#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gbm s LEU 4 N 0.00 2.24 -0.03 6.55 2.96 -1.26 -4.86 118.68 124.28 3gbm s LEU 4 Ca 0.00 -0.61 -0.25 0.00 -0.22 0.00 0.00 54.13 53.05 3gbm s LEU 4 Cb 0.00 -1.52 -0.04 0.00 0.50 0.00 0.00 46.19 45.13 3gbm s LEU 4 CO 0.00 -0.00 0.75 -0.89 -1.32 0.00 0.00 176.35 174.89 3gbm s THR 5 N 1.32 4.95 -0.14 3.68 2.01 0.12 -3.55 115.64 124.02 3gbm s THR 5 Ca 0.05 1.57 -0.12 0.00 0.31 0.00 0.00 61.69 63.50 3gbm s THR 5 Cb -0.13 -4.09 0.04 0.00 0.01 0.00 0.00 72.50 68.32 3gbm s THR 5 CO -0.12 0.27 0.37 -1.58 -0.69 0.00 0.00 174.62 172.87 3gbm s GLN 6 N 0.61 0.42 -0.01 4.92 0.74 -1.26 -0.41 119.66 124.67 3gbm s GLN 6 Ca 0.40 0.55 -0.30 0.00 0.05 0.00 0.00 55.36 56.05 3gbm s GLN 6 Cb -0.19 0.17 -0.05 0.00 1.10 0.00 0.00 33.01 34.04 3gbm s GLN 6 CO 0.21 -0.07 1.26 -1.25 -0.55 0.00 0.00 175.29 174.88 3gbm s PRO 7 N 0.39 4.35 0.31 1.67 0.04 -1.26 -4.85 135.00 135.66 3gbm s PRO 7 Ca -0.02 1.78 0.08 0.00 0.04 0.00 0.00 61.00 62.89 3gbm s PRO 7 Cb -0.04 -3.50 0.88 0.00 0.04 0.00 0.00 34.50 31.89 3gbm s PRO 7 CO -0.02 -0.43 1.67 -1.35 0.04 0.00 0.00 177.00 176.91 3gbm h PRO 8 N 7.38 0.33 -3.38 0.56 0.11 -1.96 -3.40 132.00 131.63 3gbm h PRO 8 Ca -0.37 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.64 3gbm h PRO 8 Cb 1.18 -0.07 -0.16 0.00 0.11 0.00 0.00 31.00 32.06 3gbm h PRO 8 CO 0.87 0.22 -0.23 -1.54 -0.21 0.00 0.00 178.00 177.11 3gbm s SER 9 N -5.05 -0.11 -0.03 -2.05 1.04 -1.26 -1.35 113.70 104.89 3gbm s SER 9 Ca -0.11 -0.27 -0.07 0.00 0.48 0.00 0.00 55.95 55.98 3gbm s SER 9 Cb 0.28 0.38 0.01 0.00 0.10 0.00 0.00 66.02 66.78 3gbm s SER 9 CO 0.78 -0.68 0.16 -0.69 0.98 0.00 0.00 173.24 173.80 3gbm s VAL 11 N -2.97 0.04 0.05 5.02 1.01 -1.02 -4.97 120.40 117.56 3gbm s VAL 11 Ca -0.02 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.64 3gbm s VAL 11 Cb 0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 36.38 36.01 3gbm s VAL 11 CO -0.06 -0.20 -0.10 -0.44 0.00 0.00 0.00 175.10 174.31 3gbm s SER 12 N -0.68 1.14 -0.10 3.32 0.01 -1.26 -1.40 113.70 114.73 3gbm s SER 12 Ca -0.08 -0.54 -0.33 0.00 1.31 0.00 0.00 55.95 56.31 3gbm s SER 12 Cb -0.05 -0.00 0.13 0.00 0.21 0.00 0.00 66.02 66.31 3gbm s SER 12 CO 0.01 -0.14 1.28 0.00 0.41 0.00 0.00 173.24 174.80 3gbm s ALA 13 N -1.26 -2.20 -0.00 1.44 0.00 -1.17 -4.99 121.76 113.58 3gbm s ALA 13 Ca -0.06 1.09 -0.02 0.00 0.00 0.00 0.00 51.96 52.97 3gbm s ALA 13 Cb -0.09 0.14 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 3gbm s ALA 13 CO 0.01 -0.87 0.17 0.00 0.00 0.00 0.00 175.76 175.07 3gbm s ALA 14 N -2.37 3.91 -0.81 0.00 0.00 -1.26 -4.93 121.76 116.30 3gbm s ALA 14 Ca 0.12 -0.78 -0.31 0.00 0.00 0.00 0.00 51.96 51.00 3gbm s ALA 14 Cb 0.03 -1.84 -0.17 0.00 0.00 0.00 0.00 23.12 21.13 3gbm s ALA 14 CO -0.04 0.75 2.57 -2.30 0.00 0.00 0.00 175.76 176.74 3gbm n PRO 15 N 0.93 0.32 0.00 0.00 -0.02 -1.26 -2.14 135.00 132.83 3gbm n PRO 15 Ca -0.11 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 3gbm n PRO 15 Cb 0.52 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3gbm n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gbm n GLY 16 N 6.43 1.30 3.95 -1.23 0.00 -1.17 -4.88 105.19 109.58 3gbm n GLY 16 Ca 0.57 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 46.31 3gbm n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gbm s GLN 17 N 0.00 0.95 -0.34 1.61 -0.21 -0.91 -3.63 119.66 117.13 3gbm s GLN 17 Ca 0.00 -0.57 -0.01 0.00 0.02 0.00 0.00 55.36 54.80 3gbm s GLN 17 Cb 0.00 -1.97 0.08 0.00 1.00 0.00 0.00 33.01 32.11 3gbm s GLN 17 CO 0.00 -2.14 0.07 -1.59 -2.12 0.00 0.00 175.29 169.51 3gbm s LYS 18 N -5.69 2.14 0.54 2.91 0.00 -1.26 -2.39 119.74 115.99 3gbm s LYS 18 Ca 0.72 -1.54 -0.09 0.00 0.00 0.00 0.00 55.97 55.05 3gbm s LYS 18 Cb -0.04 -3.30 -0.04 0.00 0.00 0.00 0.00 37.83 34.44 3gbm s LYS 18 CO 0.51 -0.81 0.92 0.14 0.00 0.00 0.00 175.35 176.10 3gbm s VAL 19 N 1.16 4.77 -0.05 1.79 -7.23 -0.66 -4.91 120.40 115.26 3gbm s VAL 19 Ca 0.01 0.64 -0.02 0.00 -1.81 0.00 0.00 61.98 60.81 3gbm s VAL 19 Cb -0.21 -3.84 0.03 0.00 0.56 0.00 0.00 36.38 32.92 3gbm s VAL 19 CO -0.03 -0.94 0.04 0.42 -0.31 0.00 0.00 175.10 174.27 3gbm s THR 20 N -2.90 0.05 -0.31 5.32 -4.23 -1.26 -2.30 115.64 110.02 3gbm s THR 20 Ca 0.52 0.32 -0.11 0.00 -1.18 0.00 0.00 61.69 61.24 3gbm s THR 20 Cb -0.11 -0.27 -0.03 0.00 1.34 0.00 0.00 72.50 73.43 3gbm s THR 20 CO 0.47 0.20 0.20 -0.63 -0.54 0.00 0.00 174.62 174.32 3gbm s ILE 21 N 2.06 5.14 0.53 2.99 1.01 -0.03 -4.92 121.20 127.98 3gbm s ILE 21 Ca 0.04 -0.09 0.00 0.00 0.00 0.00 0.00 60.65 60.61 3gbm s ILE 21 Cb -0.12 -3.55 0.02 0.00 0.01 0.00 0.00 42.46 38.83 3gbm s ILE 21 CO -0.04 0.13 0.76 -0.94 0.00 0.00 0.00 174.94 174.85 3gbm s SER 22 N 1.72 5.41 -0.26 3.58 1.04 -1.26 0.03 113.70 123.95 3gbm s SER 22 Ca 0.06 0.11 -0.21 0.00 0.48 0.00 0.00 55.95 56.39 3gbm s SER 22 Cb -0.17 -1.08 0.07 0.00 0.10 0.00 0.00 66.02 64.95 3gbm s SER 22 CO 0.10 -1.04 0.69 0.00 0.98 0.00 0.00 173.24 173.96 3gbm s SER 24 N 0.79 -0.38 0.26 0.00 0.15 0.45 0.53 113.70 115.50 3gbm s SER 24 Ca -0.03 0.72 -0.18 0.00 0.70 0.00 0.00 55.95 57.16 3gbm s SER 24 Cb -0.05 0.71 0.07 0.00 -1.71 0.00 0.00 66.02 65.03 3gbm s SER 24 CO -0.06 -0.13 0.91 0.61 1.20 0.00 0.00 173.24 175.76 3gbm n GLY 25 N 3.16 0.77 0.00 9.45 0.00 -1.21 0.10 105.19 117.46 3gbm n GLY 25 Ca -0.15 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.68 3gbm n GLY 25 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gbm n SER 26 N -1.37 0.00 0.00 1.61 3.41 -1.26 -4.66 113.62 111.35 3gbm n SER 26 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 3gbm n SER 26 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 3gbm n SER 26 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3gbm n SER 27 N 0.00 0.00 0.00 4.04 3.41 -1.26 -2.98 113.62 116.83 3gbm n SER 27 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3gbm n SER 27 Cb 0.00 -0.06 0.00 0.00 -0.26 0.00 0.00 64.21 63.89 3gbm n SER 27 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3gbm n ASN 27 N 0.35 0.00 0.05 4.04 0.23 -1.26 -1.94 115.26 116.72 3gbm n ASN 27 Ca 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 54.58 53.97 3gbm n ASN 27 Cb 0.00 0.00 0.07 0.00 -2.08 0.00 0.00 39.78 37.77 3gbm n ASN 27 CO 0.00 0.00 0.00 0.40 -0.93 0.00 0.00 177.26 176.73 3gbm h ILE 28 N 0.00 1.36 0.24 1.53 2.04 -1.75 -0.10 117.51 120.83 3gbm h ILE 28 Ca 0.00 -1.96 0.00 0.00 1.00 0.00 0.00 64.86 63.91 3gbm h ILE 28 Cb 0.00 1.95 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 3gbm h ILE 28 CO 0.00 0.59 -0.24 1.23 0.00 0.00 0.00 178.15 179.73 3gbm h GLY 29 N 1.26 -0.53 0.00 5.37 0.00 -1.87 -3.31 103.07 103.99 3gbm h GLY 29 Ca -0.01 0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.55 3gbm h GLY 29 CO 0.11 -0.22 -0.34 3.45 0.00 0.00 0.00 176.54 179.54 3gbm h ASN 30 N -0.51 0.00 -3.24 0.19 -0.00 -1.90 -3.49 115.58 106.62 3gbm h ASN 30 Ca -0.00 -0.44 -0.46 0.00 -0.00 0.00 0.00 56.30 55.40 3gbm h ASN 30 Cb 0.48 0.00 0.05 0.00 -0.00 0.00 0.00 38.32 38.85 3gbm h ASN 30 CO -0.05 0.91 0.08 -1.81 -0.00 0.00 0.00 177.43 176.55 3gbm s ASP 31 N -6.07 5.50 0.62 6.14 1.11 -0.05 -5.08 116.67 118.85 3gbm s ASP 31 Ca -0.15 0.45 -0.07 0.00 0.18 0.00 0.00 52.55 52.97 3gbm s ASP 31 Cb 0.00 -1.45 0.02 0.00 1.07 0.00 0.00 42.92 42.56 3gbm s ASP 31 CO 0.39 -1.05 0.94 -0.31 1.18 0.00 0.00 175.17 176.31 3gbm s TYR 32 N -2.87 3.22 0.00 4.23 2.02 -1.26 -4.47 117.35 118.23 3gbm s TYR 32 Ca 0.54 0.67 0.08 0.00 -0.37 0.00 0.00 57.07 57.98 3gbm s TYR 32 Cb -0.10 -2.83 -0.02 0.00 -0.40 0.00 0.00 41.96 38.61 3gbm s TYR 32 CO 0.42 -0.93 -0.23 0.08 -1.57 0.00 0.00 175.55 173.31 3gbm s VAL 33 N -3.06 1.86 0.18 0.71 1.01 -1.26 -4.22 120.40 115.61 3gbm s VAL 33 Ca 0.55 -1.09 0.09 0.00 0.00 0.00 0.00 61.98 61.53 3gbm s VAL 33 Cb -0.11 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 3gbm s VAL 33 CO 0.46 0.45 -0.18 -0.44 0.00 0.00 0.00 175.10 175.40 3gbm s SER 34 N -0.74 2.71 0.08 3.32 0.01 -0.49 -0.21 113.70 118.38 3gbm s SER 34 Ca 0.09 -0.90 0.08 0.00 1.31 0.00 0.00 55.95 56.53 3gbm s SER 34 Cb -0.09 -0.16 -0.03 0.00 0.21 0.00 0.00 66.02 65.95 3gbm s SER 34 CO -0.00 -0.06 -0.21 0.26 0.41 0.00 0.00 173.24 173.64 3gbm s TRP 35 N -2.26 1.79 0.05 2.43 0.52 -0.03 0.78 118.94 122.22 3gbm s TRP 35 Ca 0.18 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.93 3gbm s TRP 35 Cb -0.05 -1.01 -0.03 0.00 -1.15 0.00 0.00 33.47 31.24 3gbm s TRP 35 CO 0.07 0.17 -0.11 0.71 0.02 0.00 0.00 176.95 177.80 3gbm s TYR 36 N -1.04 0.98 -0.08 -1.98 2.02 0.97 -0.77 117.35 117.45 3gbm s TYR 36 Ca 0.07 -0.45 0.04 0.00 -0.37 0.00 0.00 57.07 56.36 3gbm s TYR 36 Cb -0.10 -0.57 -0.01 0.00 -0.40 0.00 0.00 41.96 40.89 3gbm s TYR 36 CO 0.03 -0.00 -0.22 -1.14 -1.57 0.00 0.00 175.55 172.65 3gbm s GLN 37 N -1.56 2.83 -0.18 -0.62 0.74 0.03 -1.55 119.66 119.35 3gbm s GLN 37 Ca -0.05 -0.85 -0.01 0.00 0.05 0.00 0.00 55.36 54.51 3gbm s GLN 37 Cb -0.09 -2.29 0.05 0.00 1.10 0.00 0.00 33.01 31.77 3gbm s GLN 37 CO 0.01 0.31 -0.03 -1.14 -0.55 0.00 0.00 175.29 173.89 3gbm s GLN 38 N 0.03 1.31 -0.00 1.67 0.74 0.13 -0.99 119.66 122.55 3gbm s GLN 38 Ca -0.09 -0.59 -0.13 0.00 0.05 0.00 0.00 55.36 54.60 3gbm s GLN 38 Cb -0.15 -2.13 -0.06 0.00 1.10 0.00 0.00 33.01 31.77 3gbm s GLN 38 CO 0.05 -0.50 0.38 -0.51 -0.55 0.00 0.00 175.29 174.16 3gbm s LEU 39 N 1.63 4.45 0.20 3.68 1.43 -1.26 -1.66 118.68 127.15 3gbm s LEU 39 Ca -0.01 0.89 -0.33 0.00 -1.03 0.00 0.00 54.13 53.66 3gbm s LEU 39 Cb -0.16 -2.59 -0.14 0.00 0.03 0.00 0.00 46.19 43.33 3gbm s LEU 39 CO -0.07 0.31 1.43 -0.81 0.23 0.00 0.00 176.35 177.44 3gbm n PRO 40 N 1.71 1.91 -0.35 1.29 -0.04 -1.26 -1.29 135.00 136.97 3gbm n PRO 40 Ca -0.14 0.68 0.00 0.00 -0.04 0.00 0.00 63.50 64.00 3gbm n PRO 40 Cb 0.53 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.63 3gbm n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3gbm n GLY 41 N 2.56 0.86 3.21 0.55 0.00 -1.26 -5.05 105.19 106.06 3gbm n GLY 41 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 3gbm n GLY 41 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gbm s THR 42 N -2.80 1.26 0.65 2.61 -4.23 -0.41 -5.14 115.64 107.59 3gbm s THR 42 Ca 0.00 -1.43 -0.17 0.00 -1.18 0.00 0.00 61.69 58.91 3gbm s THR 42 Cb 0.00 -1.25 -0.00 0.00 1.34 0.00 0.00 72.50 72.59 3gbm s THR 42 CO 0.00 -0.24 1.19 0.00 -0.54 0.00 0.00 174.62 175.03 3gbm s ALA 43 N -1.44 2.38 0.75 3.99 0.00 -1.26 -4.47 121.76 121.70 3gbm s ALA 43 Ca 0.02 0.88 -0.16 0.00 0.00 0.00 0.00 51.96 52.70 3gbm s ALA 43 Cb -0.09 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.56 3gbm s ALA 43 CO 0.03 -1.43 0.47 -2.30 0.00 0.00 0.00 175.76 172.53 3gbm n PRO 44 N -2.14 0.23 -4.13 0.00 -0.02 -1.26 -4.73 135.00 122.95 3gbm n PRO 44 Ca 0.13 0.12 -0.20 0.00 -2.02 0.00 0.00 63.50 61.52 3gbm n PRO 44 Cb 0.50 -1.79 -0.16 0.00 -0.02 0.00 0.00 33.50 32.02 3gbm n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 3gbm s LYS 45 N -2.79 0.83 -0.09 -0.52 2.20 -0.16 -4.92 119.74 114.28 3gbm s LYS 45 Ca 0.64 -0.09 -0.30 0.00 -0.36 0.00 0.00 55.97 55.86 3gbm s LYS 45 Cb -0.33 -0.86 -0.04 0.00 -1.51 0.00 0.00 37.83 35.09 3gbm s LYS 45 CO 0.60 -0.10 1.49 -1.17 -0.36 0.00 0.00 175.35 175.81 3gbm s LEU 46 N 0.99 4.27 -0.26 5.43 2.96 -1.26 -0.79 118.68 130.03 3gbm s LEU 46 Ca -0.10 2.02 -0.15 0.00 -0.22 0.00 0.00 54.13 55.68 3gbm s LEU 46 Cb -0.14 -3.54 -0.11 0.00 0.50 0.00 0.00 46.19 42.90 3gbm s LEU 46 CO -0.00 -0.85 -0.34 0.00 -1.32 0.00 0.00 176.35 173.84 3gbm n LEU 47 N 6.80 1.95 -3.98 -0.68 -0.00 0.05 -4.85 117.00 116.28 3gbm n LEU 47 Ca 0.16 0.34 -0.09 0.00 -0.00 0.00 0.00 56.01 56.42 3gbm n LEU 47 Cb 0.44 -0.81 -0.10 0.00 -0.00 0.00 0.00 43.42 42.95 3gbm n LEU 47 CO 0.60 0.39 -0.29 0.27 -0.00 0.00 0.00 177.39 178.35 3gbm s ILE 48 N -2.58 0.15 0.23 1.47 -5.25 -1.13 -4.18 121.20 109.91 3gbm s ILE 48 Ca -0.36 -1.20 0.01 0.00 -0.99 0.00 0.00 60.65 58.10 3gbm s ILE 48 Cb 0.12 -0.85 -0.05 0.00 2.95 0.00 0.00 42.46 44.64 3gbm s ILE 48 CO 0.48 -0.66 0.09 -0.72 -1.79 0.00 0.00 174.94 172.34 3gbm s TYR 49 N -2.56 1.40 -1.43 1.37 1.13 -0.08 -0.85 117.35 116.33 3gbm s TYR 49 Ca -0.06 -1.21 -0.09 0.00 -1.41 0.00 0.00 57.07 54.30 3gbm s TYR 49 Cb -0.02 -0.79 0.05 0.00 -1.10 0.00 0.00 41.96 40.10 3gbm s TYR 49 CO -0.05 -0.40 0.68 -0.25 -2.51 0.00 0.00 175.55 173.02 3gbm n ASP 50 N -0.39 -4.89 0.00 -0.18 8.00 -1.17 -0.16 116.55 117.76 3gbm n ASP 50 Ca -0.00 -0.45 0.00 0.00 0.71 0.00 0.00 54.79 55.05 3gbm n ASP 50 Cb 0.66 -3.97 0.00 0.00 -0.02 0.00 0.00 41.12 37.79 3gbm n ASP 50 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3gbm n ASN 51 N -2.53 0.00 0.00 -2.24 3.02 0.71 -4.36 115.26 109.86 3gbm n ASN 51 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 3gbm n ASN 51 Cb 0.56 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 3gbm n ASN 51 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 3gbm n ASN 52 N 2.88 0.00 -4.89 6.41 0.23 -1.03 -3.62 115.26 115.24 3gbm n ASN 52 Ca 0.00 -1.00 -0.29 0.00 -0.53 0.00 0.00 54.58 52.76 3gbm n ASN 52 Cb 0.00 0.00 0.03 0.00 -2.08 0.00 0.00 39.78 37.73 3gbm n ASN 52 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3gbm s LYS 53 N 0.00 3.02 -0.10 -3.83 3.01 0.78 -4.75 119.74 117.87 3gbm s LYS 53 Ca 0.00 0.38 -0.04 0.00 -1.01 0.00 0.00 55.97 55.30 3gbm s LYS 53 Cb 0.00 -2.11 0.05 0.00 -1.01 0.00 0.00 37.83 34.76 3gbm s LYS 53 CO 0.00 -0.84 0.19 0.50 0.51 0.00 0.00 175.35 175.71 3gbm s ARG 54 N -5.21 0.07 0.68 1.68 3.52 -1.26 -0.91 118.95 117.53 3gbm s ARG 54 Ca 0.56 0.61 -0.12 0.00 -0.13 0.00 0.00 55.73 56.65 3gbm s ARG 54 Cb -0.11 -0.22 0.01 0.00 -1.56 0.00 0.00 34.95 33.07 3gbm s ARG 54 CO 0.50 -0.31 1.07 -1.25 -0.81 0.00 0.00 175.30 174.50 3gbm s PRO 55 N 2.33 2.90 0.43 5.12 0.04 -1.26 -4.95 135.00 139.62 3gbm s PRO 55 Ca 0.03 1.07 -0.26 0.00 0.04 0.00 0.00 61.00 61.88 3gbm s PRO 55 Cb -0.12 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.35 3gbm s PRO 55 CO -0.07 -1.14 1.41 0.43 0.04 0.00 0.00 177.00 177.67 3gbm n SER 56 N -2.90 3.22 0.00 6.66 7.64 -1.26 -2.57 113.62 124.41 3gbm n SER 56 Ca 0.08 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.09 3gbm n SER 56 Cb 0.53 -1.58 0.00 0.00 -1.01 0.00 0.00 64.21 62.15 3gbm n SER 56 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3gbm n GLY 57 N 0.61 3.18 3.60 0.23 0.00 -1.26 -5.06 105.19 106.49 3gbm n GLY 57 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 3gbm n GLY 57 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gbm s ILE 58 N -2.88 5.19 0.57 -0.61 -1.09 -1.06 -5.06 121.20 116.26 3gbm s ILE 58 Ca 0.00 0.53 -0.19 0.00 -2.23 0.00 0.00 60.65 58.76 3gbm s ILE 58 Cb 0.00 -3.68 -0.04 0.00 -1.58 0.00 0.00 42.46 37.15 3gbm s ILE 58 CO 0.00 0.16 1.16 -2.84 -1.23 0.00 0.00 174.94 172.19 3gbm s PRO 59 N 2.04 3.16 0.00 2.79 0.02 -1.26 -4.89 135.00 136.86 3gbm s PRO 59 Ca 0.14 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.83 3gbm s PRO 59 Cb -0.16 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.39 3gbm s PRO 59 CO 0.10 -1.02 0.74 -0.40 -0.33 0.00 0.00 177.00 176.10 3gbm n ASP 60 N -1.51 0.21 0.22 2.53 5.75 -1.26 -2.16 116.55 120.33 3gbm n ASP 60 Ca 0.12 -1.69 0.10 0.00 -0.01 0.00 0.00 54.79 53.31 3gbm n ASP 60 Cb 0.51 -0.11 0.40 0.00 -1.03 0.00 0.00 41.12 40.89 3gbm n ASP 60 CO 0.00 0.00 0.00 0.08 -0.11 0.00 0.00 177.20 177.17 3gbm h ARG 61 N 0.04 0.00 -6.24 0.11 0.11 -1.91 -3.43 114.38 103.06 3gbm h ARG 61 Ca 0.00 0.00 -0.57 0.00 0.10 0.00 0.00 59.98 59.51 3gbm h ARG 61 Cb 0.11 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 31.14 3gbm h ARG 61 CO 0.00 0.22 -0.04 -0.06 0.10 0.00 0.00 179.97 180.19 3gbm s PHE 62 N -3.53 3.80 0.33 4.08 0.08 -0.92 -2.75 117.98 119.07 3gbm s PHE 62 Ca 0.02 1.26 -0.18 0.00 0.12 0.00 0.00 56.93 58.15 3gbm s PHE 62 Cb 0.09 -2.49 0.06 0.00 -0.57 0.00 0.00 43.02 40.11 3gbm s PHE 62 CO 0.64 0.58 0.86 -1.54 -0.10 0.00 0.00 175.22 175.66 3gbm s SER 63 N -1.14 -0.01 0.18 1.36 1.04 -0.78 -5.00 113.70 109.36 3gbm s SER 63 Ca 0.29 -1.00 -0.23 0.00 0.48 0.00 0.00 55.95 55.49 3gbm s SER 63 Cb -0.19 0.75 0.07 0.00 0.10 0.00 0.00 66.02 66.75 3gbm s SER 63 CO 0.19 -1.49 0.99 -0.83 0.98 0.00 0.00 173.24 173.08 3gbm s GLY 64 N -3.15 -0.07 0.30 7.32 0.00 -1.26 -0.96 107.32 109.49 3gbm s GLY 64 Ca 0.17 -0.09 -0.20 0.00 0.00 0.00 0.00 44.72 44.60 3gbm s GLY 64 CO 0.10 0.85 0.78 -1.35 0.00 0.00 0.00 173.10 173.48 3gbm s SER 65 N -3.12 -0.16 -0.64 1.64 1.04 -0.63 -4.36 113.70 107.48 3gbm s SER 65 Ca 0.16 -0.77 0.05 0.00 0.48 0.00 0.00 55.95 55.87 3gbm s SER 65 Cb -0.02 0.74 0.17 0.00 0.10 0.00 0.00 66.02 67.01 3gbm s SER 65 CO 0.04 -1.40 0.45 -1.59 0.98 0.00 0.00 173.24 171.71 3gbm s LYS 66 N -3.27 2.12 0.00 4.02 0.00 -1.26 -1.26 119.74 120.09 3gbm s LYS 66 Ca 0.13 -3.05 0.00 0.00 0.00 0.00 0.00 55.97 53.05 3gbm s LYS 66 Cb -0.05 -3.02 0.00 0.00 0.00 0.00 0.00 37.83 34.76 3gbm s LYS 66 CO 0.08 -1.29 1.06 -1.13 0.00 0.00 0.00 175.35 174.07 3gbm n SER 67 N 2.23 2.94 0.00 0.03 3.41 -0.96 -4.81 113.62 116.46 3gbm n SER 67 Ca 0.20 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.12 3gbm n SER 67 Cb 0.37 -0.58 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 3gbm n SER 67 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gbm n GLY 68 N 1.22 0.76 1.83 5.00 0.00 -1.26 -4.82 105.19 107.92 3gbm n GLY 68 Ca 0.00 -1.94 -0.03 0.00 0.00 0.00 0.00 46.02 44.05 3gbm n GLY 68 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3gbm n THR 69 N 6.02 1.63 -3.52 2.61 5.66 -1.26 -4.69 114.28 120.73 3gbm n THR 69 Ca 0.00 -0.60 -0.12 0.00 -3.05 0.00 0.00 64.05 60.29 3gbm n THR 69 Cb 0.00 -1.53 -0.04 0.00 -1.55 0.00 0.00 70.33 67.21 3gbm n THR 69 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 3gbm s SER 70 N 2.11 -0.45 0.03 1.09 1.04 -1.26 -3.35 113.70 112.90 3gbm s SER 70 Ca 0.17 0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.90 3gbm s SER 70 Cb 0.08 0.41 -0.02 0.00 0.10 0.00 0.00 66.02 66.59 3gbm s SER 70 CO 0.00 -0.56 -0.04 0.00 0.98 0.00 0.00 173.24 173.62 3gbm s ALA 71 N -2.05 0.27 0.10 5.32 0.00 0.19 -2.26 121.76 123.32 3gbm s ALA 71 Ca -0.01 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.28 3gbm s ALA 71 Cb -0.01 0.15 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 3gbm s ALA 71 CO -0.02 -0.17 -0.15 0.95 0.00 0.00 0.00 175.76 176.38 3gbm s THR 72 N -1.82 1.26 0.08 0.00 -4.23 -0.39 0.30 115.64 110.84 3gbm s THR 72 Ca -0.11 -1.53 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 3gbm s THR 72 Cb -0.07 -1.34 -0.04 0.00 1.34 0.00 0.00 72.50 72.39 3gbm s THR 72 CO -0.02 -0.31 -0.17 -0.22 -0.54 0.00 0.00 174.62 173.36 3gbm s LEU 73 N -2.12 2.70 -0.03 4.79 2.96 0.10 -1.61 118.68 125.48 3gbm s LEU 73 Ca 0.04 -0.47 0.02 0.00 -0.22 0.00 0.00 54.13 53.49 3gbm s LEU 73 Cb -0.07 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 45.07 3gbm s LEU 73 CO 0.03 0.22 -0.06 -0.83 -1.32 0.00 0.00 176.35 174.38 3gbm s GLY 74 N -1.81 0.44 0.07 7.98 0.00 -0.13 -0.85 107.32 113.01 3gbm s GLY 74 Ca 0.17 -0.16 0.07 0.00 0.00 0.00 0.00 44.72 44.80 3gbm s GLY 74 CO 0.08 0.18 -0.14 -0.42 0.00 0.00 0.00 173.10 172.80 3gbm s ILE 75 N 0.53 3.06 0.01 0.90 1.01 -0.97 -1.87 121.20 123.87 3gbm s ILE 75 Ca -0.07 -1.22 0.00 0.00 0.00 0.00 0.00 60.65 59.36 3gbm s ILE 75 Cb -0.11 -2.36 -0.01 0.00 0.01 0.00 0.00 42.46 39.99 3gbm s ILE 75 CO 0.00 0.24 -0.02 0.42 0.00 0.00 0.00 174.94 175.58 3gbm s THR 76 N -1.05 0.13 -0.88 2.92 -4.23 -1.11 -1.66 115.64 109.76 3gbm s THR 76 Ca 0.17 -0.48 -0.05 0.00 -1.18 0.00 0.00 61.69 60.15 3gbm s THR 76 Cb -0.11 -0.20 0.01 0.00 1.34 0.00 0.00 72.50 73.54 3gbm s THR 76 CO 0.09 -0.22 0.77 0.61 -0.54 0.00 0.00 174.62 175.32 3gbm n GLY 77 N 2.33 -0.06 3.76 3.99 0.00 -1.01 -4.80 105.19 109.41 3gbm n GLY 77 Ca -0.18 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.38 3gbm n GLY 77 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3gbm s LEU 78 N -5.15 4.56 0.48 0.99 0.05 -1.24 -4.63 118.68 113.74 3gbm s LEU 78 Ca 0.31 2.26 0.07 0.00 0.05 0.00 0.00 54.13 56.82 3gbm s LEU 78 Cb -0.14 -3.63 0.01 0.00 -2.05 0.00 0.00 46.19 40.39 3gbm s LEU 78 CO 0.49 -0.13 0.41 -1.10 -0.55 0.00 0.00 176.35 175.47 3gbm s GLN 79 N -1.44 2.37 0.29 1.48 -0.21 -1.26 -3.06 119.66 117.84 3gbm s GLN 79 Ca 0.44 -1.77 -0.02 0.00 0.02 0.00 0.00 55.36 54.03 3gbm s GLN 79 Cb -0.32 -2.26 0.42 0.00 1.00 0.00 0.00 33.01 31.85 3gbm s GLN 79 CO 0.41 -0.43 1.96 1.79 -2.12 0.00 0.00 175.29 176.90 3gbm h THR 80 N 0.86 1.21 -0.93 -0.19 1.35 -2.00 -2.35 112.91 110.85 3gbm h THR 80 Ca -0.38 -0.40 0.25 0.00 -0.55 0.00 0.00 66.41 65.33 3gbm h THR 80 Cb 1.28 -0.06 -0.05 0.00 -1.73 0.00 0.00 68.15 67.60 3gbm h THR 80 CO 0.57 0.21 0.65 1.23 -0.25 0.00 0.00 175.52 177.93 3gbm h GLY 81 N 1.16 0.34 1.12 5.82 0.00 -2.02 -0.39 103.07 109.11 3gbm h GLY 81 Ca 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.59 3gbm h GLY 81 CO -0.08 -0.02 0.00 1.22 0.00 0.00 0.00 176.54 177.67 3gbm n ASP 82 N -4.36 0.00 -4.56 0.19 9.92 -0.88 -4.67 116.55 112.18 3gbm n ASP 82 Ca 0.20 -0.47 -0.40 0.00 -0.53 0.00 0.00 54.79 53.59 3gbm n ASP 82 Cb 0.91 -0.06 -0.03 0.00 -0.64 0.00 0.00 41.12 41.30 3gbm n ASP 82 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 3gbm s GLU 83 N -2.12 2.86 0.11 -1.24 8.01 -0.16 -4.86 118.70 121.30 3gbm s GLU 83 Ca 0.27 0.81 -0.14 0.00 0.01 0.00 0.00 54.97 55.91 3gbm s GLU 83 Cb 0.13 -4.32 0.05 0.00 -4.31 0.00 0.00 34.13 25.69 3gbm s GLU 83 CO 0.24 -2.44 0.67 0.00 0.01 0.00 0.00 175.26 173.73 3gbm n ALA 84 N 11.86 -1.75 -2.82 5.21 0.00 -1.22 -4.89 120.51 126.90 3gbm n ALA 84 Ca 0.20 -0.65 -0.35 0.00 0.00 0.00 0.00 53.44 52.64 3gbm n ALA 84 Cb 0.51 0.35 -0.05 0.00 0.00 0.00 0.00 19.45 20.25 3gbm n ALA 84 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3gbm s ASN 85 N -2.57 6.45 -0.06 0.00 0.01 -0.66 -1.03 114.94 117.07 3gbm s ASN 85 Ca 0.15 0.50 0.02 0.00 -0.71 0.00 0.00 52.86 52.82 3gbm s ASN 85 Cb -0.02 -2.07 0.01 0.00 0.41 0.00 0.00 41.25 39.58 3gbm s ASN 85 CO 0.03 0.32 -0.11 -0.31 -1.51 0.00 0.00 177.10 175.52 3gbm s TYR 86 N -1.19 1.36 -0.03 2.20 1.51 -0.96 0.17 117.35 120.41 3gbm s TYR 86 Ca 0.22 -0.48 0.04 0.00 -1.01 0.00 0.00 57.07 55.84 3gbm s TYR 86 Cb -0.13 -1.01 -0.01 0.00 -0.11 0.00 0.00 41.96 40.71 3gbm s TYR 86 CO 0.12 -0.26 -0.17 0.71 -1.11 0.00 0.00 175.55 174.85 3gbm s TYR 87 N 0.65 1.60 0.20 2.71 2.02 -0.60 -2.21 117.35 121.72 3gbm s TYR 87 Ca -0.14 -0.41 -0.16 0.00 -0.37 0.00 0.00 57.07 56.00 3gbm s TYR 87 Cb -0.15 -1.07 -0.08 0.00 -0.40 0.00 0.00 41.96 40.26 3gbm s TYR 87 CO 0.03 -0.12 0.63 0.00 -1.57 0.00 0.00 175.55 174.53 3gbm s ALA 89 N -1.58 1.91 0.30 0.00 0.00 0.23 -0.78 121.76 121.84 3gbm s ALA 89 Ca 0.43 -1.29 -0.13 0.00 0.00 0.00 0.00 51.96 50.97 3gbm s ALA 89 Cb -0.15 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.72 3gbm s ALA 89 CO 0.20 0.40 0.60 -0.08 0.00 0.00 0.00 175.76 176.87 3gbm s THR 90 N -1.14 0.00 -0.18 0.00 -1.32 -0.16 -1.40 115.64 111.44 3gbm s THR 90 Ca 0.08 -1.26 -0.05 0.00 -1.21 0.00 0.00 61.69 59.25 3gbm s THR 90 Cb -0.10 -2.39 -0.03 0.00 -1.51 0.00 0.00 72.50 68.48 3gbm s THR 90 CO 0.05 0.00 -0.00 0.86 -2.21 0.00 0.00 174.62 173.31 3gbm s TRP 91 N -3.45 3.06 -0.20 9.09 -0.11 -1.26 -0.34 118.94 125.74 3gbm s TRP 91 Ca 0.20 -0.31 0.01 0.00 1.22 0.00 0.00 56.10 57.21 3gbm s TRP 91 Cb -0.03 -2.04 0.04 0.00 -1.50 0.00 0.00 33.47 29.94 3gbm s TRP 91 CO 0.11 -0.10 -0.11 0.34 -4.62 0.00 0.00 176.95 172.56 3gbm s ASP 92 N 0.67 3.36 -0.39 5.86 2.15 -0.29 -4.48 116.67 123.54 3gbm s ASP 92 Ca -0.00 -0.86 -0.14 0.00 0.43 0.00 0.00 52.55 51.98 3gbm s ASP 92 Cb -0.14 -1.26 0.01 0.00 -0.30 0.00 0.00 42.92 41.23 3gbm s ASP 92 CO 0.02 -0.13 0.28 -0.13 -0.17 0.00 0.00 175.17 175.04 3gbm s ARG 93 N 1.38 3.04 0.78 4.34 3.00 -0.82 -2.31 118.95 128.36 3gbm s ARG 93 Ca -0.01 -0.97 -0.11 0.00 0.00 0.00 0.00 55.73 54.64 3gbm s ARG 93 Cb -0.16 -3.92 0.06 0.00 0.00 0.00 0.00 34.95 30.93 3gbm s ARG 93 CO -0.09 -0.70 1.09 0.95 0.00 0.00 0.00 175.30 176.56 3gbm s THR 95 N 1.67 3.16 0.02 0.02 -4.23 -1.26 -4.96 115.64 110.06 3gbm s THR 95 Ca 0.05 0.38 -0.30 0.00 -1.18 0.00 0.00 61.69 60.63 3gbm s THR 95 Cb -0.19 -3.15 -0.07 0.00 1.34 0.00 0.00 72.50 70.43 3gbm s THR 95 CO 0.10 -0.49 1.66 0.00 -0.54 0.00 0.00 174.62 175.34 3gbm s ALA 95 N -3.17 3.64 0.16 3.99 0.00 -1.26 -5.02 121.76 120.10 3gbm s ALA 95 Ca 0.60 1.09 -0.18 0.00 0.00 0.00 0.00 51.96 53.47 3gbm s ALA 95 Cb -0.14 -3.72 0.04 0.00 0.00 0.00 0.00 23.12 19.30 3gbm s ALA 95 CO 0.54 -1.24 0.49 1.52 0.00 0.00 0.00 175.76 177.07 3gbm s TYR 95 N 3.29 -0.25 -0.23 0.00 -0.85 -0.98 -5.00 117.35 113.33 3gbm s TYR 95 Ca 0.74 -0.06 -0.29 0.00 -0.52 0.00 0.00 57.07 56.95 3gbm s TYR 95 Cb -0.37 0.38 0.01 0.00 0.38 0.00 0.00 41.96 42.35 3gbm s TYR 95 CO 0.32 -0.81 1.11 0.08 -1.52 0.00 0.00 175.55 174.72 3gbm s VAL 96 N -3.82 4.54 -0.10 -3.49 1.01 -1.26 -1.13 120.40 116.15 3gbm s VAL 96 Ca 0.05 1.85 -0.02 0.00 0.00 0.00 0.00 61.98 63.86 3gbm s VAL 96 Cb 0.00 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 32.10 3gbm s VAL 96 CO -0.09 -0.23 -0.02 0.54 0.00 0.00 0.00 175.10 175.29 3gbm s VAL 97 N 3.39 4.08 0.27 2.92 0.11 0.54 -4.98 120.40 126.74 3gbm s VAL 97 Ca 0.47 -0.32 0.06 0.00 -2.93 0.00 0.00 61.98 59.26 3gbm s VAL 97 Cb -0.16 -2.72 -0.03 0.00 -1.53 0.00 0.00 36.38 31.94 3gbm s VAL 97 CO 0.10 0.58 0.36 -0.36 -3.33 0.00 0.00 175.10 172.45 3gbm s PHE 98 N -0.57 3.27 0.69 1.54 0.40 -1.26 -0.99 117.98 121.06 3gbm s PHE 98 Ca 0.09 -0.11 -0.09 0.00 -0.60 0.00 0.00 56.93 56.22 3gbm s PHE 98 Cb -0.12 -1.67 0.03 0.00 0.51 0.00 0.00 43.02 41.78 3gbm s PHE 98 CO 0.02 0.32 1.04 0.20 0.70 0.00 0.00 175.22 177.50 3gbm s GLY 99 N -4.01 1.62 0.55 4.36 0.00 0.04 -4.53 107.32 105.35 3gbm s GLY 99 Ca 0.37 -0.59 0.29 0.00 0.00 0.00 0.00 44.72 44.79 3gbm s GLY 99 CO 0.29 -0.22 2.14 -1.33 0.00 0.00 0.00 173.10 173.98 3gbm h GLY 100 N -0.58 0.00 0.00 0.20 0.00 -1.90 -3.45 103.07 97.35 3gbm h GLY 100 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3gbm h GLY 100 CO 0.63 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.78 3gbm n GLY 101 N -0.88 2.08 3.10 4.60 0.00 -1.26 -5.07 105.19 107.77 3gbm n GLY 101 Ca -0.02 -2.00 -0.08 0.00 0.00 0.00 0.00 46.02 43.92 3gbm n GLY 101 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gbm s THR 102 N -2.40 -0.66 0.08 2.61 -4.23 -0.94 -4.35 115.64 105.75 3gbm s THR 102 Ca 0.00 0.05 -0.31 0.00 -1.18 0.00 0.00 61.69 60.25 3gbm s THR 102 Cb 0.00 -0.76 -0.06 0.00 1.34 0.00 0.00 72.50 73.02 3gbm s THR 102 CO 0.00 -0.02 1.22 -0.75 -0.54 0.00 0.00 174.62 174.52 3gbm s LYS 103 N 2.61 4.43 -0.24 3.99 2.36 -0.45 -2.28 119.74 130.16 3gbm s LYS 103 Ca 0.06 1.81 -0.05 0.00 -2.55 0.00 0.00 55.97 55.24 3gbm s LYS 103 Cb -0.14 -3.33 -0.01 0.00 -1.05 0.00 0.00 37.83 33.31 3gbm s LYS 103 CO -0.15 -0.26 -0.01 -1.17 1.55 0.00 0.00 175.35 175.31 3gbm s LEU 104 N 0.96 3.13 0.00 5.43 2.96 -0.19 -2.45 118.68 128.52 3gbm s LEU 104 Ca 0.59 -0.46 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 3gbm s LEU 104 Cb -0.30 -1.78 0.00 0.00 0.50 0.00 0.00 46.19 44.61 3gbm s LEU 104 CO 0.30 -0.06 0.00 0.35 -1.32 0.00 0.00 176.35 175.62 3gbm n THR 105 N 4.81 0.00 0.00 3.68 -2.24 -0.49 -3.42 114.28 116.62 3gbm n THR 105 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3gbm n THR 105 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 3gbm n THR 105 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gbm n GLN 108 N 0.00 0.00 -3.17 -0.78 1.13 -1.26 -3.03 117.38 110.27 3gbm n GLN 108 Ca 0.00 0.00 -0.23 0.00 -1.94 0.00 0.00 57.00 54.83 3gbm n GLN 108 Cb 0.00 0.00 -0.00 0.00 0.11 0.00 0.00 30.24 30.35 3gbm n GLN 108 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 3gbm s PRO 109 N -0.31 3.30 -0.37 -1.09 0.04 -1.26 -5.04 135.00 130.27 3gbm s PRO 109 Ca 0.00 -0.39 -0.40 0.00 0.04 0.00 0.00 61.00 60.25 3gbm s PRO 109 Cb 0.00 -2.61 -0.16 0.00 0.04 0.00 0.00 34.50 31.78 3gbm s PRO 109 CO 0.00 -0.05 1.94 1.17 0.04 0.00 0.00 177.00 180.10 3gbm n LYS 110 N -1.94 0.78 -4.29 4.56 3.00 -1.26 -4.77 118.16 114.24 3gbm n LYS 110 Ca -0.02 0.25 -0.34 0.00 -0.00 0.00 0.00 58.31 58.21 3gbm n LYS 110 Cb 0.57 -2.02 -0.13 0.00 0.00 0.00 0.00 35.03 33.45 3gbm n LYS 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3gbm s ALA 111 N 5.09 2.89 0.32 3.14 0.00 0.21 -4.91 121.76 128.51 3gbm s ALA 111 Ca 1.07 -0.95 -0.27 0.00 0.00 0.00 0.00 51.96 51.81 3gbm s ALA 111 Cb -1.14 -1.57 -0.09 0.00 0.00 0.00 0.00 23.12 20.31 3gbm s ALA 111 CO 0.63 -0.00 1.04 0.00 0.00 0.00 0.00 175.76 177.43 3gbm s ALA 112 N 0.75 3.26 0.50 0.00 0.00 -1.26 -1.81 121.76 123.19 3gbm s ALA 112 Ca -0.02 0.75 -0.19 0.00 0.00 0.00 0.00 51.96 52.50 3gbm s ALA 112 Cb -0.15 -3.28 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 3gbm s ALA 112 CO 0.02 -0.10 1.01 -1.25 0.00 0.00 0.00 175.76 175.44 3gbm s PRO 113 N -1.88 3.86 -0.37 0.00 0.04 -1.26 -4.46 135.00 130.92 3gbm s PRO 113 Ca 0.50 1.19 -0.10 0.00 0.04 0.00 0.00 61.00 62.63 3gbm s PRO 113 Cb -0.26 -2.11 0.03 0.00 0.04 0.00 0.00 34.50 32.19 3gbm s PRO 113 CO 0.33 -0.36 0.19 -1.54 0.04 0.00 0.00 177.00 175.66 3gbm s SER 114 N -2.38 5.68 0.28 6.66 1.04 -0.62 -4.94 113.70 119.42 3gbm s SER 114 Ca 0.64 -1.01 -0.12 0.00 0.48 0.00 0.00 55.95 55.93 3gbm s SER 114 Cb -0.13 -2.00 -0.08 0.00 0.10 0.00 0.00 66.02 63.90 3gbm s SER 114 CO 0.23 -0.38 0.64 -0.69 0.98 0.00 0.00 173.24 174.03 3gbm s VAL 115 N 1.53 4.80 -0.30 5.02 1.01 -1.26 -2.11 120.40 129.10 3gbm s VAL 115 Ca 0.02 0.72 0.03 0.00 0.00 0.00 0.00 61.98 62.74 3gbm s VAL 115 Cb -0.19 -3.61 0.17 0.00 0.00 0.00 0.00 36.38 32.74 3gbm s VAL 115 CO 0.06 -0.12 0.46 -0.89 0.00 0.00 0.00 175.10 174.60 3gbm s THR 116 N -1.90 -0.71 -0.26 3.92 2.01 -0.96 -4.98 115.64 112.77 3gbm s THR 116 Ca 0.51 -0.27 -0.15 0.00 0.31 0.00 0.00 61.69 62.08 3gbm s THR 116 Cb -0.11 -0.90 -0.04 0.00 0.01 0.00 0.00 72.50 71.47 3gbm s THR 116 CO 0.19 -0.23 0.39 -0.22 -0.69 0.00 0.00 174.62 174.06 3gbm s LEU 117 N 2.47 4.06 0.09 4.42 2.96 -1.26 -2.16 118.68 129.25 3gbm s LEU 117 Ca 0.11 0.35 0.01 0.00 -0.22 0.00 0.00 54.13 54.38 3gbm s LEU 117 Cb -0.12 -2.46 -0.04 0.00 0.50 0.00 0.00 46.19 44.07 3gbm s LEU 117 CO -0.26 -0.18 0.20 -0.36 -1.32 0.00 0.00 176.35 174.43 3gbm s PHE 118 N 1.98 3.43 0.60 5.38 0.08 0.17 -4.95 117.98 124.68 3gbm s PHE 118 Ca 0.16 0.18 0.04 0.00 0.12 0.00 0.00 56.93 57.43 3gbm s PHE 118 Cb -0.16 -1.70 0.08 0.00 -0.57 0.00 0.00 43.02 40.67 3gbm s PHE 118 CO 0.09 0.56 0.83 -1.25 -0.10 0.00 0.00 175.22 175.35 3gbm s PRO 119 N -2.66 2.21 0.28 0.24 0.04 -1.26 -2.55 135.00 131.31 3gbm s PRO 119 Ca 0.34 -1.18 -0.28 0.00 0.04 0.00 0.00 61.00 59.92 3gbm s PRO 119 Cb -0.12 -2.51 -0.14 0.00 0.04 0.00 0.00 34.50 31.76 3gbm s PRO 119 CO 0.27 -0.95 0.97 -2.30 0.04 0.00 0.00 177.00 175.02 3gbm n PRO 120 N -2.43 1.24 -3.30 0.56 -0.02 -1.18 -4.82 135.00 125.06 3gbm n PRO 120 Ca 0.12 0.44 -0.32 0.00 -2.02 0.00 0.00 63.50 61.72 3gbm n PRO 120 Cb 0.60 -1.78 -0.06 0.00 -0.02 0.00 0.00 33.50 32.25 3gbm n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3gbm s SER 121 N -0.60 6.71 0.28 2.55 1.04 -1.26 -4.99 113.70 117.43 3gbm s SER 121 Ca 0.59 1.08 -0.03 0.00 0.48 0.00 0.00 55.95 58.07 3gbm s SER 121 Cb -0.72 -2.29 0.37 0.00 0.10 0.00 0.00 66.02 63.48 3gbm s SER 121 CO 0.60 -0.11 1.93 0.77 0.98 0.00 0.00 173.24 177.41 3gbm h SER 122 N 2.53 0.99 -0.75 7.02 4.64 -1.99 -1.78 113.55 124.22 3gbm h SER 122 Ca -0.47 -0.05 0.02 0.00 -0.47 0.00 0.00 61.79 60.81 3gbm h SER 122 Cb 1.17 -0.25 -0.04 0.00 -0.31 0.00 0.00 62.40 62.97 3gbm h SER 122 CO 0.67 0.76 0.49 1.05 -0.87 0.00 0.00 176.83 178.93 3gbm h GLU 123 N 1.14 0.96 -0.95 4.77 9.09 -1.98 0.74 114.58 128.35 3gbm h GLU 123 Ca 0.30 -0.06 0.00 0.00 0.05 0.00 0.00 59.36 59.66 3gbm h GLU 123 Cb -0.06 -0.22 -0.05 0.00 -1.65 0.00 0.00 28.75 26.78 3gbm h GLU 123 CO -0.06 0.63 0.61 1.49 0.05 0.00 0.00 179.01 181.74 3gbm h GLU 124 N 0.99 1.27 -0.81 1.06 4.81 -1.77 -2.18 114.58 117.95 3gbm h GLU 124 Ca 0.28 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.38 3gbm h GLU 124 Cb -0.07 -0.28 -0.04 0.00 0.63 0.00 0.00 28.75 28.99 3gbm h GLU 124 CO -0.08 0.86 0.33 -0.07 -0.73 0.00 0.00 179.01 179.32 3gbm h LEU 125 N 1.30 1.10 -1.53 1.64 3.38 -0.19 -1.52 115.31 119.49 3gbm h LEU 125 Ca 0.35 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 58.19 3gbm h LEU 125 Cb -0.12 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.32 3gbm h LEU 125 CO -0.07 0.97 0.36 -0.61 0.09 0.00 0.00 178.44 179.18 3gbm h GLN 126 N 1.17 0.59 -1.51 1.13 5.75 0.74 -2.04 115.11 120.93 3gbm h GLN 126 Ca 0.27 -0.04 -0.51 0.00 -0.15 0.00 0.00 58.65 58.23 3gbm h GLN 126 Cb 0.20 -0.13 -0.20 0.00 1.07 0.00 0.00 27.48 28.42 3gbm h GLN 126 CO -0.02 0.39 0.61 0.00 -2.65 0.00 0.00 178.83 177.16 3gbm n ALA 127 N -2.47 5.88 -3.39 3.38 0.00 -0.60 -4.91 120.51 118.38 3gbm n ALA 127 Ca 0.07 -2.70 -0.20 0.00 0.00 0.00 0.00 53.44 50.61 3gbm n ALA 127 Cb 0.16 -1.70 -0.03 0.00 0.00 0.00 0.00 19.45 17.88 3gbm n ALA 127 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3gbm n ASN 128 N -0.01 -1.75 -4.11 0.00 5.15 -0.77 -4.91 115.26 108.87 3gbm n ASN 128 Ca 0.46 -0.29 -0.09 0.00 -0.60 0.00 0.00 54.58 54.06 3gbm n ASN 128 Cb 0.56 -1.56 -0.10 0.00 -0.53 0.00 0.00 39.78 38.16 3gbm n ASN 128 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 3gbm s LYS 129 N -5.99 0.82 -0.18 1.20 3.01 -1.00 -4.77 119.74 112.83 3gbm s LYS 129 Ca 0.37 -1.34 -0.07 0.00 -1.01 0.00 0.00 55.97 53.92 3gbm s LYS 129 Cb -0.21 0.24 0.08 0.00 -1.01 0.00 0.00 37.83 36.92 3gbm s LYS 129 CO 0.46 -0.22 0.39 0.00 0.51 0.00 0.00 175.35 176.49 3gbm s ALA 130 N -3.99 -1.03 -0.15 5.17 0.00 -1.07 -3.11 121.76 117.57 3gbm s ALA 130 Ca 0.17 1.43 0.02 0.00 0.00 0.00 0.00 51.96 53.58 3gbm s ALA 130 Cb 0.07 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 22.05 3gbm s ALA 130 CO -0.03 -0.59 -0.20 0.99 0.00 0.00 0.00 175.76 175.94 3gbm s THR 131 N 2.21 1.95 -0.12 0.00 2.01 -1.26 -1.28 115.64 119.14 3gbm s THR 131 Ca -0.04 -0.89 -0.17 0.00 0.31 0.00 0.00 61.69 60.90 3gbm s THR 131 Cb -0.11 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 3gbm s THR 131 CO -0.12 0.53 0.44 -0.76 -0.69 0.00 0.00 174.62 174.01 3gbm s LEU 132 N 1.06 4.28 -0.21 4.42 1.02 -0.13 -3.12 118.68 125.98 3gbm s LEU 132 Ca -0.02 0.76 0.02 0.00 0.02 0.00 0.00 54.13 54.90 3gbm s LEU 132 Cb -0.14 -2.63 0.04 0.00 0.02 0.00 0.00 46.19 43.48 3gbm s LEU 132 CO -0.06 0.03 -0.12 -0.69 0.02 0.00 0.00 176.35 175.52 3gbm s VAL 133 N 0.53 1.88 -0.35 -1.59 1.01 -1.06 -1.15 120.40 119.68 3gbm s VAL 133 Ca 0.24 -1.19 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 3gbm s VAL 133 Cb -0.15 -1.92 0.08 0.00 0.00 0.00 0.00 36.38 34.40 3gbm s VAL 133 CO 0.09 0.18 0.09 0.00 0.00 0.00 0.00 175.10 175.46 3gbm s LEU 135 N 1.17 5.48 -0.18 0.00 1.43 -0.92 -0.91 118.68 124.75 3gbm s LEU 135 Ca 0.02 -1.24 -0.09 0.00 -1.03 0.00 0.00 54.13 51.79 3gbm s LEU 135 Cb -0.21 -2.24 -0.05 0.00 0.03 0.00 0.00 46.19 43.72 3gbm s LEU 135 CO -0.03 -0.71 0.12 -0.63 0.23 0.00 0.00 176.35 175.33 3gbm s ILE 136 N 1.87 5.32 0.21 -0.59 1.01 -0.76 -2.28 121.20 125.99 3gbm s ILE 136 Ca 0.07 0.16 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 3gbm s ILE 136 Cb -0.23 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 38.80 3gbm s ILE 136 CO 0.08 0.47 0.23 -0.94 0.00 0.00 0.00 174.94 174.78 3gbm s SER 137 N 0.13 0.08 -1.47 3.58 1.04 -0.90 -0.74 113.70 115.43 3gbm s SER 137 Ca 0.08 -1.25 -0.00 0.00 0.48 0.00 0.00 55.95 55.26 3gbm s SER 137 Cb -0.11 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.44 3gbm s SER 137 CO -0.01 -0.92 0.23 0.47 0.98 0.00 0.00 173.24 173.99 3gbm n ASP 138 N -0.30 0.26 -4.74 7.02 8.00 0.48 -1.59 116.55 125.68 3gbm n ASP 138 Ca 0.01 -1.13 -0.22 0.00 0.71 0.00 0.00 54.79 54.15 3gbm n ASP 138 Cb 0.65 -2.39 -0.06 0.00 -0.02 0.00 0.00 41.12 39.30 3gbm n ASP 138 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 3gbm s PHE 139 N -4.15 2.90 -0.26 1.24 -0.71 -1.03 -4.46 117.98 111.51 3gbm s PHE 139 Ca 0.01 -0.18 -0.19 0.00 -1.04 0.00 0.00 56.93 55.53 3gbm s PHE 139 Cb -0.00 -1.32 0.07 0.00 -1.21 0.00 0.00 43.02 40.55 3gbm s PHE 139 CO 0.94 0.55 0.66 -0.47 -1.34 0.00 0.00 175.22 175.56 3gbm s TYR 140 N -2.24 -0.86 0.62 3.49 6.14 -0.75 -1.27 117.35 122.49 3gbm s TYR 140 Ca 0.33 1.90 -0.16 0.00 0.64 0.00 0.00 57.07 59.78 3gbm s TYR 140 Cb -0.07 0.41 -0.02 0.00 0.42 0.00 0.00 41.96 42.70 3gbm s TYR 140 CO 0.23 -0.43 1.11 -1.25 0.64 0.00 0.00 175.55 175.85 3gbm s PRO 141 N 0.96 2.99 -0.42 4.97 0.04 -1.26 0.67 135.00 142.94 3gbm s PRO 141 Ca -0.05 1.42 -0.03 0.00 0.04 0.00 0.00 61.00 62.39 3gbm s PRO 141 Cb -0.05 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.49 3gbm s PRO 141 CO -0.09 -1.11 1.53 0.41 0.04 0.00 0.00 177.00 177.79 3gbm n GLY 142 N -0.40 2.32 2.76 0.56 0.00 -1.26 -4.74 105.19 104.42 3gbm n GLY 142 Ca 0.10 -0.41 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 3gbm n GLY 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gbm s ALA 143 N 4.08 0.95 -0.02 4.61 0.00 -1.26 -4.81 121.76 125.31 3gbm s ALA 143 Ca 0.19 -0.54 0.02 0.00 0.00 0.00 0.00 51.96 51.64 3gbm s ALA 143 Cb 0.05 -1.05 0.00 0.00 0.00 0.00 0.00 23.12 22.13 3gbm s ALA 143 CO -0.02 -0.94 -0.06 0.14 0.00 0.00 0.00 175.76 174.88 3gbm s VAL 144 N 1.88 0.56 0.31 0.00 -7.23 -1.26 -4.46 120.40 110.20 3gbm s VAL 144 Ca 0.01 -0.25 -0.10 0.00 -1.81 0.00 0.00 61.98 59.83 3gbm s VAL 144 Cb -0.16 -0.51 -0.07 0.00 0.56 0.00 0.00 36.38 36.21 3gbm s VAL 144 CO -0.07 0.18 0.66 0.42 -0.31 0.00 0.00 175.10 175.98 3gbm s THR 145 N 0.18 4.85 -0.06 5.32 -4.23 -0.92 -4.94 115.64 115.84 3gbm s THR 145 Ca -0.02 0.54 -0.01 0.00 -1.18 0.00 0.00 61.69 61.02 3gbm s THR 145 Cb -0.07 -3.67 0.03 0.00 1.34 0.00 0.00 72.50 70.13 3gbm s THR 145 CO -0.00 -0.28 -0.01 -0.69 -0.54 0.00 0.00 174.62 173.10 3gbm s VAL 146 N -2.07 0.40 0.08 2.29 1.01 -1.26 -1.38 120.40 119.47 3gbm s VAL 146 Ca 0.49 0.07 0.09 0.00 0.00 0.00 0.00 61.98 62.63 3gbm s VAL 146 Cb -0.11 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.72 3gbm s VAL 146 CO 0.25 0.25 -0.22 0.00 0.00 0.00 0.00 175.10 175.38 3gbm s ALA 147 N 1.69 2.51 0.12 5.51 0.00 -0.09 -5.00 121.76 126.50 3gbm s ALA 147 Ca 0.01 -1.31 0.06 0.00 0.00 0.00 0.00 51.96 50.72 3gbm s ALA 147 Cb -0.13 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.36 3gbm s ALA 147 CO -0.04 0.56 -0.02 -1.58 0.00 0.00 0.00 175.76 174.68 3gbm s TRP 148 N -0.99 2.89 -0.04 0.00 0.52 -1.26 -0.22 118.94 119.85 3gbm s TRP 148 Ca 0.15 -0.09 0.04 0.00 0.02 0.00 0.00 56.10 56.22 3gbm s TRP 148 Cb -0.10 -1.47 -0.00 0.00 -1.15 0.00 0.00 33.47 30.75 3gbm s TRP 148 CO 0.06 0.48 -0.16 0.15 0.02 0.00 0.00 176.95 177.50 3gbm s LYS 149 N -2.46 1.61 -0.26 4.98 -0.14 -0.56 -1.32 119.74 121.59 3gbm s LYS 149 Ca 0.25 -0.57 -0.10 0.00 -1.36 0.00 0.00 55.97 54.20 3gbm s LYS 149 Cb -0.11 -1.43 -0.04 0.00 -1.68 0.00 0.00 37.83 34.57 3gbm s LYS 149 CO 0.17 0.24 0.15 0.00 -0.76 0.00 0.00 175.35 175.15 3gbm s ALA 150 N -0.01 3.45 0.00 5.17 0.00 0.33 -1.96 121.76 128.75 3gbm s ALA 150 Ca -0.02 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.91 3gbm s ALA 150 Cb -0.10 -2.31 0.00 0.00 0.00 0.00 0.00 23.12 20.71 3gbm s ALA 150 CO 0.02 -0.39 0.00 -0.25 0.00 0.00 0.00 175.76 175.13 3gbm n ASP 151 N 4.72 0.00 -0.45 0.00 8.00 0.71 -0.93 116.55 128.61 3gbm n ASP 151 Ca -0.15 0.00 0.14 0.00 0.71 0.00 0.00 54.79 55.49 3gbm n ASP 151 Cb 0.52 0.00 0.54 0.00 -0.02 0.00 0.00 41.12 42.16 3gbm n ASP 151 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3gbm n SER 152 N 4.77 1.41 -4.43 -2.24 3.41 -1.26 -4.72 113.62 110.56 3gbm n SER 152 Ca 0.00 -1.45 -0.28 0.00 -0.26 0.00 0.00 58.87 56.88 3gbm n SER 152 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.84 3gbm n SER 152 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3gbm s SER 153 N -2.02 3.52 0.54 4.04 1.04 -0.10 -5.04 113.70 115.67 3gbm s SER 153 Ca 0.38 -0.76 -0.18 0.00 0.48 0.00 0.00 55.95 55.88 3gbm s SER 153 Cb 0.21 -0.32 -0.06 0.00 0.10 0.00 0.00 66.02 65.95 3gbm s SER 153 CO 0.34 0.15 1.04 -2.16 0.98 0.00 0.00 173.24 173.59 3gbm s PRO 154 N -2.38 3.61 -0.10 4.02 0.04 -1.26 0.12 135.00 139.05 3gbm s PRO 154 Ca 0.18 1.24 0.01 0.00 0.04 0.00 0.00 61.00 62.46 3gbm s PRO 154 Cb -0.09 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.40 3gbm s PRO 154 CO 0.09 -0.58 -0.10 0.14 0.04 0.00 0.00 177.00 176.59 3gbm s VAL 155 N -2.27 1.15 -0.14 -0.36 -7.23 -0.44 -4.62 120.40 106.48 3gbm s VAL 155 Ca 0.65 -0.40 0.18 0.00 -1.81 0.00 0.00 61.98 60.59 3gbm s VAL 155 Cb -0.15 -1.11 -0.26 0.00 0.56 0.00 0.00 36.38 35.42 3gbm s VAL 155 CO 0.29 0.38 0.17 2.29 -0.31 0.00 0.00 175.10 177.92 3gbm n LYS 156 N 4.57 0.84 -1.91 4.82 2.85 -1.26 -4.13 118.16 123.94 3gbm n LYS 156 Ca -0.16 -0.06 -0.42 0.00 -1.05 0.00 0.00 58.31 56.62 3gbm n LYS 156 Cb 0.51 -1.48 -0.03 0.00 -0.65 0.00 0.00 35.03 33.38 3gbm n LYS 156 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3gbm s ALA 157 N -2.73 3.79 0.00 0.58 0.00 -1.26 -3.54 121.76 118.60 3gbm s ALA 157 Ca -0.09 1.40 0.00 0.00 0.00 0.00 0.00 51.96 53.27 3gbm s ALA 157 Cb 0.08 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.57 3gbm s ALA 157 CO 0.79 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 176.16 3gbm n GLY 158 N 3.63 0.43 3.83 0.00 0.00 -1.26 -4.81 105.19 107.01 3gbm n GLY 158 Ca 0.13 -0.85 -0.37 0.00 0.00 0.00 0.00 46.02 44.94 3gbm n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gbm s VAL 159 N -2.00 5.36 -0.26 1.61 1.01 -1.23 -1.42 120.40 123.46 3gbm s VAL 159 Ca 0.00 0.40 -0.02 0.00 0.00 0.00 0.00 61.98 62.36 3gbm s VAL 159 Cb 0.00 -3.51 0.09 0.00 0.00 0.00 0.00 36.38 32.95 3gbm s VAL 159 CO 0.00 0.56 0.08 -1.61 0.00 0.00 0.00 175.10 174.13 3gbm s GLU 160 N -0.68 0.57 -0.15 2.72 0.41 -0.74 -4.99 118.70 115.83 3gbm s GLU 160 Ca 0.16 -0.71 -0.07 0.00 -0.41 0.00 0.00 54.97 53.95 3gbm s GLU 160 Cb -0.13 -1.85 -0.04 0.00 -1.78 0.00 0.00 34.13 30.33 3gbm s GLU 160 CO 0.05 -0.87 0.09 0.99 -0.49 0.00 0.00 175.26 175.03 3gbm s THR 161 N 1.81 5.04 0.69 3.63 2.01 -1.26 -1.84 115.64 125.72 3gbm s THR 161 Ca 0.06 0.04 -0.11 0.00 0.31 0.00 0.00 61.69 61.99 3gbm s THR 161 Cb -0.17 -3.22 0.00 0.00 0.01 0.00 0.00 72.50 69.12 3gbm s THR 161 CO -0.21 0.54 1.08 0.42 -0.69 0.00 0.00 174.62 175.75 3gbm s THR 162 N -0.33 3.79 0.71 -0.82 -4.23 -0.15 -5.01 115.64 109.61 3gbm s THR 162 Ca 0.10 0.58 -0.13 0.00 -1.18 0.00 0.00 61.69 61.06 3gbm s THR 162 Cb -0.12 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 70.18 3gbm s THR 162 CO 0.01 -0.76 1.10 0.42 -0.54 0.00 0.00 174.62 174.85 3gbm s THR 163 N -3.30 3.31 0.78 3.99 -4.23 -1.26 -4.60 115.64 110.32 3gbm s THR 163 Ca 0.57 0.52 -0.11 0.00 -1.18 0.00 0.00 61.69 61.49 3gbm s THR 163 Cb -0.11 -3.03 0.06 0.00 1.34 0.00 0.00 72.50 70.76 3gbm s THR 163 CO 0.52 -0.46 1.11 -2.16 -0.54 0.00 0.00 174.62 173.09 3gbm s PRO 164 N -4.47 2.12 -0.25 3.99 0.04 -1.26 -4.70 135.00 130.46 3gbm s PRO 164 Ca 0.64 1.28 -0.03 0.00 0.04 0.00 0.00 61.00 62.94 3gbm s PRO 164 Cb -0.19 -1.87 0.14 0.00 0.04 0.00 0.00 34.50 32.62 3gbm s PRO 164 CO 0.48 -1.76 0.44 0.45 0.04 0.00 0.00 177.00 176.65 3gbm s SER 165 N -3.11 -0.22 0.04 6.66 0.15 -0.54 -4.92 113.70 111.75 3gbm s SER 165 Ca 0.63 0.49 -0.38 0.00 0.70 0.00 0.00 55.95 57.40 3gbm s SER 165 Cb -0.19 1.41 -0.17 0.00 -1.71 0.00 0.00 66.02 65.36 3gbm s SER 165 CO 0.54 -0.28 1.33 2.29 1.20 0.00 0.00 173.24 178.32 3gbm n LYS 166 N 5.38 0.95 -2.94 5.44 0.00 -1.26 -2.66 118.16 123.07 3gbm n LYS 166 Ca -0.04 0.34 -0.18 0.00 -0.00 0.00 0.00 58.31 58.43 3gbm n LYS 166 Cb 0.50 -1.97 0.03 0.00 -0.00 0.00 0.00 35.03 33.59 3gbm n LYS 166 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.40 176.75 3gbm s GLN 167 N 0.65 2.66 0.51 -1.58 -0.21 -0.07 -4.96 119.66 116.66 3gbm s GLN 167 Ca 0.87 -1.23 0.20 0.00 0.02 0.00 0.00 55.36 55.21 3gbm s GLN 167 Cb -1.02 -2.69 1.27 0.00 1.00 0.00 0.00 33.01 31.58 3gbm s GLN 167 CO 0.50 -0.47 2.04 0.77 -2.12 0.00 0.00 175.29 176.01 3gbm h SER 168 N 0.44 0.08 -0.55 5.90 0.02 -1.94 -1.47 113.55 116.03 3gbm h SER 168 Ca -0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 3gbm h SER 168 Cb 1.28 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.81 3gbm h SER 168 CO 0.45 0.05 0.00 -0.46 -1.14 0.00 0.00 176.83 175.73 3gbm n ASN 169 N -4.45 5.25 -0.81 3.07 6.94 -1.26 -4.96 115.26 119.05 3gbm n ASN 169 Ca 0.06 -2.78 -0.11 0.00 -0.02 0.00 0.00 54.58 51.73 3gbm n ASN 169 Cb 0.39 -0.65 -0.05 0.00 -2.36 0.00 0.00 39.78 37.11 3gbm n ASN 169 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 3gbm n ASN 170 N 0.69 -5.04 -3.07 0.53 3.02 -0.55 -5.00 115.26 105.83 3gbm n ASN 170 Ca 0.26 0.26 -0.07 0.00 -0.03 0.00 0.00 54.58 55.00 3gbm n ASN 170 Cb 1.08 -3.47 0.02 0.00 -0.61 0.00 0.00 39.78 36.80 3gbm n ASN 170 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3gbm n LYS 172 N -1.68 0.86 -4.55 3.52 5.02 -1.26 -4.86 118.16 115.22 3gbm n LYS 172 Ca -0.11 -1.14 -0.26 0.00 -2.02 0.00 0.00 58.31 54.79 3gbm n LYS 172 Cb 0.48 -0.08 -0.11 0.00 -0.02 0.00 0.00 35.03 35.30 3gbm n LYS 172 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 3gbm s TYR 173 N -0.32 2.38 0.16 2.13 1.51 -0.39 -0.89 117.35 121.92 3gbm s TYR 173 Ca 0.22 -0.56 -0.07 0.00 -1.01 0.00 0.00 57.07 55.65 3gbm s TYR 173 Cb -0.02 -1.44 -0.02 0.00 -0.11 0.00 0.00 41.96 40.38 3gbm s TYR 173 CO 0.14 0.52 0.24 0.00 -1.11 0.00 0.00 175.55 175.34 3gbm s ALA 174 N -2.68 0.21 0.07 3.71 0.00 -1.09 -0.39 121.76 121.59 3gbm s ALA 174 Ca 0.33 -1.03 -0.27 0.00 0.00 0.00 0.00 51.96 50.98 3gbm s ALA 174 Cb 0.04 0.89 0.09 0.00 0.00 0.00 0.00 23.12 24.14 3gbm s ALA 174 CO 0.16 -0.62 1.01 0.00 0.00 0.00 0.00 175.76 176.31 3gbm s ALA 175 N -3.99 -1.81 -0.08 0.00 0.00 0.08 -1.47 121.76 114.48 3gbm s ALA 175 Ca 0.20 0.51 -0.09 0.00 0.00 0.00 0.00 51.96 52.57 3gbm s ALA 175 Cb 0.04 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.68 3gbm s ALA 175 CO 0.01 -0.94 0.25 -1.12 0.00 0.00 0.00 175.76 173.97 3gbm s SER 176 N -2.80 -0.24 0.03 0.00 0.01 -1.26 -1.82 113.70 107.61 3gbm s SER 176 Ca 0.11 0.44 0.07 0.00 1.31 0.00 0.00 55.95 57.88 3gbm s SER 176 Cb -0.00 0.49 -0.02 0.00 0.21 0.00 0.00 66.02 66.70 3gbm s SER 176 CO -0.02 -0.13 -0.21 -0.55 0.41 0.00 0.00 173.24 172.74 3gbm s SER 177 N -0.06 2.49 -0.15 2.44 0.15 -0.09 -0.97 113.70 117.50 3gbm s SER 177 Ca -0.02 -0.48 -0.01 0.00 0.70 0.00 0.00 55.95 56.14 3gbm s SER 177 Cb -0.02 -0.23 0.04 0.00 -1.71 0.00 0.00 66.02 64.10 3gbm s SER 177 CO 0.01 0.19 -0.05 -0.31 1.20 0.00 0.00 173.24 174.28 3gbm s TYR 178 N -0.71 1.53 -0.20 3.44 1.51 -0.77 -0.63 117.35 121.53 3gbm s TYR 178 Ca 0.08 -0.92 -0.11 0.00 -1.01 0.00 0.00 57.07 55.11 3gbm s TYR 178 Cb -0.09 -1.24 -0.05 0.00 -0.11 0.00 0.00 41.96 40.47 3gbm s TYR 178 CO 0.01 -0.57 0.17 -1.17 -1.11 0.00 0.00 175.55 172.88 3gbm s LEU 179 N 1.69 4.19 -0.13 -1.29 2.96 -0.30 -1.80 118.68 123.99 3gbm s LEU 179 Ca 0.02 0.25 -0.06 0.00 -0.22 0.00 0.00 54.13 54.12 3gbm s LEU 179 Cb -0.14 -2.15 -0.04 0.00 0.50 0.00 0.00 46.19 44.36 3gbm s LEU 179 CO -0.08 0.13 0.07 -0.44 -1.32 0.00 0.00 176.35 174.72 3gbm s SER 180 N 0.57 5.78 0.07 3.68 0.01 -0.51 -0.96 113.70 122.35 3gbm s SER 180 Ca 0.09 0.23 -0.08 0.00 1.31 0.00 0.00 55.95 57.51 3gbm s SER 180 Cb -0.12 -1.85 -0.01 0.00 0.21 0.00 0.00 66.02 64.25 3gbm s SER 180 CO 0.01 0.31 0.16 -0.76 0.41 0.00 0.00 173.24 173.37 3gbm s LEU 181 N -0.47 1.57 0.50 2.44 1.43 -0.40 -4.70 118.68 119.04 3gbm s LEU 181 Ca 0.10 -0.64 -0.14 0.00 -1.03 0.00 0.00 54.13 52.42 3gbm s LEU 181 Cb -0.12 0.90 -0.07 0.00 0.03 0.00 0.00 46.19 46.93 3gbm s LEU 181 CO 0.02 -0.67 0.94 0.42 0.23 0.00 0.00 176.35 177.28 3gbm s THR 182 N -3.58 4.61 0.19 5.49 -4.23 -1.26 -2.61 115.64 114.26 3gbm s THR 182 Ca 0.03 1.03 -0.12 0.00 -1.18 0.00 0.00 61.69 61.45 3gbm s THR 182 Cb 0.04 -3.74 0.13 0.00 1.34 0.00 0.00 72.50 70.26 3gbm s THR 182 CO -0.09 -0.70 1.71 -0.65 -0.54 0.00 0.00 174.62 174.34 3gbm h PRO 183 N 0.86 0.21 -0.61 3.99 0.11 -1.86 -2.33 132.00 132.38 3gbm h PRO 183 Ca -0.47 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.72 3gbm h PRO 183 Cb 1.19 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.18 3gbm h PRO 183 CO 0.62 0.14 0.25 0.93 -0.21 0.00 0.00 178.00 179.73 3gbm h GLU 184 N 0.22 0.44 -0.74 1.05 3.07 -1.98 0.39 114.58 117.02 3gbm h GLU 184 Ca 0.27 -0.03 0.06 0.00 -0.50 0.00 0.00 59.36 59.16 3gbm h GLU 184 Cb 0.37 -0.10 -0.06 0.00 -0.84 0.00 0.00 28.75 28.13 3gbm h GLU 184 CO -0.36 0.29 0.43 1.96 -1.40 0.00 0.00 179.01 179.93 3gbm h GLN 185 N 0.45 0.77 0.01 2.33 4.20 -1.90 -0.08 115.11 120.89 3gbm h GLN 185 Ca 0.30 -0.05 -0.20 0.00 0.06 0.00 0.00 58.65 58.77 3gbm h GLN 185 Cb 0.34 -0.17 0.02 0.00 0.30 0.00 0.00 27.48 27.96 3gbm h GLN 185 CO -0.28 0.51 -0.77 2.35 -0.67 0.00 0.00 178.83 179.97 3gbm h TRP 186 N 0.79 0.75 -0.68 2.96 2.91 -0.56 -3.20 115.95 118.92 3gbm h TRP 186 Ca 0.33 -0.42 -0.08 0.00 1.13 0.00 0.00 58.89 59.85 3gbm h TRP 186 Cb 0.19 -0.08 -0.03 0.00 -0.51 0.00 0.00 29.16 28.73 3gbm h TRP 186 CO -0.06 1.25 0.12 0.87 -1.03 0.00 0.00 178.44 179.59 3gbm h LYS 187 N 0.04 1.11 0.00 2.65 1.79 -0.29 -3.28 116.57 118.60 3gbm h LYS 187 Ca -0.10 -0.29 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 3gbm h LYS 187 Cb 1.47 -0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.99 3gbm h LYS 187 CO 0.15 1.01 0.00 -1.13 -1.08 0.00 0.00 179.45 178.40 3gbm n SER 188 N -4.22 0.00 -4.89 0.86 3.41 -0.05 -4.83 113.62 103.90 3gbm n SER 188 Ca 0.05 0.43 -0.21 0.00 -0.26 0.00 0.00 58.87 58.88 3gbm n SER 188 Cb 0.29 -0.47 -0.03 0.00 -0.26 0.00 0.00 64.21 63.73 3gbm n SER 188 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3gbm s HIS 189 N -2.95 3.21 -0.02 7.33 3.76 -1.21 -5.04 115.29 120.37 3gbm s HIS 189 Ca 0.12 -0.11 -0.21 0.00 -0.15 0.00 0.00 55.06 54.71 3gbm s HIS 189 Cb 0.15 -1.56 -0.13 0.00 1.11 0.00 0.00 32.58 32.14 3gbm s HIS 189 CO 0.40 0.41 0.94 -0.09 -0.85 0.00 0.00 174.74 175.55 3gbm h ARG 190 N 1.30 -0.50 -3.66 1.40 2.43 -1.89 -3.44 114.38 110.01 3gbm h ARG 190 Ca -0.49 0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.64 3gbm h ARG 190 Cb 1.24 0.11 -0.12 0.00 -0.42 0.00 0.00 29.97 30.78 3gbm h ARG 190 CO 0.60 -0.20 -0.22 -1.54 -1.51 0.00 0.00 179.97 177.10 3gbm s SER 191 N -5.00 -0.05 -0.03 -3.80 1.04 -1.26 -4.50 113.70 100.10 3gbm s SER 191 Ca -0.12 -0.63 0.03 0.00 0.48 0.00 0.00 55.95 55.70 3gbm s SER 191 Cb 0.01 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.58 3gbm s SER 191 CO 0.41 -0.87 -0.10 -0.31 0.98 0.00 0.00 173.24 173.35 3gbm s TYR 192 N -3.89 1.04 -0.04 5.02 1.51 -0.62 -0.21 117.35 120.16 3gbm s TYR 192 Ca 0.10 -0.27 0.03 0.00 -1.01 0.00 0.00 57.07 55.92 3gbm s TYR 192 Cb 0.03 -0.74 0.01 0.00 -0.11 0.00 0.00 41.96 41.14 3gbm s TYR 192 CO -0.06 -0.11 -0.12 -1.12 -1.11 0.00 0.00 175.55 173.04 3gbm s SER 193 N 0.17 1.59 -0.33 2.29 0.01 -0.83 -1.07 113.70 115.53 3gbm s SER 193 Ca -0.03 -0.26 -0.17 0.00 1.31 0.00 0.00 55.95 56.80 3gbm s SER 193 Cb -0.09 -0.55 -0.01 0.00 0.21 0.00 0.00 66.02 65.58 3gbm s SER 193 CO 0.01 0.07 0.47 0.00 0.41 0.00 0.00 173.24 174.19 3gbm s GLN 195 N 2.27 3.84 -0.16 0.00 -0.21 0.70 -1.40 119.66 124.70 3gbm s GLN 195 Ca 0.17 -0.09 -0.01 0.00 0.02 0.00 0.00 55.36 55.45 3gbm s GLN 195 Cb -0.16 -3.30 0.04 0.00 1.00 0.00 0.00 33.01 30.59 3gbm s GLN 195 CO 0.12 0.54 -0.05 0.08 -2.12 0.00 0.00 175.29 173.87 3gbm s VAL 196 N -0.37 1.02 -0.02 1.09 1.01 -0.66 -0.91 120.40 121.57 3gbm s VAL 196 Ca 0.13 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.59 3gbm s VAL 196 Cb -0.12 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 3gbm s VAL 196 CO 0.03 0.15 -0.02 -0.89 0.00 0.00 0.00 175.10 174.36 3gbm s THR 197 N 1.67 3.99 -0.27 3.92 2.01 -0.48 -1.54 115.64 124.95 3gbm s THR 197 Ca 0.01 -0.60 -0.05 0.00 0.31 0.00 0.00 61.69 61.37 3gbm s THR 197 Cb -0.15 -2.75 0.15 0.00 0.01 0.00 0.00 72.50 69.76 3gbm s THR 197 CO -0.08 0.43 0.54 -2.28 -0.69 0.00 0.00 174.62 172.54 3gbm s HIS 198 N -1.01 -1.25 -1.47 4.92 5.04 -0.95 -2.15 115.29 118.41 3gbm s HIS 198 Ca 0.18 1.72 -0.08 0.00 -1.54 0.00 0.00 55.06 55.33 3gbm s HIS 198 Cb -0.11 0.50 0.05 0.00 0.04 0.00 0.00 32.58 33.06 3gbm s HIS 198 CO 0.08 -0.72 0.76 0.39 -2.34 0.00 0.00 174.74 172.91 3gbm n GLU 199 N 5.42 -4.58 -1.25 2.88 -0.58 -1.26 -1.82 120.64 119.46 3gbm n GLU 199 Ca -0.06 0.53 -0.09 0.00 -0.42 0.00 0.00 57.16 57.13 3gbm n GLU 199 Cb 0.50 -5.15 -0.04 0.00 -0.57 0.00 0.00 31.44 26.18 3gbm n GLU 199 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3gbm n GLY 200 N -1.68 0.96 3.24 0.62 0.00 -1.26 -4.99 105.19 102.07 3gbm n GLY 200 Ca -0.13 -0.23 -0.36 0.00 0.00 0.00 0.00 46.02 45.31 3gbm n GLY 200 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gbm s SER 203 N -2.53 4.73 -0.13 1.61 0.01 -0.75 -5.10 113.70 111.55 3gbm s SER 203 Ca 0.00 -0.94 -0.20 0.00 1.31 0.00 0.00 55.95 56.12 3gbm s SER 203 Cb 0.00 -1.75 -0.04 0.00 0.21 0.00 0.00 66.02 64.45 3gbm s SER 203 CO 0.00 -0.19 0.54 -0.89 0.41 0.00 0.00 173.24 173.11 3gbm s THR 204 N 1.36 5.13 0.20 1.44 2.01 -1.26 -2.25 115.64 122.26 3gbm s THR 204 Ca -0.01 1.07 0.05 0.00 0.31 0.00 0.00 61.69 63.11 3gbm s THR 204 Cb -0.18 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.42 3gbm s THR 204 CO -0.01 0.26 0.26 -0.69 -0.69 0.00 0.00 174.62 173.74 3gbm s VAL 205 N 0.99 4.96 -0.19 3.82 1.01 -0.59 -4.99 120.40 125.42 3gbm s VAL 205 Ca 0.28 -0.99 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 3gbm s VAL 205 Cb -0.16 -3.62 0.09 0.00 0.00 0.00 0.00 36.38 32.70 3gbm s VAL 205 CO 0.12 -0.21 0.34 -0.70 0.00 0.00 0.00 175.10 174.65 3gbm s GLU 206 N -3.53 0.26 0.03 2.72 2.12 -1.26 -1.65 118.70 117.38 3gbm s GLU 206 Ca 0.33 0.77 0.01 0.00 0.36 0.00 0.00 54.97 56.44 3gbm s GLU 206 Cb -0.10 -0.08 -0.04 0.00 0.26 0.00 0.00 34.13 34.17 3gbm s GLU 206 CO 0.27 -0.38 0.10 0.15 -0.54 0.00 0.00 175.26 174.86 3gbm s LYS 207 N 2.51 3.07 0.08 4.30 -0.14 -0.49 -4.96 119.74 124.11 3gbm s LYS 207 Ca 0.03 -0.53 0.06 0.00 -1.36 0.00 0.00 55.97 54.17 3gbm s LYS 207 Cb -0.13 -2.85 -0.03 0.00 -1.68 0.00 0.00 37.83 33.14 3gbm s LYS 207 CO -0.12 0.62 -0.16 0.99 -0.76 0.00 0.00 175.35 175.92 3gbm s THR 208 N -1.29 1.26 0.05 2.17 2.01 -1.26 -0.30 115.64 118.28 3gbm s THR 208 Ca 0.26 -1.40 -0.02 0.00 0.31 0.00 0.00 61.69 60.85 3gbm s THR 208 Cb -0.12 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 3gbm s THR 208 CO 0.18 -0.21 -0.01 0.68 -0.69 0.00 0.00 174.62 174.57 3gbm s VAL 209 N -1.33 0.21 -0.00 3.82 -7.23 -0.23 -4.98 120.40 110.64 3gbm s VAL 209 Ca 0.01 -1.72 -0.14 0.00 -1.81 0.00 0.00 61.98 58.32 3gbm s VAL 209 Cb -0.10 -1.44 0.02 0.00 0.56 0.00 0.00 36.38 35.42 3gbm s VAL 209 CO 0.03 -0.95 0.29 0.00 -0.31 0.00 0.00 175.10 174.16 3gbm s ALA 210 N -3.79 -0.71 -0.42 1.32 0.00 -1.26 -1.59 121.76 115.32 3gbm s ALA 210 Ca 0.06 0.22 -0.28 0.00 0.00 0.00 0.00 51.96 51.95 3gbm s ALA 210 Cb 0.07 0.12 -0.08 0.00 0.00 0.00 0.00 23.12 23.23 3gbm s ALA 210 CO -0.10 -0.28 2.35 -2.30 0.00 0.00 0.00 175.76 175.43 3gbm n PRO 211 N 1.19 1.27 -2.58 0.00 -0.02 -1.26 -2.66 135.00 130.94 3gbm n PRO 211 Ca -0.21 0.21 -0.06 0.00 -2.02 0.00 0.00 63.50 61.42 3gbm n PRO 211 Cb 0.56 -3.12 -0.02 0.00 -0.02 0.00 0.00 33.50 30.90 3gbm n PRO 211 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3gbm n THR 212 N 7.79 -0.12 -0.17 3.45 -2.24 -1.26 -5.11 114.28 116.62 3gbm n THR 212 Ca 0.37 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 3gbm n THR 212 Cb 0.44 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 3gbm n THR 212 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71