00 0.00 1.13 4.20 -1.34 -3.39 115.11 115.70 2glm h GLN 19 Ca -0.00 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.44 2glm h GLN 19 Cb 0.24 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 2glm h GLN 19 CO 0.01 0.00 -1.86 -0.89 -0.67 0.00 0.00 178.83 175.42 2glm n ILE 20 N -2.54 1.52 -3.02 2.54 2.08 -0.86 -4.56 119.36 114.52 2glm n ILE 20 Ca 0.03 -0.16 -0.34 0.00 0.56 0.00 0.00 62.75 62.84 2glm n ILE 20 Cb 0.49 -2.07 -0.06 0.00 -0.75 0.00 0.00 39.64 37.24 2glm n ILE 20 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2glm s LEU 21 N -7.70 4.15 0.14 1.39 1.43 -0.44 -4.66 118.68 112.99 2glm s LEU 21 Ca -0.34 1.47 0.24 0.00 -1.03 0.00 0.00 54.13 54.47 2glm s LEU 21 Cb 0.10 -4.03 0.35 0.00 0.03 0.00 0.00 46.19 42.64 2glm s LEU 21 CO 0.46 -0.15 1.33 1.55 0.23 0.00 0.00 176.35 179.78 2glm h PRO 22 N 2.63 0.00 -6.76 1.29 0.13 -1.88 -3.44 132.00 123.97 2glm h PRO 22 Ca -0.48 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.08 2glm h PRO 22 Cb 1.18 0.00 0.14 0.00 0.13 0.00 0.00 31.00 32.46 2glm h PRO 22 CO 0.64 0.00 0.21 0.72 -0.23 0.00 0.00 178.00 179.35 2glm n HIS 23 N -2.18 1.21 -4.18 1.56 8.25 -1.26 -5.02 115.22 113.61 2glm n HIS 23 Ca 0.03 0.49 -0.16 0.00 -0.26 0.00 0.00 57.72 57.83 2glm n HIS 23 Cb 0.45 -2.22 -0.07 0.00 1.12 0.00 0.00 29.99 29.27 2glm n HIS 23 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2glm s ARG 24 N -2.36 1.68 0.27 -0.41 1.81 -1.26 -4.66 118.95 114.02 2glm s ARG 24 Ca 0.68 -1.79 -0.30 0.00 -1.72 0.00 0.00 55.73 52.59 2glm s ARG 24 Cb -0.49 0.37 -0.13 0.00 -0.45 0.00 0.00 34.95 34.25 2glm s ARG 24 CO 0.53 -0.64 1.39 0.98 -0.68 0.00 0.00 175.30 176.87 2glm n TYR 25 N -0.51 2.23 -1.87 -0.53 9.36 -1.26 0.86 117.16 125.44 2glm n TYR 25 Ca 0.03 0.45 -0.35 0.00 3.32 0.00 0.00 57.90 61.36 2glm n TYR 25 Cb 0.63 -2.46 0.04 0.00 -0.63 0.00 0.00 39.34 36.92 2glm n TYR 25 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2glm n PRO 26 N 1.67 2.93 0.00 2.98 -0.04 -1.26 -4.91 135.00 136.37 2glm n PRO 26 Ca 0.10 -3.69 0.00 0.00 -0.04 0.00 0.00 63.50 59.87 2glm n PRO 26 Cb 0.33 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 2glm n PRO 26 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2glm n MET 27 N -0.64 -0.01 -2.82 0.54 2.81 0.25 -4.93 117.12 112.32 2glm n MET 27 Ca 0.53 -0.58 -0.43 0.00 -1.81 0.00 0.00 57.70 55.41 2glm n MET 27 Cb 0.48 -0.87 -0.04 0.00 -0.71 0.00 0.00 33.22 32.08 2glm n MET 27 CO 0.00 0.00 0.00 -1.17 1.51 0.00 0.00 175.97 176.31 2glm s LEU 28 N -0.18 4.14 -0.39 4.03 2.96 -0.91 -4.69 118.68 123.64 2glm s LEU 28 Ca 0.00 -0.66 0.05 0.00 -0.22 0.00 0.00 54.13 53.30 2glm s LEU 28 Cb 0.00 -2.61 0.51 0.00 0.50 0.00 0.00 46.19 44.59 2glm s LEU 28 CO 0.00 -1.39 1.60 0.18 -1.32 0.00 0.00 176.35 175.42 2glm n LEU 29 N 7.76 5.39 -3.74 -0.68 4.77 -1.26 -4.88 117.00 124.35 2glm n LEU 29 Ca -0.01 -4.05 -0.26 0.00 -0.03 0.00 0.00 56.01 51.66 2glm n LEU 29 Cb 0.47 -0.68 -0.17 0.00 -2.33 0.00 0.00 43.42 40.71 2glm n LEU 29 CO 0.65 1.44 -0.37 -0.69 -1.33 0.00 0.00 177.39 177.09 2glm s VAL 30 N -3.83 0.44 -0.03 4.08 1.01 -1.26 -4.62 120.40 116.18 2glm s VAL 30 Ca 0.52 -0.30 -0.01 0.00 0.00 0.00 0.00 61.98 62.19 2glm s VAL 30 Cb 0.44 -0.83 -0.27 0.00 0.00 0.00 0.00 36.38 35.72 2glm s VAL 30 CO 0.02 -0.05 0.72 0.44 0.00 0.00 0.00 175.10 176.23 2glm h ASP 31 N 8.28 0.33 -4.87 3.32 3.32 -1.44 -3.47 116.42 121.89 2glm h ASP 31 Ca -0.17 -0.54 -0.08 0.00 0.02 0.00 0.00 57.03 56.26 2glm h ASP 31 Cb 1.12 -0.11 -0.20 0.00 0.22 0.00 0.00 39.33 40.37 2glm h ASP 31 CO 0.31 1.46 0.04 -0.60 -1.72 0.00 0.00 179.24 178.73 2glm s ARG 32 N -2.60 0.91 -0.22 3.56 3.52 -0.91 -2.86 118.95 120.35 2glm s ARG 32 Ca -0.11 0.21 -0.03 0.00 -0.13 0.00 0.00 55.73 55.67 2glm s ARG 32 Cb 0.07 0.43 0.01 0.00 -1.56 0.00 0.00 34.95 33.89 2glm s ARG 32 CO 0.83 -0.26 -0.07 0.42 -0.81 0.00 0.00 175.30 175.41 2glm s ILE 33 N -1.04 3.04 -0.85 4.11 1.01 -0.31 -0.71 121.20 126.44 2glm s ILE 33 Ca -0.10 -0.72 0.22 0.00 0.00 0.00 0.00 60.65 60.04 2glm s ILE 33 Cb -0.02 -2.42 -0.21 0.00 0.01 0.00 0.00 42.46 39.82 2glm s ILE 33 CO 0.07 0.37 0.92 0.35 0.00 0.00 0.00 174.94 176.65 2glm n THR 34 N 4.74 0.02 -3.70 2.92 -2.24 -0.61 -0.87 114.28 114.54 2glm n THR 34 Ca -0.18 -0.08 -0.12 0.00 -2.27 0.00 0.00 64.05 61.40 2glm n THR 34 Cb 0.50 0.73 -0.09 0.00 -2.10 0.00 0.00 70.33 69.36 2glm n THR 34 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2glm s GLU 35 N -3.08 0.53 -0.22 -0.78 2.12 -0.86 -4.60 118.70 111.82 2glm s GLU 35 Ca 0.06 0.76 -0.07 0.00 0.36 0.00 0.00 54.97 56.08 2glm s GLU 35 Cb 0.16 0.18 0.10 0.00 0.26 0.00 0.00 34.13 34.83 2glm s GLU 35 CO 0.85 -0.10 0.46 -1.17 -0.54 0.00 0.00 175.26 174.76 2glm s LEU 36 N 0.70 -0.74 -0.25 2.70 1.98 -0.99 -1.48 118.68 120.59 2glm s LEU 36 Ca -0.04 1.05 0.00 0.00 -2.89 0.00 0.00 54.13 52.26 2glm s LEU 36 Cb -0.05 1.52 0.07 0.00 0.66 0.00 0.00 46.19 48.39 2glm s LEU 36 CO -0.05 -0.23 -0.01 -1.58 -1.89 0.00 0.00 176.35 172.59 2glm s GLN 37 N 2.66 1.34 0.10 1.98 2.00 -0.30 -4.43 119.66 123.01 2glm s GLN 37 Ca -0.01 -1.02 -0.34 0.00 -2.00 0.00 0.00 55.36 51.98 2glm s GLN 37 Cb -0.12 -2.50 -0.18 0.00 0.80 0.00 0.00 33.01 31.01 2glm s GLN 37 CO -0.14 -0.70 0.82 0.00 -0.50 0.00 0.00 175.29 174.76 2glm n ALA 38 N 4.70 -3.15 -0.64 1.58 0.00 -1.26 -0.87 120.51 120.87 2glm n ALA 38 Ca -0.08 0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.87 2glm n ALA 38 Cb 0.44 -1.70 0.00 0.00 0.00 0.00 0.00 19.45 18.19 2glm n ALA 38 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2glm n ASN 39 N 1.76 -1.95 0.04 0.00 4.13 -1.26 -4.66 115.26 113.32 2glm n ASN 39 Ca 0.19 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.45 2glm n ASN 39 Cb 0.17 -2.74 -0.00 0.00 -1.54 0.00 0.00 39.78 35.67 2glm n ASN 39 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2glm n GLN 40 N -0.92 0.01 -3.83 3.52 6.02 -0.05 -4.64 117.38 117.49 2glm n GLN 40 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.93 2glm n GLN 40 Cb 0.16 -0.49 -0.00 0.00 1.02 0.00 0.00 30.24 30.93 2glm n GLN 40 CO 0.00 0.00 0.00 -1.59 -1.01 0.00 0.00 177.06 174.46 2glm s LYS 41 N -1.95 1.74 -0.18 -1.09 -2.85 -0.57 0.76 119.74 115.60 2glm s LYS 41 Ca -0.01 -1.03 -0.16 0.00 -1.00 0.00 0.00 55.97 53.78 2glm s LYS 41 Cb 0.00 0.54 0.05 0.00 -2.06 0.00 0.00 37.83 36.36 2glm s LYS 41 CO 0.01 -0.80 0.47 -1.50 0.10 0.00 0.00 175.35 173.62 2glm s ILE 42 N -3.14 -0.00 -0.13 3.79 2.07 -0.24 -1.15 121.20 122.40 2glm s ILE 42 Ca 0.14 0.00 -0.00 0.00 -1.41 0.00 0.00 60.65 59.38 2glm s ILE 42 Cb -0.04 -0.65 0.02 0.00 0.13 0.00 0.00 42.46 41.92 2glm s ILE 42 CO 0.07 0.00 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.31 2glm s VAL 43 N 0.28 1.27 0.29 4.00 1.01 -0.55 -1.31 120.40 125.40 2glm s VAL 43 Ca -0.00 -0.46 0.07 0.00 0.00 0.00 0.00 61.98 61.58 2glm s VAL 43 Cb -0.03 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 2glm s VAL 43 CO 0.00 0.39 0.24 0.00 0.00 0.00 0.00 175.10 175.73 2glm n ALA 44 N 4.86 0.61 -3.30 5.51 0.00 0.08 -1.58 120.51 126.71 2glm n ALA 44 Ca -0.14 -1.68 -0.10 0.00 0.00 0.00 0.00 53.44 51.52 2glm n ALA 44 Cb 0.50 1.35 -0.03 0.00 0.00 0.00 0.00 19.45 21.26 2glm n ALA 44 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2glm s TYR 45 N -3.15 -0.24 -0.04 0.00 1.13 0.11 0.22 117.35 115.38 2glm s TYR 45 Ca 0.34 -0.07 0.01 0.00 -1.41 0.00 0.00 57.07 55.93 2glm s TYR 45 Cb 0.02 0.42 0.02 0.00 -1.10 0.00 0.00 41.96 41.32 2glm s TYR 45 CO 0.24 -0.87 -0.02 0.21 -2.51 0.00 0.00 175.55 172.59 2glm s LYS 46 N -3.83 0.55 0.36 -3.49 2.20 0.04 -1.07 119.74 114.48 2glm s LYS 46 Ca 0.06 -0.00 -0.25 0.00 -0.36 0.00 0.00 55.97 55.41 2glm s LYS 46 Cb -0.01 -0.66 -0.10 0.00 -1.51 0.00 0.00 37.83 35.56 2glm s LYS 46 CO -0.07 -0.12 0.99 -0.80 -0.36 0.00 0.00 175.35 175.00 2glm s ASN 47 N 1.00 7.09 -0.24 1.43 0.01 -1.26 -0.99 114.94 121.98 2glm s ASN 47 Ca -0.10 1.92 -0.03 0.00 -0.71 0.00 0.00 52.86 53.94 2glm s ASN 47 Cb -0.14 -2.58 0.01 0.00 0.41 0.00 0.00 41.25 38.95 2glm s ASN 47 CO -0.01 -0.25 -0.03 -0.63 -1.51 0.00 0.00 177.10 174.67 2glm s ILE 48 N -1.65 3.24 0.14 0.60 -1.09 0.15 -4.91 121.20 117.68 2glm s ILE 48 Ca 0.54 -0.75 0.08 0.00 -2.23 0.00 0.00 60.65 58.29 2glm s ILE 48 Cb -0.20 -2.57 -0.04 0.00 -1.58 0.00 0.00 42.46 38.07 2glm s ILE 48 CO 0.25 0.28 -0.18 0.28 -1.23 0.00 0.00 174.94 174.34 2glm s THR 49 N 1.42 1.72 0.36 2.92 -1.32 -1.26 0.19 115.64 119.66 2glm s THR 49 Ca 0.03 -1.79 0.30 0.00 -1.21 0.00 0.00 61.69 59.02 2glm s THR 49 Cb -0.16 -1.72 0.32 0.00 -1.51 0.00 0.00 72.50 69.43 2glm s THR 49 CO -0.03 -0.26 2.06 0.15 -2.21 0.00 0.00 174.62 174.33 2glm h PHE 50 N 3.50 0.00 0.00 9.09 3.57 -1.95 -3.24 116.94 127.91 2glm h PHE 50 Ca -0.43 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.07 2glm h PHE 50 Cb 1.20 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.94 2glm h PHE 50 CO 0.66 0.10 0.00 -1.71 -2.23 0.00 0.00 178.31 175.13 2glm n ASN 51 N -3.46 3.52 -4.37 0.41 4.05 -1.26 -4.79 115.26 109.37 2glm n ASN 51 Ca -0.01 -1.91 -0.31 0.00 0.45 0.00 0.00 54.58 52.80 2glm n ASN 51 Cb 0.25 -0.73 -0.15 0.00 1.23 0.00 0.00 39.78 40.39 2glm n ASN 51 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 2glm s GLU 52 N 0.54 2.00 0.20 1.20 2.02 -1.22 -5.03 118.70 118.39 2glm s GLU 52 Ca 0.00 -1.00 -0.11 0.00 0.02 0.00 0.00 54.97 53.88 2glm s GLU 52 Cb 0.00 -2.07 0.19 0.00 0.10 0.00 0.00 34.13 32.35 2glm s GLU 52 CO 0.00 0.54 1.80 0.22 0.02 0.00 0.00 175.26 177.84 2glm h ASP 53 N 4.98 0.45 -0.96 -0.19 -0.00 -1.94 -2.83 116.42 115.93 2glm h ASP 53 Ca -0.46 0.03 0.31 0.00 -0.00 0.00 0.00 57.03 56.91 2glm h ASP 53 Cb 1.14 -0.06 -0.16 0.00 -0.00 0.00 0.00 39.33 40.25 2glm h ASP 53 CO 0.46 0.30 0.31 -0.37 -0.00 0.00 0.00 179.24 179.94 2glm h VAL 54 N 0.59 0.15 0.00 2.25 -1.51 -1.96 0.33 116.25 116.11 2glm h VAL 54 Ca 0.26 -0.04 -0.00 0.00 -1.23 0.00 0.00 66.70 65.69 2glm h VAL 54 Cb 0.17 0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 29.35 2glm h VAL 54 CO -0.18 0.02 -0.00 -0.26 -1.23 0.00 0.00 177.57 175.92 2glm h PHE 55 N 0.12 0.00 -0.74 5.19 -1.00 -1.76 -2.76 116.94 115.99 2glm h PHE 55 Ca 0.67 0.00 0.10 0.00 2.81 0.00 0.00 57.97 61.55 2glm h PHE 55 Cb 1.52 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 41.03 2glm h PHE 55 CO -0.23 0.00 0.49 -0.91 -1.61 0.00 0.00 178.31 176.05 2glm h ASN 56 N 0.00 0.57 0.00 2.17 2.35 -1.08 -3.03 115.58 116.55 2glm h ASN 56 Ca -0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2glm h ASN 56 Cb 0.23 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2glm h ASN 56 CO 0.00 0.34 -0.05 0.61 -1.65 0.00 0.00 177.43 176.68 2glm n GLY 57 N -1.47 3.06 2.41 2.83 0.00 -1.11 -4.14 105.19 106.78 2glm n GLY 57 Ca 0.12 -0.50 -0.18 0.00 0.00 0.00 0.00 46.02 45.47 2glm n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2glm n HIS 58 N -0.82 -1.54 -4.23 1.61 -0.00 -1.06 -4.60 115.22 104.59 2glm n HIS 58 Ca 0.07 -2.85 -0.13 0.00 -0.00 0.00 0.00 57.72 54.80 2glm n HIS 58 Cb 0.49 0.41 -0.10 0.00 -0.00 0.00 0.00 29.99 30.79 2glm n HIS 58 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 2glm s PHE 59 N -0.47 1.16 0.20 1.57 0.40 -0.84 -1.84 117.98 118.16 2glm s PHE 59 Ca 0.34 -0.89 -0.32 0.00 -0.60 0.00 0.00 56.93 55.46 2glm s PHE 59 Cb 0.20 -0.64 -0.13 0.00 0.51 0.00 0.00 43.02 42.96 2glm s PHE 59 CO -0.16 -0.07 1.63 -2.30 0.70 0.00 0.00 175.22 175.01 2glm n PRO 60 N -0.18 2.46 -2.05 0.24 -0.02 -1.26 -1.53 135.00 132.66 2glm n PRO 60 Ca -0.09 0.89 -0.14 0.00 -2.02 0.00 0.00 63.50 62.13 2glm n PRO 60 Cb 0.62 -2.68 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 2glm n PRO 60 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2glm n ASN 61 N 3.40 -4.47 -2.65 2.55 3.02 -1.26 -4.87 115.26 110.97 2glm n ASN 61 Ca 0.15 0.08 -0.03 0.00 -0.03 0.00 0.00 54.58 54.75 2glm n ASN 61 Cb 0.32 -3.53 0.10 0.00 -0.61 0.00 0.00 39.78 36.07 2glm n ASN 61 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2glm n LYS 62 N -2.43 0.00 -1.67 3.52 0.00 -0.58 -5.13 118.16 111.87 2glm n LYS 62 Ca -0.16 -0.50 -0.43 0.00 0.00 0.00 0.00 58.31 57.22 2glm n LYS 62 Cb 0.59 -0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.58 2glm n LYS 62 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 2glm n PRO 63 N 0.95 2.80 -3.76 1.64 -0.04 -1.21 -1.99 135.00 133.39 2glm n PRO 63 Ca -0.04 1.03 -0.22 0.00 -0.04 0.00 0.00 63.50 64.22 2glm n PRO 63 Cb 0.75 -2.97 -0.18 0.00 -0.04 0.00 0.00 33.50 31.06 2glm n PRO 63 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2glm s ILE 64 N 4.28 0.29 -0.04 0.52 1.01 -0.77 -4.53 121.20 121.97 2glm s ILE 64 Ca 0.89 0.17 -0.30 0.00 0.00 0.00 0.00 60.65 61.41 2glm s ILE 64 Cb -0.46 -0.46 -0.06 0.00 0.01 0.00 0.00 42.46 41.49 2glm s ILE 64 CO 0.43 0.24 1.58 0.12 0.00 0.00 0.00 174.94 177.31 2glm s PHE 65 N 1.97 2.24 0.09 3.97 5.36 0.29 -4.59 117.98 127.31 2glm s PHE 65 Ca 0.04 0.37 -0.36 0.00 -0.96 0.00 0.00 56.93 56.03 2glm s PHE 65 Cb -0.12 -3.85 -0.15 0.00 -0.34 0.00 0.00 43.02 38.55 2glm s PHE 65 CO -0.05 -3.47 1.47 -2.30 -1.46 0.00 0.00 175.22 169.42 2glm n PRO 66 N 6.60 1.56 -0.30 10.12 -0.02 -1.26 -4.52 135.00 147.18 2glm n PRO 66 Ca 0.16 0.57 0.02 0.00 -2.02 0.00 0.00 63.50 62.23 2glm n PRO 66 Cb 0.43 -2.27 0.16 0.00 -0.02 0.00 0.00 33.50 31.80 2glm n PRO 66 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 2glm h GLY 67 N 5.41 1.30 2.00 -1.23 0.00 -1.99 -0.38 103.07 108.19 2glm h GLY 67 Ca -0.47 -0.34 -0.03 0.00 0.00 0.00 0.00 47.33 46.49 2glm h GLY 67 CO 0.84 0.17 -0.13 -0.39 0.00 0.00 0.00 176.54 177.03 2glm h VAL 68 N 0.86 0.79 0.00 4.60 -1.51 -1.99 -0.76 116.25 118.23 2glm h VAL 68 Ca 0.40 -0.48 -0.14 0.00 -1.23 0.00 0.00 66.70 65.24 2glm h VAL 68 Cb 0.31 1.29 -0.02 0.00 -2.13 0.00 0.00 31.29 30.74 2glm h VAL 68 CO -0.22 0.12 -0.66 -0.07 -1.23 0.00 0.00 177.57 175.51 2glm h LEU 69 N 0.00 0.00 -0.43 4.19 3.38 -1.46 -0.11 115.31 120.88 2glm h LEU 69 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 2glm h LEU 69 Cb 0.28 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2glm h LEU 69 CO 0.02 0.66 -0.11 0.40 0.09 0.00 0.00 178.44 179.50 2glm h ILE 70 N 0.00 1.27 -0.54 1.22 2.04 -0.47 -0.43 117.51 120.61 2glm h ILE 70 Ca -0.01 -1.22 -0.05 0.00 1.00 0.00 0.00 64.86 64.59 2glm h ILE 70 Cb 1.35 1.17 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 2glm h ILE 70 CO 0.09 0.41 0.15 0.58 0.00 0.00 0.00 178.15 179.38 2glm h VAL 71 N 0.66 1.24 -0.57 1.67 2.07 -1.09 -1.38 116.25 118.85 2glm h VAL 71 Ca 0.11 -0.83 0.02 0.00 0.82 0.00 0.00 66.70 66.81 2glm h VAL 71 Cb 0.65 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.14 2glm h VAL 71 CO 0.04 0.31 0.36 -0.08 0.02 0.00 0.00 177.57 178.22 2glm h GLU 72 N 0.75 0.71 -0.94 1.57 4.57 -0.78 -0.02 114.58 120.44 2glm h GLU 72 Ca 0.17 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2glm h GLU 72 Cb 0.31 -0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 2glm h GLU 72 CO -0.00 0.47 0.60 0.78 -1.18 0.00 0.00 179.01 179.68 2glm h GLY 73 N 0.73 1.34 1.05 1.92 0.00 -0.69 -1.30 103.07 106.11 2glm h GLY 73 Ca 0.22 -0.52 -0.08 0.00 0.00 0.00 0.00 47.33 46.95 2glm h GLY 73 CO -0.07 0.51 0.07 -0.33 0.00 0.00 0.00 176.54 176.72 2glm h MET 74 N 1.28 1.01 -0.77 4.80 2.86 -0.50 -2.76 114.93 120.85 2glm h MET 74 Ca 0.34 -0.29 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2glm h MET 74 Cb -0.11 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.41 2glm h MET 74 CO -0.07 0.97 0.30 0.00 1.06 0.00 0.00 176.91 179.17 2glm h ALA 75 N 1.01 1.07 -0.58 6.32 0.00 -0.39 -1.52 119.26 125.17 2glm h ALA 75 Ca 0.18 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2glm h ALA 75 Cb 0.47 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2glm h ALA 75 CO 0.02 0.66 0.05 1.96 0.00 0.00 0.00 179.25 181.93 2glm h GLN 76 N 1.13 0.97 -0.44 0.00 4.20 -1.13 0.24 115.11 120.06 2glm h GLN 76 Ca 0.26 -0.27 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2glm h GLN 76 Cb 0.23 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 2glm h GLN 76 CO -0.02 0.92 -0.05 0.77 -0.67 0.00 0.00 178.83 179.79 2glm h SER 77 N 0.90 0.81 -0.59 1.46 0.02 -1.29 0.40 113.55 115.26 2glm h SER 77 Ca 0.17 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.78 2glm h SER 77 Cb 0.46 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 2glm h SER 77 CO 0.02 0.95 0.34 1.23 -1.14 0.00 0.00 176.83 178.23 2glm h GLY 78 N 0.65 0.86 0.94 -3.77 0.00 -0.83 0.30 103.07 101.23 2glm h GLY 78 Ca 0.12 -0.37 0.01 0.00 0.00 0.00 0.00 47.33 47.09 2glm h GLY 78 CO 0.03 0.36 0.27 -1.33 0.00 0.00 0.00 176.54 175.88 2glm h GLY 79 N 0.80 0.62 1.07 4.60 0.00 -0.05 0.34 103.07 110.44 2glm h GLY 79 Ca 0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2glm h GLY 79 CO -0.04 0.19 0.45 -2.75 0.00 0.00 0.00 176.54 174.40 2glm h PHE 80 N 0.55 1.20 0.19 5.60 3.57 -0.58 -1.12 116.94 126.34 2glm h PHE 80 Ca 0.17 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2glm h PHE 80 Cb -0.02 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 38.34 2glm h PHE 80 CO -0.06 0.84 -0.09 1.25 -2.23 0.00 0.00 178.31 178.02 2glm h LEU 81 N 1.21 -0.21 -0.20 0.59 5.85 -0.07 -1.94 115.31 120.55 2glm h LEU 81 Ca 0.30 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.96 2glm h LEU 81 Cb 0.06 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2glm h LEU 81 CO -0.04 -0.02 -0.06 0.00 -0.34 0.00 0.00 178.44 177.97 2glm h ALA 82 N 0.40 0.11 0.57 1.25 0.00 -0.07 -1.24 119.26 120.29 2glm h ALA 82 Ca -0.03 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 2glm h ALA 82 Cb 0.30 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.27 2glm h ALA 82 CO 0.04 -0.49 -0.27 0.35 0.00 0.00 0.00 179.25 178.88 2glm h PHE 83 N -0.02 -0.71 -0.18 0.00 3.57 -1.19 -3.07 116.94 115.34 2glm h PHE 83 Ca 0.10 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2glm h PHE 83 Cb 0.17 0.23 -0.01 0.00 2.79 0.00 0.00 35.95 39.13 2glm h PHE 83 CO -0.23 -0.42 0.08 1.79 -2.23 0.00 0.00 178.31 177.30 2glm h THR 84 N -0.80 1.07 -0.52 4.41 1.35 -1.30 -0.49 112.91 116.63 2glm h THR 84 Ca -0.08 -0.21 0.05 0.00 -0.55 0.00 0.00 66.41 65.62 2glm h THR 84 Cb 0.60 0.85 -0.03 0.00 -1.73 0.00 0.00 68.15 67.84 2glm h THR 84 CO 0.13 0.08 0.35 0.28 -0.25 0.00 0.00 175.52 176.11 2glm h SER 85 N 0.24 0.45 0.29 5.36 0.02 -1.13 0.49 113.55 119.26 2glm h SER 85 Ca 0.06 -0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.70 2glm h SER 85 Cb 0.04 -0.10 -0.06 0.00 0.14 0.00 0.00 62.40 62.43 2glm h SER 85 CO -0.01 0.30 -1.99 0.18 -1.14 0.00 0.00 176.83 174.17 2glm n LEU 86 N -4.47 0.49 0.00 5.07 4.77 -0.42 -4.66 117.00 117.78 2glm n LEU 86 Ca 0.07 0.23 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 2glm n LEU 86 Cb 0.21 0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 2glm n LEU 86 CO 0.34 0.42 -0.00 0.79 -1.33 0.00 0.00 177.39 177.61 2glm n TRP 87 N -2.90 0.00 -4.11 -1.77 8.01 -0.33 -5.13 117.44 111.22 2glm n TRP 87 Ca -0.23 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 55.96 2glm n TRP 87 Cb 1.08 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.38 2glm n TRP 87 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2glm n GLY 88 N 0.54 -0.96 3.48 6.99 0.00 0.17 -4.32 105.19 111.08 2glm n GLY 88 Ca 0.00 -1.20 -0.43 0.00 0.00 0.00 0.00 46.02 44.38 2glm n GLY 88 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2glm s PHE 89 N 0.00 3.03 -0.46 1.61 5.36 -1.26 -4.23 117.98 122.03 2glm s PHE 89 Ca 0.00 -1.40 0.03 0.00 -0.96 0.00 0.00 56.93 54.60 2glm s PHE 89 Cb 0.00 -4.40 0.13 0.00 -0.34 0.00 0.00 43.02 38.41 2glm s PHE 89 CO 0.00 -1.59 0.23 0.34 -1.46 0.00 0.00 175.22 172.74 2glm s ASP 90 N 3.84 3.94 0.30 6.13 -1.08 -1.26 -5.00 116.67 123.53 2glm s ASP 90 Ca 0.38 -2.71 0.05 0.00 -0.52 0.00 0.00 52.55 49.75 2glm s ASP 90 Cb -0.03 -1.26 0.73 0.00 -1.46 0.00 0.00 42.92 40.90 2glm s ASP 90 CO -0.07 -0.26 1.75 -0.65 0.52 0.00 0.00 175.17 176.46 2glm h PRO 91 N 6.73 0.64 0.07 4.34 0.11 -1.91 -0.87 132.00 141.10 2glm h PRO 91 Ca -0.04 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 2glm h PRO 91 Cb 0.92 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.88 2glm h PRO 91 CO 0.56 0.42 -0.08 0.93 -0.21 0.00 0.00 178.00 179.62 2glm h GLU 92 N 0.66 -0.15 -0.71 1.05 3.07 -1.94 -2.47 114.58 114.09 2glm h GLU 92 Ca 0.57 0.01 0.04 0.00 -0.50 0.00 0.00 59.36 59.48 2glm h GLU 92 Cb 0.95 0.03 -0.05 0.00 -0.84 0.00 0.00 28.75 28.84 2glm h GLU 92 CO -0.42 -0.10 0.44 0.82 -1.40 0.00 0.00 179.01 178.35 2glm h ILE 93 N -0.15 1.06 -0.94 3.13 2.04 -1.95 -2.61 117.51 118.08 2glm h ILE 93 Ca -0.01 -0.29 0.25 0.00 1.00 0.00 0.00 64.86 65.82 2glm h ILE 93 Cb 0.14 0.15 -0.13 0.00 -0.74 0.00 0.00 36.82 36.24 2glm h ILE 93 CO -0.02 0.15 0.45 0.00 0.00 0.00 0.00 178.15 178.73 2glm h ALA 94 N 1.32 1.60 -0.18 1.87 0.00 -1.07 0.29 119.26 123.10 2glm h ALA 94 Ca 0.30 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.38 2glm h ALA 94 Cb 0.08 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2glm h ALA 94 CO -0.13 -0.39 0.00 0.36 0.00 0.00 0.00 179.25 179.08 2glm n LYS 95 N -5.04 1.64 0.00 0.00 2.85 -0.94 -2.76 118.16 113.91 2glm n LYS 95 Ca 0.25 -0.74 0.00 0.00 -1.05 0.00 0.00 58.31 56.77 2glm n LYS 95 Cb 0.75 -1.34 0.00 0.00 -0.65 0.00 0.00 35.03 33.79 2glm n LYS 95 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2glm n THR 96 N 0.10 0.14 -4.28 0.58 -2.24 1.00 -4.94 114.28 104.63 2glm n THR 96 Ca 0.07 -0.56 -0.16 0.00 -2.27 0.00 0.00 64.05 61.13 2glm n THR 96 Cb 0.28 0.95 -0.10 0.00 -2.10 0.00 0.00 70.33 69.35 2glm n THR 96 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2glm s LYS 97 N -0.14 1.14 -0.02 -0.78 1.02 -1.07 -0.73 119.74 119.16 2glm s LYS 97 Ca 0.00 -1.47 -0.02 0.00 0.02 0.00 0.00 55.97 54.50 2glm s LYS 97 Cb 0.00 -0.82 0.01 0.00 -0.52 0.00 0.00 37.83 36.50 2glm s LYS 97 CO 0.00 0.12 0.06 -1.50 -0.92 0.00 0.00 175.35 173.11 2glm s ILE 98 N -3.08 -0.00 -0.45 2.17 1.10 0.66 -4.73 121.20 116.86 2glm s ILE 98 Ca 0.18 0.01 -0.14 0.00 -0.51 0.00 0.00 60.65 60.19 2glm s ILE 98 Cb 0.01 -0.10 0.07 0.00 0.15 0.00 0.00 42.46 42.59 2glm s ILE 98 CO 0.03 0.00 0.35 -0.69 -2.11 0.00 0.00 174.94 172.53 2glm s VAL 99 N 0.09 5.05 -0.11 4.00 1.01 -1.26 0.68 120.40 129.86 2glm s VAL 99 Ca -0.01 -1.06 -0.03 0.00 0.00 0.00 0.00 61.98 60.89 2glm s VAL 99 Cb -0.01 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 2glm s VAL 99 CO -0.00 -0.52 0.02 -0.47 0.00 0.00 0.00 175.10 174.13 2glm s TYR 100 N 1.61 3.19 -0.16 5.22 6.14 0.15 -4.91 117.35 128.60 2glm s TYR 100 Ca 0.04 0.16 -0.17 0.00 0.64 0.00 0.00 57.07 57.74 2glm s TYR 100 Cb -0.23 -1.85 -0.04 0.00 0.42 0.00 0.00 41.96 40.26 2glm s TYR 100 CO 0.06 0.41 0.42 -0.06 0.64 0.00 0.00 175.55 177.02 2glm s PHE 101 N -0.63 3.45 -0.13 4.97 0.08 -1.26 0.14 117.98 124.60 2glm s PHE 101 Ca 0.10 0.75 -0.18 0.00 0.12 0.00 0.00 56.93 57.72 2glm s PHE 101 Cb -0.12 -2.51 -0.25 0.00 -0.57 0.00 0.00 43.02 39.57 2glm s PHE 101 CO 0.02 0.11 0.48 0.52 -0.10 0.00 0.00 175.22 176.26 2glm h MET 102 N 6.94 0.16 -3.99 0.44 2.86 -1.58 -3.48 114.93 116.28 2glm h MET 102 Ca -0.39 -0.28 -0.10 0.00 -2.06 0.00 0.00 59.70 56.87 2glm h MET 102 Cb 1.17 0.10 -0.14 0.00 0.06 0.00 0.00 31.60 32.79 2glm h MET 102 CO 0.75 1.13 -0.50 0.95 1.06 0.00 0.00 176.91 180.30 2glm s THR 103 N -2.43 0.17 -0.02 2.22 -4.23 -1.18 -5.01 115.64 105.15 2glm s THR 103 Ca -0.22 -1.45 -0.01 0.00 -1.18 0.00 0.00 61.69 58.83 2glm s THR 103 Cb 0.04 -1.44 0.02 0.00 1.34 0.00 0.00 72.50 72.47 2glm s THR 103 CO 0.72 -0.78 0.05 -0.63 -0.54 0.00 0.00 174.62 173.44 2glm s ILE 104 N -3.89 -0.03 0.25 2.99 1.01 -1.26 -2.02 121.20 118.25 2glm s ILE 104 Ca 0.06 0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.84 2glm s ILE 104 Cb 0.06 -0.09 -0.03 0.00 0.01 0.00 0.00 42.46 42.41 2glm s ILE 104 CO -0.10 0.05 0.22 -1.81 0.00 0.00 0.00 174.94 173.30 2glm s ASP 105 N 0.63 0.61 -1.26 3.58 1.11 0.64 -4.94 116.67 117.03 2glm s ASP 105 Ca -0.05 -1.46 -0.09 0.00 0.18 0.00 0.00 52.55 51.13 2glm s ASP 105 Cb -0.07 0.46 0.01 0.00 1.07 0.00 0.00 42.92 44.39 2glm s ASP 105 CO -0.02 -0.96 0.16 0.29 1.18 0.00 0.00 175.17 175.83 2glm n LYS 106 N -0.40 -0.77 -3.26 8.23 5.02 -1.26 -1.74 118.16 123.99 2glm n LYS 106 Ca 0.03 0.05 -0.40 0.00 -2.02 0.00 0.00 58.31 55.97 2glm n LYS 106 Cb 0.64 -2.77 -0.07 0.00 -0.02 0.00 0.00 35.03 32.81 2glm n LYS 106 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2glm s VAL 107 N -4.07 5.10 -0.08 -0.18 1.01 -1.25 -3.80 120.40 117.13 2glm s VAL 107 Ca 0.12 0.87 0.01 0.00 0.00 0.00 0.00 61.98 62.98 2glm s VAL 107 Cb -0.07 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.51 2glm s VAL 107 CO 0.86 0.13 -0.09 -0.75 0.00 0.00 0.00 175.10 175.24 2glm s LYS 108 N 2.02 1.50 -0.35 2.72 2.20 -0.21 -4.98 119.74 122.64 2glm s LYS 108 Ca 0.22 -0.30 -0.14 0.00 -0.36 0.00 0.00 55.97 55.38 2glm s LYS 108 Cb -0.15 -1.39 -0.01 0.00 -1.51 0.00 0.00 37.83 34.76 2glm s LYS 108 CO 0.09 -0.11 0.32 -0.06 -0.36 0.00 0.00 175.35 175.23 2glm s PHE 109 N 1.13 3.22 -0.21 4.03 0.40 -1.26 -1.86 117.98 123.42 2glm s PHE 109 Ca -0.06 -0.18 -0.01 0.00 -0.60 0.00 0.00 56.93 56.08 2glm s PHE 109 Cb -0.14 -2.61 -0.20 0.00 0.51 0.00 0.00 43.02 40.58 2glm s PHE 109 CO -0.02 -0.44 -0.01 0.54 0.70 0.00 0.00 175.22 175.99 2glm n ARG 110 N 5.27 0.69 -3.85 0.44 1.74 -0.01 -4.99 116.66 115.95 2glm n ARG 110 Ca -0.10 0.19 -0.13 0.00 -0.77 0.00 0.00 57.85 57.03 2glm n ARG 110 Cb 0.49 -1.59 -0.15 0.00 -1.02 0.00 0.00 32.46 30.20 2glm n ARG 110 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2glm s ILE 111 N -2.53 -0.00 0.46 0.55 1.01 -1.02 -5.02 121.20 114.64 2glm s ILE 111 Ca -0.30 0.06 -0.24 0.00 0.00 0.00 0.00 60.65 60.17 2glm s ILE 111 Cb 0.08 -0.05 -0.07 0.00 0.01 0.00 0.00 42.46 42.43 2glm s ILE 111 CO 0.67 0.03 1.28 -2.16 0.00 0.00 0.00 174.94 174.76 2glm s PRO 112 N 0.33 3.70 -0.13 2.79 0.04 -1.26 -4.79 135.00 135.68 2glm s PRO 112 Ca -0.03 2.07 -0.07 0.00 0.04 0.00 0.00 61.00 63.01 2glm s PRO 112 Cb -0.04 -2.53 -0.04 0.00 0.04 0.00 0.00 34.50 31.93 2glm s PRO 112 CO -0.01 -0.69 0.11 0.08 0.04 0.00 0.00 177.00 176.53 2glm s VAL 113 N -1.35 5.22 0.16 -0.36 1.01 -1.26 -5.03 120.40 118.79 2glm s VAL 113 Ca 0.62 0.11 -0.01 0.00 0.00 0.00 0.00 61.98 62.70 2glm s VAL 113 Cb -0.36 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 2glm s VAL 113 CO 0.45 0.58 0.08 0.42 0.00 0.00 0.00 175.10 176.62 2glm s THR 114 N -0.67 0.11 0.22 3.92 -4.23 -1.26 -0.55 115.64 113.18 2glm s THR 114 Ca 0.12 -1.95 -0.32 0.00 -1.18 0.00 0.00 61.69 58.37 2glm s THR 114 Cb -0.12 -2.21 -0.14 0.00 1.34 0.00 0.00 72.50 71.37 2glm s THR 114 CO 0.02 -0.30 1.43 -2.65 -0.54 0.00 0.00 174.62 172.58 2glm n PRO 115 N -0.17 1.99 0.00 3.99 -0.02 -1.26 -1.57 135.00 137.96 2glm n PRO 115 Ca -0.03 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2glm n PRO 115 Cb 0.64 -2.38 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2glm n PRO 115 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2glm n GLY 116 N 2.39 2.86 3.81 -1.23 0.00 0.13 -4.93 105.19 108.22 2glm n GLY 116 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2glm n GLY 116 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2glm s ASP 117 N -1.42 6.74 -0.41 1.61 -0.00 -0.61 -4.87 116.67 117.70 2glm s ASP 117 Ca 0.00 1.78 -0.04 0.00 -0.00 0.00 0.00 52.55 54.29 2glm s ASP 117 Cb 0.00 -2.55 0.11 0.00 -0.00 0.00 0.00 42.92 40.48 2glm s ASP 117 CO 0.00 -0.50 0.22 -0.60 -0.00 0.00 0.00 175.17 174.28 2glm s ARG 118 N -3.18 2.09 -0.79 8.23 3.52 -1.26 -0.68 118.95 126.88 2glm s ARG 118 Ca 0.64 -1.79 -0.25 0.00 -0.13 0.00 0.00 55.73 54.20 2glm s ARG 118 Cb -0.12 -3.62 0.04 0.00 -1.56 0.00 0.00 34.95 29.70 2glm s ARG 118 CO 0.16 -1.07 1.26 -1.17 -0.81 0.00 0.00 175.30 173.67 2glm s LEU 119 N 1.18 3.46 -0.14 -0.88 2.96 -0.16 -4.37 118.68 120.72 2glm s LEU 119 Ca 0.07 -0.77 -0.23 0.00 -0.22 0.00 0.00 54.13 52.99 2glm s LEU 119 Cb -0.23 -2.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.90 2glm s LEU 119 CO -0.04 -1.70 0.71 -0.70 -1.32 0.00 0.00 176.35 173.30 2glm s GLU 120 N 5.26 4.31 -0.18 1.98 2.12 0.92 -0.78 118.70 132.33 2glm s GLU 120 Ca 0.35 0.81 -0.14 0.00 0.36 0.00 0.00 54.97 56.36 2glm s GLU 120 Cb -0.08 -3.53 -0.05 0.00 0.26 0.00 0.00 34.13 30.74 2glm s GLU 120 CO 0.09 -0.15 0.29 0.71 -0.54 0.00 0.00 175.26 175.66 2glm s TYR 121 N 1.58 3.42 -0.26 5.30 4.12 0.58 0.10 117.35 132.19 2glm s TYR 121 Ca 0.34 0.54 0.03 0.00 0.02 0.00 0.00 57.07 58.00 2glm s TYR 121 Cb -0.17 -2.37 0.06 0.00 -1.52 0.00 0.00 41.96 37.97 2glm s TYR 121 CO 0.13 0.16 -0.09 -1.01 0.02 0.00 0.00 175.55 174.77 2glm s HIS 122 N 0.73 3.16 -0.08 2.71 3.76 0.55 -0.74 115.29 125.38 2glm s HIS 122 Ca 0.16 -2.29 0.04 0.00 -0.15 0.00 0.00 55.06 52.81 2glm s HIS 122 Cb -0.13 -1.95 0.00 0.00 1.11 0.00 0.00 32.58 31.60 2glm s HIS 122 CO 0.05 -0.87 -0.20 -0.51 -0.85 0.00 0.00 174.74 172.36 2glm s LEU 123 N 1.13 1.94 0.13 0.89 2.01 -0.42 -1.23 118.68 123.14 2glm s LEU 123 Ca -0.07 -0.46 0.08 0.00 0.01 0.00 0.00 54.13 53.69 2glm s LEU 123 Cb -0.20 -1.20 -0.04 0.00 0.01 0.00 0.00 46.19 44.76 2glm s LEU 123 CO -0.06 0.13 -0.12 -1.61 1.01 0.00 0.00 176.35 175.70 2glm s GLU 124 N 0.37 1.99 -0.44 1.70 0.41 0.34 -1.08 118.70 122.00 2glm s GLU 124 Ca -0.15 -1.15 -0.25 0.00 -0.41 0.00 0.00 54.97 53.00 2glm s GLU 124 Cb -0.16 -2.20 0.02 0.00 -1.78 0.00 0.00 34.13 30.01 2glm s GLU 124 CO 0.06 0.47 0.91 0.08 -0.49 0.00 0.00 175.26 176.30 2glm s VAL 125 N -1.35 4.51 0.02 2.63 1.01 0.23 -1.93 120.40 125.52 2glm s VAL 125 Ca 0.21 0.82 0.10 0.00 0.00 0.00 0.00 61.98 63.11 2glm s VAL 125 Cb -0.10 -4.40 -0.15 0.00 0.00 0.00 0.00 36.38 31.73 2glm s VAL 125 CO 0.13 -0.76 1.19 -0.07 0.00 0.00 0.00 175.10 175.60 2glm h LEU 126 N 10.42 0.00 -7.00 3.92 3.38 -0.99 -3.47 115.31 121.56 2glm h LEU 126 Ca -0.24 0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.88 2glm h LEU 126 Cb 1.08 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.52 2glm h LEU 126 CO 1.01 0.87 0.66 -0.75 0.09 0.00 0.00 178.44 180.32 2glm s LYS 127 N -2.76 0.22 -0.10 1.13 2.20 -0.74 -5.00 119.74 114.69 2glm s LYS 127 Ca 0.01 0.31 -0.07 0.00 -0.36 0.00 0.00 55.97 55.85 2glm s LYS 127 Cb 0.09 0.09 0.04 0.00 -1.51 0.00 0.00 37.83 36.53 2glm s LYS 127 CO 0.80 -0.03 0.25 -3.38 -0.36 0.00 0.00 175.35 172.63 2glm s HIS 128 N 0.52 -0.31 -0.30 4.03 -3.43 -1.26 -0.55 115.29 113.98 2glm s HIS 128 Ca 0.00 0.75 0.01 0.00 -0.80 0.00 0.00 55.06 55.02 2glm s HIS 128 Cb -0.04 0.08 0.14 0.00 -1.43 0.00 0.00 32.58 31.33 2glm s HIS 128 CO -0.12 -0.19 0.33 0.21 -2.00 0.00 0.00 174.74 172.97 2glm s LYS 129 N 0.73 0.39 7.45 -0.38 2.20 -0.95 -5.04 119.74 124.14 2glm s LYS 129 Ca -0.05 -0.20 0.00 0.00 -0.36 0.00 0.00 55.97 55.36 2glm s LYS 129 Cb -0.06 -0.60 0.00 0.00 -1.51 0.00 0.00 37.83 35.66 2glm s LYS 129 CO -0.05 -1.06 0.00 0.41 -0.36 0.00 0.00 175.35 174.30 2glm n GLY 130 N 5.15 2.54 0.32 5.54 0.00 -1.26 -2.64 105.19 114.85 2glm n GLY 130 Ca 0.00 -0.30 0.14 0.00 0.00 0.00 0.00 46.02 45.87 2glm n GLY 130 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2glm n MET 131 N 12.96 1.31 -3.60 1.61 2.81 -1.26 -4.81 117.12 126.14 2glm n MET 131 Ca 0.00 -0.65 -0.38 0.00 -1.81 0.00 0.00 57.70 54.86 2glm n MET 131 Cb 0.00 -1.49 -0.11 0.00 -0.71 0.00 0.00 33.22 30.92 2glm n MET 131 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2glm s ILE 132 N -2.14 5.32 -0.09 2.02 -1.09 -1.08 -1.44 121.20 122.70 2glm s ILE 132 Ca 0.36 0.18 0.03 0.00 -2.23 0.00 0.00 60.65 58.99 2glm s ILE 132 Cb 0.21 -3.53 0.01 0.00 -1.58 0.00 0.00 42.46 37.57 2glm s ILE 132 CO 0.39 0.27 -0.18 0.26 -1.23 0.00 0.00 174.94 174.44 2glm s TRP 133 N 1.64 2.01 -0.22 3.97 0.52 -0.25 -2.24 118.94 124.37 2glm s TRP 133 Ca 0.07 -0.81 -0.01 0.00 0.02 0.00 0.00 56.10 55.37 2glm s TRP 133 Cb -0.16 -1.40 0.02 0.00 -1.15 0.00 0.00 33.47 30.79 2glm s TRP 133 CO 0.10 -0.36 -0.11 -0.65 0.02 0.00 0.00 176.95 175.95 2glm s GLN 134 N 0.55 2.96 0.26 4.98 -0.21 0.29 0.12 119.66 128.61 2glm s GLN 134 Ca -0.16 -0.88 0.04 0.00 0.02 0.00 0.00 55.36 54.39 2glm s GLN 134 Cb -0.17 -2.84 -0.06 0.00 1.00 0.00 0.00 33.01 30.94 2glm s GLN 134 CO 0.06 -0.30 0.00 0.14 -2.12 0.00 0.00 175.29 173.06 2glm s VAL 135 N 1.33 1.21 0.17 1.09 -7.23 -0.20 -0.31 120.40 116.46 2glm s VAL 135 Ca 0.02 -2.05 -0.21 0.00 -1.81 0.00 0.00 61.98 57.94 2glm s VAL 135 Cb -0.15 -2.48 0.05 0.00 0.56 0.00 0.00 36.38 34.36 2glm s VAL 135 CO -0.07 -0.24 0.57 -0.83 -0.31 0.00 0.00 175.10 174.22 2glm s GLY 136 N -3.38 -0.42 0.00 2.32 0.00 -0.81 -1.43 107.32 103.60 2glm s GLY 136 Ca 0.31 0.20 0.00 0.00 0.00 0.00 0.00 44.72 45.23 2glm s GLY 136 CO 0.11 -0.01 0.00 0.61 0.00 0.00 0.00 173.10 173.81 2glm n GLY 137 N -0.36 -0.55 3.23 0.20 0.00 -0.83 -0.50 105.19 106.37 2glm n GLY 137 Ca -0.14 -0.78 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 2glm n GLY 137 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2glm s THR 138 N -3.53 0.08 -0.16 2.61 -4.23 -0.36 -1.97 115.64 108.07 2glm s THR 138 Ca 0.00 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.50 2glm s THR 138 Cb 0.00 -2.52 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 2glm s THR 138 CO 0.00 0.00 -0.10 0.00 -0.54 0.00 0.00 174.62 173.98 2glm s ALA 139 N -4.03 2.69 0.16 3.99 0.00 0.47 -0.33 121.76 124.71 2glm s ALA 139 Ca 0.39 -0.99 0.11 0.00 0.00 0.00 0.00 51.96 51.47 2glm s ALA 139 Cb 0.07 -1.39 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 2glm s ALA 139 CO 0.14 -0.00 -0.24 -0.65 0.00 0.00 0.00 175.76 175.00 2glm s GLN 140 N 0.76 1.41 -0.15 0.00 -0.21 0.29 -0.78 119.66 120.98 2glm s GLN 140 Ca -0.04 -1.42 -0.04 0.00 0.02 0.00 0.00 55.36 53.88 2glm s GLN 140 Cb -0.15 -1.76 0.05 0.00 1.00 0.00 0.00 33.01 32.15 2glm s GLN 140 CO 0.01 0.40 0.06 0.08 -2.12 0.00 0.00 175.29 173.72 2glm s VAL 141 N -1.45 0.13 -1.24 1.09 1.01 -0.53 -0.06 120.40 119.35 2glm s VAL 141 Ca 0.17 -0.17 -0.05 0.00 0.00 0.00 0.00 61.98 61.92 2glm s VAL 141 Cb -0.09 -0.65 0.01 0.00 0.00 0.00 0.00 36.38 35.65 2glm s VAL 141 CO 0.08 -0.14 1.07 -0.67 0.00 0.00 0.00 175.10 175.43 2glm n ASP 142 N 5.20 -4.62 0.00 3.32 4.64 -1.26 -2.31 116.55 121.52 2glm n ASP 142 Ca -0.07 -0.54 0.00 0.00 -1.38 0.00 0.00 54.79 52.80 2glm n ASP 142 Cb 0.49 -4.86 0.00 0.00 -1.04 0.00 0.00 41.12 35.70 2glm n ASP 142 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2glm n GLY 143 N -1.64 0.75 3.54 0.27 0.00 -1.26 -5.00 105.19 101.86 2glm n GLY 143 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.58 2glm n GLY 143 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2glm s LYS 144 N -0.28 3.13 -0.03 1.61 1.02 -0.98 -5.08 119.74 119.13 2glm s LYS 144 Ca 0.00 -0.54 -0.30 0.00 0.02 0.00 0.00 55.97 55.15 2glm s LYS 144 Cb 0.00 -2.72 -0.06 0.00 -0.52 0.00 0.00 37.83 34.54 2glm s LYS 144 CO 0.00 0.49 1.55 0.08 -0.92 0.00 0.00 175.35 176.55 2glm s VAL 145 N -0.32 3.60 -0.17 3.17 1.01 -1.26 -1.46 120.40 124.96 2glm s VAL 145 Ca 0.05 0.85 0.14 0.00 0.00 0.00 0.00 61.98 63.02 2glm s VAL 145 Cb -0.12 -3.55 -0.20 0.00 0.00 0.00 0.00 36.38 32.50 2glm s VAL 145 CO 0.02 -0.05 0.37 1.33 0.00 0.00 0.00 175.10 176.78 2glm n VAL 146 N 5.15 0.00 -3.46 2.92 0.24 0.04 -4.53 118.33 118.69 2glm n VAL 146 Ca 0.16 -0.29 -0.12 0.00 -2.04 0.00 0.00 64.34 62.05 2glm n VAL 146 Cb 0.43 0.38 -0.03 0.00 -1.47 0.00 0.00 33.84 33.15 2glm n VAL 146 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2glm s ALA 147 N -2.80 -1.70 -0.07 2.33 0.00 -1.12 -0.83 121.76 117.56 2glm s ALA 147 Ca -0.03 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.61 2glm s ALA 147 Cb 0.09 0.55 0.03 0.00 0.00 0.00 0.00 23.12 23.79 2glm s ALA 147 CO 0.58 -0.67 0.31 -1.83 0.00 0.00 0.00 175.76 174.14 2glm s GLU 148 N -3.08 0.50 0.21 0.00 -1.05 -0.78 -0.40 118.70 114.10 2glm s GLU 148 Ca 0.00 0.14 -0.23 0.00 -0.15 0.00 0.00 54.97 54.73 2glm s GLU 148 Cb -0.01 0.23 0.05 0.00 -0.44 0.00 0.00 34.13 33.96 2glm s GLU 148 CO -0.08 -0.10 0.77 0.00 0.95 0.00 0.00 175.26 176.79 2glm s ALA 149 N -0.53 -1.44 -0.01 -0.84 0.00 -0.83 -1.04 121.76 117.07 2glm s ALA 149 Ca -0.06 0.04 0.02 0.00 0.00 0.00 0.00 51.96 51.96 2glm s ALA 149 Cb -0.04 0.78 -0.00 0.00 0.00 0.00 0.00 23.12 23.86 2glm s ALA 149 CO 0.02 -0.96 -0.07 -1.21 0.00 0.00 0.00 175.76 173.53 2glm s GLU 150 N -3.68 0.68 0.03 0.00 2.02 -0.71 -1.96 118.70 115.08 2glm s GLU 150 Ca 0.09 -0.25 -0.03 0.00 0.02 0.00 0.00 54.97 54.80 2glm s GLU 150 Cb -0.04 -0.65 -0.02 0.00 0.10 0.00 0.00 34.13 33.52 2glm s GLU 150 CO 0.01 0.13 0.02 -0.51 0.02 0.00 0.00 175.26 174.93 2glm s LEU 151 N -0.01 2.12 -0.13 1.80 1.43 -0.51 -0.26 118.68 123.11 2glm s LEU 151 Ca 0.01 -0.64 0.01 0.00 -1.03 0.00 0.00 54.13 52.48 2glm s LEU 151 Cb -0.05 0.34 0.02 0.00 0.03 0.00 0.00 46.19 46.52 2glm s LEU 151 CO -0.00 -0.46 -0.16 -0.75 0.23 0.00 0.00 176.35 175.20 2glm s LYS 152 N -2.56 2.40 0.29 1.70 2.20 -0.86 -1.04 119.74 121.88 2glm s LYS 152 Ca -0.06 -0.62 0.10 0.00 -0.36 0.00 0.00 55.97 55.04 2glm s LYS 152 Cb -0.02 -2.08 -0.05 0.00 -1.51 0.00 0.00 37.83 34.18 2glm s LYS 152 CO -0.05 -0.12 -0.03 0.00 -0.36 0.00 0.00 175.35 174.79 2glm s ALA 153 N 1.15 3.11 -0.09 3.13 0.00 0.33 -1.41 121.76 127.98 2glm s ALA 153 Ca -0.02 -1.78 0.02 0.00 0.00 0.00 0.00 51.96 50.18 2glm s ALA 153 Cb -0.14 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.42 2glm s ALA 153 CO -0.05 0.21 -0.13 1.41 0.00 0.00 0.00 175.76 177.20 2glm s MET 154 N -3.66 1.89 -0.41 0.00 1.75 0.12 -1.09 119.30 117.90 2glm s MET 154 Ca 0.32 -0.45 -0.22 0.00 -1.25 0.00 0.00 55.69 54.09 2glm s MET 154 Cb -0.04 -1.63 0.02 0.00 2.84 0.00 0.00 34.83 36.01 2glm s MET 154 CO 0.19 -0.05 0.70 0.42 -0.65 0.00 0.00 175.02 175.63 2glm s ILE 155 N 0.95 4.77 0.37 10.11 1.01 -0.52 -0.68 121.20 137.21 2glm s ILE 155 Ca -0.09 0.42 0.08 0.00 0.00 0.00 0.00 60.65 61.06 2glm s ILE 155 Cb -0.15 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 2glm s ILE 155 CO -0.00 -0.55 0.17 0.00 0.00 0.00 0.00 174.94 174.56 2glm s ALA 156 N 2.98 3.57 0.49 9.38 0.00 0.21 -4.89 121.76 133.50 2glm s ALA 156 Ca 0.26 -1.93 -0.20 0.00 0.00 0.00 0.00 51.96 50.09 2glm s ALA 156 Cb -0.13 -0.64 -0.08 0.00 0.00 0.00 0.00 23.12 22.27 2glm s ALA 156 CO 0.19 -0.05 1.05 -2.00 0.00 0.00 0.00 175.76 174.95 2glm s GLU 157 N -3.89 3.74 0.18 0.00 2.56 -1.26 -0.25 118.70 119.79 2glm s GLU 157 Ca 0.40 1.41 0.25 0.00 0.00 0.00 0.00 54.97 57.02 2glm s GLU 157 Cb -0.01 -2.10 0.49 0.00 2.00 0.00 0.00 34.13 34.52 2glm s GLU 157 CO 0.23 -0.49 1.49 -0.09 -0.56 0.00 0.00 175.26 175.84 2glm h ARG 158 N 1.54 0.00 0.00 4.30 2.43 -1.22 -3.41 114.38 118.02 2glm h ARG 158 Ca -0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2glm h ARG 158 Cb 1.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2glm h ARG 158 CO 0.59 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 179.44