#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xgy s ILE 2 N 0.00 4.04 -0.16 0.53 -1.09 -1.26 -5.02 121.20 118.24 1xgy s ILE 2 Ca 0.00 1.49 -0.06 0.00 -2.23 0.00 0.00 60.65 59.86 1xgy s ILE 2 Cb 0.00 -3.96 -0.04 0.00 -1.58 0.00 0.00 42.46 36.89 1xgy s ILE 2 CO 0.00 0.13 0.04 -0.69 -1.23 0.00 0.00 174.94 173.19 1xgy s VAL 3 N 0.90 4.60 -0.20 2.92 1.01 -1.26 -4.84 120.40 123.53 1xgy s VAL 3 Ca 0.57 -0.11 -0.04 0.00 0.00 0.00 0.00 61.98 62.40 1xgy s VAL 3 Cb -0.29 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.04 1xgy s VAL 3 CO 0.30 0.50 -0.02 -0.04 0.00 0.00 0.00 175.10 175.84 1xgy s MET 4 N 0.04 3.54 -0.16 2.72 -1.94 -1.26 -0.46 119.30 121.78 1xgy s MET 4 Ca 0.04 -0.56 -0.02 0.00 -1.71 0.00 0.00 55.69 53.44 1xgy s MET 4 Cb -0.12 -3.03 -0.02 0.00 2.01 0.00 0.00 34.83 33.67 1xgy s MET 4 CO 0.01 -0.03 -0.08 0.99 -0.01 0.00 0.00 175.02 175.91 1xgy s THR 5 N 1.07 3.46 0.10 2.05 2.01 -0.06 -4.33 115.64 119.93 1xgy s THR 5 Ca 0.02 -0.51 0.01 0.00 0.31 0.00 0.00 61.69 61.53 1xgy s THR 5 Cb -0.14 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 69.82 1xgy s THR 5 CO 0.01 0.49 -0.05 -1.10 -0.69 0.00 0.00 174.62 173.28 1xgy s GLN 6 N 0.56 0.82 0.59 4.92 -0.21 -1.26 -1.93 119.66 123.16 1xgy s GLN 6 Ca -0.05 -1.34 -0.08 0.00 0.02 0.00 0.00 55.36 53.92 1xgy s GLN 6 Cb -0.15 -0.15 -0.01 0.00 1.00 0.00 0.00 33.01 33.70 1xgy s GLN 6 CO 0.03 -0.04 0.94 0.00 -2.12 0.00 0.00 175.29 174.10 1xgy s ALA 7 N -3.67 3.20 0.14 6.09 0.00 -1.26 -4.76 121.76 121.49 1xgy s ALA 7 Ca 0.12 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1xgy s ALA 7 Cb 0.06 -2.78 -0.10 0.00 0.00 0.00 0.00 23.12 20.30 1xgy s ALA 7 CO -0.05 -0.75 1.31 0.00 0.00 0.00 0.00 175.76 176.27 1xgy h ALA 8 N -0.21 0.39 -2.93 0.00 0.00 -1.98 -3.35 119.26 111.17 1xgy h ALA 8 Ca -0.45 -0.77 -0.21 0.00 0.00 0.00 0.00 54.91 53.48 1xgy h ALA 8 Cb 1.23 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 18.76 1xgy h ALA 8 CO 0.62 0.94 -0.71 -0.06 0.00 0.00 0.00 179.25 180.04 1xgy s PHE 9 N -3.06 0.47 0.50 0.00 0.40 -1.26 -1.79 117.98 113.23 1xgy s PHE 9 Ca -0.03 -0.59 -0.04 0.00 -0.60 0.00 0.00 56.93 55.67 1xgy s PHE 9 Cb 0.09 -0.30 -0.02 0.00 0.51 0.00 0.00 43.02 43.30 1xgy s PHE 9 CO 0.85 -0.17 0.77 -1.54 0.70 0.00 0.00 175.22 175.83 1xgy s SER 10 N -1.73 5.98 0.34 1.36 1.04 -1.06 -4.90 113.70 114.73 1xgy s SER 10 Ca -0.10 0.69 -0.29 0.00 0.48 0.00 0.00 55.95 56.73 1xgy s SER 10 Cb -0.07 -1.92 -0.11 0.00 0.10 0.00 0.00 66.02 64.01 1xgy s SER 10 CO -0.02 -0.72 1.53 0.20 0.98 0.00 0.00 173.24 175.22 1xgy s ASN 11 N -4.18 6.35 -0.04 7.02 -0.87 -1.26 -4.65 114.94 117.30 1xgy s ASN 11 Ca 0.49 3.02 -0.38 0.00 -1.57 0.00 0.00 52.86 54.41 1xgy s ASN 11 Cb -0.10 -2.66 -0.17 0.00 -0.02 0.00 0.00 41.25 38.30 1xgy s ASN 11 CO 0.43 -0.90 1.43 -2.65 -2.57 0.00 0.00 177.10 172.85 1xgy n PRO 12 N 1.15 1.00 -4.45 -0.60 -0.02 -1.26 -4.79 135.00 126.02 1xgy n PRO 12 Ca 0.04 0.36 -0.34 0.00 -2.02 0.00 0.00 63.50 61.54 1xgy n PRO 12 Cb 0.38 -2.00 -0.14 0.00 -0.02 0.00 0.00 33.50 31.73 1xgy n PRO 12 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1xgy s VAL 13 N 1.37 3.34 -0.01 -1.45 1.01 -0.58 -4.75 120.40 119.33 1xgy s VAL 13 Ca 0.90 -0.54 -0.30 0.00 0.00 0.00 0.00 61.98 62.03 1xgy s VAL 13 Cb -1.04 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1xgy s VAL 13 CO 0.54 0.49 1.00 -0.89 0.00 0.00 0.00 175.10 176.24 1xgy s THR 14 N 0.65 4.80 0.51 3.92 2.01 -1.26 -0.95 115.64 125.32 1xgy s THR 14 Ca -0.05 2.01 -0.19 0.00 0.31 0.00 0.00 61.69 63.77 1xgy s THR 14 Cb -0.15 -4.29 -0.12 0.00 0.01 0.00 0.00 72.50 67.95 1xgy s THR 14 CO 0.02 0.13 0.35 0.18 -0.69 0.00 0.00 174.62 174.61 1xgy n LEU 15 N 4.09 -0.70 0.00 4.42 4.77 -1.26 -1.33 117.00 126.98 1xgy n LEU 15 Ca 0.07 0.76 0.00 0.00 -0.03 0.00 0.00 56.01 56.81 1xgy n LEU 15 Cb 0.50 -1.06 0.00 0.00 -2.33 0.00 0.00 43.42 40.53 1xgy n LEU 15 CO 0.52 -3.50 0.00 0.61 -1.33 0.00 0.00 177.39 173.69 1xgy n GLY 16 N 1.99 2.81 0.00 -0.72 0.00 -0.49 -4.96 105.19 103.82 1xgy n GLY 16 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1xgy n GLY 16 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xgy n THR 17 N -0.92 0.00 -3.73 2.61 -1.04 -0.45 -4.46 114.28 106.30 1xgy n THR 17 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 1xgy n THR 17 Cb 0.00 -1.70 -0.04 0.00 -1.82 0.00 0.00 70.33 66.77 1xgy n THR 17 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1xgy s SER 18 N -1.15 5.00 -0.04 8.00 0.01 -1.23 -1.25 113.70 123.04 1xgy s SER 18 Ca 0.00 -0.73 -0.29 0.00 1.31 0.00 0.00 55.95 56.24 1xgy s SER 18 Cb 0.00 -0.66 0.09 0.00 0.21 0.00 0.00 66.02 65.66 1xgy s SER 18 CO 0.00 -0.54 0.79 0.00 0.41 0.00 0.00 173.24 173.90 1xgy s ALA 19 N -2.45 -1.80 -0.06 1.44 0.00 -0.75 -4.86 121.76 113.28 1xgy s ALA 19 Ca 0.45 1.20 -0.09 0.00 0.00 0.00 0.00 51.96 53.52 1xgy s ALA 19 Cb -0.03 0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.13 1xgy s ALA 19 CO 0.26 -0.47 0.24 -1.54 0.00 0.00 0.00 175.76 174.25 1xgy s SER 20 N -1.65 -0.19 -0.06 0.00 1.04 -1.26 0.52 113.70 112.10 1xgy s SER 20 Ca -0.04 0.30 0.04 0.00 0.48 0.00 0.00 55.95 56.74 1xgy s SER 20 Cb -0.00 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.52 1xgy s SER 20 CO 0.01 -0.20 -0.20 -0.63 0.98 0.00 0.00 173.24 173.20 1xgy s ILE 21 N -0.40 2.56 0.42 -1.02 1.09 0.96 -4.83 121.20 119.98 1xgy s ILE 21 Ca -0.05 -0.89 0.08 0.00 -1.10 0.00 0.00 60.65 58.69 1xgy s ILE 21 Cb -0.03 -1.98 0.01 0.00 -1.06 0.00 0.00 42.46 39.40 1xgy s ILE 21 CO 0.01 0.57 0.57 -0.94 -0.10 0.00 0.00 174.94 175.05 1xgy s SER 22 N -0.30 5.62 -0.30 3.58 1.04 -1.26 -0.85 113.70 121.22 1xgy s SER 22 Ca 0.01 -0.45 -0.17 0.00 0.48 0.00 0.00 55.95 55.83 1xgy s SER 22 Cb -0.13 -0.63 0.18 0.00 0.10 0.00 0.00 66.02 65.55 1xgy s SER 22 CO 0.03 -0.77 1.15 0.00 0.98 0.00 0.00 173.24 174.63 1xgy s ARG 24 N 1.87 2.24 -0.09 0.00 3.03 -0.81 -1.19 118.95 124.01 1xgy s ARG 24 Ca -0.03 -0.95 0.03 0.00 2.03 0.00 0.00 55.73 56.81 1xgy s ARG 24 Cb -0.03 -2.36 -0.01 0.00 -1.03 0.00 0.00 34.95 31.52 1xgy s ARG 24 CO -0.15 0.53 -0.19 -1.54 -1.13 0.00 0.00 175.30 172.82 1xgy s SER 25 N -2.03 3.58 0.00 -2.89 1.04 -0.02 -0.88 113.70 112.49 1xgy s SER 25 Ca 0.21 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 56.24 1xgy s SER 25 Cb -0.11 -1.20 0.00 0.00 0.10 0.00 0.00 66.02 64.81 1xgy s SER 25 CO 0.13 0.22 0.59 -1.54 0.98 0.00 0.00 173.24 173.62 1xgy n SER 26 N 3.12 0.00 -3.51 7.02 3.41 0.39 -4.64 113.62 119.41 1xgy n SER 26 Ca -0.18 0.14 -0.15 0.00 -0.26 0.00 0.00 58.87 58.42 1xgy n SER 26 Cb 0.52 -0.14 -0.05 0.00 -0.26 0.00 0.00 64.21 64.29 1xgy n SER 26 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1xgy s LYS 27 N -2.17 1.04 0.00 4.33 2.20 -1.26 -4.91 119.74 118.97 1xgy s LYS 27 Ca 0.00 0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.68 1xgy s LYS 27 Cb 0.00 0.49 0.00 0.00 -1.51 0.00 0.00 37.83 36.81 1xgy s LYS 27 CO 0.00 -0.36 0.00 0.45 -0.36 0.00 0.00 175.35 175.08 1xgy n SER 27 N 0.57 -1.07 -0.56 1.43 2.88 -1.26 -4.83 113.62 110.78 1xgy n SER 27 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1xgy n SER 27 Cb 0.59 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.05 1xgy n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1xgy n LEU 27 N 0.00 -1.33 -4.48 2.46 7.94 -1.26 -5.07 117.00 115.26 1xgy n LEU 27 Ca 0.00 1.06 -0.27 0.00 -1.11 0.00 0.00 56.01 55.70 1xgy n LEU 27 Cb 0.00 -0.40 -0.11 0.00 0.53 0.00 0.00 43.42 43.44 1xgy n LEU 27 CO 0.00 0.10 -0.48 -2.28 -1.11 0.00 0.00 177.39 173.62 1xgy s HIS 27 N -2.75 2.42 0.46 1.96 5.65 -0.58 -4.96 115.29 117.48 1xgy s HIS 27 Ca 0.00 -0.31 0.34 0.00 0.25 0.00 0.00 55.06 55.34 1xgy s HIS 27 Cb 0.00 -1.18 1.52 0.00 -1.18 0.00 0.00 32.58 31.74 1xgy s HIS 27 CO 0.00 0.53 1.59 0.77 -0.65 0.00 0.00 174.74 176.97 1xgy h SER 27 N 3.00 0.18 0.00 9.88 0.02 -2.04 1.00 113.55 125.59 1xgy h SER 27 Ca -0.46 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 1xgy h SER 27 Cb 1.21 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.89 1xgy h SER 27 CO 0.51 -0.22 0.00 -0.46 -1.14 0.00 0.00 176.83 175.52 1xgy n ASN 28 N -4.64 0.00 0.00 3.07 0.23 -1.26 -4.88 115.26 107.77 1xgy n ASN 28 Ca 0.40 -1.15 0.00 0.00 -0.53 0.00 0.00 54.58 53.31 1xgy n ASN 28 Cb 1.60 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 39.30 1xgy n ASN 28 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xgy n GLY 29 N 0.73 0.94 3.74 4.83 0.00 0.34 -5.03 105.19 110.75 1xgy n GLY 29 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1xgy n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xgy s ILE 30 N -3.45 5.22 -0.34 -0.61 1.09 -1.25 -4.80 121.20 117.06 1xgy s ILE 30 Ca 0.00 0.76 -0.17 0.00 -1.10 0.00 0.00 60.65 60.15 1xgy s ILE 30 Cb 0.00 -3.72 -0.01 0.00 -1.06 0.00 0.00 42.46 37.67 1xgy s ILE 30 CO 0.00 0.39 0.45 -0.89 -0.10 0.00 0.00 174.94 174.79 1xgy s THR 31 N 0.33 5.08 -1.34 2.92 2.01 -1.26 -1.53 115.64 121.85 1xgy s THR 31 Ca 0.22 0.25 -0.08 0.00 0.31 0.00 0.00 61.69 62.39 1xgy s THR 31 Cb -0.14 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.44 1xgy s THR 31 CO 0.08 -0.15 2.81 -1.22 -0.69 0.00 0.00 174.62 175.44 1xgy n TYR 32 N 5.59 2.25 -4.12 4.92 4.02 -1.26 -2.96 117.16 125.60 1xgy n TYR 32 Ca -0.06 -2.82 -0.33 0.00 -0.01 0.00 0.00 57.90 54.67 1xgy n TYR 32 Cb 0.49 -2.14 -0.07 0.00 -0.02 0.00 0.00 39.34 37.59 1xgy n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1xgy s LEU 33 N -0.76 3.88 0.21 7.72 2.96 -1.26 -0.81 118.68 130.61 1xgy s LEU 33 Ca 0.64 0.15 0.03 0.00 -0.22 0.00 0.00 54.13 54.73 1xgy s LEU 33 Cb 0.20 -2.22 -0.05 0.00 0.50 0.00 0.00 46.19 44.62 1xgy s LEU 33 CO -0.08 0.29 -0.01 -0.31 -1.32 0.00 0.00 176.35 174.92 1xgy s TYR 34 N -1.16 1.44 -0.06 5.38 1.51 0.12 -0.27 117.35 124.30 1xgy s TYR 34 Ca 0.22 -0.93 0.01 0.00 -1.01 0.00 0.00 57.07 55.35 1xgy s TYR 34 Cb -0.12 -0.82 0.02 0.00 -0.11 0.00 0.00 41.96 40.93 1xgy s TYR 34 CO 0.12 -0.08 -0.05 -1.58 -1.11 0.00 0.00 175.55 172.85 1xgy s TRP 35 N -3.48 0.98 0.01 2.71 0.52 0.12 -1.34 118.94 118.46 1xgy s TRP 35 Ca 0.26 -0.35 0.07 0.00 0.02 0.00 0.00 56.10 56.11 1xgy s TRP 35 Cb 0.05 -0.86 -0.02 0.00 -1.15 0.00 0.00 33.47 31.50 1xgy s TRP 35 CO 0.07 -0.29 -0.21 0.71 0.02 0.00 0.00 176.95 177.25 1xgy s TYR 36 N 1.22 1.86 -0.07 -1.98 1.51 0.12 0.21 117.35 120.22 1xgy s TYR 36 Ca -0.06 -0.36 0.05 0.00 -1.01 0.00 0.00 57.07 55.69 1xgy s TYR 36 Cb -0.14 -1.16 -0.01 0.00 -0.11 0.00 0.00 41.96 40.55 1xgy s TYR 36 CO -0.02 0.02 -0.24 -1.17 -1.11 0.00 0.00 175.55 173.04 1xgy s LEU 37 N -0.78 2.06 -0.33 -1.29 2.96 -0.40 -0.68 118.68 120.20 1xgy s LEU 37 Ca 0.08 -0.52 0.03 0.00 -0.22 0.00 0.00 54.13 53.51 1xgy s LEU 37 Cb -0.08 -1.35 0.10 0.00 0.50 0.00 0.00 46.19 45.35 1xgy s LEU 37 CO 0.00 0.20 0.05 -1.58 -1.32 0.00 0.00 176.35 173.70 1xgy s GLN 38 N 0.07 1.42 0.40 1.98 0.74 0.29 -1.20 119.66 123.35 1xgy s GLN 38 Ca -0.10 -1.78 -0.25 0.00 0.05 0.00 0.00 55.36 53.28 1xgy s GLN 38 Cb -0.15 -3.08 -0.09 0.00 1.10 0.00 0.00 33.01 30.79 1xgy s GLN 38 CO 0.06 -0.93 1.17 1.03 -0.55 0.00 0.00 175.29 176.06 1xgy s ARG 39 N 0.98 4.08 -0.14 1.67 0.52 -1.26 -1.28 118.95 123.52 1xgy s ARG 39 Ca 0.10 1.84 -0.30 0.00 -0.52 0.00 0.00 55.73 56.85 1xgy s ARG 39 Cb -0.19 -2.69 -0.08 0.00 0.52 0.00 0.00 34.95 32.51 1xgy s ARG 39 CO -0.10 -0.30 2.11 -2.30 0.02 0.00 0.00 175.30 174.73 1xgy n PRO 40 N 0.12 2.20 0.00 3.54 -0.02 -1.26 -2.13 135.00 137.44 1xgy n PRO 40 Ca 0.04 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1xgy n PRO 40 Cb 0.46 -3.04 0.00 0.00 -0.02 0.00 0.00 33.50 30.91 1xgy n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xgy n GLY 41 N 5.31 3.39 2.25 -1.23 0.00 -1.26 -5.08 105.19 108.57 1xgy n GLY 41 Ca 0.27 -1.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 1xgy n GLY 41 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1xgy n GLN 42 N 0.00 -0.16 -3.13 1.61 6.02 -0.91 -5.11 117.38 115.71 1xgy n GLN 42 Ca 0.00 -1.44 -0.29 0.00 -0.01 0.00 0.00 57.00 55.26 1xgy n GLN 42 Cb 0.00 -0.54 -0.03 0.00 1.02 0.00 0.00 30.24 30.69 1xgy n GLN 42 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1xgy s SER 43 N -3.53 6.48 0.63 1.08 0.01 -1.26 -4.69 113.70 112.42 1xgy s SER 43 Ca 0.40 0.90 -0.18 0.00 1.31 0.00 0.00 55.95 58.38 1xgy s SER 43 Cb -0.02 -2.22 -0.02 0.00 0.21 0.00 0.00 66.02 63.97 1xgy s SER 43 CO 0.27 -0.28 1.24 -2.84 0.41 0.00 0.00 173.24 172.04 1xgy s PRO 44 N -3.68 2.69 0.06 12.44 0.02 -1.26 -4.61 135.00 140.66 1xgy s PRO 44 Ca 0.47 1.92 0.04 0.00 0.02 0.00 0.00 61.00 63.45 1xgy s PRO 44 Cb -0.11 -1.88 -0.03 0.00 0.02 0.00 0.00 34.50 32.51 1xgy s PRO 44 CO 0.30 -1.45 -0.12 1.14 -0.33 0.00 0.00 177.00 176.55 1xgy s GLN 45 N -3.43 0.71 0.02 5.54 -2.07 -0.34 -4.94 119.66 115.14 1xgy s GLN 45 Ca 0.79 -0.86 -0.25 0.00 -1.82 0.00 0.00 55.36 53.22 1xgy s GLN 45 Cb -0.33 -0.63 -0.05 0.00 -1.09 0.00 0.00 33.01 30.91 1xgy s GLN 45 CO 0.37 0.13 0.77 -1.17 -1.32 0.00 0.00 175.29 174.08 1xgy s LEU 46 N -1.64 4.42 -0.05 2.60 2.96 -1.26 -1.28 118.68 124.43 1xgy s LEU 46 Ca -0.05 1.41 -0.07 0.00 -0.22 0.00 0.00 54.13 55.21 1xgy s LEU 46 Cb -0.10 -3.23 -0.03 0.00 0.50 0.00 0.00 46.19 43.33 1xgy s LEU 46 CO 0.02 -0.03 -0.15 0.18 -1.32 0.00 0.00 176.35 175.04 1xgy n LEU 47 N 3.10 1.26 -4.31 -0.68 4.77 0.13 -4.76 117.00 116.51 1xgy n LEU 47 Ca -0.01 0.19 -0.30 0.00 -0.03 0.00 0.00 56.01 55.86 1xgy n LEU 47 Cb 0.50 -0.45 -0.16 0.00 -2.33 0.00 0.00 43.42 40.98 1xgy n LEU 47 CO 0.48 -0.31 -0.56 -0.63 -1.33 0.00 0.00 177.39 175.03 1xgy s ILE 48 N -2.33 2.01 0.06 -0.08 -1.09 -1.08 -1.65 121.20 117.04 1xgy s ILE 48 Ca -0.13 -1.14 0.04 0.00 -2.23 0.00 0.00 60.65 57.18 1xgy s ILE 48 Cb 0.03 -1.68 -0.03 0.00 -1.58 0.00 0.00 42.46 39.20 1xgy s ILE 48 CO 0.19 0.51 -0.12 -0.72 -1.23 0.00 0.00 174.94 173.57 1xgy s TYR 49 N -0.64 1.01 -1.40 3.97 -0.85 -0.03 0.12 117.35 119.52 1xgy s TYR 49 Ca 0.10 -0.47 -0.08 0.00 -0.52 0.00 0.00 57.07 56.09 1xgy s TYR 49 Cb -0.10 -0.58 0.04 0.00 0.38 0.00 0.00 41.96 41.70 1xgy s TYR 49 CO -0.00 0.00 0.99 0.54 -1.52 0.00 0.00 175.55 175.56 1xgy n ARG 50 N 1.35 -6.24 0.00 -3.49 1.74 -0.74 -1.64 116.66 107.64 1xgy n ARG 50 Ca -0.22 0.70 0.00 0.00 -0.77 0.00 0.00 57.85 57.56 1xgy n ARG 50 Cb 0.54 -5.59 0.00 0.00 -1.02 0.00 0.00 32.46 26.40 1xgy n ARG 50 CO 0.00 0.00 0.00 -0.12 -1.52 0.00 0.00 177.63 175.99 1xgy n MET 51 N -4.64 0.00 -0.14 5.56 0.00 0.62 -4.37 117.12 114.15 1xgy n MET 51 Ca -0.07 0.00 0.01 0.00 -0.00 0.00 0.00 57.70 57.64 1xgy n MET 51 Cb 0.58 -0.05 0.01 0.00 0.00 0.00 0.00 33.22 33.76 1xgy n MET 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1xgy n SER 52 N 1.86 0.52 -4.63 6.12 3.41 -1.21 -3.47 113.62 116.22 1xgy n SER 52 Ca 0.00 -1.60 -0.35 0.00 -0.26 0.00 0.00 58.87 56.67 1xgy n SER 52 Cb 0.00 -0.09 -0.10 0.00 -0.26 0.00 0.00 64.21 63.76 1xgy n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1xgy s ASN 53 N -0.66 5.44 0.53 4.04 0.01 -0.65 -4.62 114.94 119.03 1xgy s ASN 53 Ca 0.03 0.07 -0.19 0.00 -0.71 0.00 0.00 52.86 52.06 1xgy s ASN 53 Cb 0.02 -1.85 -0.07 0.00 0.41 0.00 0.00 41.25 39.76 1xgy s ASN 53 CO 0.00 0.22 1.05 -0.76 -1.51 0.00 0.00 177.10 176.10 1xgy s LEU 54 N 0.08 3.71 -0.11 0.60 1.43 -1.26 -0.85 118.68 122.28 1xgy s LEU 54 Ca 0.04 1.90 -0.06 0.00 -1.03 0.00 0.00 54.13 54.98 1xgy s LEU 54 Cb -0.13 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.51 1xgy s LEU 54 CO 0.01 -0.94 0.11 0.00 0.23 0.00 0.00 176.35 175.76 1xgy s ALA 55 N -2.15 3.77 0.08 4.21 0.00 -0.66 -4.85 121.76 122.16 1xgy s ALA 55 Ca 0.66 -0.67 -0.37 0.00 0.00 0.00 0.00 51.96 51.58 1xgy s ALA 55 Cb -0.17 -1.87 -0.18 0.00 0.00 0.00 0.00 23.12 20.90 1xgy s ALA 55 CO 0.27 0.62 1.14 0.45 0.00 0.00 0.00 175.76 178.23 1xgy n SER 56 N 1.99 0.73 0.00 0.00 2.88 -1.26 -1.04 113.62 116.92 1xgy n SER 56 Ca -0.20 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1xgy n SER 56 Cb 0.55 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 1xgy n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xgy n GLY 57 N 1.99 2.53 3.75 0.46 0.00 -1.26 -5.07 105.19 107.59 1xgy n GLY 57 Ca 0.18 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1xgy n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgy s VAL 58 N -1.75 3.50 0.43 1.61 1.01 -0.21 -4.99 120.40 120.00 1xgy s VAL 58 Ca 0.00 1.36 -0.25 0.00 0.00 0.00 0.00 61.98 63.08 1xgy s VAL 58 Cb 0.00 -3.86 -0.08 0.00 0.00 0.00 0.00 36.38 32.43 1xgy s VAL 58 CO 0.00 0.26 1.31 -2.84 0.00 0.00 0.00 175.10 173.83 1xgy s PRO 59 N -0.73 3.86 0.00 2.72 0.02 -1.26 -4.86 135.00 134.74 1xgy s PRO 59 Ca 0.50 2.16 0.14 0.00 0.02 0.00 0.00 61.00 63.82 1xgy s PRO 59 Cb -0.33 -2.68 0.78 0.00 0.02 0.00 0.00 34.50 32.29 1xgy s PRO 59 CO 0.39 -0.59 1.34 -0.25 -0.33 0.00 0.00 177.00 177.56 1xgy n ASP 60 N -0.04 0.00 0.00 2.53 8.00 -1.26 -1.93 116.55 123.84 1xgy n ASP 60 Ca 0.05 -0.15 0.08 0.00 0.71 0.00 0.00 54.79 55.48 1xgy n ASP 60 Cb 0.44 -0.16 0.45 0.00 -0.02 0.00 0.00 41.12 41.83 1xgy n ASP 60 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1xgy n ARG 61 N -1.16 0.82 -4.04 -1.24 1.74 -1.26 -4.62 116.66 106.89 1xgy n ARG 61 Ca 0.09 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.82 1xgy n ARG 61 Cb 0.09 -1.29 -0.11 0.00 -1.02 0.00 0.00 32.46 30.13 1xgy n ARG 61 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1xgy s PHE 62 N -2.00 3.18 0.19 -1.55 0.40 -0.81 0.14 117.98 117.52 1xgy s PHE 62 Ca 0.23 -0.08 0.08 0.00 -0.60 0.00 0.00 56.93 56.56 1xgy s PHE 62 Cb 0.11 -2.08 -0.04 0.00 0.51 0.00 0.00 43.02 41.51 1xgy s PHE 62 CO 0.18 0.03 -0.17 -1.12 0.70 0.00 0.00 175.22 174.84 1xgy s SER 63 N 0.59 2.70 -0.11 1.36 0.01 0.21 -4.94 113.70 113.51 1xgy s SER 63 Ca 0.02 -0.94 -0.04 0.00 1.31 0.00 0.00 55.95 56.30 1xgy s SER 63 Cb -0.13 -0.16 0.06 0.00 0.21 0.00 0.00 66.02 66.00 1xgy s SER 63 CO 0.02 -0.09 0.22 -0.83 0.41 0.00 0.00 173.24 172.96 1xgy s GLY 64 N -3.02 -0.04 0.17 3.44 0.00 -1.26 -0.72 107.32 105.90 1xgy s GLY 64 Ca 0.20 0.74 0.04 0.00 0.00 0.00 0.00 44.72 45.69 1xgy s GLY 64 CO 0.07 1.85 0.13 -1.14 0.00 0.00 0.00 173.10 174.01 1xgy n SER 65 N 5.34 -0.10 0.00 1.64 3.41 -0.78 -3.85 113.62 119.29 1xgy n SER 65 Ca -0.05 -2.10 0.00 0.00 -0.26 0.00 0.00 58.87 56.45 1xgy n SER 65 Cb 0.50 0.79 0.00 0.00 -0.26 0.00 0.00 64.21 65.23 1xgy n SER 65 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xgy n GLY 66 N -0.13 2.51 2.90 5.00 0.00 -1.26 -1.70 105.19 112.50 1xgy n GLY 66 Ca 0.03 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 1xgy n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xgy s SER 67 N 0.00 4.08 0.24 1.61 0.01 0.72 -4.94 113.70 115.42 1xgy s SER 67 Ca 0.00 -1.50 0.00 0.00 1.31 0.00 0.00 55.95 55.76 1xgy s SER 67 Cb 0.00 -1.19 0.00 0.00 0.21 0.00 0.00 66.02 65.04 1xgy s SER 67 CO 0.00 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 173.95 1xgy n GLY 68 N 4.63 0.20 0.57 3.44 0.00 -1.26 -0.47 105.19 112.30 1xgy n GLY 68 Ca -0.06 0.69 0.06 0.00 0.00 0.00 0.00 46.02 46.71 1xgy n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xgy n THR 69 N 0.00 0.65 -4.40 2.61 -2.24 -1.26 -4.76 114.28 104.88 1xgy n THR 69 Ca 0.00 -0.83 -0.33 0.00 -2.27 0.00 0.00 64.05 60.62 1xgy n THR 69 Cb 0.00 0.75 -0.16 0.00 -2.10 0.00 0.00 70.33 68.83 1xgy n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1xgy s ASP 70 N -0.97 3.36 0.38 3.42 1.01 0.38 -0.84 116.67 123.40 1xgy s ASP 70 Ca 0.19 -0.57 0.04 0.00 0.71 0.00 0.00 52.55 52.93 1xgy s ASP 70 Cb 0.11 -1.51 -0.06 0.00 1.01 0.00 0.00 42.92 42.47 1xgy s ASP 70 CO 0.15 0.05 0.05 -0.36 0.21 0.00 0.00 175.17 175.27 1xgy s PHE 71 N 1.02 2.08 -0.28 4.23 0.40 -0.33 0.26 117.98 125.35 1xgy s PHE 71 Ca -0.02 -0.92 -0.19 0.00 -0.60 0.00 0.00 56.93 55.20 1xgy s PHE 71 Cb -0.15 -1.43 0.11 0.00 0.51 0.00 0.00 43.02 42.06 1xgy s PHE 71 CO -0.05 0.11 0.85 0.00 0.70 0.00 0.00 175.22 176.83 1xgy s ALA 72 N -3.09 -2.02 -0.20 5.36 0.00 -0.69 -2.43 121.76 118.69 1xgy s ALA 72 Ca 0.32 2.21 -0.10 0.00 0.00 0.00 0.00 51.96 54.39 1xgy s ALA 72 Cb 0.08 -1.50 -0.05 0.00 0.00 0.00 0.00 23.12 21.65 1xgy s ALA 72 CO 0.15 -0.34 0.13 -1.17 0.00 0.00 0.00 175.76 174.53 1xgy s LEU 73 N 1.14 4.20 -0.05 0.00 2.96 -0.03 -1.86 118.68 125.05 1xgy s LEU 73 Ca -0.06 0.23 0.05 0.00 -0.22 0.00 0.00 54.13 54.13 1xgy s LEU 73 Cb -0.05 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 1xgy s LEU 73 CO -0.13 0.19 -0.18 -0.60 -1.32 0.00 0.00 176.35 174.31 1xgy s ARG 74 N 0.30 2.45 -0.24 1.98 3.52 0.11 -0.03 118.95 127.04 1xgy s ARG 74 Ca 0.08 -0.76 -0.00 0.00 -0.13 0.00 0.00 55.73 54.91 1xgy s ARG 74 Cb -0.11 -2.29 0.03 0.00 -1.56 0.00 0.00 34.95 31.02 1xgy s ARG 74 CO -0.02 0.57 -0.10 0.42 -0.81 0.00 0.00 175.30 175.37 1xgy s ILE 75 N -0.62 2.58 0.08 4.11 1.09 0.18 0.67 121.20 129.30 1xgy s ILE 75 Ca 0.09 -1.13 -0.29 0.00 -1.10 0.00 0.00 60.65 58.23 1xgy s ILE 75 Cb -0.11 -2.31 -0.13 0.00 -1.06 0.00 0.00 42.46 38.85 1xgy s ILE 75 CO 0.01 0.22 1.46 0.28 -0.10 0.00 0.00 174.94 176.81 1xgy h SER 76 N 7.95 -1.27 -2.90 3.58 0.02 0.91 -2.01 113.55 119.84 1xgy h SER 76 Ca -0.33 0.12 -0.54 0.00 -0.84 0.00 0.00 61.79 60.21 1xgy h SER 76 Cb 1.10 0.45 -0.40 0.00 0.14 0.00 0.00 62.40 63.69 1xgy h SER 76 CO 0.57 -0.49 -0.77 0.00 -1.14 0.00 0.00 176.83 174.99 1xgy s ARG 77 N -5.30 0.33 0.22 3.45 1.70 -1.23 -3.54 118.95 114.57 1xgy s ARG 77 Ca -0.14 -0.66 -0.32 0.00 -0.47 0.00 0.00 55.73 54.14 1xgy s ARG 77 Cb 0.04 -1.40 -0.12 0.00 -0.57 0.00 0.00 34.95 32.90 1xgy s ARG 77 CO 0.50 -1.00 1.70 0.14 -1.08 0.00 0.00 175.30 175.56 1xgy s VAL 78 N 1.97 2.02 -0.03 4.99 -7.23 -0.38 -4.74 120.40 117.01 1xgy s VAL 78 Ca 0.09 0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.29 1xgy s VAL 78 Cb -0.16 -3.01 -0.03 0.00 0.56 0.00 0.00 36.38 33.73 1xgy s VAL 78 CO -0.33 0.00 -0.03 -1.61 -0.31 0.00 0.00 175.10 172.82 1xgy s GLU 79 N 0.89 2.74 0.65 4.82 2.02 -1.26 -1.40 118.70 127.16 1xgy s GLU 79 Ca 0.73 -0.60 0.17 0.00 0.02 0.00 0.00 54.97 55.29 1xgy s GLU 79 Cb -0.50 -2.62 0.86 0.00 0.10 0.00 0.00 34.13 31.97 1xgy s GLU 79 CO 0.35 0.64 1.46 0.00 0.02 0.00 0.00 175.26 177.73 1xgy h ALA 80 N 4.69 1.94 -0.00 5.21 0.00 -2.01 0.85 119.26 129.94 1xgy h ALA 80 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1xgy h ALA 80 Cb 1.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1xgy h ALA 80 CO 0.55 -0.85 -0.05 0.39 0.00 0.00 0.00 179.25 179.29 1xgy n GLU 81 N -2.88 0.93 0.00 0.00 4.71 -1.26 -3.24 120.64 118.90 1xgy n GLU 81 Ca 0.04 -0.28 0.13 0.00 -0.01 0.00 0.00 57.16 57.04 1xgy n GLU 81 Cb 0.83 -1.49 0.33 0.00 -1.01 0.00 0.00 31.44 30.10 1xgy n GLU 81 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1xgy n ASP 82 N -0.79 0.72 -4.76 1.62 8.00 0.29 -4.94 116.55 116.69 1xgy n ASP 82 Ca 0.18 -0.54 -0.39 0.00 0.71 0.00 0.00 54.79 54.75 1xgy n ASP 82 Cb 0.24 0.17 0.01 0.00 -0.02 0.00 0.00 41.12 41.51 1xgy n ASP 82 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xgy s VAL 83 N -2.75 2.41 -5.00 2.53 1.01 -1.20 -4.89 120.40 112.51 1xgy s VAL 83 Ca 0.18 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.51 1xgy s VAL 83 Cb 0.18 -3.20 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1xgy s VAL 83 CO 0.60 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.35 1xgy n GLY 84 N 0.63 -0.35 3.63 4.51 0.00 -1.26 -4.43 105.19 107.92 1xgy n GLY 84 Ca 0.05 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 44.22 1xgy n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xgy s VAL 85 N -2.60 4.37 -0.37 1.61 0.11 -0.41 -0.55 120.40 122.56 1xgy s VAL 85 Ca 0.00 -0.20 -0.10 0.00 -2.93 0.00 0.00 61.98 58.75 1xgy s VAL 85 Cb 0.00 -2.90 0.04 0.00 -1.53 0.00 0.00 36.38 31.99 1xgy s VAL 85 CO 0.00 0.54 0.19 -0.31 -3.33 0.00 0.00 175.10 172.19 1xgy s TYR 86 N -0.24 3.26 -0.13 1.54 1.51 0.14 -0.55 117.35 122.89 1xgy s TYR 86 Ca 0.06 -1.14 -0.08 0.00 -1.01 0.00 0.00 57.07 54.89 1xgy s TYR 86 Cb -0.12 -2.45 -0.04 0.00 -0.11 0.00 0.00 41.96 39.23 1xgy s TYR 86 CO 0.02 -0.69 0.16 0.71 -1.11 0.00 0.00 175.55 174.64 1xgy s TYR 87 N 1.50 3.57 0.16 2.71 1.51 0.14 -2.09 117.35 124.86 1xgy s TYR 87 Ca 0.01 0.53 0.04 0.00 -1.01 0.00 0.00 57.07 56.64 1xgy s TYR 87 Cb -0.20 -2.02 -0.04 0.00 -0.11 0.00 0.00 41.96 39.60 1xgy s TYR 87 CO 0.05 0.63 0.23 0.00 -1.11 0.00 0.00 175.55 175.36 1xgy s GLY 89 N -3.23 -0.15 -0.29 0.00 0.00 -0.45 -1.22 107.32 101.99 1xgy s GLY 89 Ca 0.33 0.52 -0.10 0.00 0.00 0.00 0.00 44.72 45.47 1xgy s GLY 89 CO 0.27 0.40 0.17 1.62 0.00 0.00 0.00 173.10 175.56 1xgy s GLN 90 N -0.32 3.70 -0.28 2.90 -0.44 -0.11 0.14 119.66 125.25 1xgy s GLN 90 Ca -0.04 -0.48 0.10 0.00 -2.50 0.00 0.00 55.36 52.44 1xgy s GLN 90 Cb -0.03 -3.60 0.54 0.00 -1.64 0.00 0.00 33.01 28.28 1xgy s GLN 90 CO 0.01 -0.27 1.52 -1.33 0.50 0.00 0.00 175.29 175.72 1xgy n MET 91 N 5.02 2.27 0.07 1.67 2.81 0.01 -3.18 117.12 125.79 1xgy n MET 91 Ca -0.14 -3.07 -0.06 0.00 -1.81 0.00 0.00 57.70 52.62 1xgy n MET 91 Cb 0.51 -1.88 -0.03 0.00 -0.71 0.00 0.00 33.22 31.10 1xgy n MET 91 CO 0.00 0.00 0.00 1.25 1.51 0.00 0.00 175.97 178.73 1xgy h LEU 92 N 1.30 -0.24 -8.39 4.03 5.85 -1.93 -3.48 115.31 112.45 1xgy h LEU 92 Ca 0.21 -0.06 -0.27 0.00 0.84 0.00 0.00 57.88 58.60 1xgy h LEU 92 Cb 1.77 0.06 -0.17 0.00 0.37 0.00 0.00 40.66 42.69 1xgy h LEU 92 CO 0.44 0.25 -0.72 -1.83 -0.34 0.00 0.00 178.44 176.24 1xgy s GLU 93 N -2.62 0.78 0.32 1.25 -1.05 -1.26 -5.09 118.70 111.03 1xgy s GLU 93 Ca -0.06 -1.15 -0.28 0.00 -0.15 0.00 0.00 54.97 53.33 1xgy s GLU 93 Cb 0.00 -0.36 -0.10 0.00 -0.44 0.00 0.00 34.13 33.24 1xgy s GLU 93 CO 0.18 0.04 1.16 -1.01 0.95 0.00 0.00 175.26 176.58 1xgy s HIS 94 N -2.71 3.35 0.46 4.83 3.76 -1.26 -3.90 115.29 119.82 1xgy s HIS 94 Ca 0.05 1.60 -0.17 0.00 -0.15 0.00 0.00 55.06 56.39 1xgy s HIS 94 Cb -0.01 -3.39 -0.09 0.00 1.11 0.00 0.00 32.58 30.20 1xgy s HIS 94 CO -0.02 -1.00 0.93 -2.14 -0.85 0.00 0.00 174.74 171.66 1xgy s PRO 95 N -1.71 4.04 0.22 8.40 0.02 -1.26 -4.96 135.00 139.74 1xgy s PRO 95 Ca 0.48 0.94 -0.30 0.00 0.02 0.00 0.00 61.00 62.14 1xgy s PRO 95 Cb -0.33 -2.20 -0.09 0.00 0.02 0.00 0.00 34.50 31.90 1xgy s PRO 95 CO 0.43 -0.12 1.23 -0.51 -0.33 0.00 0.00 177.00 177.69 1xgy s LEU 96 N -3.64 4.45 0.01 -5.54 1.43 -1.25 -4.81 118.68 109.34 1xgy s LEU 96 Ca 0.59 2.34 0.00 0.00 -1.03 0.00 0.00 54.13 56.03 1xgy s LEU 96 Cb -0.10 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 1xgy s LEU 96 CO 0.24 -0.40 -0.02 0.42 0.23 0.00 0.00 176.35 176.81 1xgy s THR 97 N -0.30 0.12 0.39 5.49 -4.23 -1.19 -5.03 115.64 110.89 1xgy s THR 97 Ca 0.52 -0.59 0.08 0.00 -1.18 0.00 0.00 61.69 60.52 1xgy s THR 97 Cb -0.34 -0.21 -0.05 0.00 1.34 0.00 0.00 72.50 73.24 1xgy s THR 97 CO 0.40 -0.30 0.15 -0.36 -0.54 0.00 0.00 174.62 173.97 1xgy s PHE 98 N -0.91 2.61 0.17 3.99 0.40 -1.26 -0.94 117.98 122.04 1xgy s PHE 98 Ca -0.09 -0.53 -0.02 0.00 -0.60 0.00 0.00 56.93 55.69 1xgy s PHE 98 Cb -0.06 -1.83 0.04 0.00 0.51 0.00 0.00 43.02 41.67 1xgy s PHE 98 CO -0.01 0.26 0.23 0.41 0.70 0.00 0.00 175.22 176.81 1xgy n GLY 99 N -1.18 -0.60 0.17 4.36 0.00 -0.35 -4.50 105.19 103.09 1xgy n GLY 99 Ca -0.02 -1.77 0.05 0.00 0.00 0.00 0.00 46.02 44.29 1xgy n GLY 99 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xgy h THR 100 N -0.92 0.63 0.00 2.61 2.02 -1.86 -3.45 112.91 111.94 1xgy h THR 100 Ca -0.07 -1.84 0.00 0.00 0.77 0.00 0.00 66.41 65.27 1xgy h THR 100 Cb 0.22 2.27 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1xgy h THR 100 CO 0.06 0.35 0.00 0.61 0.37 0.00 0.00 175.52 176.91 1xgy n GLY 101 N 1.11 2.50 2.85 2.16 0.00 -1.26 -4.99 105.19 107.56 1xgy n GLY 101 Ca 0.02 -1.86 -0.17 0.00 0.00 0.00 0.00 46.02 44.01 1xgy n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xgy s THR 102 N -2.69 -0.30 0.21 2.61 2.01 -0.89 -4.24 115.64 112.36 1xgy s THR 102 Ca 0.00 0.23 -0.22 0.00 0.31 0.00 0.00 61.69 62.00 1xgy s THR 102 Cb 0.00 -0.41 -0.08 0.00 0.01 0.00 0.00 72.50 72.01 1xgy s THR 102 CO 0.00 0.05 0.76 -0.75 -0.69 0.00 0.00 174.62 174.00 1xgy s LYS 103 N 2.32 4.39 -0.49 4.92 2.20 -0.74 0.29 119.74 132.63 1xgy s LYS 103 Ca 0.03 1.01 -0.22 0.00 -0.36 0.00 0.00 55.97 56.44 1xgy s LYS 103 Cb -0.13 -3.01 0.04 0.00 -1.51 0.00 0.00 37.83 33.22 1xgy s LYS 103 CO -0.08 0.45 0.75 -1.17 -0.36 0.00 0.00 175.35 174.94 1xgy s LEU 104 N -1.68 4.46 0.10 5.43 2.96 0.29 -2.55 118.68 127.69 1xgy s LEU 104 Ca 0.41 -0.45 -0.06 0.00 -0.22 0.00 0.00 54.13 53.80 1xgy s LEU 104 Cb -0.19 -2.73 -0.05 0.00 0.50 0.00 0.00 46.19 43.72 1xgy s LEU 104 CO 0.23 -0.97 0.36 -0.70 -1.32 0.00 0.00 176.35 173.95 1xgy s GLU 105 N 3.19 3.65 0.10 1.98 2.12 -1.26 -4.23 118.70 124.25 1xgy s GLU 105 Ca 0.24 -0.02 -0.03 0.00 0.36 0.00 0.00 54.97 55.53 1xgy s GLU 105 Cb -0.15 -2.94 -0.05 0.00 0.26 0.00 0.00 34.13 31.26 1xgy s GLU 105 CO 0.18 0.53 0.30 -0.51 -0.54 0.00 0.00 175.26 175.22 1xgy s LEU 106 N -2.27 4.31 0.14 2.70 1.43 -1.26 -1.52 118.68 122.20 1xgy s LEU 106 Ca 0.36 0.45 -0.25 0.00 -1.03 0.00 0.00 54.13 53.67 1xgy s LEU 106 Cb -0.13 -3.14 -0.07 0.00 0.03 0.00 0.00 46.19 42.88 1xgy s LEU 106 CO 0.21 0.11 0.76 -0.75 0.23 0.00 0.00 176.35 176.91 1xgy s LYS 107 N -2.56 4.53 0.23 1.70 2.20 -0.12 -4.65 119.74 121.05 1xgy s LYS 107 Ca 0.38 1.11 0.02 0.00 -0.36 0.00 0.00 55.97 57.12 1xgy s LYS 107 Cb -0.13 -3.28 -0.05 0.00 -1.51 0.00 0.00 37.83 32.86 1xgy s LYS 107 CO 0.26 0.52 0.04 0.50 -0.36 0.00 0.00 175.35 176.31 1xgy s ARG 108 N -0.93 1.31 0.15 4.03 6.06 -1.26 -4.82 118.95 123.49 1xgy s ARG 108 Ca 0.36 -1.68 -0.17 0.00 -2.50 0.00 0.00 55.73 51.74 1xgy s ARG 108 Cb -0.22 -0.37 -0.07 0.00 0.06 0.00 0.00 34.95 34.34 1xgy s ARG 108 CO 0.25 -0.19 0.61 0.00 -2.50 0.00 0.00 175.30 173.46 1xgy s ALA 109 N -3.63 3.53 0.22 6.12 0.00 -1.26 -4.99 121.76 121.75 1xgy s ALA 109 Ca 0.31 -0.00 -0.30 0.00 0.00 0.00 0.00 51.96 51.97 1xgy s ALA 109 Cb 0.07 -2.64 -0.16 0.00 0.00 0.00 0.00 23.12 20.39 1xgy s ALA 109 CO 0.10 0.40 0.91 -0.25 0.00 0.00 0.00 175.76 176.92 1xgy n ASP 110 N 0.97 0.50 -3.86 0.00 10.43 -1.26 -4.86 116.55 118.48 1xgy n ASP 110 Ca -0.05 1.16 -0.18 0.00 2.57 0.00 0.00 54.79 58.28 1xgy n ASP 110 Cb 0.51 -1.15 -0.16 0.00 1.84 0.00 0.00 41.12 42.16 1xgy n ASP 110 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1xgy s ALA 111 N -0.78 0.49 0.45 2.24 0.00 -0.14 -4.94 121.76 119.08 1xgy s ALA 111 Ca 0.65 0.05 -0.20 0.00 0.00 0.00 0.00 51.96 52.46 1xgy s ALA 111 Cb -0.83 -0.36 -0.10 0.00 0.00 0.00 0.00 23.12 21.83 1xgy s ALA 111 CO 0.57 -0.03 0.97 0.00 0.00 0.00 0.00 175.76 177.27 1xgy s ALA 112 N 0.92 3.01 0.26 0.00 0.00 -1.26 -1.81 121.76 122.88 1xgy s ALA 112 Ca -0.11 0.41 -0.30 0.00 0.00 0.00 0.00 51.96 51.97 1xgy s ALA 112 Cb -0.14 -3.17 -0.10 0.00 0.00 0.00 0.00 23.12 19.72 1xgy s ALA 112 CO -0.01 0.01 1.33 -2.14 0.00 0.00 0.00 175.76 174.96 1xgy s PRO 113 N -3.29 4.36 -0.68 0.00 0.02 -1.26 -4.50 135.00 129.65 1xgy s PRO 113 Ca 0.63 2.17 -0.13 0.00 0.02 0.00 0.00 61.00 63.68 1xgy s PRO 113 Cb -0.10 -3.13 0.17 0.00 0.02 0.00 0.00 34.50 31.46 1xgy s PRO 113 CO 0.16 -0.25 0.61 0.99 -0.33 0.00 0.00 177.00 178.18 1xgy s THR 114 N -0.42 5.18 -0.02 0.99 2.01 -0.39 -4.90 115.64 118.09 1xgy s THR 114 Ca 0.54 -2.12 -0.19 0.00 0.31 0.00 0.00 61.69 60.22 1xgy s THR 114 Cb -0.39 -4.27 -0.05 0.00 0.01 0.00 0.00 72.50 67.80 1xgy s THR 114 CO 0.45 -0.94 0.55 -0.69 -0.69 0.00 0.00 174.62 173.30 1xgy s VAL 115 N 0.74 4.97 -0.01 3.82 1.01 -1.26 -1.59 120.40 128.08 1xgy s VAL 115 Ca 0.12 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.25 1xgy s VAL 115 Cb -0.19 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.31 1xgy s VAL 115 CO -0.04 0.42 -0.05 -0.44 0.00 0.00 0.00 175.10 175.00 1xgy s SER 116 N -0.16 0.64 0.08 3.32 0.01 -0.00 -4.98 113.70 112.60 1xgy s SER 116 Ca 0.29 -0.09 0.10 0.00 1.31 0.00 0.00 55.95 57.56 1xgy s SER 116 Cb -0.17 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 65.88 1xgy s SER 116 CO 0.15 0.03 -0.26 -0.51 0.41 0.00 0.00 173.24 173.06 1xgy s ILE 117 N 0.16 2.21 -0.01 1.44 2.07 -1.26 -0.09 121.20 125.71 1xgy s ILE 117 Ca -0.01 -1.53 0.02 0.00 -1.41 0.00 0.00 60.65 57.72 1xgy s ILE 117 Cb -0.05 -1.91 -0.00 0.00 0.13 0.00 0.00 42.46 40.63 1xgy s ILE 117 CO -0.00 0.26 -0.07 -0.36 -1.91 0.00 0.00 174.94 172.86 1xgy s PHE 118 N -0.91 0.63 0.62 3.50 0.40 0.82 -4.99 117.98 118.06 1xgy s PHE 118 Ca 0.13 -0.13 -0.14 0.00 -0.60 0.00 0.00 56.93 56.19 1xgy s PHE 118 Cb -0.10 -0.44 -0.03 0.00 0.51 0.00 0.00 43.02 42.96 1xgy s PHE 118 CO 0.04 -0.04 1.04 -2.14 0.70 0.00 0.00 175.22 174.82 1xgy s PRO 119 N -0.00 3.33 0.29 0.24 0.02 -1.26 -2.61 135.00 135.01 1xgy s PRO 119 Ca 0.00 1.02 -0.30 0.00 0.02 0.00 0.00 61.00 61.74 1xgy s PRO 119 Cb -0.04 -2.04 -0.12 0.00 0.02 0.00 0.00 34.50 32.31 1xgy s PRO 119 CO -0.00 -0.79 1.45 -2.30 -0.33 0.00 0.00 177.00 175.03 1xgy n PRO 120 N -2.43 2.32 -1.11 5.54 -0.02 -1.25 -4.83 135.00 133.23 1xgy n PRO 120 Ca 0.08 0.82 -0.33 0.00 -2.02 0.00 0.00 63.50 62.05 1xgy n PRO 120 Cb 0.53 -2.51 0.13 0.00 -0.02 0.00 0.00 33.50 31.63 1xgy n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1xgy s SER 121 N 0.21 3.63 0.16 2.55 1.04 -1.26 -4.88 113.70 115.15 1xgy s SER 121 Ca 0.63 2.31 -0.15 0.00 0.48 0.00 0.00 55.95 59.22 1xgy s SER 121 Cb -0.57 -2.58 0.04 0.00 0.10 0.00 0.00 66.02 63.00 1xgy s SER 121 CO 0.53 -2.64 1.78 -1.28 0.98 0.00 0.00 173.24 172.61 1xgy h SER 122 N -0.96 0.58 0.69 7.02 0.87 -1.99 -2.56 113.55 117.20 1xgy h SER 122 Ca -0.46 -0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 59.99 1xgy h SER 122 Cb 1.29 -0.15 0.01 0.00 -0.44 0.00 0.00 62.40 63.11 1xgy h SER 122 CO 0.46 0.48 -0.33 -0.33 -0.53 0.00 0.00 176.83 176.59 1xgy h GLU 123 N 0.63 -0.89 -0.89 2.24 3.07 -1.99 -2.88 114.58 113.87 1xgy h GLU 123 Ca 0.17 0.06 0.19 0.00 -0.50 0.00 0.00 59.36 59.27 1xgy h GLU 123 Cb 0.02 0.20 -0.07 0.00 -0.84 0.00 0.00 28.75 28.07 1xgy h GLU 123 CO -0.03 -0.58 0.58 0.37 -1.40 0.00 0.00 179.01 177.95 1xgy h GLN 124 N -0.97 0.46 0.00 2.33 4.15 -1.84 1.32 115.11 120.56 1xgy h GLN 124 Ca -0.09 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.30 1xgy h GLN 124 Cb 0.72 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.31 1xgy h GLN 124 CO 0.16 0.31 0.00 1.28 -1.93 0.00 0.00 178.83 178.64 1xgy n LEU 125 N -4.53 0.00 0.00 -2.39 4.77 -0.97 -0.35 117.00 113.54 1xgy n LEU 125 Ca 0.19 0.19 0.11 0.00 -0.03 0.00 0.00 56.01 56.47 1xgy n LEU 125 Cb 0.63 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.45 1xgy n LEU 125 CO 0.30 -0.14 -0.15 0.41 -1.33 0.00 0.00 177.39 176.48 1xgy n THR 126 N -1.19 0.04 0.68 -5.08 -1.04 0.45 -3.93 114.28 104.20 1xgy n THR 126 Ca 0.05 -0.16 0.12 0.00 -2.04 0.00 0.00 64.05 62.02 1xgy n THR 126 Cb 0.06 0.57 0.22 0.00 -1.82 0.00 0.00 70.33 69.35 1xgy n THR 126 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1xgy n SER 127 N -1.76 3.03 0.00 8.00 7.64 0.53 -4.92 113.62 126.14 1xgy n SER 127 Ca 0.02 -1.94 0.00 0.00 1.01 0.00 0.00 58.87 57.96 1xgy n SER 127 Cb 0.40 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 1xgy n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xgy n GLY 128 N 1.41 0.75 3.44 0.23 0.00 -1.17 -5.04 105.19 104.80 1xgy n GLY 128 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 1xgy n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xgy s GLY 129 N -1.85 1.77 -0.10 -0.02 0.00 -1.15 -1.52 107.32 104.44 1xgy s GLY 129 Ca 0.00 -1.72 -0.04 0.00 0.00 0.00 0.00 44.72 42.96 1xgy s GLY 129 CO 0.00 -1.77 0.21 0.00 0.00 0.00 0.00 173.10 171.54 1xgy s ALA 130 N -1.98 -0.36 -0.06 3.20 0.00 0.01 -3.20 121.76 119.37 1xgy s ALA 130 Ca 0.24 0.75 0.03 0.00 0.00 0.00 0.00 51.96 52.99 1xgy s ALA 130 Cb -0.07 -0.88 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1xgy s ALA 130 CO 0.12 -0.56 -0.17 -1.54 0.00 0.00 0.00 175.76 173.61 1xgy s SER 131 N 2.26 2.20 -0.26 0.00 1.04 -1.26 0.78 113.70 118.44 1xgy s SER 131 Ca 0.01 -0.37 -0.10 0.00 0.48 0.00 0.00 55.95 55.97 1xgy s SER 131 Cb -0.12 -0.86 -0.05 0.00 0.10 0.00 0.00 66.02 65.09 1xgy s SER 131 CO -0.07 0.11 0.16 -0.69 0.98 0.00 0.00 173.24 173.73 1xgy s VAL 132 N 0.36 5.15 -0.15 5.02 1.01 0.53 -3.76 120.40 128.57 1xgy s VAL 132 Ca -0.11 0.11 -0.07 0.00 0.00 0.00 0.00 61.98 61.91 1xgy s VAL 132 Cb -0.15 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1xgy s VAL 132 CO 0.04 0.29 0.09 -0.69 0.00 0.00 0.00 175.10 174.84 1xgy s VAL 133 N 1.55 5.09 -0.12 2.92 1.01 -1.07 -0.82 120.40 128.95 1xgy s VAL 133 Ca 0.07 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.11 1xgy s VAL 133 Cb -0.15 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.00 1xgy s VAL 133 CO 0.08 0.54 -0.11 0.00 0.00 0.00 0.00 175.10 175.61 1xgy s PHE 135 N 1.50 3.20 -0.38 0.00 0.08 0.87 -0.68 117.98 122.56 1xgy s PHE 135 Ca 0.03 -0.06 -0.02 0.00 0.12 0.00 0.00 56.93 57.00 1xgy s PHE 135 Cb -0.13 -2.22 0.09 0.00 -0.57 0.00 0.00 43.02 40.19 1xgy s PHE 135 CO -0.08 -0.09 0.14 -0.51 -0.10 0.00 0.00 175.22 174.58 1xgy s LEU 136 N 1.17 4.88 0.10 -0.37 1.43 0.21 -0.82 118.68 125.27 1xgy s LEU 136 Ca 0.06 -1.86 0.06 0.00 -1.03 0.00 0.00 54.13 51.36 1xgy s LEU 136 Cb -0.14 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 1xgy s LEU 136 CO 0.04 -0.46 -0.05 0.20 0.23 0.00 0.00 176.35 176.31 1xgy s ASN 137 N 1.58 4.68 -1.11 2.29 0.02 -0.62 0.58 114.94 122.36 1xgy s ASN 137 Ca 0.05 -0.30 -0.21 0.00 -1.02 0.00 0.00 52.86 51.39 1xgy s ASN 137 Cb -0.22 -1.00 -0.00 0.00 0.02 0.00 0.00 41.25 40.06 1xgy s ASN 137 CO -0.04 0.17 0.77 0.59 0.02 0.00 0.00 177.10 178.61 1xgy n ASN 138 N 0.61 -5.29 -4.75 -1.22 3.02 -0.99 -1.26 115.26 105.37 1xgy n ASN 138 Ca -0.12 -1.01 -0.23 0.00 -0.03 0.00 0.00 54.58 53.19 1xgy n ASN 138 Cb 0.52 -3.15 -0.06 0.00 -0.61 0.00 0.00 39.78 36.49 1xgy n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1xgy s PHE 139 N -3.42 2.70 -0.29 3.10 -0.12 0.24 -4.56 117.98 115.64 1xgy s PHE 139 Ca 0.43 -0.42 -0.20 0.00 -0.05 0.00 0.00 56.93 56.68 1xgy s PHE 139 Cb -0.17 -1.75 0.13 0.00 -0.63 0.00 0.00 43.02 40.60 1xgy s PHE 139 CO 0.87 0.26 1.00 -0.47 -0.05 0.00 0.00 175.22 176.83 1xgy s TYR 140 N -2.45 -0.53 1.16 3.49 5.04 -0.75 -0.72 117.35 122.59 1xgy s TYR 140 Ca 0.39 1.16 -0.16 0.00 -2.44 0.00 0.00 57.07 56.02 1xgy s TYR 140 Cb -0.02 0.37 0.27 0.00 0.35 0.00 0.00 41.96 42.93 1xgy s TYR 140 CO 0.23 -0.26 1.06 -1.25 -1.34 0.00 0.00 175.55 173.99 1xgy s PRO 141 N 0.82 -0.91 0.31 4.97 0.04 -1.26 -0.97 135.00 138.00 1xgy s PRO 141 Ca -0.03 0.33 0.03 0.00 0.04 0.00 0.00 61.00 61.36 1xgy s PRO 141 Cb -0.04 -1.60 0.51 0.00 0.04 0.00 0.00 34.50 33.41 1xgy s PRO 141 CO -0.11 -3.59 1.83 1.57 0.04 0.00 0.00 177.00 176.74 1xgy h LYS 142 N -2.50 0.59 -6.03 4.56 2.10 -1.97 -3.43 116.57 109.88 1xgy h LYS 142 Ca -0.52 -0.14 -0.61 0.00 -2.00 0.00 0.00 60.65 57.38 1xgy h LYS 142 Cb 1.32 -0.08 -0.00 0.00 -0.90 0.00 0.00 32.23 32.58 1xgy h LYS 142 CO 0.45 0.63 1.43 -0.25 -2.00 0.00 0.00 179.45 179.71 1xgy n ASP 143 N -4.25 3.04 -3.91 7.07 8.00 -1.26 -4.94 116.55 120.31 1xgy n ASP 143 Ca 0.02 0.36 -0.10 0.00 0.71 0.00 0.00 54.79 55.78 1xgy n ASP 143 Cb 0.28 -1.46 -0.09 0.00 -0.02 0.00 0.00 41.12 39.82 1xgy n ASP 143 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1xgy s ILE 144 N 7.47 0.12 -0.00 0.53 -1.16 -1.26 -4.50 121.20 122.40 1xgy s ILE 144 Ca 1.02 -0.97 0.02 0.00 -0.51 0.00 0.00 60.65 60.21 1xgy s ILE 144 Cb -0.51 -0.75 -0.01 0.00 0.61 0.00 0.00 42.46 41.81 1xgy s ILE 144 CO 0.41 -0.54 -0.08 0.21 -2.81 0.00 0.00 174.94 172.13 1xgy s ASN 145 N -1.90 0.88 -0.05 4.50 3.04 -0.65 -5.02 114.94 115.74 1xgy s ASN 145 Ca -0.08 -0.16 0.01 0.00 0.04 0.00 0.00 52.86 52.68 1xgy s ASN 145 Cb -0.03 -0.09 0.02 0.00 -1.54 0.00 0.00 41.25 39.61 1xgy s ASN 145 CO -0.03 0.08 -0.05 -0.69 -3.04 0.00 0.00 177.10 173.37 1xgy s VAL 146 N -0.23 0.61 0.04 -5.21 1.01 -1.26 -0.24 120.40 115.12 1xgy s VAL 146 Ca 0.02 -0.17 0.09 0.00 0.00 0.00 0.00 61.98 61.92 1xgy s VAL 146 Cb -0.03 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 1xgy s VAL 146 CO -0.00 0.24 -0.24 -0.54 0.00 0.00 0.00 175.10 174.56 1xgy s LYS 147 N 0.87 1.91 -0.16 2.72 1.02 -0.36 -4.96 119.74 120.78 1xgy s LYS 147 Ca -0.12 -1.06 -0.05 0.00 0.02 0.00 0.00 55.97 54.77 1xgy s LYS 147 Cb -0.15 -2.05 -0.03 0.00 -0.52 0.00 0.00 37.83 35.09 1xgy s LYS 147 CO 0.01 0.53 -0.01 -1.58 -0.92 0.00 0.00 175.35 173.37 1xgy s TRP 148 N -0.82 3.09 -0.19 3.18 0.52 -1.26 0.03 118.94 123.49 1xgy s TRP 148 Ca 0.12 -0.18 0.00 0.00 0.02 0.00 0.00 56.10 56.07 1xgy s TRP 148 Cb -0.10 -1.98 0.04 0.00 -1.15 0.00 0.00 33.47 30.28 1xgy s TRP 148 CO 0.03 0.04 -0.09 0.15 0.02 0.00 0.00 176.95 177.09 1xgy s LYS 149 N 0.30 1.87 -0.31 4.98 1.02 0.22 -0.37 119.74 127.45 1xgy s LYS 149 Ca -0.02 -0.73 -0.14 0.00 0.02 0.00 0.00 55.97 55.10 1xgy s LYS 149 Cb -0.14 -2.28 -0.03 0.00 -0.52 0.00 0.00 37.83 34.87 1xgy s LYS 149 CO 0.02 -0.42 0.33 -1.50 -0.92 0.00 0.00 175.35 172.87 1xgy s ILE 150 N 1.47 5.20 -1.20 2.17 2.07 -0.27 -0.63 121.20 130.01 1xgy s ILE 150 Ca -0.00 0.23 -0.07 0.00 -1.41 0.00 0.00 60.65 59.39 1xgy s ILE 150 Cb -0.16 -3.73 -0.02 0.00 0.13 0.00 0.00 42.46 38.69 1xgy s ILE 150 CO -0.08 0.05 0.78 0.47 -1.91 0.00 0.00 174.94 174.25 1xgy n ASP 151 N 5.30 -3.53 -1.25 4.50 8.00 0.17 -2.32 116.55 127.43 1xgy n ASP 151 Ca -0.10 -0.85 -0.16 0.00 0.71 0.00 0.00 54.79 54.39 1xgy n ASP 151 Cb 0.50 -4.15 -0.07 0.00 -0.02 0.00 0.00 41.12 37.38 1xgy n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xgy n GLY 152 N -1.52 1.64 2.75 0.44 0.00 -1.26 -4.98 105.19 102.26 1xgy n GLY 152 Ca -0.19 -0.23 -0.18 0.00 0.00 0.00 0.00 46.02 45.41 1xgy n GLY 152 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xgy s SER 153 N -2.82 0.81 0.49 1.61 1.04 -0.98 -5.09 113.70 108.76 1xgy s SER 153 Ca 0.00 0.18 -0.23 0.00 0.48 0.00 0.00 55.95 56.38 1xgy s SER 153 Cb 0.00 0.03 -0.07 0.00 0.10 0.00 0.00 66.02 66.08 1xgy s SER 153 CO 0.00 -0.23 1.27 1.21 0.98 0.00 0.00 173.24 176.47 1xgy n GLU 154 N 5.12 1.74 -3.95 4.02 2.13 -1.26 -1.11 120.64 127.33 1xgy n GLU 154 Ca -0.08 0.63 -0.20 0.00 0.66 0.00 0.00 57.16 58.17 1xgy n GLU 154 Cb 0.50 -2.44 -0.17 0.00 0.27 0.00 0.00 31.44 29.61 1xgy n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 1xgy s ARG 155 N -2.52 0.56 -0.18 5.31 3.52 0.50 -4.85 118.95 121.29 1xgy s ARG 155 Ca 0.66 0.03 -0.15 0.00 -0.13 0.00 0.00 55.73 56.15 1xgy s ARG 155 Cb -0.46 -0.75 -0.09 0.00 -1.56 0.00 0.00 34.95 32.09 1xgy s ARG 155 CO 0.54 -0.17 -0.11 1.04 -0.81 0.00 0.00 175.30 175.78 1xgy n GLN 156 N 4.44 0.51 -1.91 5.12 6.02 -1.26 -4.33 117.38 125.97 1xgy n GLN 156 Ca -0.19 0.47 -0.40 0.00 -0.01 0.00 0.00 57.00 56.87 1xgy n GLN 156 Cb 0.50 -1.65 0.01 0.00 1.02 0.00 0.00 30.24 30.12 1xgy n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1xgy s ASN 157 N -6.29 6.05 0.00 1.08 0.01 -1.26 -3.18 114.94 111.36 1xgy s ASN 157 Ca -0.24 2.80 0.00 0.00 -0.71 0.00 0.00 52.86 54.71 1xgy s ASN 157 Cb 0.05 -2.65 0.00 0.00 0.41 0.00 0.00 41.25 39.06 1xgy s ASN 157 CO 0.39 -1.04 0.00 0.61 -1.51 0.00 0.00 177.10 175.55 1xgy n GLY 158 N 0.62 0.62 3.81 0.66 0.00 -1.26 -4.91 105.19 104.72 1xgy n GLY 158 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1xgy n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xgy s VAL 159 N -2.13 5.42 -0.08 1.61 1.01 -1.19 -0.08 120.40 124.96 1xgy s VAL 159 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.26 1xgy s VAL 159 Cb 0.00 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.93 1xgy s VAL 159 CO 0.00 0.53 -0.05 -0.76 0.00 0.00 0.00 175.10 174.82 1xgy s LEU 160 N -0.37 1.11 0.15 3.92 1.43 -0.53 -4.97 118.68 119.43 1xgy s LEU 160 Ca 0.13 -0.19 0.08 0.00 -1.03 0.00 0.00 54.13 53.12 1xgy s LEU 160 Cb -0.12 -0.62 -0.04 0.00 0.03 0.00 0.00 46.19 45.43 1xgy s LEU 160 CO 0.02 -0.10 -0.08 0.20 0.23 0.00 0.00 176.35 176.62 1xgy s ASN 161 N 1.45 4.41 0.01 2.29 0.01 -1.26 -1.39 114.94 120.46 1xgy s ASN 161 Ca -0.02 -0.47 -0.00 0.00 -0.71 0.00 0.00 52.86 51.66 1xgy s ASN 161 Cb -0.13 -0.82 -0.01 0.00 0.41 0.00 0.00 41.25 40.69 1xgy s ASN 161 CO -0.04 0.13 -0.01 -0.55 -1.51 0.00 0.00 177.10 175.12 1xgy s SER 162 N -2.62 0.16 -0.05 -1.22 0.15 -0.75 -5.02 113.70 104.36 1xgy s SER 162 Ca 0.24 -0.34 0.00 0.00 0.70 0.00 0.00 55.95 56.56 1xgy s SER 162 Cb -0.10 0.08 0.02 0.00 -1.71 0.00 0.00 66.02 64.32 1xgy s SER 162 CO 0.15 -0.22 -0.02 0.26 1.20 0.00 0.00 173.24 174.62 1xgy s TRP 163 N -1.03 0.61 0.74 3.44 0.51 -1.26 -1.68 118.94 120.27 1xgy s TRP 163 Ca -0.11 -0.14 -0.12 0.00 -2.12 0.00 0.00 56.10 53.61 1xgy s TRP 163 Cb -0.07 -0.63 0.04 0.00 -0.81 0.00 0.00 33.47 32.00 1xgy s TRP 163 CO -0.01 -0.21 1.11 0.95 -0.51 0.00 0.00 176.95 178.29 1xgy s THR 164 N 1.19 3.17 0.68 2.01 -4.23 -0.94 -5.03 115.64 112.49 1xgy s THR 164 Ca -0.07 0.38 -0.04 0.00 -1.18 0.00 0.00 61.69 60.78 1xgy s THR 164 Cb -0.14 -3.32 0.07 0.00 1.34 0.00 0.00 72.50 70.45 1xgy s THR 164 CO -0.02 -0.49 0.96 -1.81 -0.54 0.00 0.00 174.62 172.72 1xgy s ASP 165 N -4.30 4.75 0.20 3.99 1.01 -1.26 -4.56 116.67 116.50 1xgy s ASP 165 Ca 0.59 0.15 -0.32 0.00 0.71 0.00 0.00 52.55 53.68 1xgy s ASP 165 Cb -0.12 -0.77 -0.13 0.00 1.01 0.00 0.00 42.92 42.91 1xgy s ASP 165 CO 0.52 -1.59 1.63 1.67 0.21 0.00 0.00 175.17 177.61 1xgy n GLN 166 N -2.79 2.47 -1.47 8.23 7.27 -1.26 -4.74 117.38 125.09 1xgy n GLN 166 Ca 0.10 0.89 -0.34 0.00 0.07 0.00 0.00 57.00 57.71 1xgy n GLN 166 Cb 0.60 -2.68 0.09 0.00 2.41 0.00 0.00 30.24 30.66 1xgy n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1xgy s ASP 167 N 0.92 4.27 0.00 1.69 -1.08 0.58 -4.86 116.67 118.19 1xgy s ASP 167 Ca 0.75 2.36 0.24 0.00 -0.52 0.00 0.00 52.55 55.38 1xgy s ASP 167 Cb -0.58 -2.59 0.96 0.00 -1.46 0.00 0.00 42.92 39.25 1xgy s ASP 167 CO 0.38 -2.21 1.68 -1.20 0.52 0.00 0.00 175.17 174.33 1xgy n SER 168 N -2.64 1.41 0.00 -0.34 7.64 -1.26 -2.40 113.62 116.03 1xgy n SER 168 Ca 0.13 -1.56 0.00 0.00 1.01 0.00 0.00 58.87 58.45 1xgy n SER 168 Cb 0.50 -0.05 0.00 0.00 -1.01 0.00 0.00 64.21 63.65 1xgy n SER 168 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1xgy n LYS 169 N 0.13 0.49 -0.01 1.43 5.02 -1.26 -4.86 118.16 119.10 1xgy n LYS 169 Ca 0.18 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.35 1xgy n LYS 169 Cb 0.31 -0.64 -0.14 0.00 -0.02 0.00 0.00 35.03 34.54 1xgy n LYS 169 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 1xgy h ASP 170 N 0.00 0.11 -0.14 4.39 3.32 -1.97 -3.47 116.42 118.66 1xgy h ASP 170 Ca 0.00 -0.25 -0.06 0.00 0.02 0.00 0.00 57.03 56.74 1xgy h ASP 170 Cb 0.29 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1xgy h ASP 170 CO 0.00 1.22 -0.06 -1.20 -1.72 0.00 0.00 179.24 177.49 1xgy n SER 171 N -3.17 -4.65 -4.74 6.45 7.64 -1.01 -4.93 113.62 109.21 1xgy n SER 171 Ca -0.20 0.08 -0.25 0.00 1.01 0.00 0.00 58.87 59.50 1xgy n SER 171 Cb 1.05 -2.42 0.09 0.00 -1.01 0.00 0.00 64.21 61.92 1xgy n SER 171 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1xgy s THR 172 N -1.68 2.23 0.06 0.44 2.01 -1.26 -4.57 115.64 112.87 1xgy s THR 172 Ca 0.00 -0.34 0.04 0.00 0.31 0.00 0.00 61.69 61.71 1xgy s THR 172 Cb 0.00 -2.90 -0.03 0.00 0.01 0.00 0.00 72.50 69.59 1xgy s THR 172 CO 0.00 0.00 -0.13 -0.31 -0.69 0.00 0.00 174.62 173.49 1xgy s TYR 173 N -3.28 1.08 0.14 4.92 1.51 0.10 -0.31 117.35 121.51 1xgy s TYR 173 Ca 0.64 -0.47 0.01 0.00 -1.01 0.00 0.00 57.07 56.24 1xgy s TYR 173 Cb -0.08 -0.61 -0.04 0.00 -0.11 0.00 0.00 41.96 41.11 1xgy s TYR 173 CO 0.45 0.02 0.00 -1.12 -1.11 0.00 0.00 175.55 173.80 1xgy s SER 174 N -1.70 0.94 0.01 2.29 0.01 -1.26 0.82 113.70 114.80 1xgy s SER 174 Ca -0.04 -1.14 -0.13 0.00 1.31 0.00 0.00 55.95 55.94 1xgy s SER 174 Cb -0.10 0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.31 1xgy s SER 174 CO 0.02 -0.59 0.28 -0.32 0.41 0.00 0.00 173.24 173.03 1xgy s MET 175 N -3.93 0.68 -0.03 12.44 1.75 0.20 -2.22 119.30 128.18 1xgy s MET 175 Ca 0.21 -0.33 0.01 0.00 -1.25 0.00 0.00 55.69 54.33 1xgy s MET 175 Cb 0.06 0.30 0.02 0.00 2.84 0.00 0.00 34.83 38.05 1xgy s MET 175 CO 0.01 -0.19 -0.03 0.45 -0.65 0.00 0.00 175.02 174.61 1xgy s SER 176 N -1.57 0.66 -0.04 1.11 0.15 -0.68 -0.62 113.70 112.71 1xgy s SER 176 Ca -0.11 -0.08 0.04 0.00 0.70 0.00 0.00 55.95 56.49 1xgy s SER 176 Cb -0.04 -0.27 -0.00 0.00 -1.71 0.00 0.00 66.02 64.00 1xgy s SER 176 CO 0.02 -0.04 -0.16 -0.55 1.20 0.00 0.00 173.24 173.71 1xgy s SER 177 N 0.66 1.98 -0.14 5.45 0.15 0.14 -1.81 113.70 120.14 1xgy s SER 177 Ca -0.08 -0.32 -0.00 0.00 0.70 0.00 0.00 55.95 56.25 1xgy s SER 177 Cb -0.11 -0.54 0.03 0.00 -1.71 0.00 0.00 66.02 63.69 1xgy s SER 177 CO -0.00 0.14 -0.09 -0.89 1.20 0.00 0.00 173.24 173.60 1xgy s THR 178 N 0.06 1.22 -0.43 6.45 2.01 -0.49 -0.14 115.64 124.32 1xgy s THR 178 Ca -0.04 -0.51 -0.16 0.00 0.31 0.00 0.00 61.69 61.30 1xgy s THR 178 Cb -0.11 -1.26 0.04 0.00 0.01 0.00 0.00 72.50 71.18 1xgy s THR 178 CO 0.02 0.32 0.35 -0.22 -0.69 0.00 0.00 174.62 174.40 1xgy s LEU 179 N 1.61 5.24 -0.24 4.42 2.96 -0.00 -1.45 118.68 131.22 1xgy s LEU 179 Ca 0.03 -1.01 -0.09 0.00 -0.22 0.00 0.00 54.13 52.84 1xgy s LEU 179 Cb -0.14 -2.20 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 1xgy s LEU 179 CO -0.09 -0.54 0.13 -0.89 -1.32 0.00 0.00 176.35 173.65 1xgy s THR 180 N 1.74 5.02 0.43 3.68 2.01 0.89 -0.35 115.64 129.07 1xgy s THR 180 Ca 0.06 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.15 1xgy s THR 180 Cb -0.20 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 68.93 1xgy s THR 180 CO 0.09 0.34 0.08 -0.76 -0.69 0.00 0.00 174.62 173.68 1xgy s LEU 181 N 1.26 2.13 0.33 4.42 1.43 0.23 -4.70 118.68 123.79 1xgy s LEU 181 Ca 0.06 -1.64 -0.18 0.00 -1.03 0.00 0.00 54.13 51.35 1xgy s LEU 181 Cb -0.14 -0.34 -0.09 0.00 0.03 0.00 0.00 46.19 45.65 1xgy s LEU 181 CO 0.05 -0.87 0.80 -0.89 0.23 0.00 0.00 176.35 175.67 1xgy s THR 182 N -3.10 4.57 0.34 5.49 2.01 -1.26 -0.81 115.64 122.88 1xgy s THR 182 Ca 0.20 1.17 0.07 0.00 0.31 0.00 0.00 61.69 63.44 1xgy s THR 182 Cb 0.03 -3.66 0.31 0.00 0.01 0.00 0.00 72.50 69.19 1xgy s THR 182 CO 0.11 -0.14 1.87 0.50 -0.69 0.00 0.00 174.62 176.27 1xgy h LYS 183 N 2.38 0.74 -0.27 4.92 3.64 -1.51 0.40 116.57 126.87 1xgy h LYS 183 Ca -0.48 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 58.78 1xgy h LYS 183 Cb 1.18 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.82 1xgy h LYS 183 CO 0.64 0.49 -0.10 -0.44 -2.27 0.00 0.00 179.45 177.77 1xgy h ASP 184 N 0.76 0.56 0.53 4.20 3.32 -1.92 -1.07 116.42 122.80 1xgy h ASP 184 Ca 0.44 -0.39 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 1xgy h ASP 184 Cb 0.62 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1xgy h ASP 184 CO -0.20 0.83 -0.54 -0.08 -1.72 0.00 0.00 179.24 177.52 1xgy h GLU 185 N 0.30 0.02 -0.57 3.56 4.81 -1.68 -2.50 114.58 118.52 1xgy h GLU 185 Ca 0.06 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 59.18 1xgy h GLU 185 Cb 0.60 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.96 1xgy h GLU 185 CO 0.03 0.56 -0.05 -0.92 -0.73 0.00 0.00 179.01 177.91 1xgy h TYR 186 N 0.01 1.15 -0.00 0.92 3.20 -0.12 -2.91 116.97 119.23 1xgy h TYR 186 Ca -0.00 -0.22 0.00 0.00 3.14 0.00 0.00 58.73 61.65 1xgy h TYR 186 Cb 0.96 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.94 1xgy h TYR 186 CO 0.00 1.04 -0.08 0.39 -1.64 0.00 0.00 178.16 177.87 1xgy n GLU 187 N -4.18 0.12 0.22 1.82 1.02 -0.42 -3.33 120.64 115.89 1xgy n GLU 187 Ca 0.02 -0.02 0.11 0.00 -0.02 0.00 0.00 57.16 57.25 1xgy n GLU 187 Cb 0.37 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.58 1xgy n GLU 187 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xgy h ARG 188 N 0.05 0.00 -5.94 3.49 3.08 -1.24 -3.45 114.38 110.36 1xgy h ARG 188 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1xgy h ARG 188 Cb 0.45 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.40 1xgy h ARG 188 CO 0.00 0.13 -0.58 -1.01 -1.07 0.00 0.00 179.97 177.44 1xgy s HIS 189 N -3.32 2.57 -0.01 3.04 3.76 -1.21 -5.08 115.29 115.03 1xgy s HIS 189 Ca 0.04 -0.50 0.01 0.00 -0.15 0.00 0.00 55.06 54.46 1xgy s HIS 189 Cb 0.07 -1.66 -0.02 0.00 1.11 0.00 0.00 32.58 32.08 1xgy s HIS 189 CO 0.65 0.39 0.01 -1.71 -0.85 0.00 0.00 174.74 173.23 1xgy n ASN 190 N -1.04 4.66 -4.44 1.40 5.15 -1.26 -4.86 115.26 114.87 1xgy n ASN 190 Ca -0.03 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.61 1xgy n ASN 190 Cb 0.63 0.69 -0.13 0.00 -0.53 0.00 0.00 39.78 40.45 1xgy n ASN 190 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1xgy s SER 191 N -2.87 4.58 -0.16 1.20 0.15 -1.26 -2.45 113.70 112.88 1xgy s SER 191 Ca -0.01 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.43 1xgy s SER 191 Cb 0.01 -1.75 0.03 0.00 -1.71 0.00 0.00 66.02 62.59 1xgy s SER 191 CO 0.06 0.12 -0.12 -0.31 1.20 0.00 0.00 173.24 174.19 1xgy s TYR 192 N 0.65 2.15 0.05 3.44 1.51 -0.84 0.45 117.35 124.76 1xgy s TYR 192 Ca -0.03 -1.27 0.08 0.00 -1.01 0.00 0.00 57.07 54.85 1xgy s TYR 192 Cb -0.15 -1.56 -0.03 0.00 -0.11 0.00 0.00 41.96 40.12 1xgy s TYR 192 CO 0.02 -0.67 -0.24 0.99 -1.11 0.00 0.00 175.55 174.54 1xgy s THR 193 N 1.49 1.92 -0.27 -0.71 2.01 0.20 -1.86 115.64 118.42 1xgy s THR 193 Ca 0.03 -1.33 0.02 0.00 0.31 0.00 0.00 61.69 60.72 1xgy s THR 193 Cb -0.14 -1.66 0.07 0.00 0.01 0.00 0.00 72.50 70.79 1xgy s THR 193 CO -0.10 0.26 -0.03 0.00 -0.69 0.00 0.00 174.62 174.06 1xgy s GLU 195 N 1.25 4.33 -0.25 0.00 2.02 0.10 -3.12 118.70 123.04 1xgy s GLU 195 Ca -0.02 0.65 0.02 0.00 0.02 0.00 0.00 54.97 55.65 1xgy s GLU 195 Cb -0.19 -3.39 0.06 0.00 0.10 0.00 0.00 34.13 30.71 1xgy s GLU 195 CO -0.08 0.25 -0.09 0.00 0.02 0.00 0.00 175.26 175.35 1xgy s ALA 196 N 0.25 2.38 -0.31 5.21 0.00 0.30 -1.23 121.76 128.36 1xgy s ALA 196 Ca 0.30 -1.64 -0.15 0.00 0.00 0.00 0.00 51.96 50.48 1xgy s ALA 196 Cb -0.17 -1.53 -0.02 0.00 0.00 0.00 0.00 23.12 21.39 1xgy s ALA 196 CO 0.15 -1.18 0.35 0.99 0.00 0.00 0.00 175.76 176.07 1xgy s THR 197 N 1.19 5.18 0.07 0.00 2.01 0.67 -0.34 115.64 124.41 1xgy s THR 197 Ca -0.08 0.23 -0.01 0.00 0.31 0.00 0.00 61.69 62.14 1xgy s THR 197 Cb -0.20 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 1xgy s THR 197 CO -0.05 0.01 -0.02 -2.28 -0.69 0.00 0.00 174.62 171.58 1xgy s HIS 198 N 2.02 0.61 0.30 4.92 2.46 -1.26 -1.64 115.29 122.71 1xgy s HIS 198 Ca 0.12 -1.07 0.01 0.00 0.47 0.00 0.00 55.06 54.59 1xgy s HIS 198 Cb -0.16 -0.42 0.48 0.00 -0.13 0.00 0.00 32.58 32.35 1xgy s HIS 198 CO 0.11 -0.37 1.87 -0.22 -2.47 0.00 0.00 174.74 173.66 1xgy h LYS 199 N 3.09 0.75 -0.00 2.88 3.64 -1.93 -3.03 116.57 121.97 1xgy h LYS 199 Ca -0.34 -0.14 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1xgy h LYS 199 Cb 1.15 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.85 1xgy h LYS 199 CO 0.65 0.67 0.07 1.79 -2.27 0.00 0.00 179.45 180.36 1xgy h THR 200 N 0.73 0.01 -3.88 1.00 1.35 -1.88 -3.43 112.91 106.82 1xgy h THR 200 Ca 0.17 0.00 -0.25 0.00 -0.55 0.00 0.00 66.41 65.78 1xgy h THR 200 Cb 0.24 0.93 -0.17 0.00 -1.73 0.00 0.00 68.15 67.42 1xgy h THR 200 CO -0.01 0.00 -0.71 -0.55 -0.25 0.00 0.00 175.52 174.00 1xgy s SER 201 N -5.01 1.04 -0.06 5.36 0.15 -1.14 -5.00 113.70 109.04 1xgy s SER 201 Ca -0.05 -0.82 -0.15 0.00 0.70 0.00 0.00 55.95 55.64 1xgy s SER 201 Cb 0.12 0.07 -0.30 0.00 -1.71 0.00 0.00 66.02 64.20 1xgy s SER 201 CO 0.38 -0.35 0.69 0.74 1.20 0.00 0.00 173.24 175.90 1xgy h THR 202 N 3.60 1.08 -3.00 6.45 2.02 -1.84 -3.42 112.91 117.81 1xgy h THR 202 Ca -0.36 -2.50 -0.62 0.00 0.77 0.00 0.00 66.41 63.71 1xgy h THR 202 Cb 1.18 2.83 -0.06 0.00 -1.74 0.00 0.00 68.15 70.36 1xgy h THR 202 CO 0.55 0.78 -0.27 -0.44 0.37 0.00 0.00 175.52 176.51 1xgy s SER 203 N -7.20 6.68 0.30 4.18 0.01 -1.26 -5.03 113.70 111.37 1xgy s SER 203 Ca -0.16 0.80 -0.29 0.00 1.31 0.00 0.00 55.95 57.61 1xgy s SER 203 Cb 0.04 -2.21 -0.13 0.00 0.21 0.00 0.00 66.02 63.94 1xgy s SER 203 CO 0.83 0.29 1.35 -0.81 0.41 0.00 0.00 173.24 175.31 1xgy n PRO 204 N 2.19 2.12 -2.55 12.44 -0.04 -1.26 -4.90 135.00 142.99 1xgy n PRO 204 Ca -0.14 0.75 -0.42 0.00 -0.04 0.00 0.00 63.50 63.64 1xgy n PRO 204 Cb 0.53 -2.37 -0.03 0.00 -0.04 0.00 0.00 33.50 31.59 1xgy n PRO 204 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1xgy s ILE 205 N -0.65 4.42 -0.06 0.52 1.09 0.54 -4.79 121.20 122.28 1xgy s ILE 205 Ca 0.61 1.73 0.05 0.00 -1.10 0.00 0.00 60.65 61.94 1xgy s ILE 205 Cb -0.59 -4.11 -0.01 0.00 -1.06 0.00 0.00 42.46 36.69 1xgy s ILE 205 CO 0.57 0.12 -0.22 -0.69 -0.10 0.00 0.00 174.94 174.62 1xgy s VAL 206 N 1.16 1.80 0.00 2.92 1.01 -1.26 -0.54 120.40 125.50 1xgy s VAL 206 Ca 0.55 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.62 1xgy s VAL 206 Cb -0.25 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 1xgy s VAL 206 CO 0.28 0.51 -0.01 -0.54 0.00 0.00 0.00 175.10 175.33 1xgy s LYS 207 N -0.03 0.11 0.29 2.72 -0.14 -1.18 -5.02 119.74 116.49 1xgy s LYS 207 Ca -0.05 -0.13 -0.20 0.00 -1.36 0.00 0.00 55.97 54.23 1xgy s LYS 207 Cb -0.13 -0.04 0.02 0.00 -1.68 0.00 0.00 37.83 36.00 1xgy s LYS 207 CO 0.04 0.01 0.71 -1.12 -0.76 0.00 0.00 175.35 174.23 1xgy s SER 208 N -0.26 -0.22 0.14 2.83 0.01 -1.26 -0.87 113.70 114.07 1xgy s SER 208 Ca -0.02 -0.68 -0.17 0.00 1.31 0.00 0.00 55.95 56.38 1xgy s SER 208 Cb -0.02 0.74 0.04 0.00 0.21 0.00 0.00 66.02 66.99 1xgy s SER 208 CO -0.00 -1.37 0.44 0.72 0.41 0.00 0.00 173.24 173.44 1xgy s PHE 209 N -3.76 -0.24 0.26 2.43 -0.12 -0.78 -5.01 117.98 110.77 1xgy s PHE 209 Ca 0.12 -0.06 0.05 0.00 -0.05 0.00 0.00 56.93 56.99 1xgy s PHE 209 Cb -0.06 0.32 -0.06 0.00 -0.63 0.00 0.00 43.02 42.59 1xgy s PHE 209 CO 0.08 -0.75 -0.03 -0.80 -0.05 0.00 0.00 175.22 173.67 1xgy s ASN 210 N -2.80 2.38 0.00 1.98 0.02 -1.26 -1.98 114.94 113.28 1xgy s ASN 210 Ca 0.03 -1.21 0.00 0.00 -1.02 0.00 0.00 52.86 50.66 1xgy s ASN 210 Cb 0.01 -0.10 0.00 0.00 0.02 0.00 0.00 41.25 41.19 1xgy s ASN 210 CO -0.11 -0.43 0.00 -2.11 0.02 0.00 0.00 177.10 174.47