#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qbm s ILE 2 N 0.00 4.23 0.00 2.12 1.01 -1.26 -4.93 121.20 122.37 1qbm s ILE 2 Ca 0.00 -0.25 0.06 0.00 0.00 0.00 0.00 60.65 60.46 1qbm s ILE 2 Cb 0.00 -2.83 -0.02 0.00 0.01 0.00 0.00 42.46 39.62 1qbm s ILE 2 CO 0.00 0.53 -0.20 0.00 0.00 0.00 0.00 174.94 175.27 1qbm s GLN 3 N -0.12 1.51 -0.19 2.79 0.00 -1.26 -4.62 119.66 117.77 1qbm s GLN 3 Ca 0.04 -0.76 -0.13 0.00 -0.00 0.00 0.00 55.36 54.51 1qbm s GLN 3 Cb -0.13 -1.50 -0.05 0.00 0.00 0.00 0.00 33.01 31.33 1qbm s GLN 3 CO 0.02 0.40 0.27 -1.64 0.00 0.00 0.00 175.29 174.35 1qbm s MET 4 N -0.65 4.19 -0.51 9.60 -1.94 -1.26 0.93 119.30 129.67 1qbm s MET 4 Ca 0.07 0.01 -0.09 0.00 -1.71 0.00 0.00 55.69 53.98 1qbm s MET 4 Cb -0.08 -3.48 0.13 0.00 2.01 0.00 0.00 34.83 33.42 1qbm s MET 4 CO -0.00 0.14 0.38 0.99 -0.01 0.00 0.00 175.02 176.52 1qbm s THR 5 N 0.78 4.21 0.28 2.05 2.01 0.10 -4.35 115.64 120.73 1qbm s THR 5 Ca 0.14 -1.97 -0.28 0.00 0.31 0.00 0.00 61.69 59.89 1qbm s THR 5 Cb -0.13 -3.76 -0.09 0.00 0.01 0.00 0.00 72.50 68.52 1qbm s THR 5 CO 0.04 -0.80 0.98 -1.58 -0.69 0.00 0.00 174.62 172.57 1qbm s GLN 6 N 1.12 4.69 -0.11 4.92 0.74 -1.26 -1.35 119.66 128.40 1qbm s GLN 6 Ca 0.08 1.50 -0.09 0.00 0.05 0.00 0.00 55.36 56.90 1qbm s GLN 6 Cb -0.24 -3.07 0.03 0.00 1.10 0.00 0.00 33.01 30.83 1qbm s GLN 6 CO -0.02 0.34 0.28 0.45 -0.55 0.00 0.00 175.29 175.80 1qbm s SER 7 N -1.28 -0.30 0.50 6.67 0.15 0.99 -4.55 113.70 115.87 1qbm s SER 7 Ca 0.46 0.58 -0.03 0.00 0.70 0.00 0.00 55.95 57.66 1qbm s SER 7 Cb -0.25 0.56 -0.01 0.00 -1.71 0.00 0.00 66.02 64.61 1qbm s SER 7 CO 0.31 -0.12 0.77 -2.16 1.20 0.00 0.00 173.24 173.24 1qbm s PRO 8 N 0.43 3.17 0.22 5.44 0.04 -1.26 0.56 135.00 143.59 1qbm s PRO 8 Ca -0.02 -0.14 -0.05 0.00 0.04 0.00 0.00 61.00 60.83 1qbm s PRO 8 Cb -0.04 -2.42 0.19 0.00 0.04 0.00 0.00 34.50 32.27 1qbm s PRO 8 CO -0.02 -0.37 1.66 0.00 0.04 0.00 0.00 177.00 178.31 1qbm h ALA 9 N 0.19 0.91 -3.30 8.56 0.00 -1.80 -3.39 119.26 120.43 1qbm h ALA 9 Ca -0.46 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 53.80 1qbm h ALA 9 Cb 1.24 -0.18 -0.22 0.00 0.00 0.00 0.00 17.79 18.63 1qbm h ALA 9 CO 0.60 0.63 -0.75 0.45 0.00 0.00 0.00 179.25 180.18 1qbm s SER 10 N -6.70 1.02 -0.13 0.00 0.15 -1.26 -0.50 113.70 106.29 1qbm s SER 10 Ca -0.10 -0.52 -0.05 0.00 0.70 0.00 0.00 55.95 55.98 1qbm s SER 10 Cb 0.13 0.00 0.06 0.00 -1.71 0.00 0.00 66.02 64.51 1qbm s SER 10 CO 0.84 -0.15 0.27 -0.22 1.20 0.00 0.00 173.24 175.18 1qbm s LEU 11 N -1.47 -0.08 -0.14 3.45 0.20 0.17 -4.86 118.68 115.96 1qbm s LEU 11 Ca -0.07 0.60 -0.12 0.00 0.69 0.00 0.00 54.13 55.23 1qbm s LEU 11 Cb -0.09 0.76 -0.05 0.00 -0.43 0.00 0.00 46.19 46.38 1qbm s LEU 11 CO 0.01 -0.21 0.26 -0.44 -0.29 0.00 0.00 176.35 175.67 1qbm s SER 12 N 2.02 6.44 0.32 3.68 0.01 -1.26 -0.92 113.70 123.99 1qbm s SER 12 Ca -0.03 0.52 0.03 0.00 1.31 0.00 0.00 55.95 57.78 1qbm s SER 12 Cb -0.11 -2.16 -0.01 0.00 0.21 0.00 0.00 66.02 63.95 1qbm s SER 12 CO -0.09 0.20 0.37 0.00 0.41 0.00 0.00 173.24 174.12 1qbm n ALA 13 N 3.05 0.16 -2.42 1.44 0.00 0.70 -4.76 120.51 118.68 1qbm n ALA 13 Ca -0.14 -1.67 -0.09 0.00 0.00 0.00 0.00 53.44 51.53 1qbm n ALA 13 Cb 0.52 1.35 -0.10 0.00 0.00 0.00 0.00 19.45 21.22 1qbm n ALA 13 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1qbm s SER 14 N -3.11 0.59 0.18 0.00 1.04 -1.26 -0.17 113.70 110.96 1qbm s SER 14 Ca 0.32 -0.82 -0.33 0.00 0.48 0.00 0.00 55.95 55.60 1qbm s SER 14 Cb 0.00 0.14 -0.15 0.00 0.10 0.00 0.00 66.02 66.12 1qbm s SER 14 CO 0.23 -0.45 1.41 0.52 0.98 0.00 0.00 173.24 175.92 1qbm n VAL 15 N 0.61 0.47 0.00 5.02 0.31 -1.26 -0.97 118.33 122.51 1qbm n VAL 15 Ca -0.17 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 1qbm n VAL 15 Cb 0.59 -1.27 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 1qbm n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qbm n GLY 16 N 2.59 1.90 3.85 2.92 0.00 0.52 -4.91 105.19 112.06 1qbm n GLY 16 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.86 1qbm n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qbm s GLU 17 N -0.88 3.48 0.03 1.61 2.12 -0.14 -4.43 118.70 120.48 1qbm s GLU 17 Ca 0.00 0.86 0.03 0.00 0.36 0.00 0.00 54.97 56.22 1qbm s GLU 17 Cb 0.00 -2.06 -0.04 0.00 0.26 0.00 0.00 34.13 32.29 1qbm s GLU 17 CO 0.00 -0.67 -0.04 0.99 -0.54 0.00 0.00 175.26 175.00 1qbm s THR 18 N -3.02 3.80 -0.08 -1.70 2.01 -1.22 -0.56 115.64 114.87 1qbm s THR 18 Ca 0.57 -0.82 -0.11 0.00 0.31 0.00 0.00 61.69 61.64 1qbm s THR 18 Cb -0.12 -2.70 0.03 0.00 0.01 0.00 0.00 72.50 69.72 1qbm s THR 18 CO 0.50 0.32 0.29 -0.69 -0.69 0.00 0.00 174.62 174.35 1qbm s VAL 19 N -1.09 0.02 -0.05 3.82 1.01 -0.05 -4.96 120.40 119.10 1qbm s VAL 19 Ca 0.19 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.03 1qbm s VAL 19 Cb -0.11 -0.48 0.01 0.00 0.00 0.00 0.00 36.38 35.80 1qbm s VAL 19 CO 0.10 -0.10 -0.13 0.42 0.00 0.00 0.00 175.10 175.40 1qbm s THR 20 N -0.34 1.18 -0.03 3.92 -4.23 -1.25 0.21 115.64 115.10 1qbm s THR 20 Ca -0.05 -0.54 0.04 0.00 -1.18 0.00 0.00 61.69 59.96 1qbm s THR 20 Cb -0.03 -1.05 -0.03 0.00 1.34 0.00 0.00 72.50 72.72 1qbm s THR 20 CO 0.01 0.36 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.69 1qbm s ILE 21 N 0.40 3.13 0.25 2.99 1.01 0.17 -4.84 121.20 124.31 1qbm s ILE 21 Ca -0.10 -0.78 0.12 0.00 0.00 0.00 0.00 60.65 59.89 1qbm s ILE 21 Cb -0.13 -2.26 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 1qbm s ILE 21 CO 0.03 0.53 -0.21 0.42 0.00 0.00 0.00 174.94 175.72 1qbm s THR 22 N -0.79 2.47 -0.05 2.92 -4.23 0.19 -0.48 115.64 115.67 1qbm s THR 22 Ca 0.13 -2.29 -0.02 0.00 -1.18 0.00 0.00 61.69 58.33 1qbm s THR 22 Cb -0.11 -2.26 0.04 0.00 1.34 0.00 0.00 72.50 71.51 1qbm s THR 22 CO 0.02 -0.32 0.10 0.00 -0.54 0.00 0.00 174.62 173.88 1qbm s ARG 24 N 1.58 3.05 0.43 0.00 3.52 -0.46 -1.11 118.95 125.96 1qbm s ARG 24 Ca -0.04 -0.83 -0.23 0.00 -0.13 0.00 0.00 55.73 54.51 1qbm s ARG 24 Cb -0.12 -2.92 -0.08 0.00 -1.56 0.00 0.00 34.95 30.26 1qbm s ARG 24 CO -0.05 -0.30 1.08 0.00 -0.81 0.00 0.00 175.30 175.23 1qbm s ALA 25 N 1.37 3.01 -1.76 6.12 0.00 0.22 0.02 121.76 130.76 1qbm s ALA 25 Ca 0.03 0.74 0.19 0.00 0.00 0.00 0.00 51.96 52.92 1qbm s ALA 25 Cb -0.15 -3.30 1.05 0.00 0.00 0.00 0.00 23.12 20.72 1qbm s ALA 25 CO -0.06 -0.35 1.54 -1.13 0.00 0.00 0.00 175.76 175.77 1qbm n SER 26 N -0.35 0.00 -3.42 0.00 3.41 0.26 -4.76 113.62 108.77 1qbm n SER 26 Ca 0.06 -0.33 -0.11 0.00 -0.26 0.00 0.00 58.87 58.24 1qbm n SER 26 Cb 0.50 -0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.30 1qbm n SER 26 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1qbm s GLY 27 N -2.24 0.72 -0.10 5.00 0.00 -1.26 -4.90 107.32 104.53 1qbm s GLY 27 Ca 0.24 -0.98 -0.30 0.00 0.00 0.00 0.00 44.72 43.69 1qbm s GLY 27 CO 0.25 -0.59 1.32 0.21 0.00 0.00 0.00 173.10 174.29 1qbm s ASN 28 N -3.09 6.92 0.00 1.64 3.84 -1.26 -4.53 114.94 118.46 1qbm s ASN 28 Ca 0.22 1.85 0.19 0.00 0.21 0.00 0.00 52.86 55.32 1qbm s ASN 28 Cb -0.03 -2.54 0.35 0.00 -0.55 0.00 0.00 41.25 38.48 1qbm s ASN 28 CO 0.13 -0.74 1.28 2.30 -2.79 0.00 0.00 177.10 177.28 1qbm n ILE 29 N 5.12 0.53 -3.01 -5.21 -5.35 0.43 -4.97 119.36 106.90 1qbm n ILE 29 Ca 0.14 -0.77 -0.20 0.00 -0.27 0.00 0.00 62.75 61.64 1qbm n ILE 29 Cb 0.45 0.92 0.01 0.00 -1.74 0.00 0.00 39.64 39.27 1qbm n ILE 29 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 1qbm n HIS 30 N 1.16 -1.72 -0.99 4.28 8.25 -1.24 -1.01 115.22 123.96 1qbm n HIS 30 Ca 0.16 0.35 0.00 0.00 -0.26 0.00 0.00 57.72 57.97 1qbm n HIS 30 Cb 0.52 -3.39 0.00 0.00 1.12 0.00 0.00 29.99 28.24 1qbm n HIS 30 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1qbm n ASN 31 N -2.23 -3.55 -4.45 0.41 4.13 -1.26 -4.92 115.26 103.39 1qbm n ASN 31 Ca -0.08 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.74 1qbm n ASN 31 Cb 0.59 -1.29 0.00 0.00 -1.54 0.00 0.00 39.78 37.54 1qbm n ASN 31 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1qbm n TYR 32 N -2.67 4.68 -3.93 3.10 4.02 -0.18 -3.00 117.16 119.18 1qbm n TYR 32 Ca 0.00 -3.09 -0.11 0.00 -0.01 0.00 0.00 57.90 54.68 1qbm n TYR 32 Cb 0.13 -2.39 -0.13 0.00 -0.02 0.00 0.00 39.34 36.93 1qbm n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1qbm s LEU 33 N 2.64 2.08 0.08 7.72 1.98 -1.26 -2.02 118.68 129.91 1qbm s LEU 33 Ca 0.48 -0.18 0.03 0.00 -2.89 0.00 0.00 54.13 51.57 1qbm s LEU 33 Cb 0.01 0.01 -0.03 0.00 0.66 0.00 0.00 46.19 46.84 1qbm s LEU 33 CO 0.03 -0.10 -0.10 0.00 -1.89 0.00 0.00 176.35 174.30 1qbm s ALA 34 N -0.50 1.02 -0.05 5.97 0.00 -0.29 -0.98 121.76 126.92 1qbm s ALA 34 Ca -0.05 -1.10 0.06 0.00 0.00 0.00 0.00 51.96 50.86 1qbm s ALA 34 Cb -0.04 0.03 -0.01 0.00 0.00 0.00 0.00 23.12 23.10 1qbm s ALA 34 CO -0.00 -0.02 -0.23 -1.58 0.00 0.00 0.00 175.76 173.92 1qbm s TRP 35 N -2.21 2.22 0.11 0.00 0.52 0.69 -1.25 118.94 119.03 1qbm s TRP 35 Ca 0.02 -0.65 0.10 0.00 0.02 0.00 0.00 56.10 55.59 1qbm s TRP 35 Cb -0.04 -1.47 -0.04 0.00 -1.15 0.00 0.00 33.47 30.77 1qbm s TRP 35 CO 0.00 -0.20 -0.25 0.71 0.02 0.00 0.00 176.95 177.23 1qbm s TYR 36 N -0.11 2.13 -0.05 -1.98 1.51 0.22 -1.36 117.35 117.70 1qbm s TYR 36 Ca -0.03 -0.39 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 1qbm s TYR 36 Cb -0.13 -1.17 -0.02 0.00 -0.11 0.00 0.00 41.96 40.53 1qbm s TYR 36 CO 0.03 0.27 -0.21 -1.14 -1.11 0.00 0.00 175.55 173.39 1qbm s GLN 37 N -1.91 2.51 -0.17 -0.62 0.74 -0.01 -1.11 119.66 119.08 1qbm s GLN 37 Ca 0.11 -0.83 -0.01 0.00 0.05 0.00 0.00 55.36 54.68 1qbm s GLN 37 Cb -0.10 -2.23 0.04 0.00 1.10 0.00 0.00 33.01 31.82 1qbm s GLN 37 CO 0.05 0.48 -0.03 -1.14 -0.55 0.00 0.00 175.29 174.09 1qbm s GLN 38 N -0.38 1.23 0.56 1.67 0.74 -0.25 -0.77 119.66 122.46 1qbm s GLN 38 Ca 0.03 -0.47 -0.03 0.00 0.05 0.00 0.00 55.36 54.95 1qbm s GLN 38 Cb -0.12 -1.96 0.02 0.00 1.10 0.00 0.00 33.01 32.05 1qbm s GLN 38 CO 0.02 -0.46 0.83 0.15 -0.55 0.00 0.00 175.29 175.27 1qbm s LYS 39 N 1.69 2.73 -0.17 1.67 1.02 -1.26 -0.82 119.74 124.61 1qbm s LYS 39 Ca 0.00 -0.37 -0.38 0.00 0.02 0.00 0.00 55.97 55.24 1qbm s LYS 39 Cb -0.15 -2.38 -0.14 0.00 -0.52 0.00 0.00 37.83 34.63 1qbm s LYS 39 CO -0.07 -0.69 1.75 0.00 -0.92 0.00 0.00 175.35 175.42 1qbm n GLN 40 N -2.45 1.52 -1.83 1.68 0.00 -1.26 -1.43 117.38 113.62 1qbm n GLN 40 Ca 0.05 0.56 -0.18 0.00 0.00 0.00 0.00 57.00 57.43 1qbm n GLN 40 Cb 0.59 -2.29 -0.05 0.00 0.00 0.00 0.00 30.24 28.48 1qbm n GLN 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1qbm n GLY 41 N 4.09 0.98 3.62 2.61 0.00 -1.26 -4.98 105.19 110.24 1qbm n GLY 41 Ca 0.24 -0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 1qbm n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qbm s LYS 42 N -4.03 1.96 0.24 1.61 1.02 -0.51 -5.13 119.74 114.90 1qbm s LYS 42 Ca 0.00 -2.05 -0.14 0.00 0.02 0.00 0.00 55.97 53.80 1qbm s LYS 42 Cb 0.00 -1.69 -0.08 0.00 -0.52 0.00 0.00 37.83 35.54 1qbm s LYS 42 CO 0.00 -0.02 0.65 -1.12 -0.92 0.00 0.00 175.35 173.94 1qbm s SER 43 N -3.71 6.80 0.81 2.83 0.01 -1.26 -4.64 113.70 114.53 1qbm s SER 43 Ca 0.35 1.17 -0.14 0.00 1.31 0.00 0.00 55.95 58.63 1qbm s SER 43 Cb 0.08 -2.32 0.01 0.00 0.21 0.00 0.00 66.02 64.00 1qbm s SER 43 CO 0.18 -0.06 0.68 -2.65 0.41 0.00 0.00 173.24 171.80 1qbm n PRO 44 N 0.14 0.11 -4.04 12.44 -0.02 -1.26 -4.68 135.00 137.70 1qbm n PRO 44 Ca -0.00 0.09 -0.16 0.00 -2.02 0.00 0.00 63.50 61.41 1qbm n PRO 44 Cb 0.52 -2.00 -0.15 0.00 -0.02 0.00 0.00 33.50 31.85 1qbm n PRO 44 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1qbm s GLN 45 N -3.37 0.35 0.15 -0.52 0.74 0.05 -4.95 119.66 112.11 1qbm s GLN 45 Ca 0.65 -0.06 -0.30 0.00 0.05 0.00 0.00 55.36 55.70 1qbm s GLN 45 Cb -0.30 -0.40 -0.07 0.00 1.10 0.00 0.00 33.01 33.34 1qbm s GLN 45 CO 0.59 -0.01 1.15 -1.17 -0.55 0.00 0.00 175.29 175.30 1qbm s LEU 46 N 0.37 4.45 -0.19 3.68 2.96 -1.26 -0.83 118.68 127.86 1qbm s LEU 46 Ca -0.04 2.11 -0.07 0.00 -0.22 0.00 0.00 54.13 55.91 1qbm s LEU 46 Cb -0.07 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 42.94 1qbm s LEU 46 CO -0.01 -0.32 -0.22 0.18 -1.32 0.00 0.00 176.35 174.66 1qbm n LEU 47 N 2.76 1.65 -3.95 -0.68 4.77 -0.47 -4.68 117.00 116.42 1qbm n LEU 47 Ca 0.05 0.16 -0.10 0.00 -0.03 0.00 0.00 56.01 56.09 1qbm n LEU 47 Cb 0.46 -0.56 -0.11 0.00 -2.33 0.00 0.00 43.42 40.87 1qbm n LEU 47 CO 0.55 0.47 -0.33 -0.69 -1.33 0.00 0.00 177.39 176.05 1qbm s VAL 48 N -2.34 0.09 0.20 4.08 1.01 -1.17 0.14 120.40 122.40 1qbm s VAL 48 Ca -0.26 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1qbm s VAL 48 Cb 0.09 -0.24 -0.05 0.00 0.00 0.00 0.00 36.38 36.19 1qbm s VAL 48 CO 0.34 -0.39 0.07 -0.72 0.00 0.00 0.00 175.10 174.40 1qbm s TYR 49 N -1.17 1.24 -1.46 5.22 1.13 -0.65 -0.22 117.35 121.44 1qbm s TYR 49 Ca -0.13 -1.19 -0.12 0.00 -1.41 0.00 0.00 57.07 54.22 1qbm s TYR 49 Cb -0.08 -0.69 0.08 0.00 -1.10 0.00 0.00 41.96 40.17 1qbm s TYR 49 CO -0.01 -0.41 0.73 0.09 -2.51 0.00 0.00 175.55 173.45 1qbm n ASN 50 N -0.29 -4.42 0.00 -0.18 4.13 -0.16 -1.70 115.26 112.64 1qbm n ASN 50 Ca -0.02 -0.59 0.00 0.00 1.68 0.00 0.00 54.58 55.65 1qbm n ASN 50 Cb 0.65 -3.58 0.00 0.00 -1.54 0.00 0.00 39.78 35.30 1qbm n ASN 50 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1qbm n ALA 51 N -4.07 0.00 -0.52 5.41 0.00 -0.70 -4.15 120.51 116.48 1qbm n ALA 51 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1qbm n ALA 51 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1qbm n ALA 51 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1qbm n LYS 52 N 0.00 0.37 -3.03 0.00 2.85 -1.16 -3.00 118.16 114.18 1qbm n LYS 52 Ca 0.00 -0.09 -0.42 0.00 -1.05 0.00 0.00 58.31 56.75 1qbm n LYS 52 Cb 0.00 -0.48 -0.06 0.00 -0.65 0.00 0.00 35.03 33.84 1qbm n LYS 52 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1qbm s THR 53 N -0.08 4.80 0.18 0.58 2.01 -0.69 -4.49 115.64 117.96 1qbm s THR 53 Ca 0.00 0.66 -0.31 0.00 0.31 0.00 0.00 61.69 62.35 1qbm s THR 53 Cb 0.00 -4.17 -0.10 0.00 0.01 0.00 0.00 72.50 68.24 1qbm s THR 53 CO 0.00 -0.42 1.55 -0.76 -0.69 0.00 0.00 174.62 174.30 1qbm s LEU 54 N 2.94 4.37 1.15 4.42 1.02 -1.26 -1.63 118.68 129.68 1qbm s LEU 54 Ca 0.28 2.64 -0.18 0.00 0.02 0.00 0.00 54.13 56.88 1qbm s LEU 54 Cb -0.14 -3.60 0.27 0.00 0.02 0.00 0.00 46.19 42.74 1qbm s LEU 54 CO 0.17 -0.81 1.15 0.00 0.02 0.00 0.00 176.35 176.88 1qbm s ALA 55 N 0.94 0.95 0.23 4.21 0.00 0.12 -4.93 121.76 123.28 1qbm s ALA 55 Ca 0.68 -0.99 -0.31 0.00 0.00 0.00 0.00 51.96 51.35 1qbm s ALA 55 Cb -0.44 -2.87 -0.11 0.00 0.00 0.00 0.00 23.12 19.71 1qbm s ALA 55 CO 0.33 -3.34 1.54 -0.51 0.00 0.00 0.00 175.76 173.79 1qbm s ASP 56 N -4.09 6.54 0.00 0.00 1.01 -1.26 -2.59 116.67 116.28 1qbm s ASP 56 Ca 0.71 2.74 0.00 0.00 0.71 0.00 0.00 52.55 56.71 1qbm s ASP 56 Cb -0.09 -2.62 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1qbm s ASP 56 CO 0.55 -0.81 0.00 0.61 0.21 0.00 0.00 175.17 175.73 1qbm n GLY 57 N 2.80 0.42 3.62 0.21 0.00 -1.26 -4.96 105.19 106.01 1qbm n GLY 57 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1qbm n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qbm s VAL 58 N -2.04 4.95 0.87 1.61 1.01 -1.07 -5.04 120.40 120.70 1qbm s VAL 58 Ca 0.00 1.07 -0.10 0.00 0.00 0.00 0.00 61.98 62.95 1qbm s VAL 58 Cb 0.00 -3.97 0.12 0.00 0.00 0.00 0.00 36.38 32.53 1qbm s VAL 58 CO 0.00 -0.04 1.14 -2.16 0.00 0.00 0.00 175.10 174.03 1qbm s PRO 59 N 2.58 1.38 0.57 2.72 0.04 -1.26 -4.84 135.00 136.19 1qbm s PRO 59 Ca 0.27 1.47 0.37 0.00 0.04 0.00 0.00 61.00 63.15 1qbm s PRO 59 Cb -0.15 -1.78 2.03 0.00 0.04 0.00 0.00 34.50 34.64 1qbm s PRO 59 CO 0.10 -2.35 2.14 0.77 0.04 0.00 0.00 177.00 177.70 1qbm h SER 60 N -1.61 0.00 0.26 6.66 0.02 -2.00 -2.59 113.55 114.29 1qbm h SER 60 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 1qbm h SER 60 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1qbm h SER 60 CO 0.44 0.00 0.00 -2.11 -1.14 0.00 0.00 176.83 174.02 1qbm n ARG 61 N -2.83 0.10 -3.53 3.45 1.85 -1.26 -4.50 116.66 109.94 1qbm n ARG 61 Ca -0.02 0.50 -0.36 0.00 -1.00 0.00 0.00 57.85 56.96 1qbm n ARG 61 Cb 0.09 -1.77 -0.07 0.00 -1.05 0.00 0.00 32.46 29.66 1qbm n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1qbm s PHE 62 N -3.29 3.47 0.10 2.89 0.08 -0.98 0.11 117.98 120.36 1qbm s PHE 62 Ca 0.01 0.61 0.05 0.00 0.12 0.00 0.00 56.93 57.72 1qbm s PHE 62 Cb 0.06 -2.35 -0.03 0.00 -0.57 0.00 0.00 43.02 40.13 1qbm s PHE 62 CO 0.21 0.24 -0.14 0.45 -0.10 0.00 0.00 175.22 175.89 1qbm s SER 63 N 0.44 1.79 -0.00 1.36 0.15 0.37 -4.95 113.70 112.86 1qbm s SER 63 Ca 0.17 -0.73 0.02 0.00 0.70 0.00 0.00 55.95 56.11 1qbm s SER 63 Cb -0.13 -0.05 -0.01 0.00 -1.71 0.00 0.00 66.02 64.12 1qbm s SER 63 CO 0.04 -0.13 -0.08 -0.83 1.20 0.00 0.00 173.24 173.44 1qbm s GLY 64 N -2.17 0.38 0.21 9.45 0.00 -1.26 -0.93 107.32 112.99 1qbm s GLY 64 Ca 0.04 -0.34 -0.08 0.00 0.00 0.00 0.00 44.72 44.34 1qbm s GLY 64 CO 0.02 -0.28 0.31 -1.35 0.00 0.00 0.00 173.10 171.80 1qbm s SER 65 N -0.21 0.02 0.00 1.64 1.04 0.15 -4.20 113.70 112.15 1qbm s SER 65 Ca 0.03 -1.06 0.00 0.00 0.48 0.00 0.00 55.95 55.39 1qbm s SER 65 Cb -0.03 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1qbm s SER 65 CO -0.00 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 173.85 1qbm n GLY 66 N -0.30 2.71 3.64 7.32 0.00 -1.26 0.23 105.19 117.52 1qbm n GLY 66 Ca -0.02 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.22 1qbm n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qbm s SER 67 N 0.00 -0.57 0.33 1.61 1.04 -0.86 -4.96 113.70 110.29 1qbm s SER 67 Ca 0.00 1.08 0.00 0.00 0.48 0.00 0.00 55.95 57.51 1qbm s SER 67 Cb 0.00 1.11 0.00 0.00 0.10 0.00 0.00 66.02 67.23 1qbm s SER 67 CO 0.00 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1qbm n GLY 68 N 2.52 1.10 0.03 7.32 0.00 -1.26 -3.00 105.19 111.90 1qbm n GLY 68 Ca -0.14 0.34 -0.02 0.00 0.00 0.00 0.00 46.02 46.21 1qbm n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qbm n THR 69 N 0.00 0.35 -3.68 2.61 -2.24 -1.26 -0.43 114.28 109.63 1qbm n THR 69 Ca 0.00 -0.26 -0.37 0.00 -2.27 0.00 0.00 64.05 61.15 1qbm n THR 69 Cb 0.00 -0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 67.61 1qbm n THR 69 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1qbm s GLN 70 N -2.26 4.03 0.05 -0.78 2.00 -1.16 -0.61 119.66 120.93 1qbm s GLN 70 Ca -0.03 -0.29 0.03 0.00 -2.00 0.00 0.00 55.36 53.07 1qbm s GLN 70 Cb 0.03 -3.52 -0.03 0.00 0.80 0.00 0.00 33.01 30.29 1qbm s GLN 70 CO 0.29 0.03 -0.09 0.71 -0.50 0.00 0.00 175.29 175.73 1qbm s TYR 71 N 1.13 0.80 0.03 1.67 1.51 -0.27 -2.02 117.35 120.19 1qbm s TYR 71 Ca 0.07 -0.50 -0.01 0.00 -1.01 0.00 0.00 57.07 55.62 1qbm s TYR 71 Cb -0.14 -0.47 -0.02 0.00 -0.11 0.00 0.00 41.96 41.22 1qbm s TYR 71 CO 0.05 -0.05 -0.02 -1.12 -1.11 0.00 0.00 175.55 173.30 1qbm s SER 72 N -1.65 0.28 -0.09 2.29 0.01 0.14 -0.69 113.70 113.98 1qbm s SER 72 Ca -0.08 -0.59 0.03 0.00 1.31 0.00 0.00 55.95 56.63 1qbm s SER 72 Cb -0.10 0.13 0.01 0.00 0.21 0.00 0.00 66.02 66.27 1qbm s SER 72 CO 0.01 -0.37 -0.20 -0.22 0.41 0.00 0.00 173.24 172.87 1qbm s LEU 73 N -1.78 1.93 -0.06 2.44 2.96 0.37 -0.67 118.68 123.87 1qbm s LEU 73 Ca -0.11 -0.48 0.05 0.00 -0.22 0.00 0.00 54.13 53.37 1qbm s LEU 73 Cb -0.06 -1.22 -0.01 0.00 0.50 0.00 0.00 46.19 45.41 1qbm s LEU 73 CO -0.03 0.11 -0.22 -0.75 -1.32 0.00 0.00 176.35 174.14 1qbm s LYS 74 N 0.52 2.35 -0.17 1.98 2.20 -0.11 0.43 119.74 126.95 1qbm s LYS 74 Ca -0.16 -0.79 -0.01 0.00 -0.36 0.00 0.00 55.97 54.66 1qbm s LYS 74 Cb -0.17 -1.96 -0.01 0.00 -1.51 0.00 0.00 37.83 34.19 1qbm s LYS 74 CO 0.06 0.29 -0.12 0.42 -0.36 0.00 0.00 175.35 175.64 1qbm s ILE 75 N 0.02 2.95 -0.11 5.43 1.01 0.13 -0.48 121.20 130.16 1qbm s ILE 75 Ca -0.07 -0.66 -0.14 0.00 0.00 0.00 0.00 60.65 59.77 1qbm s ILE 75 Cb -0.14 -2.28 -0.13 0.00 0.01 0.00 0.00 42.46 39.93 1qbm s ILE 75 CO 0.04 0.49 0.42 -1.13 0.00 0.00 0.00 174.94 174.76 1qbm h ASN 76 N 7.40 -0.02 -2.77 3.58 -0.73 0.56 -0.10 115.58 123.49 1qbm h ASN 76 Ca -0.34 -0.45 -0.61 0.00 1.87 0.00 0.00 56.30 56.76 1qbm h ASN 76 Cb 1.18 0.01 -0.42 0.00 0.27 0.00 0.00 38.32 39.36 1qbm h ASN 76 CO 0.58 0.69 -0.63 -0.24 -0.37 0.00 0.00 177.43 177.47 1qbm n SER 77 N -4.73 2.82 -3.25 1.15 2.88 -1.25 -3.37 113.62 107.87 1qbm n SER 77 Ca -0.05 -3.18 -0.41 0.00 -1.33 0.00 0.00 58.87 53.89 1qbm n SER 77 Cb 0.23 -0.72 -0.10 0.00 -0.75 0.00 0.00 64.21 62.88 1qbm n SER 77 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1qbm n LEU 78 N 1.74 0.47 -4.93 2.46 4.77 0.28 -4.43 117.00 117.36 1qbm n LEU 78 Ca 0.23 0.41 -0.25 0.00 -0.03 0.00 0.00 56.01 56.37 1qbm n LEU 78 Cb 0.38 -0.68 0.01 0.00 -2.33 0.00 0.00 43.42 40.80 1qbm n LEU 78 CO 0.28 -0.57 0.35 -1.10 -1.33 0.00 0.00 177.39 175.02 1qbm s GLN 79 N 5.12 3.28 0.54 3.23 -1.52 -1.26 -0.35 119.66 128.69 1qbm s GLN 79 Ca 0.94 -0.16 0.26 0.00 -1.95 0.00 0.00 55.36 54.45 1qbm s GLN 79 Cb -1.08 -2.48 1.42 0.00 -0.22 0.00 0.00 33.01 30.65 1qbm s GLN 79 CO 0.46 -0.23 1.99 -1.35 -0.25 0.00 0.00 175.29 175.91 1qbm h PRO 80 N 0.32 0.00 -0.17 2.91 0.11 -1.98 -2.04 132.00 131.15 1qbm h PRO 80 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1qbm h PRO 80 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1qbm h PRO 80 CO 0.60 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.54 1qbm n GLU 81 N -4.31 1.48 0.00 1.05 0.00 -1.26 -3.45 120.64 114.15 1qbm n GLU 81 Ca 0.10 -0.73 0.13 0.00 0.00 0.00 0.00 57.16 56.66 1qbm n GLU 81 Cb 0.63 -1.25 0.42 0.00 0.00 0.00 0.00 31.44 31.24 1qbm n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1qbm n ASP 82 N 0.03 0.77 -4.66 -1.84 8.00 -0.77 -4.86 116.55 113.22 1qbm n ASP 82 Ca 0.11 -0.66 -0.43 0.00 0.71 0.00 0.00 54.79 54.52 1qbm n ASP 82 Cb 0.20 0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.36 1qbm n ASP 82 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1qbm s PHE 83 N -2.60 2.84 -0.77 1.24 0.08 -1.22 -4.88 117.98 112.68 1qbm s PHE 83 Ca 0.23 0.99 0.00 0.00 0.12 0.00 0.00 56.93 58.27 1qbm s PHE 83 Cb 0.19 -3.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.13 1qbm s PHE 83 CO 0.54 -1.75 0.00 0.41 -0.10 0.00 0.00 175.22 174.32 1qbm n GLY 84 N 3.61 -0.93 3.94 4.36 0.00 -1.22 -4.77 105.19 110.18 1qbm n GLY 84 Ca 0.14 -0.78 -0.24 0.00 0.00 0.00 0.00 46.02 45.14 1qbm n GLY 84 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qbm s SER 85 N -4.00 6.33 -0.04 1.61 0.01 0.00 -1.01 113.70 116.60 1qbm s SER 85 Ca 0.00 0.41 0.01 0.00 1.31 0.00 0.00 55.95 57.68 1qbm s SER 85 Cb 0.00 -2.01 0.02 0.00 0.21 0.00 0.00 66.02 64.24 1qbm s SER 85 CO 0.00 -0.21 -0.04 -0.31 0.41 0.00 0.00 173.24 173.09 1qbm s TYR 86 N -2.16 0.73 0.07 2.43 2.02 0.99 -1.09 117.35 120.34 1qbm s TYR 86 Ca 0.39 -0.20 0.08 0.00 -0.37 0.00 0.00 57.07 56.97 1qbm s TYR 86 Cb -0.10 -0.66 -0.03 0.00 -0.40 0.00 0.00 41.96 40.77 1qbm s TYR 86 CO 0.33 -0.20 -0.21 0.71 -1.57 0.00 0.00 175.55 174.62 1qbm s TYR 87 N 0.96 1.83 0.07 2.71 2.02 -0.27 0.01 117.35 124.68 1qbm s TYR 87 Ca -0.10 -0.39 0.08 0.00 -0.37 0.00 0.00 57.07 56.29 1qbm s TYR 87 Cb -0.14 -1.06 -0.03 0.00 -0.40 0.00 0.00 41.96 40.33 1qbm s TYR 87 CO -0.00 0.14 -0.21 0.00 -1.57 0.00 0.00 175.55 173.91 1qbm s GLN 89 N -1.61 0.79 0.01 0.00 0.74 -0.38 0.26 119.66 119.47 1qbm s GLN 89 Ca 0.15 -0.70 -0.00 0.00 0.05 0.00 0.00 55.36 54.86 1qbm s GLN 89 Cb -0.10 -0.75 -0.04 0.00 1.10 0.00 0.00 33.01 33.22 1qbm s GLN 89 CO 0.06 0.18 0.10 -3.38 -0.55 0.00 0.00 175.29 171.70 1qbm s HIS 90 N -0.88 3.32 -0.17 1.67 -3.43 -0.81 -1.13 115.29 113.85 1qbm s HIS 90 Ca -0.01 0.21 0.15 0.00 -0.80 0.00 0.00 55.06 54.61 1qbm s HIS 90 Cb -0.08 -1.73 0.44 0.00 -1.43 0.00 0.00 32.58 29.78 1qbm s HIS 90 CO 0.01 0.56 1.19 1.97 -2.00 0.00 0.00 174.74 176.48 1qbm n PHE 91 N 1.00 0.54 -0.02 0.38 -1.74 -0.85 -4.04 117.46 112.73 1qbm n PHE 91 Ca -0.12 -1.42 -0.17 0.00 -0.56 0.00 0.00 57.45 55.19 1qbm n PHE 91 Cb 0.52 -0.24 -0.08 0.00 1.52 0.00 0.00 39.48 41.21 1qbm n PHE 91 CO 0.00 0.00 0.00 2.35 -0.56 0.00 0.00 176.76 178.55 1qbm h TRP 92 N 1.31 0.99 -2.98 2.97 2.91 -1.83 -3.48 115.95 115.85 1qbm h TRP 92 Ca -0.01 -0.44 0.02 0.00 1.13 0.00 0.00 58.89 59.59 1qbm h TRP 92 Cb 1.33 -0.15 -0.10 0.00 -0.51 0.00 0.00 29.16 29.73 1qbm h TRP 92 CO 0.61 1.26 0.23 -1.54 -1.03 0.00 0.00 178.44 177.97 1qbm s SER 93 N -7.01 -0.45 0.10 2.65 1.04 -1.26 -5.12 113.70 103.64 1qbm s SER 93 Ca -0.11 -0.22 -0.30 0.00 0.48 0.00 0.00 55.95 55.80 1qbm s SER 93 Cb 0.08 0.64 -0.06 0.00 0.10 0.00 0.00 66.02 66.78 1qbm s SER 93 CO 0.89 -1.10 1.13 -0.89 0.98 0.00 0.00 173.24 174.25 1qbm s THR 94 N -3.79 4.11 0.32 2.02 2.01 -1.26 -3.12 115.64 115.92 1qbm s THR 94 Ca 0.05 1.61 -0.22 0.00 0.31 0.00 0.00 61.69 63.45 1qbm s THR 94 Cb -0.03 -4.03 -0.10 0.00 0.01 0.00 0.00 72.50 68.35 1qbm s THR 94 CO -0.06 0.18 0.86 -2.16 -0.69 0.00 0.00 174.62 172.75 1qbm s PRO 95 N 0.51 4.34 -1.33 4.92 0.04 -1.26 -4.19 135.00 138.03 1qbm s PRO 95 Ca 0.54 1.07 -0.16 0.00 0.04 0.00 0.00 61.00 62.48 1qbm s PRO 95 Cb -0.28 -2.64 0.07 0.00 0.04 0.00 0.00 34.50 31.70 1qbm s PRO 95 CO 0.31 0.23 1.85 0.91 0.04 0.00 0.00 177.00 180.33 1qbm n TRP 96 N 0.22 4.35 -1.73 0.56 7.02 -1.18 -4.75 117.44 121.92 1qbm n TRP 96 Ca 0.02 -2.92 -0.33 0.00 -1.02 0.00 0.00 57.50 53.26 1qbm n TRP 96 Cb 0.52 -2.56 0.05 0.00 -2.42 0.00 0.00 31.31 26.89 1qbm n TRP 96 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1qbm s THR 97 N 3.63 3.38 0.29 -0.99 -4.23 -1.26 -4.67 115.64 111.78 1qbm s THR 97 Ca 0.51 0.61 0.06 0.00 -1.18 0.00 0.00 61.69 61.69 1qbm s THR 97 Cb 0.06 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.74 1qbm s THR 97 CO 0.03 -0.43 0.34 -0.36 -0.54 0.00 0.00 174.62 173.66 1qbm s PHE 98 N -2.46 3.16 0.88 3.99 0.08 -1.26 -1.93 117.98 120.44 1qbm s PHE 98 Ca 0.65 -0.16 -0.14 0.00 0.12 0.00 0.00 56.93 57.41 1qbm s PHE 98 Cb -0.19 -1.69 0.13 0.00 -0.57 0.00 0.00 43.02 40.70 1qbm s PHE 98 CO 0.43 0.28 1.24 0.20 -0.10 0.00 0.00 175.22 177.27 1qbm s GLY 99 N -4.00 1.67 0.23 4.36 0.00 0.14 -4.46 107.32 105.26 1qbm s GLY 99 Ca 0.38 -0.88 0.23 0.00 0.00 0.00 0.00 44.72 44.46 1qbm s GLY 99 CO 0.28 -0.27 1.71 0.61 0.00 0.00 0.00 173.10 175.43 1qbm n GLY 100 N -3.45 -1.33 0.00 0.20 0.00 -1.26 -4.72 105.19 94.63 1qbm n GLY 100 Ca 0.11 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1qbm n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qbm n GLY 101 N 0.23 2.19 2.88 -0.02 0.00 -1.26 -5.05 105.19 104.16 1qbm n GLY 101 Ca 0.03 -1.78 -0.25 0.00 0.00 0.00 0.00 46.02 44.01 1qbm n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qbm s THR 102 N -2.28 0.83 -0.13 2.61 2.01 0.10 -4.38 115.64 114.40 1qbm s THR 102 Ca 0.00 -0.19 -0.14 0.00 0.31 0.00 0.00 61.69 61.67 1qbm s THR 102 Cb 0.00 -0.88 -0.05 0.00 0.01 0.00 0.00 72.50 71.59 1qbm s THR 102 CO 0.00 0.33 0.32 -0.75 -0.69 0.00 0.00 174.62 173.83 1qbm s LYS 103 N 1.63 4.17 -0.36 4.92 2.20 0.34 -0.01 119.74 132.63 1qbm s LYS 103 Ca 0.02 0.16 -0.11 0.00 -0.36 0.00 0.00 55.97 55.68 1qbm s LYS 103 Cb -0.13 -3.39 0.02 0.00 -1.51 0.00 0.00 37.83 32.82 1qbm s LYS 103 CO -0.06 0.32 0.20 -1.17 -0.36 0.00 0.00 175.35 174.28 1qbm s LEU 104 N 0.19 4.60 0.26 5.43 2.96 -0.18 0.46 118.68 132.41 1qbm s LEU 104 Ca 0.18 -0.87 0.10 0.00 -0.22 0.00 0.00 54.13 53.33 1qbm s LEU 104 Cb -0.14 -2.03 -0.05 0.00 0.50 0.00 0.00 46.19 44.48 1qbm s LEU 104 CO 0.06 -0.34 -0.09 -1.83 -1.32 0.00 0.00 176.35 172.82 1qbm s GLU 105 N 1.58 2.02 -0.05 1.98 4.04 -0.10 -3.41 118.70 124.77 1qbm s GLU 105 Ca 0.03 -1.53 -0.30 0.00 0.04 0.00 0.00 54.97 53.21 1qbm s GLU 105 Cb -0.19 -2.01 -0.04 0.00 0.02 0.00 0.00 34.13 31.91 1qbm s GLU 105 CO 0.07 0.36 1.40 0.42 -1.84 0.00 0.00 175.26 175.67 1qbm s ILE 106 N -2.31 3.85 0.34 1.83 1.01 -1.26 -0.21 121.20 124.46 1qbm s ILE 106 Ca 0.30 1.16 -0.27 0.00 0.00 0.00 0.00 60.65 61.84 1qbm s ILE 106 Cb -0.06 -3.75 -0.09 0.00 0.01 0.00 0.00 42.46 38.57 1qbm s ILE 106 CO 0.17 -0.04 1.13 -0.75 0.00 0.00 0.00 174.94 175.45 1qbm s LYS 107 N 2.87 4.35 0.26 2.79 2.20 0.76 -4.77 119.74 128.20 1qbm s LYS 107 Ca 0.63 1.80 -0.17 0.00 -0.36 0.00 0.00 55.97 57.87 1qbm s LYS 107 Cb -0.29 -2.90 0.01 0.00 -1.51 0.00 0.00 37.83 33.14 1qbm s LYS 107 CO 0.24 -0.05 0.59 -0.98 -0.36 0.00 0.00 175.35 174.79 1qbm s ARG 108 N -1.94 1.65 0.71 4.03 1.70 -1.26 -4.91 118.95 118.93 1qbm s ARG 108 Ca 0.51 -1.11 -0.13 0.00 -0.47 0.00 0.00 55.73 54.54 1qbm s ARG 108 Cb -0.30 0.54 0.02 0.00 -0.57 0.00 0.00 34.95 34.64 1qbm s ARG 108 CO 0.39 -0.72 1.09 0.00 -1.08 0.00 0.00 175.30 174.98 1qbm s ALA 109 N -3.96 2.41 0.63 7.88 0.00 -1.26 -4.96 121.76 122.50 1qbm s ALA 109 Ca 0.16 0.36 -0.18 0.00 0.00 0.00 0.00 51.96 52.30 1qbm s ALA 109 Cb -0.03 -3.28 -0.02 0.00 0.00 0.00 0.00 23.12 19.79 1qbm s ALA 109 CO 0.07 -1.46 1.25 -0.51 0.00 0.00 0.00 175.76 175.12 1qbm s ASP 110 N -3.09 4.86 -0.08 0.00 1.01 -1.26 -4.78 116.67 113.34 1qbm s ASP 110 Ca 0.63 2.50 -0.04 0.00 0.71 0.00 0.00 52.55 56.35 1qbm s ASP 110 Cb -0.18 -2.61 0.04 0.00 1.01 0.00 0.00 42.92 41.18 1qbm s ASP 110 CO 0.49 -1.82 0.19 0.00 0.21 0.00 0.00 175.17 174.23 1qbm s ALA 111 N -1.51 -0.40 0.40 5.23 0.00 0.08 -4.89 121.76 120.66 1qbm s ALA 111 Ca 0.80 0.74 -0.15 0.00 0.00 0.00 0.00 51.96 53.34 1qbm s ALA 111 Cb -0.34 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.23 1qbm s ALA 111 CO 0.37 -0.15 0.83 0.00 0.00 0.00 0.00 175.76 176.80 1qbm s ALA 112 N 0.93 3.23 0.62 0.00 0.00 -1.26 -0.65 121.76 124.64 1qbm s ALA 112 Ca -0.07 0.07 -0.15 0.00 0.00 0.00 0.00 51.96 51.81 1qbm s ALA 112 Cb -0.09 -2.88 -0.02 0.00 0.00 0.00 0.00 23.12 20.13 1qbm s ALA 112 CO -0.05 0.12 1.08 -1.25 0.00 0.00 0.00 175.76 175.65 1qbm s PRO 113 N -3.42 3.10 -0.53 0.00 0.04 -1.26 -4.56 135.00 128.38 1qbm s PRO 113 Ca 0.56 1.28 -0.18 0.00 0.04 0.00 0.00 61.00 62.70 1qbm s PRO 113 Cb -0.10 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.52 1qbm s PRO 113 CO 0.22 -1.00 0.58 0.99 0.04 0.00 0.00 177.00 177.84 1qbm s THR 114 N -2.41 4.97 0.22 1.26 2.01 0.23 -4.84 115.64 117.07 1qbm s THR 114 Ca 0.65 -0.86 -0.13 0.00 0.31 0.00 0.00 61.69 61.66 1qbm s THR 114 Cb -0.18 -4.32 -0.08 0.00 0.01 0.00 0.00 72.50 67.94 1qbm s THR 114 CO 0.39 -0.85 0.60 -0.69 -0.69 0.00 0.00 174.62 173.38 1qbm s VAL 115 N 2.33 4.82 -0.16 3.82 1.01 -1.26 -1.47 120.40 129.49 1qbm s VAL 115 Ca 0.10 0.77 -0.09 0.00 0.00 0.00 0.00 61.98 62.76 1qbm s VAL 115 Cb -0.23 -3.68 0.05 0.00 0.00 0.00 0.00 36.38 32.52 1qbm s VAL 115 CO 0.08 0.05 0.38 -0.44 0.00 0.00 0.00 175.10 175.17 1qbm s SER 116 N -2.04 -0.46 0.10 3.32 0.01 0.21 -4.95 113.70 109.88 1qbm s SER 116 Ca 0.45 0.82 0.05 0.00 1.31 0.00 0.00 55.95 58.58 1qbm s SER 116 Cb -0.13 0.71 -0.04 0.00 0.21 0.00 0.00 66.02 66.77 1qbm s SER 116 CO 0.20 -0.18 -0.03 -0.51 0.41 0.00 0.00 173.24 173.13 1qbm s ILE 117 N 1.28 3.84 -0.07 1.44 2.07 -1.26 0.03 121.20 128.53 1qbm s ILE 117 Ca -0.09 -1.07 -0.01 0.00 -1.41 0.00 0.00 60.65 58.07 1qbm s ILE 117 Cb -0.08 -2.82 0.03 0.00 0.13 0.00 0.00 42.46 39.71 1qbm s ILE 117 CO -0.11 0.11 0.00 -0.36 -1.91 0.00 0.00 174.94 172.68 1qbm s PHE 118 N -1.29 0.63 1.14 3.50 0.40 0.14 -4.95 117.98 117.55 1qbm s PHE 118 Ca 0.25 -0.14 -0.16 0.00 -0.60 0.00 0.00 56.93 56.27 1qbm s PHE 118 Cb -0.11 -0.77 0.26 0.00 0.51 0.00 0.00 43.02 42.90 1qbm s PHE 118 CO 0.17 -0.31 1.08 -1.25 0.70 0.00 0.00 175.22 175.61 1qbm s PRO 119 N 1.92 -0.71 0.21 0.24 0.04 -1.26 -1.39 135.00 134.04 1qbm s PRO 119 Ca 0.04 0.27 -0.30 0.00 0.04 0.00 0.00 61.00 61.05 1qbm s PRO 119 Cb -0.12 -1.63 -0.09 0.00 0.04 0.00 0.00 34.50 32.70 1qbm s PRO 119 CO -0.05 -3.44 1.28 -2.14 0.04 0.00 0.00 177.00 172.69 1qbm s PRO 120 N -5.09 4.42 0.41 0.56 0.02 -1.24 -4.74 135.00 129.34 1qbm s PRO 120 Ca 0.68 2.02 -0.25 0.00 0.02 0.00 0.00 61.00 63.48 1qbm s PRO 120 Cb -0.15 -3.19 -0.08 0.00 0.02 0.00 0.00 34.50 31.09 1qbm s PRO 120 CO 0.58 -0.19 1.22 -1.54 -0.33 0.00 0.00 177.00 176.73 1qbm s SER 121 N 0.16 6.36 0.52 2.53 1.04 -1.26 -4.87 113.70 118.17 1qbm s SER 121 Ca 0.55 2.46 0.29 0.00 0.48 0.00 0.00 55.95 59.72 1qbm s SER 121 Cb -0.36 -2.62 1.41 0.00 0.10 0.00 0.00 66.02 64.55 1qbm s SER 121 CO 0.39 -0.80 1.89 0.77 0.98 0.00 0.00 173.24 176.48 1qbm h SER 122 N 2.53 0.07 0.05 7.02 4.64 -2.00 0.37 113.55 126.24 1qbm h SER 122 Ca -0.49 0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 60.76 1qbm h SER 122 Cb 1.24 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 1qbm h SER 122 CO 0.62 0.03 -0.24 -0.33 -0.87 0.00 0.00 176.83 176.04 1qbm h GLU 123 N 0.07 0.32 0.09 4.77 5.08 -1.99 -2.44 114.58 120.48 1qbm h GLU 123 Ca 0.42 -0.11 -0.28 0.00 -1.00 0.00 0.00 59.36 58.39 1qbm h GLU 123 Cb 1.55 -0.03 0.03 0.00 0.50 0.00 0.00 28.75 30.80 1qbm h GLU 123 CO -0.04 0.55 -1.13 0.37 -1.00 0.00 0.00 179.01 177.76 1qbm h GLN 124 N 0.29 0.61 -0.79 2.33 4.15 -0.57 -3.20 115.11 117.93 1qbm h GLN 124 Ca 0.05 -0.77 0.12 0.00 0.77 0.00 0.00 58.65 58.81 1qbm h GLN 124 Cb 0.59 0.25 -0.08 0.00 0.21 0.00 0.00 27.48 28.44 1qbm h GLN 124 CO 0.04 1.34 0.41 -0.07 -1.93 0.00 0.00 178.83 178.62 1qbm h LEU 125 N 0.24 0.52 -1.90 -2.39 3.38 -1.32 0.17 115.31 114.00 1qbm h LEU 125 Ca -0.17 0.07 0.09 0.00 0.09 0.00 0.00 57.88 57.97 1qbm h LEU 125 Cb 1.81 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.53 1qbm h LEU 125 CO 0.22 0.26 0.46 0.74 0.09 0.00 0.00 178.44 180.21 1qbm h THR 126 N 0.64 0.25 -0.61 0.22 2.02 -1.43 0.43 112.91 114.43 1qbm h THR 126 Ca 0.41 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.59 1qbm h THR 126 Cb 0.50 0.61 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1qbm h THR 126 CO -0.31 0.00 0.00 -1.20 0.37 0.00 0.00 175.52 174.38 1qbm n SER 127 N -3.45 5.21 0.00 4.18 7.64 0.58 -4.92 113.62 122.86 1qbm n SER 127 Ca 0.05 -2.68 0.00 0.00 1.01 0.00 0.00 58.87 57.25 1qbm n SER 127 Cb 0.61 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1qbm n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1qbm n GLY 128 N 0.86 0.42 3.67 0.23 0.00 0.15 -4.98 105.19 105.55 1qbm n GLY 128 Ca 0.27 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.05 1qbm n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qbm s GLY 129 N -2.00 1.88 -0.27 -0.02 0.00 -1.14 -0.11 107.32 105.66 1qbm s GLY 129 Ca 0.00 -1.81 -0.07 0.00 0.00 0.00 0.00 44.72 42.84 1qbm s GLY 129 CO 0.00 -1.79 0.57 0.00 0.00 0.00 0.00 173.10 171.88 1qbm s ALA 130 N -2.42 -1.84 -0.14 3.20 0.00 -0.81 -2.90 121.76 116.85 1qbm s ALA 130 Ca 0.35 1.97 0.02 0.00 0.00 0.00 0.00 51.96 54.30 1qbm s ALA 130 Cb -0.03 -1.76 0.01 0.00 0.00 0.00 0.00 23.12 21.34 1qbm s ALA 130 CO 0.21 -1.00 -0.21 -1.12 0.00 0.00 0.00 175.76 173.64 1qbm s SER 131 N 2.81 3.02 -0.19 0.00 0.01 -1.26 -0.07 113.70 118.02 1qbm s SER 131 Ca 0.02 -0.58 -0.11 0.00 1.31 0.00 0.00 55.95 56.58 1qbm s SER 131 Cb -0.13 -1.40 -0.05 0.00 0.21 0.00 0.00 66.02 64.66 1qbm s SER 131 CO -0.18 0.07 0.17 -0.69 0.41 0.00 0.00 173.24 173.02 1qbm s VAL 132 N 0.87 5.38 0.20 3.43 1.01 -0.66 -3.65 120.40 126.99 1qbm s VAL 132 Ca -0.06 0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.27 1qbm s VAL 132 Cb -0.15 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1qbm s VAL 132 CO -0.03 0.42 0.03 -0.69 0.00 0.00 0.00 175.10 174.83 1qbm s VAL 133 N 0.43 3.79 -0.15 2.92 1.01 -0.49 -1.26 120.40 126.65 1qbm s VAL 133 Ca 0.10 -1.49 -0.05 0.00 0.00 0.00 0.00 61.98 60.55 1qbm s VAL 133 Cb -0.12 -2.94 0.07 0.00 0.00 0.00 0.00 36.38 33.40 1qbm s VAL 133 CO -0.00 -0.18 0.27 0.00 0.00 0.00 0.00 175.10 175.19 1qbm s PHE 135 N 2.42 3.27 -0.46 0.00 0.08 0.10 -0.32 117.98 123.08 1qbm s PHE 135 Ca 0.03 0.10 0.02 0.00 0.12 0.00 0.00 56.93 57.19 1qbm s PHE 135 Cb -0.13 -2.12 0.12 0.00 -0.57 0.00 0.00 43.02 40.33 1qbm s PHE 135 CO -0.10 0.14 0.22 -0.51 -0.10 0.00 0.00 175.22 174.88 1qbm s LEU 136 N 0.50 4.79 0.18 -0.37 1.02 0.73 -0.62 118.68 124.91 1qbm s LEU 136 Ca 0.04 -2.55 -0.01 0.00 0.02 0.00 0.00 54.13 51.63 1qbm s LEU 136 Cb -0.12 -1.71 -0.04 0.00 0.02 0.00 0.00 46.19 44.33 1qbm s LEU 136 CO 0.00 -0.36 0.37 0.20 0.02 0.00 0.00 176.35 176.58 1qbm s ASN 137 N 0.63 6.39 -0.90 2.29 0.02 -0.54 0.06 114.94 122.90 1qbm s ASN 137 Ca 0.14 0.40 -0.06 0.00 -1.02 0.00 0.00 52.86 52.31 1qbm s ASN 137 Cb -0.22 -2.01 0.01 0.00 0.02 0.00 0.00 41.25 39.05 1qbm s ASN 137 CO -0.04 -0.01 0.61 0.59 0.02 0.00 0.00 177.10 178.28 1qbm n ASN 138 N -0.49 -4.69 -4.58 -1.22 4.13 -0.24 -0.60 115.26 107.58 1qbm n ASN 138 Ca -0.05 -1.04 -0.27 0.00 1.68 0.00 0.00 54.58 54.91 1qbm n ASN 138 Cb 0.53 -1.62 -0.11 0.00 -1.54 0.00 0.00 39.78 37.05 1qbm n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1qbm s PHE 139 N -3.08 2.40 -0.29 3.10 -0.12 0.24 -4.49 117.98 115.75 1qbm s PHE 139 Ca 0.08 -0.68 -0.20 0.00 -0.05 0.00 0.00 56.93 56.09 1qbm s PHE 139 Cb -0.05 -1.62 0.14 0.00 -0.63 0.00 0.00 43.02 40.86 1qbm s PHE 139 CO 0.91 0.41 1.00 -0.47 -0.05 0.00 0.00 175.22 177.02 1qbm s TYR 140 N -2.78 -0.53 1.29 3.49 6.14 0.18 0.82 117.35 125.96 1qbm s TYR 140 Ca 0.35 1.15 -0.20 0.00 0.64 0.00 0.00 57.07 59.01 1qbm s TYR 140 Cb 0.08 0.36 0.32 0.00 0.42 0.00 0.00 41.96 43.15 1qbm s TYR 140 CO 0.17 -0.26 1.02 -1.25 0.64 0.00 0.00 175.55 175.87 1qbm s PRO 141 N 0.86 -1.91 0.00 4.97 0.04 -1.26 -0.74 135.00 136.95 1qbm s PRO 141 Ca -0.04 0.11 0.30 0.00 0.04 0.00 0.00 61.00 61.41 1qbm s PRO 141 Cb -0.04 -1.50 1.40 0.00 0.04 0.00 0.00 34.50 34.40 1qbm s PRO 141 CO -0.12 -4.20 1.97 0.36 0.04 0.00 0.00 177.00 175.05 1qbm n LYS 142 N -5.14 0.57 -2.15 4.56 0.00 -1.26 -4.77 118.16 109.96 1qbm n LYS 142 Ca 0.12 -0.10 -0.43 0.00 -0.00 0.00 0.00 58.31 57.90 1qbm n LYS 142 Cb 0.59 -1.50 -0.02 0.00 -0.00 0.00 0.00 35.03 34.10 1qbm n LYS 142 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1qbm s ASP 143 N -2.50 6.45 -0.04 -5.58 1.11 -1.26 -4.94 116.67 109.91 1qbm s ASP 143 Ca 0.29 1.62 -0.17 0.00 0.18 0.00 0.00 52.55 54.48 1qbm s ASP 143 Cb 0.20 -2.53 0.03 0.00 1.07 0.00 0.00 42.92 41.69 1qbm s ASP 143 CO 0.47 -1.20 0.37 -0.51 1.18 0.00 0.00 175.17 175.48 1qbm s ILE 144 N 4.97 0.04 -0.14 0.77 2.07 -1.26 -4.28 121.20 123.37 1qbm s ILE 144 Ca 0.69 -0.35 -0.02 0.00 -1.41 0.00 0.00 60.65 59.56 1qbm s ILE 144 Cb -0.24 -0.66 0.04 0.00 0.13 0.00 0.00 42.46 41.73 1qbm s ILE 144 CO 0.28 -0.19 -0.00 0.21 -1.91 0.00 0.00 174.94 173.32 1qbm s ASN 145 N -1.12 2.43 0.01 4.50 3.84 -0.23 -4.96 114.94 119.42 1qbm s ASN 145 Ca -0.12 -0.52 -0.09 0.00 0.21 0.00 0.00 52.86 52.34 1qbm s ASN 145 Cb -0.04 -0.64 -0.05 0.00 -0.55 0.00 0.00 41.25 39.96 1qbm s ASN 145 CO 0.05 -0.23 0.32 -0.69 -2.79 0.00 0.00 177.10 173.76 1qbm s VAL 146 N 1.83 5.21 -0.04 -5.21 1.01 -1.26 -0.87 120.40 121.07 1qbm s VAL 146 Ca 0.02 0.40 -0.01 0.00 0.00 0.00 0.00 61.98 62.39 1qbm s VAL 146 Cb -0.15 -3.60 0.03 0.00 0.00 0.00 0.00 36.38 32.66 1qbm s VAL 146 CO -0.07 0.42 0.05 -0.54 0.00 0.00 0.00 175.10 174.97 1qbm s LYS 147 N -1.56 -0.07 0.28 2.72 1.02 1.00 -4.95 119.74 118.19 1qbm s LYS 147 Ca 0.27 0.33 -0.06 0.00 0.02 0.00 0.00 55.97 56.53 1qbm s LYS 147 Cb -0.14 -0.43 -0.06 0.00 -0.52 0.00 0.00 37.83 36.68 1qbm s LYS 147 CO 0.15 -0.29 0.57 -1.58 -0.92 0.00 0.00 175.35 173.28 1qbm s TRP 148 N 1.87 3.47 -0.06 3.18 0.52 -1.26 0.08 118.94 126.73 1qbm s TRP 148 Ca 0.01 0.72 -0.07 0.00 0.02 0.00 0.00 56.10 56.78 1qbm s TRP 148 Cb -0.12 -2.16 0.02 0.00 -1.15 0.00 0.00 33.47 30.05 1qbm s TRP 148 CO -0.03 0.18 0.19 0.15 0.02 0.00 0.00 176.95 177.46 1qbm s LYS 149 N -3.40 0.29 -0.33 4.98 1.02 -0.52 -1.58 119.74 120.19 1qbm s LYS 149 Ca 0.45 0.15 0.01 0.00 0.02 0.00 0.00 55.97 56.60 1qbm s LYS 149 Cb -0.11 0.13 0.10 0.00 -0.52 0.00 0.00 37.83 37.44 1qbm s LYS 149 CO 0.28 -0.05 0.08 0.42 -0.92 0.00 0.00 175.35 175.17 1qbm s ILE 150 N -0.19 1.53 -0.77 2.17 1.01 0.55 -1.81 121.20 123.69 1qbm s ILE 150 Ca -0.03 -1.87 -0.02 0.00 0.00 0.00 0.00 60.65 58.73 1qbm s ILE 150 Cb -0.03 -2.14 -0.02 0.00 0.01 0.00 0.00 42.46 40.28 1qbm s ILE 150 CO 0.01 -0.65 0.66 0.47 0.00 0.00 0.00 174.94 175.42 1qbm n ASP 151 N 4.53 -3.45 0.00 3.58 8.00 0.80 -2.66 116.55 127.36 1qbm n ASP 151 Ca 0.01 -0.45 0.00 0.00 0.71 0.00 0.00 54.79 55.06 1qbm n ASP 151 Cb 0.42 -3.68 0.00 0.00 -0.02 0.00 0.00 41.12 37.84 1qbm n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qbm n GLY 152 N -1.19 1.10 3.68 0.44 0.00 -1.26 -4.92 105.19 103.04 1qbm n GLY 152 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 1qbm n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qbm s SER 153 N -2.74 6.47 0.73 1.61 0.01 -1.09 -5.02 113.70 113.68 1qbm s SER 153 Ca 0.00 0.56 -0.16 0.00 1.31 0.00 0.00 55.95 57.66 1qbm s SER 153 Cb 0.00 -2.24 0.02 0.00 0.21 0.00 0.00 66.02 64.01 1qbm s SER 153 CO 0.00 -0.06 1.07 1.21 0.41 0.00 0.00 173.24 175.87 1qbm n GLU 154 N 4.34 0.53 -3.64 12.44 2.13 -1.26 -0.33 120.64 134.85 1qbm n GLU 154 Ca -0.08 0.24 -0.25 0.00 0.66 0.00 0.00 57.16 57.73 1qbm n GLU 154 Cb 0.51 -2.32 -0.17 0.00 0.27 0.00 0.00 31.44 29.73 1qbm n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1qbm s ARG 155 N -3.52 0.13 -0.15 5.31 6.06 -0.61 -4.74 118.95 121.43 1qbm s ARG 155 Ca 0.75 -0.03 0.03 0.00 -2.50 0.00 0.00 55.73 53.98 1qbm s ARG 155 Cb -0.34 -1.58 -0.23 0.00 0.06 0.00 0.00 34.95 32.86 1qbm s ARG 155 CO 0.49 -0.59 0.23 1.04 -2.50 0.00 0.00 175.30 173.97 1qbm n GLN 156 N 5.25 0.70 -3.53 5.12 6.02 -1.26 -4.26 117.38 125.41 1qbm n GLN 156 Ca -0.06 0.20 -0.32 0.00 -0.01 0.00 0.00 57.00 56.81 1qbm n GLN 156 Cb 0.49 -1.65 -0.05 0.00 1.02 0.00 0.00 30.24 30.05 1qbm n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1qbm s ASN 157 N -6.48 6.57 0.00 1.08 -0.87 -1.26 -4.07 114.94 109.91 1qbm s ASN 157 Ca -0.20 0.77 0.00 0.00 -1.57 0.00 0.00 52.86 51.86 1qbm s ASN 157 Cb 0.07 -2.17 0.00 0.00 -0.02 0.00 0.00 41.25 39.14 1qbm s ASN 157 CO 0.75 -0.01 0.00 0.61 -2.57 0.00 0.00 177.10 175.88 1qbm n GLY 158 N 0.01 1.08 3.72 0.66 0.00 -1.26 -4.84 105.19 104.56 1qbm n GLY 158 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1qbm n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qbm s VAL 159 N -2.23 4.82 -0.22 1.61 1.01 -1.25 0.29 120.40 124.43 1qbm s VAL 159 Ca 0.00 1.84 0.00 0.00 0.00 0.00 0.00 61.98 63.82 1qbm s VAL 159 Cb 0.00 -4.22 0.06 0.00 0.00 0.00 0.00 36.38 32.22 1qbm s VAL 159 CO 0.00 0.25 -0.04 -0.22 0.00 0.00 0.00 175.10 175.08 1qbm s LEU 160 N 0.58 2.23 0.07 3.92 1.98 0.19 -4.93 118.68 122.72 1qbm s LEU 160 Ca 0.45 -1.04 0.04 0.00 -2.89 0.00 0.00 54.13 50.70 1qbm s LEU 160 Cb -0.21 -1.07 -0.04 0.00 0.66 0.00 0.00 46.19 45.54 1qbm s LEU 160 CO 0.25 -0.23 -0.02 0.20 -1.89 0.00 0.00 176.35 174.66 1qbm s ASN 161 N 1.49 4.95 0.05 3.68 0.01 -1.26 -0.21 114.94 123.65 1qbm s ASN 161 Ca -0.04 -0.17 -0.06 0.00 -0.71 0.00 0.00 52.86 51.88 1qbm s ASN 161 Cb -0.18 -1.18 -0.01 0.00 0.41 0.00 0.00 41.25 40.29 1qbm s ASN 161 CO -0.07 0.20 0.12 -0.55 -1.51 0.00 0.00 177.10 175.29 1qbm s SER 162 N -2.11 0.19 0.01 -1.22 0.15 -0.28 -4.99 113.70 105.46 1qbm s SER 162 Ca 0.24 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.28 1qbm s SER 162 Cb -0.12 0.26 -0.01 0.00 -1.71 0.00 0.00 66.02 64.44 1qbm s SER 162 CO 0.16 -0.59 -0.02 0.26 1.20 0.00 0.00 173.24 174.25 1qbm s TRP 163 N -3.12 0.17 0.54 3.44 0.51 -1.26 -1.40 118.94 117.83 1qbm s TRP 163 Ca -0.01 -0.29 0.00 0.00 -2.12 0.00 0.00 56.10 53.69 1qbm s TRP 163 Cb 0.02 -0.12 0.03 0.00 -0.81 0.00 0.00 33.47 32.59 1qbm s TRP 163 CO -0.07 -0.10 0.78 0.95 -0.51 0.00 0.00 176.95 178.00 1qbm s THR 164 N -0.79 2.91 0.39 2.01 -4.23 -0.94 -5.02 115.64 109.96 1qbm s THR 164 Ca -0.08 -0.59 0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1qbm s THR 164 Cb -0.05 -3.10 -0.02 0.00 1.34 0.00 0.00 72.50 70.66 1qbm s THR 164 CO -0.00 -0.07 0.60 1.51 -0.54 0.00 0.00 174.62 176.11 1qbm s ASP 165 N -4.39 6.12 -0.42 3.99 -4.77 -1.26 -4.56 116.67 111.38 1qbm s ASP 165 Ca 0.56 0.40 -0.41 0.00 -3.30 0.00 0.00 52.55 49.79 1qbm s ASP 165 Cb -0.10 -1.84 -0.17 0.00 -1.09 0.00 0.00 42.92 39.72 1qbm s ASP 165 CO 0.39 -0.46 2.01 1.67 0.70 0.00 0.00 175.17 179.48 1qbm n GLN 166 N -1.91 0.47 -1.50 2.11 7.27 -1.26 -4.84 117.38 117.73 1qbm n GLN 166 Ca -0.02 0.15 -0.46 0.00 0.07 0.00 0.00 57.00 56.74 1qbm n GLN 166 Cb 0.57 -1.86 -0.02 0.00 2.41 0.00 0.00 30.24 31.34 1qbm n GLN 166 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 1qbm n ASP 167 N 7.28 0.08 0.01 1.69 -0.08 -0.54 -4.78 116.55 120.21 1qbm n ASP 167 Ca 0.43 1.13 -0.11 0.00 -1.51 0.00 0.00 54.79 54.74 1qbm n ASP 167 Cb 0.06 -1.14 0.02 0.00 2.34 0.00 0.00 41.12 42.40 1qbm n ASP 167 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 1qbm h SER 168 N 1.48 0.64 0.81 1.67 4.64 -1.92 -0.46 113.55 120.42 1qbm h SER 168 Ca -0.35 -0.38 0.00 0.00 -0.47 0.00 0.00 61.79 60.59 1qbm h SER 168 Cb 1.38 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1qbm h SER 168 CO 0.58 1.12 -0.96 2.29 -0.87 0.00 0.00 176.83 178.99 1qbm n LYS 169 N -3.92 0.46 0.00 4.77 2.85 -1.26 -4.56 118.16 116.51 1qbm n LYS 169 Ca -0.04 0.07 0.00 0.00 -1.05 0.00 0.00 58.31 57.29 1qbm n LYS 169 Cb 0.66 -1.73 0.00 0.00 -0.65 0.00 0.00 35.03 33.31 1qbm n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1qbm n ASP 170 N -2.37 0.14 -1.49 -5.58 5.75 -1.25 -5.04 116.55 106.72 1qbm n ASP 170 Ca 0.01 -1.03 -0.16 0.00 -0.01 0.00 0.00 54.79 53.60 1qbm n ASP 170 Cb 0.50 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.52 1qbm n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1qbm n SER 171 N -0.01 -4.24 -4.85 -1.12 7.64 -0.18 -4.94 113.62 105.91 1qbm n SER 171 Ca 0.00 0.39 -0.22 0.00 1.01 0.00 0.00 58.87 60.05 1qbm n SER 171 Cb 0.28 -3.86 0.07 0.00 -1.01 0.00 0.00 64.21 59.70 1qbm n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1qbm s THR 172 N -2.37 2.41 0.49 0.44 -4.23 -1.26 -4.54 115.64 106.59 1qbm s THR 172 Ca 0.00 -0.61 0.05 0.00 -1.18 0.00 0.00 61.69 59.95 1qbm s THR 172 Cb 0.00 -2.80 -0.00 0.00 1.34 0.00 0.00 72.50 71.03 1qbm s THR 172 CO 0.00 0.00 0.22 -0.31 -0.54 0.00 0.00 174.62 173.99 1qbm s TYR 173 N -2.95 2.00 -0.09 3.99 1.51 0.24 -1.47 117.35 120.58 1qbm s TYR 173 Ca 0.61 -0.79 -0.22 0.00 -1.01 0.00 0.00 57.07 55.66 1qbm s TYR 173 Cb -0.08 -1.85 0.05 0.00 -0.11 0.00 0.00 41.96 39.97 1qbm s TYR 173 CO 0.41 -0.07 0.52 -1.12 -1.11 0.00 0.00 175.55 174.18 1qbm s SER 174 N -4.05 -0.49 0.03 2.29 0.01 -1.26 -0.59 113.70 109.64 1qbm s SER 174 Ca 0.28 0.66 0.00 0.00 1.31 0.00 0.00 55.95 58.21 1qbm s SER 174 Cb 0.01 0.67 -0.03 0.00 0.21 0.00 0.00 66.02 66.88 1qbm s SER 174 CO 0.17 -0.42 -0.04 -0.32 0.41 0.00 0.00 173.24 173.04 1qbm s MET 175 N -0.72 0.44 -0.06 12.44 0.00 0.11 -2.22 119.30 129.29 1qbm s MET 175 Ca -0.08 -0.82 -0.01 0.00 0.00 0.00 0.00 55.69 54.78 1qbm s MET 175 Cb -0.03 0.08 0.03 0.00 0.00 0.00 0.00 34.83 34.90 1qbm s MET 175 CO 0.05 -0.05 0.00 0.45 0.00 0.00 0.00 175.02 175.47 1qbm s SER 176 N -1.92 1.36 -0.11 1.11 0.15 -0.49 -0.19 113.70 113.61 1qbm s SER 176 Ca -0.08 -0.07 0.02 0.00 0.70 0.00 0.00 55.95 56.52 1qbm s SER 176 Cb -0.05 -0.39 -0.01 0.00 -1.71 0.00 0.00 66.02 63.86 1qbm s SER 176 CO -0.03 -0.17 -0.19 -0.55 1.20 0.00 0.00 173.24 173.49 1qbm s SER 177 N 1.78 3.54 -0.13 5.45 0.15 0.57 -1.12 113.70 123.94 1qbm s SER 177 Ca 0.02 -0.44 0.02 0.00 0.70 0.00 0.00 55.95 56.25 1qbm s SER 177 Cb -0.13 -1.45 0.01 0.00 -1.71 0.00 0.00 66.02 62.75 1qbm s SER 177 CO -0.04 0.17 -0.18 -0.89 1.20 0.00 0.00 173.24 173.50 1qbm s THR 178 N 0.28 1.77 -0.25 6.45 2.01 0.70 -1.00 115.64 125.60 1qbm s THR 178 Ca -0.13 -0.80 -0.13 0.00 0.31 0.00 0.00 61.69 60.94 1qbm s THR 178 Cb -0.17 -1.60 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 1qbm s THR 178 CO 0.07 0.49 0.29 -0.22 -0.69 0.00 0.00 174.62 174.56 1qbm s LEU 179 N 1.01 4.08 -0.32 4.42 0.20 -0.39 0.55 118.68 128.23 1qbm s LEU 179 Ca -0.04 0.23 -0.08 0.00 0.69 0.00 0.00 54.13 54.93 1qbm s LEU 179 Cb -0.15 -2.30 0.02 0.00 -0.43 0.00 0.00 46.19 43.32 1qbm s LEU 179 CO -0.04 -0.08 0.12 -0.89 -0.29 0.00 0.00 176.35 175.17 1qbm s THR 180 N 1.62 4.13 0.51 3.68 2.01 0.14 -1.65 115.64 126.08 1qbm s THR 180 Ca 0.12 -0.76 0.05 0.00 0.31 0.00 0.00 61.69 61.41 1qbm s THR 180 Cb -0.15 -3.19 0.01 0.00 0.01 0.00 0.00 72.50 69.17 1qbm s THR 180 CO 0.08 -0.02 0.26 -0.76 -0.69 0.00 0.00 174.62 173.49 1qbm s LEU 181 N 1.51 2.70 0.26 4.42 1.43 0.91 -4.68 118.68 125.23 1qbm s LEU 181 Ca 0.02 -1.30 0.06 0.00 -1.03 0.00 0.00 54.13 51.87 1qbm s LEU 181 Cb -0.18 -1.15 -0.03 0.00 0.03 0.00 0.00 46.19 44.87 1qbm s LEU 181 CO 0.04 -0.92 0.35 0.42 0.23 0.00 0.00 176.35 176.47 1qbm s THR 182 N -2.76 4.82 0.16 5.49 -4.23 -1.26 -1.92 115.64 115.94 1qbm s THR 182 Ca 0.29 -1.08 -0.14 0.00 -1.18 0.00 0.00 61.69 59.58 1qbm s THR 182 Cb -0.00 -3.67 0.05 0.00 1.34 0.00 0.00 72.50 70.22 1qbm s THR 182 CO 0.17 -0.29 1.75 0.50 -0.54 0.00 0.00 174.62 176.20 1qbm h LYS 183 N 1.18 0.74 -0.73 3.99 3.64 -0.74 -0.48 116.57 124.16 1qbm h LYS 183 Ca -0.50 -0.10 0.16 0.00 -1.27 0.00 0.00 60.65 58.93 1qbm h LYS 183 Cb 1.24 -0.13 -0.13 0.00 -0.41 0.00 0.00 32.23 32.79 1qbm h LYS 183 CO 0.59 0.60 -0.08 -0.44 -2.27 0.00 0.00 179.45 177.85 1qbm h ASP 184 N 0.68 -0.50 -0.02 4.20 3.32 -1.95 0.22 116.42 122.38 1qbm h ASP 184 Ca 0.18 0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.42 1qbm h ASP 184 Cb 0.10 0.39 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 1qbm h ASP 184 CO -0.02 -0.21 -0.02 -0.08 -1.72 0.00 0.00 179.24 177.19 1qbm h GLU 185 N 0.05 0.04 -0.32 3.56 4.81 -1.89 -3.21 114.58 117.62 1qbm h GLU 185 Ca 0.38 -0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.65 1qbm h GLU 185 Cb 0.62 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.93 1qbm h GLU 185 CO -0.70 0.57 -0.21 -0.92 -0.73 0.00 0.00 179.01 177.03 1qbm h TYR 186 N -0.48 -0.53 0.00 0.92 3.20 0.38 -0.46 116.97 120.00 1qbm h TYR 186 Ca 0.00 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.91 1qbm h TYR 186 Cb 0.57 0.28 0.00 0.00 1.54 0.00 0.00 36.73 39.12 1qbm h TYR 186 CO 0.11 -0.28 0.00 0.39 -1.64 0.00 0.00 178.16 176.74 1qbm n GLU 187 N -5.37 0.89 0.00 1.82 1.02 0.61 -2.29 120.64 117.33 1qbm n GLU 187 Ca 0.01 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.19 1qbm n GLU 187 Cb 0.28 -1.20 0.02 0.00 -0.02 0.00 0.00 31.44 30.51 1qbm n GLU 187 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1qbm n ARG 188 N -0.24 1.22 -4.30 3.49 0.63 -0.19 -5.01 116.66 112.26 1qbm n ARG 188 Ca 0.00 -0.76 -0.16 0.00 -0.92 0.00 0.00 57.85 56.01 1qbm n ARG 188 Cb 0.10 -1.09 -0.10 0.00 0.45 0.00 0.00 32.46 31.82 1qbm n ARG 188 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 1qbm s HIS 189 N -0.94 1.46 0.00 -0.14 3.76 -0.97 -5.09 115.29 113.37 1qbm s HIS 189 Ca 0.08 -1.01 0.00 0.00 -0.15 0.00 0.00 55.06 53.98 1qbm s HIS 189 Cb 0.07 -0.85 0.00 0.00 1.11 0.00 0.00 32.58 32.91 1qbm s HIS 189 CO 0.15 -0.16 0.00 0.09 -0.85 0.00 0.00 174.74 173.98 1qbm n ASN 190 N -0.38 4.11 -4.43 1.40 4.13 -1.26 -4.66 115.26 114.16 1qbm n ASN 190 Ca -0.04 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 55.85 1qbm n ASN 190 Cb 0.64 0.13 -0.13 0.00 -1.54 0.00 0.00 39.78 38.89 1qbm n ASN 190 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1qbm s SER 191 N -3.68 5.10 -0.28 6.41 0.15 -1.26 0.16 113.70 120.31 1qbm s SER 191 Ca 0.00 -0.27 -0.02 0.00 0.70 0.00 0.00 55.95 56.36 1qbm s SER 191 Cb 0.00 -1.91 0.04 0.00 -1.71 0.00 0.00 66.02 62.43 1qbm s SER 191 CO 0.00 -0.05 -0.02 -0.31 1.20 0.00 0.00 173.24 174.06 1qbm s TYR 192 N 1.60 3.17 0.08 3.44 2.02 -0.95 -0.14 117.35 126.57 1qbm s TYR 192 Ca 0.06 -1.65 0.09 0.00 -0.37 0.00 0.00 57.07 55.20 1qbm s TYR 192 Cb -0.15 -2.10 -0.03 0.00 -0.40 0.00 0.00 41.96 39.27 1qbm s TYR 192 CO 0.03 -0.75 -0.25 0.95 -1.57 0.00 0.00 175.55 173.97 1qbm s THR 193 N 1.31 2.01 -0.17 -0.71 -4.23 -0.75 -2.22 115.64 110.88 1qbm s THR 193 Ca -0.02 -1.49 0.01 0.00 -1.18 0.00 0.00 61.69 59.01 1qbm s THR 193 Cb -0.18 -1.76 0.01 0.00 1.34 0.00 0.00 72.50 71.91 1qbm s THR 193 CO -0.02 0.18 -0.19 0.00 -0.54 0.00 0.00 174.62 174.06 1qbm s GLU 195 N 1.19 3.23 -0.16 0.00 2.02 0.11 -1.79 118.70 123.29 1qbm s GLU 195 Ca 0.02 -0.73 -0.05 0.00 0.02 0.00 0.00 54.97 54.24 1qbm s GLU 195 Cb -0.14 -3.04 -0.03 0.00 0.10 0.00 0.00 34.13 31.02 1qbm s GLU 195 CO -0.09 -0.27 -0.01 0.00 0.02 0.00 0.00 175.26 174.91 1qbm s ALA 196 N 1.45 3.13 -0.23 5.21 0.00 0.34 -0.00 121.76 131.66 1qbm s ALA 196 Ca 0.04 -0.79 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 1qbm s ALA 196 Cb -0.15 -1.67 0.03 0.00 0.00 0.00 0.00 23.12 21.32 1qbm s ALA 196 CO -0.03 0.21 -0.10 0.99 0.00 0.00 0.00 175.76 176.83 1qbm s THR 197 N 0.35 2.66 0.25 0.00 2.01 -0.05 -0.17 115.64 120.67 1qbm s THR 197 Ca -0.02 -1.03 0.02 0.00 0.31 0.00 0.00 61.69 60.98 1qbm s THR 197 Cb -0.14 -2.31 -0.05 0.00 0.01 0.00 0.00 72.50 70.01 1qbm s THR 197 CO 0.02 0.27 0.06 -2.28 -0.69 0.00 0.00 174.62 172.00 1qbm s HIS 198 N 1.31 1.53 0.47 4.92 2.46 -1.26 -1.07 115.29 123.65 1qbm s HIS 198 Ca 0.01 -1.08 0.20 0.00 0.47 0.00 0.00 55.06 54.65 1qbm s HIS 198 Cb -0.16 -0.90 1.25 0.00 -0.13 0.00 0.00 32.58 32.64 1qbm s HIS 198 CO -0.06 -0.23 2.07 -0.22 -2.47 0.00 0.00 174.74 173.83 1qbm h LYS 199 N 2.43 0.00 0.00 2.88 3.64 -1.93 -3.05 116.57 120.54 1qbm h LYS 199 Ca -0.38 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1qbm h LYS 199 Cb 1.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.05 1qbm h LYS 199 CO 0.63 0.12 0.00 0.25 -2.27 0.00 0.00 179.45 178.18 1qbm n THR 200 N -4.14 0.18 -3.80 1.00 -2.24 -1.26 -4.74 114.28 99.28 1qbm n THR 200 Ca -0.02 0.05 -0.13 0.00 -2.27 0.00 0.00 64.05 61.68 1qbm n THR 200 Cb 0.20 -0.63 -0.12 0.00 -2.10 0.00 0.00 70.33 67.68 1qbm n THR 200 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1qbm s SER 201 N -2.52 -0.20 0.09 3.42 0.01 -1.15 -5.00 113.70 108.34 1qbm s SER 201 Ca 0.25 0.38 -0.03 0.00 1.31 0.00 0.00 55.95 57.86 1qbm s SER 201 Cb 0.17 0.41 -0.23 0.00 0.21 0.00 0.00 66.02 66.58 1qbm s SER 201 CO 0.37 -0.09 1.19 0.00 0.41 0.00 0.00 173.24 175.13 1qbm h THR 202 N 4.79 1.50 -2.85 1.44 1.03 -1.85 -3.40 112.91 113.56 1qbm h THR 202 Ca -0.26 -2.98 -0.65 0.00 -0.01 0.00 0.00 66.41 62.52 1qbm h THR 202 Cb 1.20 2.83 -0.07 0.00 -1.07 0.00 0.00 68.15 71.04 1qbm h THR 202 CO 0.38 0.87 -0.51 -0.94 -0.01 0.00 0.00 175.52 175.31 1qbm s SER 203 N -7.09 6.19 0.33 0.00 1.04 -1.26 -4.98 113.70 107.93 1qbm s SER 203 Ca -0.04 0.32 -0.28 0.00 0.48 0.00 0.00 55.95 56.43 1qbm s SER 203 Cb 0.08 -1.92 -0.12 0.00 0.10 0.00 0.00 66.02 64.15 1qbm s SER 203 CO 0.87 0.29 1.28 -2.65 0.98 0.00 0.00 173.24 174.02 1qbm n PRO 204 N 1.21 2.07 -2.86 4.02 -0.02 -1.26 -4.90 135.00 133.25 1qbm n PRO 204 Ca -0.13 0.73 -0.42 0.00 -2.02 0.00 0.00 63.50 61.66 1qbm n PRO 204 Cb 0.53 -2.30 -0.04 0.00 -0.02 0.00 0.00 33.50 31.67 1qbm n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1qbm s ILE 205 N -1.02 4.86 0.04 4.25 1.01 0.75 -4.86 121.20 126.24 1qbm s ILE 205 Ca 0.56 1.69 0.07 0.00 0.00 0.00 0.00 60.65 62.97 1qbm s ILE 205 Cb -0.58 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 37.70 1qbm s ILE 205 CO 0.61 0.02 -0.20 0.68 0.00 0.00 0.00 174.94 176.05 1qbm s VAL 206 N 2.17 1.60 -0.04 2.92 -7.23 -1.26 -0.51 120.40 118.05 1qbm s VAL 206 Ca 0.39 -1.16 0.02 0.00 -1.81 0.00 0.00 61.98 59.42 1qbm s VAL 206 Cb -0.17 -1.40 0.02 0.00 0.56 0.00 0.00 36.38 35.40 1qbm s VAL 206 CO 0.13 0.19 -0.07 -0.54 -0.31 0.00 0.00 175.10 174.50 1qbm s LYS 207 N -1.14 1.02 0.15 4.82 -0.14 -0.74 -4.98 119.74 118.72 1qbm s LYS 207 Ca 0.07 -0.20 0.01 0.00 -1.36 0.00 0.00 55.97 54.49 1qbm s LYS 207 Cb -0.09 -0.95 -0.04 0.00 -1.68 0.00 0.00 37.83 35.07 1qbm s LYS 207 CO 0.02 -0.03 0.00 -1.12 -0.76 0.00 0.00 175.35 173.46 1qbm s SER 208 N 0.74 0.97 -0.14 2.83 0.01 -1.26 -0.61 113.70 116.25 1qbm s SER 208 Ca -0.11 -1.15 -0.17 0.00 1.31 0.00 0.00 55.95 55.83 1qbm s SER 208 Cb -0.14 0.16 0.04 0.00 0.21 0.00 0.00 66.02 66.29 1qbm s SER 208 CO 0.01 -0.59 0.45 0.72 0.41 0.00 0.00 173.24 174.24 1qbm s PHE 209 N -3.75 -0.46 -0.14 2.43 -0.12 -0.94 -5.01 117.98 109.99 1qbm s PHE 209 Ca 0.22 1.07 -0.07 0.00 -0.05 0.00 0.00 56.93 58.10 1qbm s PHE 209 Cb 0.06 0.18 -0.04 0.00 -0.63 0.00 0.00 43.02 42.59 1qbm s PHE 209 CO 0.02 -0.29 0.10 -0.80 -0.05 0.00 0.00 175.22 174.20 1qbm s ASN 210 N -0.10 6.02 0.08 1.98 0.02 -1.25 -2.23 114.94 119.45 1qbm s ASN 210 Ca -0.03 0.30 -0.27 0.00 -1.02 0.00 0.00 52.86 51.84 1qbm s ASN 210 Cb -0.03 -1.95 -0.17 0.00 0.02 0.00 0.00 41.25 39.12 1qbm s ASN 210 CO 0.02 0.32 1.69 -0.09 0.02 0.00 0.00 177.10 179.05 1qbm h ARG 211 N 5.63 -0.33 -0.90 -0.60 2.43 -0.55 -3.11 114.38 116.95 1qbm h ARG 211 Ca -0.48 0.02 -0.36 0.00 -0.81 0.00 0.00 59.98 58.35 1qbm h ARG 211 Cb 1.20 0.07 -0.21 0.00 -0.42 0.00 0.00 29.97 30.61 1qbm h ARG 211 CO 0.63 -0.21 0.46 0.09 -1.51 0.00 0.00 179.97 179.42 1qbm n ASN 212 N -5.23 4.13 -3.58 -3.80 5.03 -1.26 -4.48 115.26 106.07 1qbm n ASN 212 Ca -0.09 -3.33 -0.29 0.00 0.87 0.00 0.00 54.58 51.73 1qbm n ASN 212 Cb 0.16 -0.78 -0.08 0.00 -1.02 0.00 0.00 39.78 38.06 1qbm n ASN 212 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1qbm n GLU 213 N -0.62 2.60 0.00 3.52 1.02 -1.18 -5.21 120.64 120.78 1qbm n GLU 213 Ca 0.48 -4.63 0.00 0.00 -0.02 0.00 0.00 57.16 52.99 1qbm n GLU 213 Cb 1.48 -2.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.60 1qbm n GLU 213 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31