#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g3m s LEU 4 N 0.00 1.23 -0.00 1.39 2.96 -1.26 -0.76 118.68 122.24 2g3m s LEU 4 Ca 0.00 0.03 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 2g3m s LEU 4 Cb 0.00 -0.07 0.00 0.00 0.50 0.00 0.00 46.19 46.62 2g3m s LEU 4 CO 0.00 -0.11 -0.01 -0.54 -1.32 0.00 0.00 176.35 174.38 2g3m s LYS 5 N 0.89 0.05 -0.06 1.98 1.02 -0.58 -5.01 119.74 118.03 2g3m s LYS 5 Ca -0.08 -0.02 0.01 0.00 0.02 0.00 0.00 55.97 55.91 2g3m s LYS 5 Cb -0.11 -0.05 0.02 0.00 -0.52 0.00 0.00 37.83 37.16 2g3m s LYS 5 CO -0.02 0.01 -0.08 0.42 -0.92 0.00 0.00 175.35 174.75 2g3m s ILE 6 N 0.00 0.87 0.31 2.17 1.01 -1.26 -0.26 121.20 124.04 2g3m s ILE 6 Ca 0.00 -0.30 0.10 0.00 0.00 0.00 0.00 60.65 60.45 2g3m s ILE 6 Cb -0.00 -0.84 -0.05 0.00 0.01 0.00 0.00 42.46 41.58 2g3m s ILE 6 CO -0.00 0.30 -0.11 -0.31 0.00 0.00 0.00 174.94 174.82 2g3m s TYR 7 N 0.89 2.41 0.02 3.97 1.51 -0.31 -0.41 117.35 125.44 2g3m s TYR 7 Ca -0.11 -0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 55.50 2g3m s TYR 7 Cb -0.15 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.48 2g3m s TYR 7 CO 0.01 0.63 0.11 -1.83 -1.11 0.00 0.00 175.55 173.36 2g3m s GLU 8 N -3.59 0.54 -0.30 -0.62 -1.05 -0.56 -0.53 118.70 112.59 2g3m s GLU 8 Ca 0.32 -0.61 -0.14 0.00 -0.15 0.00 0.00 54.97 54.39 2g3m s GLU 8 Cb -0.02 0.22 0.17 0.00 -0.44 0.00 0.00 34.13 34.06 2g3m s GLU 8 CO 0.17 -0.13 1.00 1.21 0.95 0.00 0.00 175.26 178.46 2g3m s ASN 9 N -1.82 -0.56 -1.37 0.83 3.04 -0.41 -2.53 114.94 112.13 2g3m s ASN 9 Ca -0.09 0.64 -0.02 0.00 0.04 0.00 0.00 52.86 53.43 2g3m s ASN 9 Cb -0.04 1.59 -0.00 0.00 -1.54 0.00 0.00 41.25 41.25 2g3m s ASN 9 CO -0.02 -0.11 0.49 0.29 -3.04 0.00 0.00 177.10 174.71 2g3m n LYS 10 N 5.07 -3.32 -1.05 0.43 5.02 -1.26 -1.78 118.16 121.27 2g3m n LYS 10 Ca -0.08 0.44 -0.02 0.00 -2.02 0.00 0.00 58.31 56.63 2g3m n LYS 10 Cb 0.53 -4.57 -0.01 0.00 -0.02 0.00 0.00 35.03 30.96 2g3m n LYS 10 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2g3m n GLY 11 N -1.91 0.54 3.06 0.72 0.00 -1.26 -4.97 105.19 101.37 2g3m n GLY 11 Ca -0.29 -0.45 -0.29 0.00 0.00 0.00 0.00 46.02 44.98 2g3m n GLY 11 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g3m s VAL 12 N -1.98 1.58 -0.23 1.61 1.01 -0.73 -0.95 120.40 120.71 2g3m s VAL 12 Ca 0.00 -0.68 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 2g3m s VAL 12 Cb 0.00 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2g3m s VAL 12 CO 0.00 0.46 0.10 -0.31 0.00 0.00 0.00 175.10 175.35 2g3m s TYR 13 N 1.12 3.19 -0.37 5.22 1.51 0.12 -1.29 117.35 126.86 2g3m s TYR 13 Ca -0.03 -0.07 -0.13 0.00 -1.01 0.00 0.00 57.07 55.83 2g3m s TYR 13 Cb -0.14 -2.22 0.00 0.00 -0.11 0.00 0.00 41.96 39.49 2g3m s TYR 13 CO -0.04 -0.10 0.25 0.21 -1.11 0.00 0.00 175.55 174.75 2g3m s LYS 14 N 1.19 3.18 -0.26 -0.62 2.20 0.31 -0.81 119.74 124.92 2g3m s LYS 14 Ca 0.06 -0.86 -0.11 0.00 -0.36 0.00 0.00 55.97 54.70 2g3m s LYS 14 Cb -0.14 -3.83 -0.05 0.00 -1.51 0.00 0.00 37.83 32.30 2g3m s LYS 14 CO 0.04 -0.59 0.19 0.08 -0.36 0.00 0.00 175.35 174.71 2g3m s VAL 15 N 1.67 5.32 -0.22 4.02 1.01 0.18 -1.16 120.40 131.22 2g3m s VAL 15 Ca 0.05 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.18 2g3m s VAL 15 Cb -0.18 -3.53 -0.01 0.00 0.00 0.00 0.00 36.38 32.66 2g3m s VAL 15 CO 0.09 0.28 -0.03 -0.69 0.00 0.00 0.00 175.10 174.75 2g3m s VAL 16 N 1.51 3.53 -0.20 2.92 1.01 0.65 -1.39 120.40 128.43 2g3m s VAL 16 Ca 0.08 -0.44 -0.04 0.00 0.00 0.00 0.00 61.98 61.57 2g3m s VAL 16 Cb -0.15 -2.61 -0.02 0.00 0.00 0.00 0.00 36.38 33.60 2g3m s VAL 16 CO 0.09 0.42 -0.03 -0.63 0.00 0.00 0.00 175.10 174.95 2g3m s ILE 17 N 1.39 3.67 0.00 2.22 -1.09 0.03 -1.53 121.20 125.89 2g3m s ILE 17 Ca 0.05 -0.41 0.00 0.00 -2.23 0.00 0.00 60.65 58.06 2g3m s ILE 17 Cb -0.14 -2.65 0.00 0.00 -1.58 0.00 0.00 42.46 38.09 2g3m s ILE 17 CO -0.02 0.44 0.00 0.61 -1.23 0.00 0.00 174.94 174.74 2g3m n GLY 18 N 4.34 2.03 2.81 6.18 0.00 0.06 -1.79 105.19 118.82 2g3m n GLY 18 Ca -0.18 -0.56 -0.28 0.00 0.00 0.00 0.00 46.02 45.00 2g3m n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g3m s GLU 19 N 0.00 2.08 0.63 1.61 2.02 -1.26 -4.88 118.70 118.90 2g3m s GLU 19 Ca 0.00 -2.98 -0.18 0.00 0.02 0.00 0.00 54.97 51.83 2g3m s GLU 19 Cb 0.00 -3.01 -0.02 0.00 0.10 0.00 0.00 34.13 31.20 2g3m s GLU 19 CO 0.00 -1.28 1.25 -2.14 0.02 0.00 0.00 175.26 173.12 2g3m s PRO 20 N -0.96 2.72 -0.55 0.39 0.02 -1.26 -4.86 135.00 130.50 2g3m s PRO 20 Ca 0.25 1.94 0.04 0.00 0.02 0.00 0.00 61.00 63.25 2g3m s PRO 20 Cb -0.07 -1.88 0.16 0.00 0.02 0.00 0.00 34.50 32.73 2g3m s PRO 20 CO -0.14 -1.43 0.39 0.12 -0.33 0.00 0.00 177.00 175.61 2g3m s PHE 21 N -1.52 2.32 0.53 6.54 5.36 -1.26 -5.01 117.98 124.95 2g3m s PHE 21 Ca 0.80 -2.79 -0.20 0.00 -0.96 0.00 0.00 56.93 53.77 2g3m s PHE 21 Cb -0.34 -1.85 -0.08 0.00 -0.34 0.00 0.00 43.02 40.41 2g3m s PHE 21 CO 0.37 -0.70 0.88 -2.30 -1.46 0.00 0.00 175.22 172.01 2g3m n PRO 22 N 2.55 0.96 0.05 10.12 -0.02 -1.26 -4.88 135.00 142.51 2g3m n PRO 22 Ca 0.22 0.36 0.05 0.00 -2.02 0.00 0.00 63.50 62.11 2g3m n PRO 22 Cb 0.40 -2.01 0.46 0.00 -0.02 0.00 0.00 33.50 32.33 2g3m n PRO 22 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2g3m h PRO 23 N 0.78 0.44 -2.68 0.52 0.11 -1.93 -3.42 132.00 125.83 2g3m h PRO 23 Ca -0.46 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 2g3m h PRO 23 Cb 1.36 -0.10 -0.18 0.00 0.11 0.00 0.00 31.00 32.19 2g3m h PRO 23 CO 0.52 0.29 -0.05 -1.50 -0.21 0.00 0.00 178.00 177.05 2g3m s ILE 24 N -5.40 0.04 -0.21 4.15 2.07 -1.26 -5.05 121.20 115.52 2g3m s ILE 24 Ca -0.08 -0.29 -0.09 0.00 -1.41 0.00 0.00 60.65 58.78 2g3m s ILE 24 Cb 0.17 -0.86 -0.04 0.00 0.13 0.00 0.00 42.46 41.86 2g3m s ILE 24 CO 0.72 -0.16 0.11 -1.61 -1.91 0.00 0.00 174.94 172.09 2g3m s GLU 25 N -1.69 4.00 -0.24 3.50 2.02 -1.26 -5.08 118.70 119.95 2g3m s GLU 25 Ca -0.10 -0.32 -0.09 0.00 0.02 0.00 0.00 54.97 54.49 2g3m s GLU 25 Cb -0.02 -3.38 -0.04 0.00 0.10 0.00 0.00 34.13 30.79 2g3m s GLU 25 CO 0.04 0.14 0.12 -0.06 0.02 0.00 0.00 175.26 175.52 2g3m s PHE 26 N 0.77 3.21 0.29 1.61 0.08 -1.26 -5.06 117.98 117.62 2g3m s PHE 26 Ca 0.06 -0.02 -0.30 0.00 0.12 0.00 0.00 56.93 56.79 2g3m s PHE 26 Cb -0.13 -2.24 -0.12 0.00 -0.57 0.00 0.00 43.02 39.96 2g3m s PHE 26 CO 0.02 -0.09 1.62 -2.30 -0.10 0.00 0.00 175.22 174.37 2g3m n PRO 27 N 4.48 2.75 -3.91 0.24 -0.02 -1.26 -4.99 135.00 132.28 2g3m n PRO 27 Ca -0.15 0.98 -0.30 0.00 -2.02 0.00 0.00 63.50 62.00 2g3m n PRO 27 Cb 0.52 -2.78 -0.15 0.00 -0.02 0.00 0.00 33.50 31.07 2g3m n PRO 27 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2g3m s LEU 28 N -0.34 3.82 0.00 2.45 1.43 -1.26 -4.89 118.68 119.89 2g3m s LEU 28 Ca 0.65 -2.05 0.00 0.00 -1.03 0.00 0.00 54.13 51.70 2g3m s LEU 28 Cb -0.49 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.38 2g3m s LEU 28 CO 0.47 -0.38 0.00 -0.62 0.23 0.00 0.00 176.35 176.05 2g3m n GLU 29 N 4.36 0.00 -1.80 1.70 1.02 -1.26 -3.78 120.64 120.88 2g3m n GLU 29 Ca 0.02 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.75 2g3m n GLU 29 Cb 0.41 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.82 2g3m n GLU 29 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2g3m n GLN 30 N 0.00 3.50 -2.30 3.49 3.00 -1.26 -4.94 117.38 118.87 2g3m n GLN 30 Ca 0.00 -2.83 -0.43 0.00 -0.01 0.00 0.00 57.00 53.73 2g3m n GLN 30 Cb 0.00 -2.98 -0.02 0.00 0.00 0.00 0.00 30.24 27.23 2g3m n GLN 30 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.06 175.47 2g3m s LYS 31 N 1.65 4.24 0.15 -1.09 -2.85 -1.25 -4.72 119.74 115.87 2g3m s LYS 31 Ca 0.52 1.83 0.11 0.00 -1.00 0.00 0.00 55.97 57.43 2g3m s LYS 31 Cb 0.15 -3.77 -0.04 0.00 -2.06 0.00 0.00 37.83 32.10 2g3m s LYS 31 CO -0.06 -0.70 -0.26 0.96 0.10 0.00 0.00 175.35 175.39 2g3m s ILE 32 N 3.36 2.31 0.17 3.79 -4.36 -1.05 -4.94 121.20 120.49 2g3m s ILE 32 Ca 0.60 -1.85 -0.33 0.00 -0.26 0.00 0.00 60.65 58.82 2g3m s ILE 32 Cb -0.26 -2.05 -0.14 0.00 1.25 0.00 0.00 42.46 41.25 2g3m s ILE 32 CO 0.20 0.02 1.42 -0.24 0.24 0.00 0.00 174.94 176.58 2g3m n SER 33 N 0.69 2.46 -4.82 4.36 2.88 -1.26 -1.50 113.62 116.43 2g3m n SER 33 Ca -0.16 1.12 -0.33 0.00 -1.33 0.00 0.00 58.87 58.16 2g3m n SER 33 Cb 0.54 -1.35 -0.07 0.00 -0.75 0.00 0.00 64.21 62.58 2g3m n SER 33 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2g3m s SER 34 N 0.50 6.95 -0.45 -3.46 0.15 0.46 -4.71 113.70 113.14 2g3m s SER 34 Ca 0.76 1.66 0.04 0.00 0.70 0.00 0.00 55.95 59.11 2g3m s SER 34 Cb -0.75 -2.53 0.43 0.00 -1.71 0.00 0.00 66.02 61.47 2g3m s SER 34 CO 0.45 -0.32 1.36 -0.46 1.20 0.00 0.00 173.24 175.48 2g3m n ASN 35 N -0.51 5.49 -3.68 5.45 2.04 -1.26 -4.92 115.26 117.87 2g3m n ASN 35 Ca 0.06 -3.75 -0.19 0.00 -0.44 0.00 0.00 54.58 50.26 2g3m n ASN 35 Cb 0.54 -0.54 -0.17 0.00 -2.53 0.00 0.00 39.78 37.07 2g3m n ASN 35 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 2g3m s LYS 36 N -3.66 -0.04 0.89 -3.83 2.20 -1.26 -5.16 119.74 108.88 2g3m s LYS 36 Ca 0.52 0.40 -0.13 0.00 -0.36 0.00 0.00 55.97 56.40 2g3m s LYS 36 Cb 0.42 -0.42 0.13 0.00 -1.51 0.00 0.00 37.83 36.46 2g3m s LYS 36 CO -0.10 -0.30 1.21 -1.54 -0.36 0.00 0.00 175.35 174.26 2g3m s SER 37 N 2.06 3.74 0.18 1.43 1.04 -1.26 -4.93 113.70 115.96 2g3m s SER 37 Ca 0.03 0.68 -0.12 0.00 0.48 0.00 0.00 55.95 57.02 2g3m s SER 37 Cb -0.12 -1.05 0.09 0.00 0.10 0.00 0.00 66.02 65.04 2g3m s SER 37 CO -0.04 -2.38 1.76 0.25 0.98 0.00 0.00 173.24 173.82 2g3m h LEU 38 N -1.38 0.82 -1.16 2.42 5.85 -1.98 -2.51 115.31 117.37 2g3m h LEU 38 Ca -0.46 -0.14 -0.08 0.00 0.84 0.00 0.00 57.88 58.04 2g3m h LEU 38 Cb 1.30 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 2g3m h LEU 38 CO 0.56 0.73 -0.39 0.77 -0.34 0.00 0.00 178.44 179.77 2g3m h SER 39 N 0.86 0.00 1.39 1.25 4.64 -1.94 -1.42 113.55 118.33 2g3m h SER 39 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2g3m h SER 39 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2g3m h SER 39 CO -0.03 0.39 0.00 -0.33 -0.87 0.00 0.00 176.83 175.99 2g3m h GLU 40 N 0.00 0.00 -0.01 4.77 5.08 -1.85 -0.97 114.58 121.61 2g3m h GLU 40 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2g3m h GLU 40 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 2g3m h GLU 40 CO 0.05 0.00 -0.28 1.28 -1.00 0.00 0.00 179.01 179.06 2g3m n LEU 41 N -2.96 1.07 -1.30 1.33 4.32 -0.62 -4.94 117.00 113.90 2g3m n LEU 41 Ca 0.02 -0.29 -0.12 0.00 -0.02 0.00 0.00 56.01 55.61 2g3m n LEU 41 Cb 0.39 -0.12 -0.01 0.00 -1.62 0.00 0.00 43.42 42.06 2g3m n LEU 41 CO 0.29 0.20 -0.15 0.61 -1.22 0.00 0.00 177.39 177.13 2g3m n GLY 42 N 1.35 0.02 3.47 -0.72 0.00 -0.37 -5.02 105.19 103.92 2g3m n GLY 42 Ca 0.12 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.45 2g3m n GLY 42 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g3m s LEU 43 N -3.32 2.63 -0.04 0.99 1.43 -0.67 -4.36 118.68 115.34 2g3m s LEU 43 Ca 0.00 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.50 2g3m s LEU 43 Cb 0.00 -1.45 -0.00 0.00 0.03 0.00 0.00 46.19 44.77 2g3m s LEU 43 CO 0.00 0.16 -0.16 -0.89 0.23 0.00 0.00 176.35 175.69 2g3m s THR 44 N -1.28 1.36 0.00 5.49 2.01 -0.58 -4.13 115.64 118.52 2g3m s THR 44 Ca 0.18 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.54 2g3m s THR 44 Cb -0.10 -1.16 -0.01 0.00 0.01 0.00 0.00 72.50 71.23 2g3m s THR 44 CO 0.10 0.39 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.64 2g3m s ILE 45 N -0.04 1.18 -0.03 1.82 1.01 -1.26 -0.47 121.20 123.41 2g3m s ILE 45 Ca -0.02 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.89 2g3m s ILE 45 Cb -0.10 -1.00 0.03 0.00 0.01 0.00 0.00 42.46 41.39 2g3m s ILE 45 CO 0.01 0.24 0.00 -0.69 0.00 0.00 0.00 174.94 174.51 2g3m s VAL 46 N -0.49 0.16 -0.25 2.92 1.01 -0.33 -4.99 120.40 118.42 2g3m s VAL 46 Ca 0.05 0.09 -0.08 0.00 0.00 0.00 0.00 61.98 62.04 2g3m s VAL 46 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 2g3m s VAL 46 CO 0.00 0.14 0.09 -1.10 0.00 0.00 0.00 175.10 174.23 2g3m s GLN 47 N 1.01 3.71 0.00 2.72 -0.21 -1.26 -0.86 119.66 124.77 2g3m s GLN 47 Ca -0.10 -0.45 0.00 0.00 0.02 0.00 0.00 55.36 54.83 2g3m s GLN 47 Cb -0.14 -3.37 0.00 0.00 1.00 0.00 0.00 33.01 30.50 2g3m s GLN 47 CO -0.02 -0.18 0.00 1.04 -2.12 0.00 0.00 175.29 174.02 2g3m n GLN 48 N 4.91 2.74 -1.73 2.91 6.02 0.30 -4.99 117.38 127.53 2g3m n GLN 48 Ca -0.16 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.65 2g3m n GLN 48 Cb 0.52 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 31.70 2g3m n GLN 48 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2g3m s GLY 49 N 0.00 -0.57 -1.38 1.08 0.00 -1.26 -3.26 107.32 101.93 2g3m s GLY 49 Ca 0.00 -1.23 -0.07 0.00 0.00 0.00 0.00 44.72 43.42 2g3m s GLY 49 CO 0.00 4.01 0.52 0.70 0.00 0.00 0.00 173.10 178.34 2g3m n ASN 50 N 17.44 -4.66 -3.88 1.64 3.02 -1.26 -4.95 115.26 122.61 2g3m n ASN 50 Ca 0.44 -0.33 -0.11 0.00 -0.03 0.00 0.00 54.58 54.55 2g3m n ASN 50 Cb 0.45 -3.81 -0.11 0.00 -0.61 0.00 0.00 39.78 35.70 2g3m n ASN 50 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2g3m s LYS 51 N -5.86 0.37 -0.11 3.52 1.02 -1.19 -2.00 119.74 115.48 2g3m s LYS 51 Ca 0.35 -0.28 0.03 0.00 0.02 0.00 0.00 55.97 56.09 2g3m s LYS 51 Cb -0.17 0.15 0.01 0.00 -0.52 0.00 0.00 37.83 37.30 2g3m s LYS 51 CO 0.43 -0.08 -0.20 0.08 -0.92 0.00 0.00 175.35 174.66 2g3m s VAL 52 N -1.01 1.85 -0.18 3.17 1.01 -0.47 -0.54 120.40 124.24 2g3m s VAL 52 Ca -0.11 -0.87 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 2g3m s VAL 52 Cb -0.06 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.69 2g3m s VAL 52 CO 0.01 0.51 -0.14 -0.63 0.00 0.00 0.00 175.10 174.85 2g3m s ILE 53 N 0.70 2.63 -0.17 2.22 1.01 -0.04 -0.79 121.20 126.77 2g3m s ILE 53 Ca -0.11 -0.76 -0.02 0.00 0.00 0.00 0.00 60.65 59.76 2g3m s ILE 53 Cb -0.16 -2.14 -0.01 0.00 0.01 0.00 0.00 42.46 40.16 2g3m s ILE 53 CO 0.02 0.50 -0.10 -0.69 0.00 0.00 0.00 174.94 174.67 2g3m s VAL 54 N 1.15 3.12 0.03 2.92 1.01 0.39 -1.19 120.40 127.83 2g3m s VAL 54 Ca 0.01 -0.61 0.07 0.00 0.00 0.00 0.00 61.98 61.45 2g3m s VAL 54 Cb -0.14 -2.36 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 2g3m s VAL 54 CO -0.05 0.49 -0.19 -1.61 0.00 0.00 0.00 175.10 173.73 2g3m s GLU 55 N 0.88 2.09 0.02 2.72 2.02 0.38 -0.40 118.70 126.41 2g3m s GLU 55 Ca -0.03 -0.96 0.00 0.00 0.02 0.00 0.00 54.97 54.01 2g3m s GLU 55 Cb -0.15 -2.17 -0.02 0.00 0.10 0.00 0.00 34.13 31.89 2g3m s GLU 55 CO 0.00 0.55 -0.04 0.21 0.02 0.00 0.00 175.26 176.00 2g3m s LYS 56 N -1.28 0.33 0.78 1.61 2.20 -0.62 -1.52 119.74 121.23 2g3m s LYS 56 Ca 0.14 -0.58 -0.11 0.00 -0.36 0.00 0.00 55.97 55.05 2g3m s LYS 56 Cb -0.10 0.01 0.06 0.00 -1.51 0.00 0.00 37.83 36.28 2g3m s LYS 56 CO 0.04 -0.02 1.10 -1.54 -0.36 0.00 0.00 175.35 174.56 2g3m s SER 57 N -1.33 4.67 -0.11 1.43 1.04 -1.26 -0.65 113.70 117.49 2g3m s SER 57 Ca -0.13 1.29 -0.04 0.00 0.48 0.00 0.00 55.95 57.55 2g3m s SER 57 Cb -0.09 -2.04 0.05 0.00 0.10 0.00 0.00 66.02 64.04 2g3m s SER 57 CO -0.01 -1.85 0.08 -0.22 0.98 0.00 0.00 173.24 172.22 2g3m s LEU 58 N -5.70 0.23 0.59 2.42 2.96 -0.07 -4.53 118.68 114.59 2g3m s LEU 58 Ca 0.60 -0.28 -0.07 0.00 -0.22 0.00 0.00 54.13 54.17 2g3m s LEU 58 Cb -0.14 -0.17 -0.01 0.00 0.50 0.00 0.00 46.19 46.37 2g3m s LEU 58 CO 0.54 -0.30 0.92 -1.81 -1.32 0.00 0.00 176.35 174.37 2g3m s ASP 59 N 2.16 5.78 0.28 3.68 1.01 -1.26 -4.44 116.67 123.88 2g3m s ASP 59 Ca 0.03 0.90 -0.02 0.00 0.71 0.00 0.00 52.55 54.17 2g3m s ASP 59 Cb -0.14 -1.94 0.42 0.00 1.01 0.00 0.00 42.92 42.28 2g3m s ASP 59 CO -0.06 -0.98 1.91 -0.07 0.21 0.00 0.00 175.17 176.18 2g3m h LEU 60 N -0.18 1.01 -0.57 1.23 3.38 -1.99 -2.54 115.31 115.65 2g3m h LEU 60 Ca -0.45 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2g3m h LEU 60 Cb 1.24 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2g3m h LEU 60 CO 0.61 0.68 -0.35 0.29 0.09 0.00 0.00 178.44 179.76 2g3m n LYS 61 N -4.46 0.85 -2.04 1.13 4.76 -1.26 -4.94 118.16 112.20 2g3m n LYS 61 Ca 0.13 -0.57 -0.41 0.00 -2.87 0.00 0.00 58.31 54.59 2g3m n LYS 61 Cb 0.13 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.82 2g3m n LYS 61 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2g3m s GLU 62 N -2.54 4.30 -0.08 1.97 2.12 -0.96 -4.91 118.70 118.60 2g3m s GLU 62 Ca 0.21 2.29 -0.01 0.00 0.36 0.00 0.00 54.97 57.82 2g3m s GLU 62 Cb 0.19 -3.07 -0.03 0.00 0.26 0.00 0.00 34.13 31.48 2g3m s GLU 62 CO 0.56 -0.30 -0.00 -1.01 -0.54 0.00 0.00 175.26 173.96 2g3m s HIS 63 N -0.80 3.13 -0.17 5.30 3.76 -0.74 -4.87 115.29 120.90 2g3m s HIS 63 Ca 0.52 0.17 0.01 0.00 -0.15 0.00 0.00 55.06 55.61 2g3m s HIS 63 Cb -0.41 -1.77 0.03 0.00 1.11 0.00 0.00 32.58 31.53 2g3m s HIS 63 CO 0.51 0.46 -0.14 0.42 -0.85 0.00 0.00 174.74 175.14 2g3m s ILE 64 N -0.90 1.69 0.29 0.60 -1.09 -1.26 -1.08 121.20 119.45 2g3m s ILE 64 Ca 0.14 -0.78 0.05 0.00 -2.23 0.00 0.00 60.65 57.83 2g3m s ILE 64 Cb -0.11 -1.61 -0.06 0.00 -1.58 0.00 0.00 42.46 39.10 2g3m s ILE 64 CO 0.03 0.41 -0.01 0.27 -1.23 0.00 0.00 174.94 174.40 2g3m s ILE 65 N 1.43 1.45 0.00 2.92 -4.36 -0.21 0.12 121.20 122.55 2g3m s ILE 65 Ca 0.04 -2.07 0.00 0.00 -0.26 0.00 0.00 60.65 58.36 2g3m s ILE 65 Cb -0.14 -2.57 0.00 0.00 1.25 0.00 0.00 42.46 41.01 2g3m s ILE 65 CO -0.11 -0.20 0.00 0.61 0.24 0.00 0.00 174.94 175.49 2g3m n GLY 66 N -0.61 0.43 2.43 6.27 0.00 -1.26 0.08 105.19 112.51 2g3m n GLY 66 Ca -0.04 -1.80 -0.03 0.00 0.00 0.00 0.00 46.02 44.15 2g3m n GLY 66 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g3m n LEU 67 N 0.00 0.16 0.00 0.99 4.77 0.20 -4.86 117.00 118.27 2g3m n LEU 67 Ca 0.00 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2g3m n LEU 67 Cb 0.00 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 39.60 2g3m n LEU 67 CO 0.00 -0.49 0.00 0.61 -1.33 0.00 0.00 177.39 176.18 2g3m n GLY 68 N -1.28 2.83 3.56 -0.72 0.00 -1.25 -4.41 105.19 103.92 2g3m n GLY 68 Ca -0.03 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 2g3m n GLY 68 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2g3m s GLU 69 N 0.00 3.09 -0.04 1.61 2.12 -1.26 -3.54 118.70 120.68 2g3m s GLU 69 Ca 0.00 -0.74 0.05 0.00 0.36 0.00 0.00 54.97 54.64 2g3m s GLU 69 Cb 0.00 -5.22 -0.01 0.00 0.26 0.00 0.00 34.13 29.16 2g3m s GLU 69 CO 0.00 -2.79 -0.18 0.15 -0.54 0.00 0.00 175.26 171.90 2g3m s LYS 70 N 5.95 1.81 -0.48 4.30 -0.14 -1.26 -4.56 119.74 125.35 2g3m s LYS 70 Ca 0.58 -0.66 -0.06 0.00 -1.36 0.00 0.00 55.97 54.47 2g3m s LYS 70 Cb -0.03 -1.60 -0.11 0.00 -1.68 0.00 0.00 37.83 34.41 2g3m s LYS 70 CO -0.05 0.30 3.17 0.00 -0.76 0.00 0.00 175.35 178.00 2g3m n ALA 71 N 3.00 6.61 -2.36 5.17 0.00 -1.26 -4.40 120.51 127.26 2g3m n ALA 71 Ca -0.17 -2.63 -0.13 0.00 0.00 0.00 0.00 53.44 50.50 2g3m n ALA 71 Cb 0.53 -2.45 -0.09 0.00 0.00 0.00 0.00 19.45 17.44 2g3m n ALA 71 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2g3m s PHE 72 N 0.14 1.21 0.61 0.00 0.40 -1.26 -0.72 117.98 118.35 2g3m s PHE 72 Ca 0.64 -1.37 -0.19 0.00 -0.60 0.00 0.00 56.93 55.41 2g3m s PHE 72 Cb 0.31 -0.49 -0.03 0.00 0.51 0.00 0.00 43.02 43.31 2g3m s PHE 72 CO -0.08 -0.76 1.16 0.39 0.70 0.00 0.00 175.22 176.63 2g3m n GLU 73 N -0.38 1.11 -0.16 0.44 4.71 -1.26 -4.87 120.64 120.23 2g3m n GLU 73 Ca 0.03 0.43 0.05 0.00 -0.01 0.00 0.00 57.16 57.66 2g3m n GLU 73 Cb 0.65 -2.38 0.35 0.00 -1.01 0.00 0.00 31.44 29.04 2g3m n GLU 73 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2g3m h LEU 74 N 0.66 0.67 -8.77 -4.62 4.07 -1.93 -3.35 115.31 102.05 2g3m h LEU 74 Ca -0.50 -0.00 -0.60 0.00 0.08 0.00 0.00 57.88 56.86 2g3m h LEU 74 Cb 1.34 -0.15 -0.10 0.00 1.08 0.00 0.00 40.66 42.84 2g3m h LEU 74 CO 0.53 0.45 0.57 -0.62 -1.08 0.00 0.00 178.44 178.28 2g3m s ASP 75 N -6.29 6.59 0.00 -0.43 -1.08 -1.26 -4.41 116.67 109.79 2g3m s ASP 75 Ca -0.10 0.38 0.23 0.00 -0.52 0.00 0.00 52.55 52.54 2g3m s ASP 75 Cb 0.19 -2.45 1.23 0.00 -1.46 0.00 0.00 42.92 40.43 2g3m s ASP 75 CO 0.77 -0.92 1.75 0.54 0.52 0.00 0.00 175.17 177.83 2g3m n ARG 76 N 6.88 0.47 -1.55 4.34 5.12 0.12 -4.95 116.66 127.08 2g3m n ARG 76 Ca 0.06 0.05 -0.38 0.00 -1.93 0.00 0.00 57.85 55.65 2g3m n ARG 76 Cb 0.48 -1.50 0.04 0.00 -1.16 0.00 0.00 32.46 30.33 2g3m n ARG 76 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2g3m n LYS 77 N -1.18 0.76 -2.87 5.56 5.02 -1.26 -3.92 118.16 120.26 2g3m n LYS 77 Ca 0.13 0.29 -0.10 0.00 -2.02 0.00 0.00 58.31 56.62 2g3m n LYS 77 Cb 0.14 -1.96 0.04 0.00 -0.02 0.00 0.00 35.03 33.23 2g3m n LYS 77 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2g3m n ARG 78 N -0.54 -3.39 -3.57 1.97 5.12 0.15 -5.02 116.66 111.39 2g3m n ARG 78 Ca 0.13 0.38 -0.17 0.00 -1.93 0.00 0.00 57.85 56.26 2g3m n ARG 78 Cb 0.47 -4.03 -0.07 0.00 -1.16 0.00 0.00 32.46 27.67 2g3m n ARG 78 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2g3m s LYS 79 N -5.24 0.97 -0.41 5.56 2.47 -1.11 -4.87 119.74 117.12 2g3m s LYS 79 Ca 0.17 0.36 -0.09 0.00 -1.56 0.00 0.00 55.97 54.85 2g3m s LYS 79 Cb -0.07 0.46 0.07 0.00 -1.46 0.00 0.00 37.83 36.82 2g3m s LYS 79 CO 0.33 -0.27 0.25 0.50 0.16 0.00 0.00 175.35 176.32 2g3m s ARG 80 N -0.88 2.61 0.03 4.03 3.52 -1.26 -1.12 118.95 125.88 2g3m s ARG 80 Ca -0.09 -1.42 -0.13 0.00 -0.13 0.00 0.00 55.73 53.96 2g3m s ARG 80 Cb -0.01 -3.76 -0.06 0.00 -1.56 0.00 0.00 34.95 29.56 2g3m s ARG 80 CO 0.08 -0.92 0.42 0.71 -0.81 0.00 0.00 175.30 174.78 2g3m s TYR 81 N 1.43 3.68 -0.16 5.12 1.51 0.52 -4.92 117.35 124.53 2g3m s TYR 81 Ca 0.03 0.94 -0.04 0.00 -1.01 0.00 0.00 57.07 56.99 2g3m s TYR 81 Cb -0.22 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.34 2g3m s TYR 81 CO 0.02 0.59 -0.02 0.08 -1.11 0.00 0.00 175.55 175.12 2g3m s VAL 82 N -1.20 4.04 -0.67 0.71 1.01 -1.26 -0.93 120.40 122.10 2g3m s VAL 82 Ca 0.27 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.82 2g3m s VAL 82 Cb -0.16 -2.78 0.17 0.00 0.00 0.00 0.00 36.38 33.62 2g3m s VAL 82 CO 0.15 0.49 0.58 -0.32 0.00 0.00 0.00 175.10 176.01 2g3m s MET 83 N 0.33 3.12 -0.28 2.72 1.75 -0.01 -4.48 119.30 122.45 2g3m s MET 83 Ca -0.03 -2.16 -0.00 0.00 -1.25 0.00 0.00 55.69 52.25 2g3m s MET 83 Cb -0.14 -4.22 0.17 0.00 2.84 0.00 0.00 34.83 33.48 2g3m s MET 83 CO 0.03 -1.27 0.52 -0.47 -0.65 0.00 0.00 175.02 173.17 2g3m s TYR 84 N 0.71 -1.36 0.04 4.11 5.04 -1.26 -3.44 117.35 121.19 2g3m s TYR 84 Ca 0.12 1.24 -0.36 0.00 -2.44 0.00 0.00 57.07 55.63 2g3m s TYR 84 Cb -0.19 0.31 -0.15 0.00 0.35 0.00 0.00 41.96 42.27 2g3m s TYR 84 CO -0.04 -0.88 1.54 0.09 -1.34 0.00 0.00 175.55 174.92 2g3m n ASN 85 N 5.40 2.42 -3.73 4.32 3.02 -1.26 -4.55 115.26 120.89 2g3m n ASN 85 Ca -0.01 1.08 -0.14 0.00 -0.03 0.00 0.00 54.58 55.49 2g3m n ASN 85 Cb 0.51 -1.28 -0.09 0.00 -0.61 0.00 0.00 39.78 38.31 2g3m n ASN 85 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2g3m s VAL 86 N 1.47 0.02 -0.53 2.41 0.11 -0.62 -4.81 120.40 118.44 2g3m s VAL 86 Ca 0.86 -0.13 -0.27 0.00 -2.93 0.00 0.00 61.98 59.50 2g3m s VAL 86 Cb -0.85 -0.62 -0.01 0.00 -1.53 0.00 0.00 36.38 33.36 2g3m s VAL 86 CO 0.47 -0.07 1.77 -0.62 -3.33 0.00 0.00 175.10 173.31 2g3m s ASP 87 N -0.31 5.59 0.00 3.54 -1.08 -1.26 -3.36 116.67 119.79 2g3m s ASP 87 Ca -0.05 0.60 0.20 0.00 -0.52 0.00 0.00 52.55 52.78 2g3m s ASP 87 Cb -0.03 -2.53 0.99 0.00 -1.46 0.00 0.00 42.92 39.89 2g3m s ASP 87 CO 0.02 -2.08 1.65 0.00 0.52 0.00 0.00 175.17 175.28 2g3m n ALA 88 N 11.54 2.04 -0.80 3.66 0.00 -1.26 -4.83 120.51 130.84 2g3m n ALA 88 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.55 2g3m n ALA 88 Cb 0.50 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.62 2g3m n ALA 88 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g3m n GLY 89 N 0.49 1.50 3.10 0.00 0.00 -1.26 -3.40 105.19 105.62 2g3m n GLY 89 Ca 0.08 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 2g3m n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g3m n ALA 90 N 6.63 4.68 -1.75 4.61 0.00 -1.26 -4.63 120.51 128.79 2g3m n ALA 90 Ca 0.00 -3.92 -0.37 0.00 0.00 0.00 0.00 53.44 49.15 2g3m n ALA 90 Cb 0.00 -3.49 0.03 0.00 0.00 0.00 0.00 19.45 15.99 2g3m n ALA 90 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 2g3m s TYR 91 N 3.27 2.38 0.45 0.00 -0.85 -1.22 -5.01 117.35 116.37 2g3m s TYR 91 Ca 0.49 1.47 0.05 0.00 -0.52 0.00 0.00 57.07 58.56 2g3m s TYR 91 Cb 0.09 -3.60 -0.05 0.00 0.38 0.00 0.00 41.96 38.78 2g3m s TYR 91 CO -0.01 -2.43 0.03 0.15 -1.52 0.00 0.00 175.55 171.76 2g3m s LYS 92 N -3.12 2.07 0.61 -3.49 1.02 -1.26 -4.65 119.74 110.92 2g3m s LYS 92 Ca 0.75 -2.19 -0.17 0.00 0.02 0.00 0.00 55.97 54.38 2g3m s LYS 92 Cb -0.34 -1.64 -0.02 0.00 -0.52 0.00 0.00 37.83 35.31 2g3m s LYS 92 CO 0.39 -0.17 1.13 -1.59 -0.92 0.00 0.00 175.35 174.18 2g3m s LYS 93 N -3.79 3.00 -0.04 1.68 -2.85 -1.26 -2.82 119.74 113.67 2g3m s LYS 93 Ca 0.25 1.51 0.00 0.00 -1.00 0.00 0.00 55.97 56.73 2g3m s LYS 93 Cb 0.06 -1.97 0.00 0.00 -2.06 0.00 0.00 37.83 33.87 2g3m s LYS 93 CO 0.13 -1.11 0.00 0.66 0.10 0.00 0.00 175.35 175.13 2g3m n TYR 94 N -1.95 0.00 -3.15 1.78 4.01 0.10 -5.00 117.16 112.95 2g3m n TYR 94 Ca 0.11 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.46 2g3m n TYR 94 Cb 0.51 -0.77 -0.06 0.00 -0.31 0.00 0.00 39.34 38.71 2g3m n TYR 94 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 2g3m s GLN 95 N -0.82 4.36 -0.12 -0.72 0.74 -1.13 -5.01 119.66 116.95 2g3m s GLN 95 Ca 0.00 0.89 -0.16 0.00 0.05 0.00 0.00 55.36 56.14 2g3m s GLN 95 Cb 0.00 -3.28 0.04 0.00 1.10 0.00 0.00 33.01 30.87 2g3m s GLN 95 CO 0.00 0.53 0.42 0.34 -0.55 0.00 0.00 175.29 176.02 2g3m s ASP 96 N -0.82 -0.40 0.83 6.67 2.15 -1.26 -4.25 116.67 119.59 2g3m s ASP 96 Ca 0.32 0.70 -0.06 0.00 0.43 0.00 0.00 52.55 53.94 2g3m s ASP 96 Cb -0.20 0.74 0.17 0.00 -0.30 0.00 0.00 42.92 43.32 2g3m s ASP 96 CO 0.21 -0.23 1.08 -0.81 -0.17 0.00 0.00 175.17 175.25 2g3m n PRO 97 N 2.43 -0.53 0.00 4.34 -0.04 -1.26 -4.97 135.00 134.97 2g3m n PRO 97 Ca -0.15 -2.37 0.00 0.00 -0.04 0.00 0.00 63.50 60.94 2g3m n PRO 97 Cb 0.57 -0.90 0.00 0.00 -0.04 0.00 0.00 33.50 33.13 2g3m n PRO 97 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2g3m n LEU 98 N 0.00 0.00 0.11 1.53 4.77 -1.26 -4.81 117.00 117.33 2g3m n LEU 98 Ca 0.16 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.10 2g3m n LEU 98 Cb 0.56 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.77 2g3m n LEU 98 CO 0.39 0.00 0.44 1.88 -1.33 0.00 0.00 177.39 178.77 2g3m h TYR 99 N 0.00 0.15 -3.72 -1.77 0.05 -1.87 -1.66 116.97 108.15 2g3m h TYR 99 Ca 0.00 -0.06 -0.68 0.00 0.05 0.00 0.00 58.73 58.04 2g3m h TYR 99 Cb 0.00 -0.02 -0.19 0.00 1.01 0.00 0.00 36.73 37.53 2g3m h TYR 99 CO 0.00 0.74 -0.73 0.08 -1.05 0.00 0.00 178.16 177.20 2g3m s VAL 100 N -3.57 3.42 -0.32 -2.88 1.01 -1.26 -3.79 120.40 113.02 2g3m s VAL 100 Ca -0.02 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.11 2g3m s VAL 100 Cb 0.12 -2.47 0.10 0.00 0.00 0.00 0.00 36.38 34.13 2g3m s VAL 100 CO 0.79 0.40 0.08 -0.44 0.00 0.00 0.00 175.10 175.93 2g3m s SER 101 N -1.35 4.26 -0.46 3.32 0.01 -0.92 -4.47 113.70 114.09 2g3m s SER 101 Ca 0.16 -1.80 -0.05 0.00 1.31 0.00 0.00 55.95 55.57 2g3m s SER 101 Cb -0.11 -1.11 0.12 0.00 0.21 0.00 0.00 66.02 65.13 2g3m s SER 101 CO 0.06 -0.40 0.28 -0.63 0.41 0.00 0.00 173.24 172.97 2g3m s ILE 102 N 1.39 3.64 -0.12 1.44 -1.09 -1.26 -3.79 121.20 121.40 2g3m s ILE 102 Ca 0.10 -2.10 -0.03 0.00 -2.23 0.00 0.00 60.65 56.38 2g3m s ILE 102 Cb -0.18 -3.45 -0.12 0.00 -1.58 0.00 0.00 42.46 37.13 2g3m s ILE 102 CO -0.19 -0.75 2.07 -2.65 -1.23 0.00 0.00 174.94 172.19 2g3m n PRO 103 N 4.53 1.14 -4.48 2.79 -0.02 -1.26 -4.01 135.00 133.70 2g3m n PRO 103 Ca -0.02 -0.63 -0.22 0.00 -2.02 0.00 0.00 63.50 60.60 2g3m n PRO 103 Cb 0.41 -1.85 -0.16 0.00 -0.02 0.00 0.00 33.50 31.88 2g3m n PRO 103 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2g3m s LEU 104 N 0.01 1.68 0.03 2.45 2.96 -1.26 -1.52 118.68 123.04 2g3m s LEU 104 Ca 0.34 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.03 2g3m s LEU 104 Cb 0.15 -0.68 -0.02 0.00 0.50 0.00 0.00 46.19 46.14 2g3m s LEU 104 CO -0.00 0.05 -0.06 0.72 -1.32 0.00 0.00 176.35 175.73 2g3m s PHE 105 N 0.45 0.52 -0.07 5.38 -0.12 -0.79 0.59 117.98 123.94 2g3m s PHE 105 Ca -0.09 -0.48 0.04 0.00 -0.05 0.00 0.00 56.93 56.35 2g3m s PHE 105 Cb -0.12 -0.32 -0.01 0.00 -0.63 0.00 0.00 43.02 41.93 2g3m s PHE 105 CO 0.02 -0.11 -0.21 0.42 -0.05 0.00 0.00 175.22 175.29 2g3m s ILE 106 N -1.33 2.43 -0.16 -4.49 1.01 0.11 -0.88 121.20 117.88 2g3m s ILE 106 Ca -0.11 -0.93 -0.06 0.00 0.00 0.00 0.00 60.65 59.55 2g3m s ILE 106 Cb -0.10 -1.92 -0.03 0.00 0.01 0.00 0.00 42.46 40.42 2g3m s ILE 106 CO -0.00 0.57 0.02 -0.55 0.00 0.00 0.00 174.94 174.97 2g3m s SER 107 N -0.18 5.28 -0.29 3.58 0.15 0.66 -1.05 113.70 121.86 2g3m s SER 107 Ca -0.02 0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.65 2g3m s SER 107 Cb -0.14 -1.86 0.07 0.00 -1.71 0.00 0.00 66.02 62.38 2g3m s SER 107 CO 0.03 0.19 -0.03 -0.69 1.20 0.00 0.00 173.24 173.95 2g3m s VAL 108 N 0.25 2.48 -0.11 4.45 1.01 -0.24 -0.59 120.40 127.64 2g3m s VAL 108 Ca 0.01 -1.73 0.02 0.00 0.00 0.00 0.00 61.98 60.29 2g3m s VAL 108 Cb -0.13 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.73 2g3m s VAL 108 CO 0.01 -0.20 -0.18 -0.75 0.00 0.00 0.00 175.10 173.99 2g3m s LYS 109 N 1.11 2.50 -1.46 2.72 2.20 -0.17 -1.80 119.74 124.84 2g3m s LYS 109 Ca -0.03 -0.67 -0.09 0.00 -0.36 0.00 0.00 55.97 54.82 2g3m s LYS 109 Cb -0.20 -2.05 0.04 0.00 -1.51 0.00 0.00 37.83 34.11 2g3m s LYS 109 CO -0.04 -0.02 0.89 -0.25 -0.36 0.00 0.00 175.35 175.57 2g3m n ASP 110 N 4.06 -5.53 0.00 1.43 8.00 -1.26 -1.13 116.55 122.11 2g3m n ASP 110 Ca -0.20 -0.53 0.00 0.00 0.71 0.00 0.00 54.79 54.78 2g3m n ASP 110 Cb 0.52 -4.42 0.00 0.00 -0.02 0.00 0.00 41.12 37.19 2g3m n ASP 110 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2g3m n GLY 111 N -1.68 1.64 3.71 0.44 0.00 -1.26 -5.00 105.19 103.03 2g3m n GLY 111 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2g3m n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g3m s VAL 112 N -3.10 5.29 -0.07 1.61 1.01 -0.29 -4.73 120.40 120.13 2g3m s VAL 112 Ca 0.00 0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.03 2g3m s VAL 112 Cb 0.00 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 2g3m s VAL 112 CO 0.00 0.43 0.24 0.00 0.00 0.00 0.00 175.10 175.78 2g3m s ALA 113 N 0.43 3.82 -0.02 5.51 0.00 0.87 -1.00 121.76 131.36 2g3m s ALA 113 Ca 0.07 -0.49 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 2g3m s ALA 113 Cb -0.11 -2.12 0.02 0.00 0.00 0.00 0.00 23.12 20.91 2g3m s ALA 113 CO -0.01 0.58 0.05 0.99 0.00 0.00 0.00 175.76 177.36 2g3m s THR 114 N -1.07 -0.04 0.11 0.00 2.01 0.24 -2.08 115.64 114.81 2g3m s THR 114 Ca 0.19 0.14 0.02 0.00 0.31 0.00 0.00 61.69 62.35 2g3m s THR 114 Cb -0.14 -0.09 -0.04 0.00 0.01 0.00 0.00 72.50 72.24 2g3m s THR 114 CO 0.08 0.06 0.21 -0.83 -0.69 0.00 0.00 174.62 173.45 2g3m s GLY 115 N 0.75 1.94 -0.18 4.40 0.00 0.15 -0.24 107.32 114.14 2g3m s GLY 115 Ca -0.06 -0.97 -0.03 0.00 0.00 0.00 0.00 44.72 43.66 2g3m s GLY 115 CO -0.02 -0.96 0.04 -0.19 0.00 0.00 0.00 173.10 171.96 2g3m s TYR 116 N -1.61 0.92 -0.23 1.90 1.51 -0.06 -0.03 117.35 119.76 2g3m s TYR 116 Ca 0.34 -0.74 -0.00 0.00 -1.01 0.00 0.00 57.07 55.66 2g3m s TYR 116 Cb -0.12 -0.97 0.03 0.00 -0.11 0.00 0.00 41.96 40.78 2g3m s TYR 116 CO 0.27 -0.57 -0.11 0.12 -1.11 0.00 0.00 175.55 174.15 2g3m s PHE 117 N 1.89 3.00 -0.44 2.71 5.36 -0.12 -1.89 117.98 128.50 2g3m s PHE 117 Ca -0.00 -1.66 -0.15 0.00 -0.96 0.00 0.00 56.93 54.16 2g3m s PHE 117 Cb -0.16 -2.00 0.05 0.00 -0.34 0.00 0.00 43.02 40.56 2g3m s PHE 117 CO -0.08 -0.76 0.35 -0.06 -1.46 0.00 0.00 175.22 173.20 2g3m s PHE 118 N 1.29 3.24 -1.43 10.12 0.40 -0.57 0.25 117.98 131.28 2g3m s PHE 118 Ca 0.01 -0.77 -0.15 0.00 -0.60 0.00 0.00 56.93 55.42 2g3m s PHE 118 Cb -0.16 -2.88 0.05 0.00 0.51 0.00 0.00 43.02 40.54 2g3m s PHE 118 CO -0.07 -0.70 2.15 -1.71 0.70 0.00 0.00 175.22 175.60 2g3m n ASN 119 N 5.18 4.04 -3.84 1.36 5.15 -0.75 -4.69 115.26 121.71 2g3m n ASN 119 Ca -0.12 -2.85 -0.16 0.00 -0.60 0.00 0.00 54.58 50.85 2g3m n ASN 119 Cb 0.45 -1.67 -0.16 0.00 -0.53 0.00 0.00 39.78 37.87 2g3m n ASN 119 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 2g3m s SER 120 N 3.33 0.39 -0.17 1.20 0.15 -1.26 -4.42 113.70 112.92 2g3m s SER 120 Ca 0.48 -0.03 0.15 0.00 0.70 0.00 0.00 55.95 57.25 2g3m s SER 120 Cb 0.12 -0.18 0.73 0.00 -1.71 0.00 0.00 66.02 64.99 2g3m s SER 120 CO -0.06 -0.07 1.63 0.00 1.20 0.00 0.00 173.24 175.94 2g3m n ALA 121 N 3.86 3.45 -1.86 5.45 0.00 -1.26 -4.87 120.51 125.29 2g3m n ALA 121 Ca -0.24 -1.65 -0.07 0.00 0.00 0.00 0.00 53.44 51.49 2g3m n ALA 121 Cb 0.52 -1.08 0.05 0.00 0.00 0.00 0.00 19.45 18.95 2g3m n ALA 121 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2g3m n SER 122 N 0.83 0.24 -3.89 0.00 3.41 -1.10 -1.94 113.62 111.17 2g3m n SER 122 Ca 0.25 -1.25 -0.42 0.00 -0.26 0.00 0.00 58.87 57.19 2g3m n SER 122 Cb 1.00 -0.25 -0.01 0.00 -0.26 0.00 0.00 64.21 64.69 2g3m n SER 122 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2g3m n LYS 123 N -1.70 2.59 -2.36 4.33 4.81 -1.25 -4.76 118.16 119.82 2g3m n LYS 123 Ca 0.05 -2.56 -0.41 0.00 -0.87 0.00 0.00 58.31 54.52 2g3m n LYS 123 Cb 0.18 -3.27 -0.04 0.00 0.02 0.00 0.00 35.03 31.92 2g3m n LYS 123 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2g3m s VAL 124 N 4.07 3.34 -0.17 3.15 1.01 -1.22 -4.46 120.40 126.12 2g3m s VAL 124 Ca 0.51 1.26 -0.02 0.00 0.00 0.00 0.00 61.98 63.73 2g3m s VAL 124 Cb 0.12 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2g3m s VAL 124 CO -0.01 0.27 -0.08 -0.63 0.00 0.00 0.00 175.10 174.64 2g3m s ILE 125 N -0.78 3.29 -0.42 2.22 -1.09 -0.08 -0.83 121.20 123.52 2g3m s ILE 125 Ca 0.48 -0.55 -0.04 0.00 -2.23 0.00 0.00 60.65 58.31 2g3m s ILE 125 Cb -0.34 -2.44 0.11 0.00 -1.58 0.00 0.00 42.46 38.21 2g3m s ILE 125 CO 0.42 0.48 0.23 -0.36 -1.23 0.00 0.00 174.94 174.49 2g3m s PHE 126 N 0.78 3.56 -0.66 3.97 0.40 -0.10 -0.84 117.98 125.09 2g3m s PHE 126 Ca -0.03 -2.31 -0.18 0.00 -0.60 0.00 0.00 56.93 53.81 2g3m s PHE 126 Cb -0.15 -3.29 0.12 0.00 0.51 0.00 0.00 43.02 40.22 2g3m s PHE 126 CO 0.01 -0.98 0.77 0.34 0.70 0.00 0.00 175.22 176.06 2g3m s ASP 127 N 2.00 6.31 -0.90 1.36 -1.08 0.16 -0.36 116.67 124.17 2g3m s ASP 127 Ca 0.08 -1.66 -0.18 0.00 -0.52 0.00 0.00 52.55 50.27 2g3m s ASP 127 Cb -0.23 -2.30 0.15 0.00 -1.46 0.00 0.00 42.92 39.07 2g3m s ASP 127 CO -0.04 -1.05 1.03 -0.69 0.52 0.00 0.00 175.17 174.95 2g3m s VAL 128 N 2.39 4.93 -1.70 1.11 1.01 -0.28 -0.77 120.40 127.10 2g3m s VAL 128 Ca 0.15 -1.76 -0.01 0.00 0.00 0.00 0.00 61.98 60.37 2g3m s VAL 128 Cb -0.20 -4.70 0.00 0.00 0.00 0.00 0.00 36.38 31.48 2g3m s VAL 128 CO 0.02 -1.39 0.10 0.61 0.00 0.00 0.00 175.10 174.44 2g3m n GLY 129 N 5.14 -0.47 0.32 4.51 0.00 0.50 0.34 105.19 115.53 2g3m n GLY 129 Ca 0.21 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 2g3m n GLY 129 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2g3m n LEU 130 N -3.08 1.69 -0.10 0.99 -0.00 -1.26 -4.12 117.00 111.14 2g3m n LEU 130 Ca -0.22 0.28 -0.10 0.00 -0.00 0.00 0.00 56.01 55.97 2g3m n LEU 130 Cb 0.67 -0.64 -0.03 0.00 -0.00 0.00 0.00 43.42 43.42 2g3m n LEU 130 CO 0.31 -0.20 0.87 -0.08 -0.00 0.00 0.00 177.39 178.28 2g3m h GLU 131 N -0.77 0.45 -4.03 1.96 4.81 -1.90 -3.39 114.58 111.72 2g3m h GLU 131 Ca -0.12 -0.09 -0.55 0.00 -0.13 0.00 0.00 59.36 58.47 2g3m h GLU 131 Cb 0.92 -0.07 -0.38 0.00 0.63 0.00 0.00 28.75 29.85 2g3m h GLU 131 CO -0.07 0.50 -0.78 -2.00 -0.73 0.00 0.00 179.01 175.92 2g3m s GLU 132 N -5.44 1.25 0.48 1.92 2.56 -1.26 -5.03 118.70 113.18 2g3m s GLU 132 Ca -0.13 -0.54 0.27 0.00 0.00 0.00 0.00 54.97 54.57 2g3m s GLU 132 Cb 0.09 -2.06 1.33 0.00 2.00 0.00 0.00 34.13 35.48 2g3m s GLU 132 CO 0.73 -0.50 1.81 -0.92 -0.56 0.00 0.00 175.26 175.83 2g3m h TYR 133 N 8.13 0.29 -0.62 5.30 3.20 -1.77 -0.82 116.97 130.67 2g3m h TYR 133 Ca -0.21 0.01 -0.24 0.00 3.14 0.00 0.00 58.73 61.43 2g3m h TYR 133 Cb 1.11 -0.09 -0.14 0.00 1.54 0.00 0.00 36.73 39.15 2g3m h TYR 133 CO 0.42 0.03 0.22 -0.40 -1.64 0.00 0.00 178.16 176.80 2g3m n ASP 134 N -4.39 3.85 -3.81 -2.11 5.75 -1.26 -4.69 116.55 109.88 2g3m n ASP 134 Ca 0.24 -3.42 -0.11 0.00 -0.01 0.00 0.00 54.79 51.48 2g3m n ASP 134 Cb 1.01 -0.71 -0.08 0.00 -1.03 0.00 0.00 41.12 40.31 2g3m n ASP 134 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2g3m s LYS 135 N -3.10 0.67 -0.26 0.11 1.02 -0.31 -0.89 119.74 116.98 2g3m s LYS 135 Ca 0.51 -0.47 -0.03 0.00 0.02 0.00 0.00 55.97 55.99 2g3m s LYS 135 Cb 0.43 0.29 0.01 0.00 -0.52 0.00 0.00 37.83 38.04 2g3m s LYS 135 CO 0.09 -0.19 -0.02 0.08 -0.92 0.00 0.00 175.35 174.38 2g3m s VAL 136 N -2.09 3.26 -0.21 3.17 1.01 0.18 -0.37 120.40 125.35 2g3m s VAL 136 Ca -0.09 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 2g3m s VAL 136 Cb -0.03 -2.63 0.00 0.00 0.00 0.00 0.00 36.38 33.72 2g3m s VAL 136 CO -0.01 0.21 -0.10 -0.63 0.00 0.00 0.00 175.10 174.57 2g3m s ILE 137 N 1.40 2.90 -0.20 2.22 1.01 0.05 -1.59 121.20 126.99 2g3m s ILE 137 Ca 0.02 -0.69 -0.05 0.00 0.00 0.00 0.00 60.65 59.92 2g3m s ILE 137 Cb -0.16 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.97 2g3m s ILE 137 CO -0.02 0.44 0.00 -0.69 0.00 0.00 0.00 174.94 174.67 2g3m s VAL 138 N 1.40 3.99 -0.21 2.92 1.01 0.47 -0.67 120.40 129.31 2g3m s VAL 138 Ca 0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 61.98 61.70 2g3m s VAL 138 Cb -0.14 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.43 2g3m s VAL 138 CO -0.07 0.43 -0.08 -0.89 0.00 0.00 0.00 175.10 174.49 2g3m s THR 139 N 0.99 3.03 -0.26 3.92 2.01 -0.02 -0.46 115.64 124.85 2g3m s THR 139 Ca 0.02 -0.65 -0.07 0.00 0.31 0.00 0.00 61.69 61.30 2g3m s THR 139 Cb -0.14 -2.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.97 2g3m s THR 139 CO 0.02 0.42 0.07 -0.63 -0.69 0.00 0.00 174.62 173.81 2g3m s ILE 140 N 1.42 4.16 -0.68 1.82 1.09 0.03 -0.90 121.20 128.14 2g3m s ILE 140 Ca 0.05 -0.36 -0.06 0.00 -1.10 0.00 0.00 60.65 59.18 2g3m s ILE 140 Cb -0.14 -3.01 -0.13 0.00 -1.06 0.00 0.00 42.46 38.12 2g3m s ILE 140 CO -0.06 0.26 2.67 -0.81 -0.10 0.00 0.00 174.94 176.90 2g3m n PRO 141 N 4.90 2.24 -3.84 2.79 -0.04 -1.26 -1.36 135.00 138.43 2g3m n PRO 141 Ca -0.16 -1.33 -0.11 0.00 -0.04 0.00 0.00 63.50 61.87 2g3m n PRO 141 Cb 0.50 -2.28 -0.09 0.00 -0.04 0.00 0.00 33.50 31.60 2g3m n PRO 141 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2g3m s GLU 142 N 2.23 0.65 0.19 0.54 2.02 -0.85 -4.86 118.70 118.63 2g3m s GLU 142 Ca 0.52 -0.53 0.25 0.00 0.02 0.00 0.00 54.97 55.23 2g3m s GLU 142 Cb 0.18 0.27 0.90 0.00 0.10 0.00 0.00 34.13 35.59 2g3m s GLU 142 CO -0.03 -0.18 1.75 -0.40 0.02 0.00 0.00 175.26 176.42 2g3m n ASP 143 N 0.91 0.62 -4.10 -0.19 5.68 -1.23 -2.76 116.55 115.48 2g3m n ASP 143 Ca -0.20 0.59 -0.08 0.00 -0.50 0.00 0.00 54.79 54.60 2g3m n ASP 143 Cb 0.58 -0.75 -0.10 0.00 -1.14 0.00 0.00 41.12 39.71 2g3m n ASP 143 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 2g3m s SER 144 N -4.17 0.65 -0.12 -1.12 0.01 -1.26 -4.76 113.70 102.93 2g3m s SER 144 Ca 0.08 -0.94 -0.30 0.00 1.31 0.00 0.00 55.95 56.10 2g3m s SER 144 Cb 0.12 0.16 0.12 0.00 0.21 0.00 0.00 66.02 66.63 2g3m s SER 144 CO 0.50 -0.53 0.99 0.54 0.41 0.00 0.00 173.24 175.15 2g3m s VAL 145 N -3.55 0.00 -0.08 3.43 0.11 -0.74 -4.79 120.40 114.77 2g3m s VAL 145 Ca 0.06 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.14 2g3m s VAL 145 Cb 0.05 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.90 2g3m s VAL 145 CO -0.08 0.00 -0.20 -1.83 -3.33 0.00 0.00 175.10 169.66 2g3m s GLU 146 N -1.82 2.53 0.16 1.54 -1.05 -1.26 -0.79 118.70 118.01 2g3m s GLU 146 Ca 0.01 -0.72 0.00 0.00 -0.15 0.00 0.00 54.97 54.11 2g3m s GLU 146 Cb -0.01 -1.97 -0.04 0.00 -0.44 0.00 0.00 34.13 31.67 2g3m s GLU 146 CO -0.02 0.15 0.04 -0.59 0.95 0.00 0.00 175.26 175.78 2g3m s PHE 147 N 0.39 1.06 -0.03 4.83 -0.12 -0.48 -1.80 117.98 121.82 2g3m s PHE 147 Ca -0.16 -1.14 0.05 0.00 -0.05 0.00 0.00 56.93 55.62 2g3m s PHE 147 Cb -0.17 -0.60 -0.01 0.00 -0.63 0.00 0.00 43.02 41.62 2g3m s PHE 147 CO 0.07 -0.38 -0.17 0.71 -0.05 0.00 0.00 175.22 175.40 2g3m s TYR 148 N -3.86 1.60 -0.32 3.49 1.51 0.14 -0.65 117.35 119.27 2g3m s TYR 148 Ca 0.25 -0.40 -0.10 0.00 -1.01 0.00 0.00 57.07 55.80 2g3m s TYR 148 Cb 0.07 -1.07 -0.01 0.00 -0.11 0.00 0.00 41.96 40.84 2g3m s TYR 148 CO 0.04 -0.11 0.17 0.08 -1.11 0.00 0.00 175.55 174.62 2g3m s VAL 149 N -0.10 4.75 -0.38 0.71 1.01 0.01 -0.94 120.40 125.45 2g3m s VAL 149 Ca -0.00 -0.38 -0.09 0.00 0.00 0.00 0.00 61.98 61.50 2g3m s VAL 149 Cb -0.10 -3.43 0.04 0.00 0.00 0.00 0.00 36.38 32.90 2g3m s VAL 149 CO 0.01 0.05 0.19 -0.63 0.00 0.00 0.00 175.10 174.72 2g3m s ILE 150 N 1.64 4.27 0.60 2.22 1.01 0.96 -0.70 121.20 131.19 2g3m s ILE 150 Ca 0.05 -1.07 -0.19 0.00 0.00 0.00 0.00 60.65 59.44 2g3m s ILE 150 Cb -0.17 -3.45 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 2g3m s ILE 150 CO 0.07 -0.29 1.21 -1.61 0.00 0.00 0.00 174.94 174.32 2g3m s GLU 151 N 1.48 2.93 0.00 2.79 2.02 -0.12 0.32 118.70 128.11 2g3m s GLU 151 Ca 0.01 1.84 0.00 0.00 0.02 0.00 0.00 54.97 56.84 2g3m s GLU 151 Cb -0.20 -1.92 0.00 0.00 0.10 0.00 0.00 34.13 32.11 2g3m s GLU 151 CO 0.04 -1.24 0.00 0.41 0.02 0.00 0.00 175.26 174.49 2g3m n GLY 152 N 0.52 0.56 0.21 -1.39 0.00 -0.88 -4.12 105.19 100.09 2g3m n GLY 152 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.26 2g3m n GLY 152 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2g3m h PRO 153 N 0.00 0.00 -6.95 1.61 0.13 -1.96 -3.43 132.00 121.40 2g3m h PRO 153 Ca 0.00 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.65 2g3m h PRO 153 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2g3m h PRO 153 CO 0.00 0.12 0.22 1.03 -0.23 0.00 0.00 178.00 179.14 2g3m s ARG 154 N -3.25 3.97 0.32 0.86 0.52 -1.26 -0.09 118.95 120.02 2g3m s ARG 154 Ca 0.05 0.78 -0.01 0.00 -0.52 0.00 0.00 55.73 56.03 2g3m s ARG 154 Cb 0.06 -2.29 0.51 0.00 0.52 0.00 0.00 34.95 33.75 2g3m s ARG 154 CO 0.67 -0.04 1.98 0.82 0.02 0.00 0.00 175.30 178.74 2g3m h ILE 155 N 1.44 1.19 -0.38 1.52 2.04 -1.90 -0.46 117.51 120.96 2g3m h ILE 155 Ca -0.48 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 2g3m h ILE 155 Cb 1.18 0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.31 2g3m h ILE 155 CO 0.63 0.19 0.11 -0.08 0.00 0.00 0.00 178.15 179.00 2g3m h GLU 156 N 1.04 0.55 -0.44 2.37 4.81 -1.92 -1.76 114.58 119.22 2g3m h GLU 156 Ca 0.28 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2g3m h GLU 156 Cb -0.11 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.15 2g3m h GLU 156 CO -0.06 0.49 0.12 -0.44 -0.73 0.00 0.00 179.01 178.39 2g3m h ASP 157 N 0.54 0.65 -0.27 1.04 3.32 -1.42 -0.87 116.42 119.42 2g3m h ASP 157 Ca 0.13 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 2g3m h ASP 157 Cb 0.18 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 2g3m h ASP 157 CO -0.01 0.70 0.16 0.58 -1.72 0.00 0.00 179.24 178.96 2g3m h VAL 158 N 0.58 1.10 -0.37 -1.35 2.07 -0.92 -1.57 116.25 115.78 2g3m h VAL 158 Ca 0.14 -0.22 -0.07 0.00 0.82 0.00 0.00 66.70 67.37 2g3m h VAL 158 Cb 0.29 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2g3m h VAL 158 CO -0.00 0.09 -0.07 -0.07 0.02 0.00 0.00 177.57 177.54 2g3m h LEU 159 N 0.34 0.60 -0.04 2.57 3.38 -1.21 0.18 115.31 121.14 2g3m h LEU 159 Ca 0.10 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2g3m h LEU 159 Cb 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2g3m h LEU 159 CO -0.02 0.72 0.02 -0.33 0.09 0.00 0.00 178.44 178.92 2g3m h GLU 160 N 0.58 0.05 -0.52 1.13 5.08 -0.84 0.20 114.58 120.26 2g3m h GLU 160 Ca 0.11 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 2g3m h GLU 160 Cb 0.48 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 2g3m h GLU 160 CO 0.03 0.18 0.21 0.87 -1.00 0.00 0.00 179.01 179.29 2g3m h LYS 161 N -0.08 0.78 -0.80 2.33 1.57 -1.04 -0.14 116.57 119.18 2g3m h LYS 161 Ca 0.01 -0.14 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2g3m h LYS 161 Cb 0.14 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.29 2g3m h LYS 161 CO -0.00 0.69 0.48 -0.92 -0.57 0.00 0.00 179.45 179.12 2g3m h TYR 162 N 0.70 1.06 -0.47 -1.35 3.20 -0.48 -0.85 116.97 118.78 2g3m h TYR 162 Ca 0.17 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.92 2g3m h TYR 162 Cb 0.20 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 2g3m h TYR 162 CO 0.01 0.71 -0.17 1.15 -1.64 0.00 0.00 178.16 178.23 2g3m h THR 163 N 1.10 1.27 -0.96 1.81 2.02 -0.33 -0.25 112.91 117.56 2g3m h THR 163 Ca 0.29 -1.30 -0.00 0.00 0.77 0.00 0.00 66.41 66.16 2g3m h THR 163 Cb -0.03 1.08 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 2g3m h THR 163 CO -0.05 0.45 0.59 -0.08 0.37 0.00 0.00 175.52 176.80 2g3m h GLU 164 N 0.81 1.29 0.14 6.66 4.57 -0.55 0.46 114.58 127.96 2g3m h GLU 164 Ca 0.12 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2g3m h GLU 164 Cb 0.71 -0.28 0.00 0.00 -0.16 0.00 0.00 28.75 29.02 2g3m h GLU 164 CO 0.05 0.89 -0.07 1.25 -1.18 0.00 0.00 179.01 179.95 2g3m h LEU 165 N 1.31 -0.16 0.00 1.64 6.46 -0.78 -3.36 115.31 120.42 2g3m h LEU 165 Ca 0.35 -0.37 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2g3m h LEU 165 Cb -0.08 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 39.89 2g3m h LEU 165 CO -0.07 0.34 -0.68 0.35 -0.62 0.00 0.00 178.44 177.76 2g3m n THR 166 N -4.94 0.12 0.00 1.05 -2.24 -0.14 -4.51 114.28 103.62 2g3m n THR 166 Ca -0.08 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2g3m n THR 166 Cb 0.26 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 2g3m n THR 166 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g3m n GLY 167 N 1.43 3.99 3.77 3.38 0.00 0.16 -4.52 105.19 113.40 2g3m n GLY 167 Ca 0.04 -1.23 -0.39 0.00 0.00 0.00 0.00 46.02 44.44 2g3m n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g3m s LYS 168 N -5.47 4.22 0.39 1.61 -0.14 -1.20 -4.60 119.74 114.54 2g3m s LYS 168 Ca 0.00 1.80 -0.27 0.00 -1.36 0.00 0.00 55.97 56.14 2g3m s LYS 168 Cb 0.00 -2.79 -0.10 0.00 -1.68 0.00 0.00 37.83 33.26 2g3m s LYS 168 CO 0.00 -0.17 1.41 -2.14 -0.76 0.00 0.00 175.35 173.69 2g3m s PRO 169 N -2.12 4.06 0.77 -1.68 0.02 -1.26 -4.23 135.00 130.55 2g3m s PRO 169 Ca 0.54 2.40 -0.11 0.00 0.02 0.00 0.00 61.00 63.85 2g3m s PRO 169 Cb -0.30 -2.89 0.05 0.00 0.02 0.00 0.00 34.50 31.38 2g3m s PRO 169 CO 0.38 -0.51 1.09 -0.59 -0.33 0.00 0.00 177.00 177.04 2g3m s PHE 170 N -1.16 2.64 -0.45 6.54 -0.71 -1.14 -4.29 117.98 119.40 2g3m s PHE 170 Ca 0.54 1.54 -0.16 0.00 -1.04 0.00 0.00 56.93 57.80 2g3m s PHE 170 Cb -0.43 -3.03 0.05 0.00 -1.21 0.00 0.00 43.02 38.39 2g3m s PHE 170 CO 0.57 -1.74 0.42 -1.17 -1.34 0.00 0.00 175.22 171.96 2g3m s LEU 171 N -5.89 5.21 0.71 -1.99 2.96 -1.26 -4.75 118.68 113.67 2g3m s LEU 171 Ca 0.61 -1.00 -0.09 0.00 -0.22 0.00 0.00 54.13 53.43 2g3m s LEU 171 Cb -0.17 -2.27 0.04 0.00 0.50 0.00 0.00 46.19 44.29 2g3m s LEU 171 CO 0.56 -0.62 1.05 -2.16 -1.32 0.00 0.00 176.35 173.86 2g3m s PRO 172 N 1.93 2.47 0.74 0.98 0.04 -1.26 -4.78 135.00 135.13 2g3m s PRO 172 Ca 0.08 0.08 -0.11 0.00 0.04 0.00 0.00 61.00 61.09 2g3m s PRO 172 Cb -0.20 -2.10 0.04 0.00 0.04 0.00 0.00 34.50 32.28 2g3m s PRO 172 CO 0.10 -1.15 1.08 -1.25 0.04 0.00 0.00 177.00 175.82 2g3m s PRO 173 N -5.30 2.46 0.36 0.56 0.04 -1.26 -4.94 135.00 126.92 2g3m s PRO 173 Ca 0.59 1.14 0.05 0.00 0.04 0.00 0.00 61.00 62.81 2g3m s PRO 173 Cb -0.11 -1.92 0.67 0.00 0.04 0.00 0.00 34.50 33.18 2g3m s PRO 173 CO 0.48 -1.48 1.95 1.98 0.04 0.00 0.00 177.00 179.96 2g3m h MET 174 N -0.93 0.59 0.00 4.56 4.05 -1.99 -2.41 114.93 118.80 2g3m h MET 174 Ca -0.44 -0.08 -0.00 0.00 -0.28 0.00 0.00 59.70 58.90 2g3m h MET 174 Cb 1.23 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.92 2g3m h MET 174 CO 0.53 0.50 -0.01 0.11 0.23 0.00 0.00 176.91 178.28 2g3m h TRP 175 N 0.59 0.00 0.00 1.39 5.08 -1.99 -1.71 115.95 119.31 2g3m h TRP 175 Ca 0.14 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.11 2g3m h TRP 175 Cb 0.14 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.30 2g3m h TRP 175 CO 0.01 0.01 0.00 0.00 -1.28 0.00 0.00 178.44 177.17 2g3m h ALA 176 N 1.99 1.00 -0.52 0.11 0.00 -1.80 -1.08 119.26 118.96 2g3m h ALA 176 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2g3m h ALA 176 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2g3m h ALA 176 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 2g3m n PHE 177 N -2.75 0.69 -1.63 0.00 3.01 -0.64 -4.74 117.46 111.40 2g3m n PHE 177 Ca -0.01 -0.37 -0.18 0.00 1.01 0.00 0.00 57.45 57.90 2g3m n PHE 177 Cb 0.17 -0.00 0.13 0.00 -0.01 0.00 0.00 39.48 39.76 2g3m n PHE 177 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2g3m n GLY 178 N 1.45 -1.27 3.66 1.37 0.00 -0.41 -4.69 105.19 105.30 2g3m n GLY 178 Ca 0.20 -1.71 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 2g3m n GLY 178 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2g3m s TYR 179 N -2.80 3.09 -0.12 1.61 5.04 -1.26 -4.35 117.35 118.56 2g3m s TYR 179 Ca 0.48 1.23 -0.02 0.00 -2.44 0.00 0.00 57.07 56.31 2g3m s TYR 179 Cb -0.01 -3.44 -0.03 0.00 0.35 0.00 0.00 41.96 38.83 2g3m s TYR 179 CO 0.33 -1.07 -0.05 -1.64 -1.34 0.00 0.00 175.55 171.79 2g3m s MET 180 N 3.42 3.30 -0.04 4.97 -1.94 -0.40 -0.60 119.30 128.00 2g3m s MET 180 Ca 0.49 -0.53 0.01 0.00 -1.71 0.00 0.00 55.69 53.95 2g3m s MET 180 Cb -0.17 -2.78 -0.03 0.00 2.01 0.00 0.00 34.83 33.85 2g3m s MET 180 CO 0.11 0.42 -0.05 0.96 -0.01 0.00 0.00 175.02 176.45 2g3m s ILE 181 N -0.12 3.86 0.17 2.53 -4.36 -0.81 -1.40 121.20 121.07 2g3m s ILE 181 Ca 0.02 -0.53 -0.17 0.00 -0.26 0.00 0.00 60.65 59.71 2g3m s ILE 181 Cb -0.13 -2.63 0.03 0.00 1.25 0.00 0.00 42.46 40.98 2g3m s ILE 181 CO 0.03 0.52 0.48 -0.55 0.24 0.00 0.00 174.94 175.65 2g3m s SER 182 N -1.09 -0.27 0.12 4.36 0.15 0.75 -1.68 113.70 116.04 2g3m s SER 182 Ca 0.15 -0.39 -0.25 0.00 0.70 0.00 0.00 55.95 56.15 2g3m s SER 182 Cb -0.11 0.54 0.07 0.00 -1.71 0.00 0.00 66.02 64.81 2g3m s SER 182 CO 0.04 -0.97 0.83 -0.60 1.20 0.00 0.00 173.24 173.74 2g3m s ARG 183 N -3.84 1.18 -0.71 5.44 3.52 -1.26 -3.81 118.95 119.46 2g3m s ARG 183 Ca 0.06 -0.56 0.04 0.00 -0.13 0.00 0.00 55.73 55.15 2g3m s ARG 183 Cb 0.00 0.47 0.17 0.00 -1.56 0.00 0.00 34.95 34.03 2g3m s ARG 183 CO -0.07 -0.53 0.51 -0.47 -0.81 0.00 0.00 175.30 173.93 2g3m s TYR 184 N -3.42 3.59 0.23 5.12 5.04 -0.26 -3.97 117.35 123.68 2g3m s TYR 184 Ca 0.07 -3.31 -0.01 0.00 -2.44 0.00 0.00 57.07 51.39 2g3m s TYR 184 Cb -0.02 -2.77 -0.03 0.00 0.35 0.00 0.00 41.96 39.49 2g3m s TYR 184 CO -0.04 -0.57 0.19 -1.12 -1.34 0.00 0.00 175.55 172.68 2g3m s SER 185 N -1.29 0.40 -0.21 4.32 0.01 -1.26 -1.60 113.70 114.08 2g3m s SER 185 Ca 0.25 -1.42 -0.13 0.00 1.31 0.00 0.00 55.95 55.96 2g3m s SER 185 Cb -0.06 0.43 -0.04 0.00 0.21 0.00 0.00 66.02 66.56 2g3m s SER 185 CO -0.15 -0.92 0.29 -0.31 0.41 0.00 0.00 173.24 172.56 2g3m s TYR 186 N -4.00 3.37 -0.20 2.43 2.02 -1.25 -5.02 117.35 114.70 2g3m s TYR 186 Ca 0.38 0.47 -0.36 0.00 -0.37 0.00 0.00 57.07 57.19 2g3m s TYR 186 Cb 0.05 -2.39 0.14 0.00 -0.40 0.00 0.00 41.96 39.37 2g3m s TYR 186 CO 0.15 0.08 1.29 1.52 -1.57 0.00 0.00 175.55 177.01 2g3m s TYR 187 N 1.02 -0.07 0.85 2.71 1.13 -1.26 -4.83 117.35 116.90 2g3m s TYR 187 Ca 0.14 0.04 -0.14 0.00 -1.41 0.00 0.00 57.07 55.69 2g3m s TYR 187 Cb -0.14 0.51 0.20 0.00 -1.10 0.00 0.00 41.96 41.44 2g3m s TYR 187 CO 0.05 -0.14 0.89 -0.35 -2.51 0.00 0.00 175.55 173.50 2g3m n PRO 188 N -0.13 -1.96 -0.27 -3.49 -0.04 -1.26 -4.77 135.00 123.09 2g3m n PRO 188 Ca 0.01 -1.40 0.19 0.00 -0.04 0.00 0.00 63.50 62.26 2g3m n PRO 188 Cb 0.58 -1.15 0.50 0.00 -0.04 0.00 0.00 33.50 33.39 2g3m n PRO 188 CO 0.00 0.00 0.00 -0.56 -0.04 0.00 0.00 175.50 174.90 2g3m h GLN 189 N 0.00 0.42 -0.24 0.54 3.07 -1.34 -0.79 115.11 116.77 2g3m h GLN 189 Ca -0.31 -0.03 -0.08 0.00 0.09 0.00 0.00 58.65 58.32 2g3m h GLN 189 Cb 0.92 -0.09 -0.01 0.00 0.08 0.00 0.00 27.48 28.37 2g3m h GLN 189 CO 0.21 0.28 -0.20 -0.44 0.09 0.00 0.00 178.83 178.76 2g3m h ASP 190 N 0.43 0.42 -0.00 0.06 3.32 -1.95 -2.55 116.42 116.14 2g3m h ASP 190 Ca 0.50 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 57.33 2g3m h ASP 190 Cb 1.22 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 2g3m h ASP 190 CO -0.21 0.64 -0.26 0.11 -1.72 0.00 0.00 179.24 177.80 2g3m h LYS 191 N 0.39 0.42 -0.06 3.56 1.79 -1.45 -0.79 116.57 120.44 2g3m h LYS 191 Ca 0.06 -0.16 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 2g3m h LYS 191 Cb 0.58 -0.03 -0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2g3m h LYS 191 CO 0.04 0.66 0.04 0.28 -1.08 0.00 0.00 179.45 179.38 2g3m h VAL 192 N 0.38 1.02 -0.58 0.50 2.07 -1.26 -0.58 116.25 117.80 2g3m h VAL 192 Ca 0.05 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 2g3m h VAL 192 Cb 0.66 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 2g3m h VAL 192 CO 0.05 0.02 -0.05 0.58 0.02 0.00 0.00 177.57 178.19 2g3m h VAL 193 N 0.07 1.27 -0.59 2.57 2.07 -1.34 -2.28 116.25 118.02 2g3m h VAL 193 Ca 0.02 -1.21 0.03 0.00 0.82 0.00 0.00 66.70 66.35 2g3m h VAL 193 Cb 0.00 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.61 2g3m h VAL 193 CO -0.00 0.44 0.36 -0.33 0.02 0.00 0.00 177.57 178.05 2g3m h GLU 194 N 0.95 0.69 -0.48 1.57 5.08 -0.87 -0.58 114.58 120.94 2g3m h GLU 194 Ca 0.16 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.43 2g3m h GLU 194 Cb 0.62 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2g3m h GLU 194 CO 0.04 0.45 0.12 1.25 -1.00 0.00 0.00 179.01 179.87 2g3m h LEU 195 N 0.71 0.73 -0.94 1.33 5.85 -0.95 -2.00 115.31 120.04 2g3m h LEU 195 Ca 0.24 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2g3m h LEU 195 Cb 0.03 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 40.82 2g3m h LEU 195 CO -0.10 0.77 0.59 0.58 -0.34 0.00 0.00 178.44 179.94 2g3m h VAL 196 N 0.65 1.25 -0.34 1.05 2.07 -1.03 -1.11 116.25 118.79 2g3m h VAL 196 Ca 0.15 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 2g3m h VAL 196 Cb 0.33 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 2g3m h VAL 196 CO 0.00 0.26 0.13 0.44 0.02 0.00 0.00 177.57 178.42 2g3m h ASP 197 N 1.29 0.47 -0.77 0.57 3.32 -0.79 -0.88 116.42 119.63 2g3m h ASP 197 Ca 0.34 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 2g3m h ASP 197 Cb -0.09 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 2g3m h ASP 197 CO -0.07 0.51 0.35 0.40 -1.72 0.00 0.00 179.24 178.71 2g3m h ILE 198 N 0.40 1.25 -0.12 0.35 2.04 -1.05 0.25 117.51 120.62 2g3m h ILE 198 Ca 0.11 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.25 2g3m h ILE 198 Cb 0.19 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2g3m h ILE 198 CO -0.01 0.30 0.07 0.24 0.00 0.00 0.00 178.15 178.75 2g3m h MET 199 N 1.09 0.17 -0.40 2.37 2.86 -0.99 -1.29 114.93 118.73 2g3m h MET 199 Ca 0.26 -0.02 -0.10 0.00 -2.06 0.00 0.00 59.70 57.78 2g3m h MET 199 Cb 0.14 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2g3m h MET 199 CO -0.03 0.18 -0.15 1.96 1.06 0.00 0.00 176.91 179.93 2g3m h GLN 200 N 0.11 0.81 -0.27 1.72 4.20 -0.93 -0.15 115.11 120.61 2g3m h GLN 200 Ca 0.04 -0.33 -0.01 0.00 0.06 0.00 0.00 58.65 58.41 2g3m h GLN 200 Cb 0.06 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2g3m h GLN 200 CO -0.01 0.96 0.14 -0.22 -0.67 0.00 0.00 178.83 179.03 2g3m h LYS 201 N 0.62 0.36 -0.39 1.46 3.64 -0.39 -1.81 116.57 120.06 2g3m h LYS 201 Ca 0.10 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 2g3m h LYS 201 Cb 0.69 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2g3m h LYS 201 CO 0.05 0.27 0.00 0.39 -2.27 0.00 0.00 179.45 177.89 2g3m n GLU 202 N -4.46 1.94 -0.28 1.90 1.02 -0.50 -4.92 120.64 115.34 2g3m n GLU 202 Ca 0.01 -1.46 0.00 0.00 -0.02 0.00 0.00 57.16 55.69 2g3m n GLU 202 Cb 0.10 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.19 2g3m n GLU 202 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g3m n GLY 203 N 1.16 0.84 3.56 0.62 0.00 -0.68 -5.06 105.19 105.62 2g3m n GLY 203 Ca 0.14 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 2g3m n GLY 203 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2g3m s PHE 204 N -2.00 3.19 -0.65 1.61 0.08 -0.08 -5.01 117.98 115.12 2g3m s PHE 204 Ca 0.00 -0.03 -0.26 0.00 0.12 0.00 0.00 56.93 56.76 2g3m s PHE 204 Cb 0.00 -2.31 0.04 0.00 -0.57 0.00 0.00 43.02 40.18 2g3m s PHE 204 CO 0.00 -0.18 1.13 0.50 -0.10 0.00 0.00 175.22 176.57 2g3m s ARG 205 N 1.56 3.27 -0.32 0.44 3.52 -1.26 -3.85 118.95 122.31 2g3m s ARG 205 Ca 0.07 -0.27 -0.16 0.00 -0.13 0.00 0.00 55.73 55.24 2g3m s ARG 205 Cb -0.15 -4.13 -0.02 0.00 -1.56 0.00 0.00 34.95 29.09 2g3m s ARG 205 CO 0.08 -1.84 0.41 0.08 -0.81 0.00 0.00 175.30 173.21 2g3m s VAL 206 N 4.85 5.13 0.06 7.11 1.01 -1.26 -4.33 120.40 132.97 2g3m s VAL 206 Ca 0.33 0.33 -0.15 0.00 0.00 0.00 0.00 61.98 62.50 2g3m s VAL 206 Cb -0.11 -3.82 -0.24 0.00 0.00 0.00 0.00 36.38 32.22 2g3m s VAL 206 CO 0.17 -0.03 1.17 0.00 0.00 0.00 0.00 175.10 176.41 2g3m h ALA 207 N 8.35 0.11 -2.93 5.51 0.00 -1.17 -3.43 119.26 125.70 2g3m h ALA 207 Ca -0.30 -0.68 0.02 0.00 0.00 0.00 0.00 54.91 53.95 2g3m h ALA 207 Cb 1.14 0.06 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 2g3m h ALA 207 CO 0.70 0.64 0.24 0.20 0.00 0.00 0.00 179.25 181.03 2g3m s GLY 208 N -4.27 -0.43 0.01 0.00 0.00 -1.23 -0.61 107.32 100.78 2g3m s GLY 208 Ca -0.10 0.26 0.07 0.00 0.00 0.00 0.00 44.72 44.95 2g3m s GLY 208 CO 0.91 0.09 -0.22 -1.34 0.00 0.00 0.00 173.10 172.54 2g3m s VAL 209 N -3.75 1.75 -0.15 1.40 -7.23 -0.31 -1.92 120.40 110.20 2g3m s VAL 209 Ca 0.05 -1.05 -0.06 0.00 -1.81 0.00 0.00 61.98 59.10 2g3m s VAL 209 Cb -0.03 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.40 2g3m s VAL 209 CO -0.06 0.40 0.06 -0.36 -0.31 0.00 0.00 175.10 174.83 2g3m s PHE 210 N -0.62 3.28 -0.28 2.82 0.40 -0.68 -1.42 117.98 121.49 2g3m s PHE 210 Ca 0.09 0.16 -0.08 0.00 -0.60 0.00 0.00 56.93 56.50 2g3m s PHE 210 Cb -0.09 -1.98 -0.02 0.00 0.51 0.00 0.00 43.02 41.44 2g3m s PHE 210 CO 0.00 0.32 0.10 -0.51 0.70 0.00 0.00 175.22 175.83 2g3m s LEU 211 N -0.15 3.72 0.84 -0.37 1.02 0.17 -4.29 118.68 119.60 2g3m s LEU 211 Ca 0.07 -0.39 -0.08 0.00 0.02 0.00 0.00 54.13 53.75 2g3m s LEU 211 Cb -0.12 -1.94 0.16 0.00 0.02 0.00 0.00 46.19 44.31 2g3m s LEU 211 CO 0.01 -0.11 1.15 -0.62 0.02 0.00 0.00 176.35 176.81 2g3m s ASP 212 N 1.59 3.76 0.34 2.29 -1.08 -1.26 -1.66 116.67 120.65 2g3m s ASP 212 Ca 0.05 -0.05 0.07 0.00 -0.52 0.00 0.00 52.55 52.11 2g3m s ASP 212 Cb -0.16 -0.17 0.40 0.00 -1.46 0.00 0.00 42.92 41.53 2g3m s ASP 212 CO 0.04 -2.28 1.06 0.16 0.52 0.00 0.00 175.17 174.67 2g3m h ILE 213 N -1.07 0.00 0.00 4.11 3.07 -1.91 -2.36 117.51 119.35 2g3m h ILE 213 Ca -0.40 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.01 2g3m h ILE 213 Cb 1.25 0.16 0.00 0.00 -0.27 0.00 0.00 36.82 37.97 2g3m h ILE 213 CO 0.39 0.00 0.00 1.41 -1.05 0.00 0.00 178.15 178.90 2g3m n HIS 214 N -1.94 0.57 0.27 0.16 8.25 -1.26 -2.59 115.22 118.68 2g3m n HIS 214 Ca -0.00 0.23 0.13 0.00 -0.26 0.00 0.00 57.72 57.81 2g3m n HIS 214 Cb 0.53 -0.86 0.24 0.00 1.12 0.00 0.00 29.99 31.01 2g3m n HIS 214 CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 2g3m h TYR 215 N 0.00 0.00 -4.43 4.41 -0.00 -1.75 -3.45 116.97 111.75 2g3m h TYR 215 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 58.73 58.23 2g3m h TYR 215 Cb 0.33 0.00 0.08 0.00 0.00 0.00 0.00 36.73 37.13 2g3m h TYR 215 CO 0.00 0.00 0.41 -1.64 -0.00 0.00 0.00 178.16 176.93 2g3m s MET 216 N -3.24 2.94 -0.48 0.10 -1.94 -1.07 0.67 119.30 116.28 2g3m s MET 216 Ca 0.07 0.56 -0.20 0.00 -1.71 0.00 0.00 55.69 54.41 2g3m s MET 216 Cb 0.06 -2.02 0.04 0.00 2.01 0.00 0.00 34.83 34.92 2g3m s MET 216 CO 0.65 -1.00 0.65 0.34 -0.01 0.00 0.00 175.02 175.65 2g3m s ASP 217 N -4.25 6.27 -1.44 3.03 2.15 -1.26 -3.91 116.67 117.26 2g3m s ASP 217 Ca 0.58 -0.62 -0.11 0.00 0.43 0.00 0.00 52.55 52.83 2g3m s ASP 217 Cb -0.11 -2.31 0.04 0.00 -0.30 0.00 0.00 42.92 40.24 2g3m s ASP 217 CO 0.53 -0.86 1.08 -1.20 -0.17 0.00 0.00 175.17 174.55 2g3m n SER 218 N 6.29 -5.70 -1.45 -0.34 7.64 -1.26 -1.47 113.62 117.32 2g3m n SER 218 Ca -0.04 -0.64 -0.18 0.00 1.01 0.00 0.00 58.87 59.03 2g3m n SER 218 Cb 0.47 -4.51 -0.08 0.00 -1.01 0.00 0.00 64.21 59.08 2g3m n SER 218 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2g3m n TYR 219 N -4.86 -0.10 -2.73 1.43 4.01 -1.26 -4.56 117.16 109.09 2g3m n TYR 219 Ca 0.02 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.34 2g3m n TYR 219 Cb 0.55 -3.15 -0.03 0.00 -0.31 0.00 0.00 39.34 36.40 2g3m n TYR 219 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2g3m s LYS 220 N -3.48 4.40 0.50 -0.72 1.02 -0.54 -4.30 119.74 116.62 2g3m s LYS 220 Ca 0.00 1.31 -0.23 0.00 0.02 0.00 0.00 55.97 57.07 2g3m s LYS 220 Cb 0.00 -3.54 -0.07 0.00 -0.52 0.00 0.00 37.83 33.70 2g3m s LYS 220 CO 0.00 -0.30 1.24 1.28 -0.92 0.00 0.00 175.35 176.65 2g3m n LEU 221 N 4.98 4.43 -3.60 3.17 4.77 -1.26 -3.14 117.00 126.36 2g3m n LEU 221 Ca 0.08 1.01 -0.24 0.00 -0.03 0.00 0.00 56.01 56.82 2g3m n LEU 221 Cb 0.49 -1.50 0.08 0.00 -2.33 0.00 0.00 43.42 40.16 2g3m n LEU 221 CO 0.51 -0.88 0.24 0.49 -1.33 0.00 0.00 177.39 176.43 2g3m n PHE 222 N -0.78 -2.87 -4.07 -1.77 3.72 -1.26 -4.97 117.46 105.46 2g3m n PHE 222 Ca 0.09 1.02 -0.07 0.00 -0.05 0.00 0.00 57.45 58.44 2g3m n PHE 222 Cb 0.43 -5.04 -0.10 0.00 -0.94 0.00 0.00 39.48 33.83 2g3m n PHE 222 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2g3m s THR 223 N -3.32 0.20 -0.07 4.37 -4.23 -1.19 -5.09 115.64 106.32 2g3m s THR 223 Ca 0.57 -1.68 0.04 0.00 -1.18 0.00 0.00 61.69 59.43 2g3m s THR 223 Cb -0.25 -1.37 -0.02 0.00 1.34 0.00 0.00 72.50 72.20 2g3m s THR 223 CO 0.73 -0.93 -0.18 0.26 -0.54 0.00 0.00 174.62 173.96 2g3m s TRP 224 N -3.63 2.63 0.02 3.99 0.52 -1.26 -4.10 118.94 117.11 2g3m s TRP 224 Ca 0.04 -0.44 -0.30 0.00 0.02 0.00 0.00 56.10 55.42 2g3m s TRP 224 Cb 0.06 -1.66 -0.08 0.00 -1.15 0.00 0.00 33.47 30.63 2g3m s TRP 224 CO -0.09 -0.03 1.92 -1.58 0.02 0.00 0.00 176.95 177.19 2g3m s HIS 225 N -0.33 1.38 0.62 -1.98 5.65 0.21 -4.27 115.29 116.57 2g3m s HIS 225 Ca 0.02 -0.37 0.30 0.00 0.25 0.00 0.00 55.06 55.26 2g3m s HIS 225 Cb -0.13 -4.20 1.63 0.00 -1.18 0.00 0.00 32.58 28.70 2g3m s HIS 225 CO 0.02 -5.34 1.99 -1.00 -0.65 0.00 0.00 174.74 169.77 2g3m h PRO 226 N 10.43 0.00 0.00 2.88 0.13 -1.90 0.68 132.00 144.23 2g3m h PRO 226 Ca -0.48 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.42 2g3m h PRO 226 Cb 1.23 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 2g3m h PRO 226 CO 0.94 0.00 -1.88 0.66 -0.23 0.00 0.00 178.00 177.50 2g3m n TYR 227 N -3.47 0.00 0.03 1.56 4.01 -1.26 -4.03 117.16 114.00 2g3m n TYR 227 Ca 0.03 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.71 2g3m n TYR 227 Cb 0.45 -0.62 -0.10 0.00 -0.31 0.00 0.00 39.34 38.76 2g3m n TYR 227 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2g3m h ARG 228 N 0.00 0.00 -2.07 -0.72 3.08 -1.92 -3.40 114.38 109.35 2g3m h ARG 228 Ca -0.35 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.18 2g3m h ARG 228 Cb 1.71 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 31.35 2g3m h ARG 228 CO -0.00 0.61 -1.03 1.19 -1.07 0.00 0.00 179.97 179.67 2g3m n PHE 229 N -3.13 1.05 0.17 3.04 3.01 0.22 -0.89 117.46 120.93 2g3m n PHE 229 Ca -0.08 -3.82 0.02 0.00 1.01 0.00 0.00 57.45 54.58 2g3m n PHE 229 Cb 0.94 -0.43 0.36 0.00 -0.01 0.00 0.00 39.48 40.35 2g3m n PHE 229 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 2g3m h PRO 230 N 3.28 0.07 -2.22 -1.08 0.11 -1.70 -3.33 132.00 127.14 2g3m h PRO 230 Ca 0.11 -0.02 -0.59 0.00 0.11 0.00 0.00 66.00 65.61 2g3m h PRO 230 Cb 0.84 -0.01 -0.42 0.00 0.11 0.00 0.00 31.00 31.53 2g3m h PRO 230 CO 0.58 0.38 -0.66 0.39 -0.21 0.00 0.00 178.00 178.47 2g3m n GLU 231 N -4.15 2.69 -0.34 1.05 -0.58 -1.26 -4.93 120.64 113.12 2g3m n GLU 231 Ca -0.02 -4.63 0.08 0.00 -0.42 0.00 0.00 57.16 52.17 2g3m n GLU 231 Cb 0.37 -2.18 0.27 0.00 -0.57 0.00 0.00 31.44 29.34 2g3m n GLU 231 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2g3m h PRO 232 N 3.60 0.90 -0.39 3.49 0.13 -1.98 -1.50 132.00 136.24 2g3m h PRO 232 Ca 0.16 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.24 2g3m h PRO 232 Cb 0.62 -0.20 -0.02 0.00 0.13 0.00 0.00 31.00 31.52 2g3m h PRO 232 CO 0.80 0.59 0.26 -0.22 -0.23 0.00 0.00 178.00 179.20 2g3m h LYS 233 N 0.93 0.50 -0.11 0.86 3.11 -1.93 -1.18 116.57 118.75 2g3m h LYS 233 Ca 0.48 -0.03 -0.23 0.00 -2.81 0.00 0.00 60.65 58.07 2g3m h LYS 233 Cb 0.53 -0.11 0.01 0.00 -1.00 0.00 0.00 32.23 31.66 2g3m h LYS 233 CO -0.25 0.33 -0.83 -0.22 -2.81 0.00 0.00 179.45 175.68 2g3m h LYS 234 N 0.52 0.71 -0.46 1.90 3.64 -1.71 -2.50 116.57 118.67 2g3m h LYS 234 Ca 0.15 -0.62 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 2g3m h LYS 234 Cb -0.04 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 2g3m h LYS 234 CO -0.03 1.23 0.23 1.25 -2.27 0.00 0.00 179.45 179.85 2g3m h LEU 235 N 0.47 0.60 -0.33 5.20 5.85 -0.94 -0.92 115.31 125.24 2g3m h LEU 235 Ca -0.06 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 2g3m h LEU 235 Cb 1.45 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 42.31 2g3m h LEU 235 CO 0.16 0.55 0.19 0.40 -0.34 0.00 0.00 178.44 179.40 2g3m h ILE 236 N 0.60 1.13 -0.08 4.05 2.04 -1.24 -1.81 117.51 122.20 2g3m h ILE 236 Ca 0.16 -0.33 -0.10 0.00 1.00 0.00 0.00 64.86 65.59 2g3m h ILE 236 Cb 0.11 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 2g3m h ILE 236 CO -0.02 0.13 -0.41 0.44 0.00 0.00 0.00 178.15 178.29 2g3m h ASP 237 N 0.42 0.19 -0.42 1.72 3.32 -1.29 -1.62 116.42 118.74 2g3m h ASP 237 Ca 0.12 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 2g3m h ASP 237 Cb 0.05 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 2g3m h ASP 237 CO -0.02 0.58 -0.10 -0.33 -1.72 0.00 0.00 179.24 177.65 2g3m h GLU 238 N 0.15 0.81 -0.45 3.56 5.08 -0.91 -0.50 114.58 122.31 2g3m h GLU 238 Ca 0.01 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 57.98 2g3m h GLU 238 Cb 0.79 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 2g3m h GLU 238 CO 0.06 0.93 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.87 2g3m h LEU 239 N 0.63 0.83 -1.05 1.33 3.38 -1.18 -2.94 115.31 116.31 2g3m h LEU 239 Ca 0.11 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.67 2g3m h LEU 239 Cb 0.63 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2g3m h LEU 239 CO 0.04 0.97 -0.10 0.45 0.09 0.00 0.00 178.44 179.90 2g3m h HIS 240 N 0.67 0.60 0.00 1.13 3.86 -1.20 -0.33 115.15 119.89 2g3m h HIS 240 Ca 0.12 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.23 2g3m h HIS 240 Cb 0.58 -0.16 -0.00 0.00 1.06 0.00 0.00 27.41 28.89 2g3m h HIS 240 CO 0.04 0.65 -0.03 0.87 0.86 0.00 0.00 177.93 180.33 2g3m h LYS 241 N 0.52 0.00 -0.58 2.45 1.57 -0.93 0.55 116.57 120.16 2g3m h LYS 241 Ca 0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.88 2g3m h LYS 241 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2g3m h LYS 241 CO 0.03 0.03 0.00 0.54 -0.57 0.00 0.00 179.45 179.47 2g3m n ARG 242 N -3.25 2.63 -3.67 3.15 1.74 -0.45 -4.96 116.66 111.85 2g3m n ARG 242 Ca -0.02 -2.48 -0.25 0.00 -0.77 0.00 0.00 57.85 54.33 2g3m n ARG 242 Cb 0.18 -1.53 0.07 0.00 -1.02 0.00 0.00 32.46 30.15 2g3m n ARG 242 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2g3m n ASN 243 N 1.52 -5.75 -4.24 0.55 5.15 0.19 -5.00 115.26 107.67 2g3m n ASN 243 Ca 0.22 -0.60 -0.33 0.00 -0.60 0.00 0.00 54.58 53.27 2g3m n ASN 243 Cb 0.60 -4.76 -0.16 0.00 -0.53 0.00 0.00 39.78 34.93 2g3m n ASN 243 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2g3m s VAL 244 N -3.32 2.35 0.53 3.44 1.01 -0.26 -4.82 120.40 119.33 2g3m s VAL 244 Ca 0.57 -0.90 -0.17 0.00 0.00 0.00 0.00 61.98 61.49 2g3m s VAL 244 Cb -0.26 -1.95 -0.07 0.00 0.00 0.00 0.00 36.38 34.10 2g3m s VAL 244 CO 0.75 0.54 1.01 -0.54 0.00 0.00 0.00 175.10 176.86 2g3m s LYS 245 N 0.60 3.77 -0.19 2.72 -0.14 0.22 -3.79 119.74 122.94 2g3m s LYS 245 Ca -0.11 1.07 -0.01 0.00 -1.36 0.00 0.00 55.97 55.56 2g3m s LYS 245 Cb -0.16 -2.11 0.00 0.00 -1.68 0.00 0.00 37.83 33.88 2g3m s LYS 245 CO 0.03 -0.43 -0.12 -1.17 -0.76 0.00 0.00 175.35 172.90 2g3m s LEU 246 N -4.10 2.56 -0.17 3.17 2.96 -1.26 -1.16 118.68 120.68 2g3m s LEU 246 Ca 0.61 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 2g3m s LEU 246 Cb -0.12 -1.61 0.01 0.00 0.50 0.00 0.00 46.19 44.96 2g3m s LEU 246 CO 0.31 0.02 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.57 2g3m s ILE 247 N 1.18 2.49 -0.11 6.68 1.09 -0.51 -0.37 121.20 131.66 2g3m s ILE 247 Ca 0.02 -0.81 -0.02 0.00 -1.10 0.00 0.00 60.65 58.73 2g3m s ILE 247 Cb -0.14 -2.06 -0.03 0.00 -1.06 0.00 0.00 42.46 39.17 2g3m s ILE 247 CO -0.05 0.51 -0.02 0.42 -0.10 0.00 0.00 174.94 175.71 2g3m s THR 248 N 1.06 4.11 0.40 2.92 -4.23 -0.88 -0.66 115.64 118.37 2g3m s THR 248 Ca -0.01 -0.31 -0.25 0.00 -1.18 0.00 0.00 61.69 59.95 2g3m s THR 248 Cb -0.14 -2.74 -0.09 0.00 1.34 0.00 0.00 72.50 70.87 2g3m s THR 248 CO -0.05 0.57 1.10 -0.51 -0.54 0.00 0.00 174.62 175.18 2g3m s ILE 249 N -0.48 3.49 -0.10 2.99 2.07 -0.67 -1.44 121.20 127.06 2g3m s ILE 249 Ca 0.08 1.19 -0.03 0.00 -1.41 0.00 0.00 60.65 60.47 2g3m s ILE 249 Cb -0.12 -3.64 0.05 0.00 0.13 0.00 0.00 42.46 38.88 2g3m s ILE 249 CO 0.02 0.05 0.10 -0.69 -1.91 0.00 0.00 174.94 172.51 2g3m s VAL 250 N -1.55 -0.14 0.21 4.00 1.01 0.74 -4.84 120.40 119.84 2g3m s VAL 250 Ca 0.57 0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.71 2g3m s VAL 250 Cb -0.26 -0.35 0.05 0.00 0.00 0.00 0.00 36.38 35.82 2g3m s VAL 250 CO 0.32 -0.01 0.29 0.47 0.00 0.00 0.00 175.10 176.18 2g3m n ASP 251 N 5.30 0.17 -0.39 3.32 8.00 -1.26 -2.96 116.55 128.72 2g3m n ASP 251 Ca -0.05 -1.19 0.06 0.00 0.71 0.00 0.00 54.79 54.32 2g3m n ASP 251 Cb 0.50 -0.21 0.03 0.00 -0.02 0.00 0.00 41.12 41.42 2g3m n ASP 251 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g3m n HIS 252 N -2.13 0.00 -3.19 1.24 1.44 -1.26 -4.91 115.22 106.41 2g3m n HIS 252 Ca 0.04 0.00 -0.39 0.00 -2.01 0.00 0.00 57.72 55.36 2g3m n HIS 252 Cb 0.15 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.20 2g3m n HIS 252 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 2g3m s GLY 253 N -1.17 2.21 -0.30 -1.39 0.00 -1.26 -4.31 107.32 101.10 2g3m s GLY 253 Ca 0.12 -0.23 -0.13 0.00 0.00 0.00 0.00 44.72 44.48 2g3m s GLY 253 CO 0.20 1.11 0.25 -0.42 0.00 0.00 0.00 173.10 174.24 2g3m s ILE 254 N 1.41 5.27 0.19 0.90 -1.09 -0.21 -4.66 121.20 123.01 2g3m s ILE 254 Ca 0.28 0.13 -0.31 0.00 -2.23 0.00 0.00 60.65 58.52 2g3m s ILE 254 Cb -0.16 -3.63 -0.11 0.00 -1.58 0.00 0.00 42.46 36.98 2g3m s ILE 254 CO 0.11 0.14 1.59 -0.60 -1.23 0.00 0.00 174.94 174.95 2g3m s ARG 255 N 1.83 4.19 -1.14 2.79 3.52 -1.26 -0.92 118.95 127.97 2g3m s ARG 255 Ca 0.09 2.43 -0.21 0.00 -0.13 0.00 0.00 55.73 57.90 2g3m s ARG 255 Cb -0.16 -3.12 0.03 0.00 -1.56 0.00 0.00 34.95 30.14 2g3m s ARG 255 CO 0.11 -0.63 1.67 0.08 -0.81 0.00 0.00 175.30 175.73 2g3m s VAL 256 N 0.97 3.91 -0.09 7.11 1.01 -0.39 -4.68 120.40 128.26 2g3m s VAL 256 Ca 0.70 -1.22 0.00 0.00 0.00 0.00 0.00 61.98 61.46 2g3m s VAL 256 Cb -0.45 -4.96 0.02 0.00 0.00 0.00 0.00 36.38 30.99 2g3m s VAL 256 CO 0.34 -1.77 -0.08 -0.62 0.00 0.00 0.00 175.10 172.97 2g3m s ASP 257 N 5.14 1.84 0.59 3.32 -1.08 -1.26 -4.94 116.67 120.28 2g3m s ASP 257 Ca 0.54 -0.26 0.29 0.00 -0.52 0.00 0.00 52.55 52.60 2g3m s ASP 257 Cb 0.01 -0.74 1.61 0.00 -1.46 0.00 0.00 42.92 42.33 2g3m s ASP 257 CO 0.01 -0.08 2.04 1.56 0.52 0.00 0.00 175.17 179.22 2g3m h GLN 258 N 7.72 0.00 -0.00 4.34 4.20 -2.02 -2.31 115.11 127.05 2g3m h GLN 258 Ca -0.30 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.41 2g3m h GLN 258 Cb 1.15 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.93 2g3m h GLN 258 CO 0.42 0.00 -0.05 0.09 -0.67 0.00 0.00 178.83 178.62 2g3m n ASN 259 N -3.75 2.30 -4.44 1.46 4.13 -1.26 -4.95 115.26 108.75 2g3m n ASN 259 Ca 0.03 -3.18 -0.43 0.00 1.68 0.00 0.00 54.58 52.68 2g3m n ASN 259 Cb 0.43 -0.44 -0.10 0.00 -1.54 0.00 0.00 39.78 38.13 2g3m n ASN 259 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 2g3m s TYR 260 N -2.92 3.24 0.22 3.10 5.04 -0.87 -5.00 117.35 120.16 2g3m s TYR 260 Ca 0.33 -0.67 -0.17 0.00 -2.44 0.00 0.00 57.07 54.12 2g3m s TYR 260 Cb 0.29 -2.69 0.22 0.00 0.35 0.00 0.00 41.96 40.13 2g3m s TYR 260 CO 0.02 -0.63 1.57 1.03 -1.34 0.00 0.00 175.55 176.20 2g3m h SER 261 N 8.65 -1.20 -0.44 4.32 0.87 -1.92 -1.09 113.55 122.73 2g3m h SER 261 Ca -0.27 0.27 0.06 0.00 -1.23 0.00 0.00 61.79 60.62 2g3m h SER 261 Cb 1.12 0.64 -0.02 0.00 -0.44 0.00 0.00 62.40 63.69 2g3m h SER 261 CO 0.75 -0.29 0.30 -0.65 -0.53 0.00 0.00 176.83 176.41 2g3m h PRO 262 N -0.06 0.34 -0.31 2.24 0.11 -1.94 0.62 132.00 133.00 2g3m h PRO 262 Ca 0.32 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.35 2g3m h PRO 262 Cb 0.59 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2g3m h PRO 262 CO -0.85 0.23 -0.04 0.35 -0.21 0.00 0.00 178.00 177.48 2g3m h PHE 263 N 0.35 0.63 -0.32 0.65 3.57 -1.48 -0.20 116.94 120.15 2g3m h PHE 263 Ca 0.19 -0.12 -0.11 0.00 3.53 0.00 0.00 57.97 61.47 2g3m h PHE 263 Cb 0.32 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 2g3m h PHE 263 CO -0.00 0.73 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.52 2g3m h LEU 264 N 0.35 0.74 -0.49 0.59 3.38 -1.02 -2.67 115.31 116.19 2g3m h LEU 264 Ca 0.08 -0.43 -0.08 0.00 0.09 0.00 0.00 57.88 57.54 2g3m h LEU 264 Cb 0.50 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2g3m h LEU 264 CO 0.02 1.01 -0.38 0.77 0.09 0.00 0.00 178.44 179.96 2g3m h SER 265 N 0.46 0.00 1.13 -0.43 4.64 -0.93 -3.13 113.55 115.30 2g3m h SER 265 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2g3m h SER 265 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2g3m h SER 265 CO 0.06 0.38 -0.27 0.61 -0.87 0.00 0.00 176.83 176.73 2g3m n GLY 266 N 0.74 -1.55 3.60 -0.77 0.00 -0.09 -4.90 105.19 102.22 2g3m n GLY 266 Ca 0.01 -0.14 -0.53 0.00 0.00 0.00 0.00 46.02 45.36 2g3m n GLY 266 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2g3m n MET 267 N -2.08 1.10 0.00 1.61 0.00 -1.01 -0.52 117.12 116.21 2g3m n MET 267 Ca 0.05 0.40 0.00 0.00 0.00 0.00 0.00 57.70 58.14 2g3m n MET 267 Cb 0.42 -2.04 0.00 0.00 0.00 0.00 0.00 33.22 31.60 2g3m n MET 267 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2g3m n GLY 268 N 2.67 2.88 0.50 -5.12 0.00 -1.26 -4.89 105.19 99.98 2g3m n GLY 268 Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 2g3m n GLY 268 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2g3m n LYS 269 N -1.68 2.81 -2.88 1.61 5.02 0.32 -5.03 118.16 118.33 2g3m n LYS 269 Ca 0.00 -2.09 -0.26 0.00 -2.02 0.00 0.00 58.31 53.94 2g3m n LYS 269 Cb 0.00 -1.32 -0.00 0.00 -0.02 0.00 0.00 35.03 33.69 2g3m n LYS 269 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2g3m s PHE 270 N -1.43 3.49 0.49 2.13 0.08 -1.25 -1.14 117.98 120.34 2g3m s PHE 270 Ca 0.22 0.60 -0.22 0.00 0.12 0.00 0.00 56.93 57.65 2g3m s PHE 270 Cb 0.14 -2.21 -0.07 0.00 -0.57 0.00 0.00 43.02 40.32 2g3m s PHE 270 CO 0.10 -0.20 1.17 0.00 -0.10 0.00 0.00 175.22 176.19 2g3m s GLU 272 N -2.88 2.14 0.32 0.00 2.02 -1.21 -1.00 118.70 118.09 2g3m s GLU 272 Ca 0.67 -2.35 0.09 0.00 0.02 0.00 0.00 54.97 53.39 2g3m s GLU 272 Cb -0.28 -1.37 -0.05 0.00 0.10 0.00 0.00 34.13 32.54 2g3m s GLU 272 CO 0.33 -0.37 0.07 0.96 0.02 0.00 0.00 175.26 176.27 2g3m s ILE 273 N -2.93 3.02 0.27 -1.63 -4.36 -0.53 -0.59 121.20 114.46 2g3m s ILE 273 Ca 0.10 -1.83 -0.06 0.00 -0.26 0.00 0.00 60.65 58.60 2g3m s ILE 273 Cb 0.02 -2.89 0.35 0.00 1.25 0.00 0.00 42.46 41.19 2g3m s ILE 273 CO 0.05 -0.24 1.60 -0.33 0.24 0.00 0.00 174.94 176.27 2g3m h GLU 274 N 1.71 0.04 0.00 0.37 4.39 -0.34 0.07 114.58 120.82 2g3m h GLU 274 Ca -0.44 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2g3m h GLU 274 Cb 1.25 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 2g3m h GLU 274 CO 0.63 0.03 0.00 -1.13 -1.16 0.00 0.00 179.01 177.38 2g3m n SER 275 N -5.46 0.00 0.00 1.42 3.41 -1.26 -4.87 113.62 106.86 2g3m n SER 275 Ca 0.16 0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.93 2g3m n SER 275 Cb 0.54 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 2g3m n SER 275 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g3m n GLY 276 N -0.56 2.81 3.81 5.00 0.00 0.01 -5.09 105.19 111.17 2g3m n GLY 276 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 2g3m n GLY 276 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g3m s GLU 277 N -0.50 1.12 0.55 1.61 8.01 -1.26 -4.77 118.70 123.46 2g3m s GLU 277 Ca 0.00 0.16 -0.18 0.00 0.01 0.00 0.00 54.97 54.96 2g3m s GLU 277 Cb 0.00 -1.85 -0.05 0.00 -4.31 0.00 0.00 34.13 27.92 2g3m s GLU 277 CO 0.00 -2.19 1.07 -0.51 0.01 0.00 0.00 175.26 173.64 2g3m s LEU 278 N -5.98 3.66 -0.44 1.80 1.43 -1.26 -1.45 118.68 116.44 2g3m s LEU 278 Ca 0.65 1.95 -0.25 0.00 -1.03 0.00 0.00 54.13 55.44 2g3m s LEU 278 Cb -0.13 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.56 2g3m s LEU 278 CO 0.53 -1.08 0.93 0.12 0.23 0.00 0.00 176.35 177.07 2g3m s PHE 279 N -2.13 2.95 -0.24 0.29 5.36 -0.17 -4.58 117.98 119.46 2g3m s PHE 279 Ca 0.67 0.46 -0.07 0.00 -0.96 0.00 0.00 56.93 57.03 2g3m s PHE 279 Cb -0.18 -3.91 -0.03 0.00 -0.34 0.00 0.00 43.02 38.56 2g3m s PHE 279 CO 0.29 -1.05 0.07 0.08 -1.46 0.00 0.00 175.22 173.16 2g3m s VAL 280 N 3.70 4.39 0.00 3.12 1.01 -1.26 -4.30 120.40 127.06 2g3m s VAL 280 Ca 0.37 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.21 2g3m s VAL 280 Cb -0.10 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2g3m s VAL 280 CO 0.25 0.35 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2g3m n GLY 281 N 4.80 6.04 2.94 4.51 0.00 0.13 -4.94 105.19 118.67 2g3m n GLY 281 Ca -0.16 -1.73 -0.19 0.00 0.00 0.00 0.00 46.02 43.94 2g3m n GLY 281 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g3m s LYS 282 N 1.55 0.78 0.01 1.61 -0.14 -1.26 -1.17 119.74 121.11 2g3m s LYS 282 Ca 0.00 -0.19 -0.00 0.00 -1.36 0.00 0.00 55.97 54.42 2g3m s LYS 282 Cb 0.00 -0.76 0.00 0.00 -1.68 0.00 0.00 37.83 35.39 2g3m s LYS 282 CO 0.00 0.03 0.02 -0.12 -0.76 0.00 0.00 175.35 174.52 2g3m n MET 283 N 3.54 0.03 -0.28 1.68 1.56 -0.65 -0.64 117.12 122.36 2g3m n MET 283 Ca -0.20 -0.09 0.07 0.00 -0.27 0.00 0.00 57.70 57.20 2g3m n MET 283 Cb 0.54 0.09 0.18 0.00 2.15 0.00 0.00 33.22 36.18 2g3m n MET 283 CO 0.00 0.00 0.00 -1.49 -0.73 0.00 0.00 175.97 173.75 2g3m h TRP 284 N 1.03 -0.07 0.00 1.12 -0.00 -1.96 0.19 115.95 116.27 2g3m h TRP 284 Ca -0.01 0.06 0.00 0.00 -0.00 0.00 0.00 58.89 58.94 2g3m h TRP 284 Cb 0.04 0.16 0.00 0.00 -0.00 0.00 0.00 29.16 29.36 2g3m h TRP 284 CO 0.00 -0.28 0.00 -2.30 -0.00 0.00 0.00 178.44 175.86 2g3m n PRO 285 N -5.38 0.02 0.00 0.49 -0.02 -1.26 -4.84 135.00 124.01 2g3m n PRO 285 Ca 0.15 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2g3m n PRO 285 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 2g3m n PRO 285 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2g3m n GLY 286 N -0.35 0.77 3.69 -1.23 0.00 0.68 -4.93 105.19 103.82 2g3m n GLY 286 Ca 0.03 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.19 2g3m n GLY 286 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g3m s THR 287 N 0.00 2.99 0.07 2.61 2.01 -1.26 -1.63 115.64 120.42 2g3m s THR 287 Ca 0.00 0.50 -0.04 0.00 0.31 0.00 0.00 61.69 62.46 2g3m s THR 287 Cb 0.00 -3.32 -0.03 0.00 0.01 0.00 0.00 72.50 69.16 2g3m s THR 287 CO 0.00 0.01 0.06 0.42 -0.69 0.00 0.00 174.62 174.41 2g3m s THR 288 N 2.38 0.18 0.31 -0.82 -4.23 -0.32 -1.26 115.64 111.88 2g3m s THR 288 Ca 0.73 -1.58 0.08 0.00 -1.18 0.00 0.00 61.69 59.75 2g3m s THR 288 Cb -0.40 -1.48 -0.06 0.00 1.34 0.00 0.00 72.50 71.89 2g3m s THR 288 CO 0.32 -0.84 -0.09 0.68 -0.54 0.00 0.00 174.62 174.15 2g3m s VAL 289 N -3.91 1.99 -0.02 2.29 -7.23 -0.09 0.18 120.40 113.62 2g3m s VAL 289 Ca 0.07 -2.19 0.05 0.00 -1.81 0.00 0.00 61.98 58.10 2g3m s VAL 289 Cb 0.07 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.48 2g3m s VAL 289 CO -0.10 -0.27 -0.17 -0.31 -0.31 0.00 0.00 175.10 173.94 2g3m s TYR 290 N -2.78 1.50 0.26 2.82 1.51 -1.26 -1.04 117.35 118.36 2g3m s TYR 290 Ca 0.31 -0.30 -0.30 0.00 -1.01 0.00 0.00 57.07 55.77 2g3m s TYR 290 Cb 0.02 -0.97 -0.09 0.00 -0.11 0.00 0.00 41.96 40.81 2g3m s TYR 290 CO 0.14 -0.04 1.28 -1.25 -1.11 0.00 0.00 175.55 174.57 2g3m s PRO 291 N -0.35 4.41 -1.13 -1.71 0.04 -1.26 0.38 135.00 135.37 2g3m s PRO 291 Ca 0.06 2.08 -0.18 0.00 0.04 0.00 0.00 61.00 62.99 2g3m s PRO 291 Cb -0.07 -3.15 0.10 0.00 0.04 0.00 0.00 34.50 31.42 2g3m s PRO 291 CO -0.00 -0.16 1.47 0.34 0.04 0.00 0.00 177.00 178.69 2g3m s ASP 292 N -0.13 6.77 0.09 6.66 2.15 -0.29 -4.65 116.67 127.27 2g3m s ASP 292 Ca 0.52 -2.25 0.08 0.00 0.43 0.00 0.00 52.55 51.33 2g3m s ASP 292 Cb -0.37 -2.50 0.40 0.00 -0.30 0.00 0.00 42.92 40.15 2g3m s ASP 292 CO 0.44 -1.13 1.24 0.49 -0.17 0.00 0.00 175.17 176.03 2g3m n PHE 293 N 7.50 0.22 0.34 -5.34 3.72 -1.26 -1.66 117.46 120.98 2g3m n PHE 293 Ca 0.37 0.11 0.15 0.00 -0.05 0.00 0.00 57.45 58.03 2g3m n PHE 293 Cb 0.47 -0.68 0.55 0.00 -0.94 0.00 0.00 39.48 38.88 2g3m n PHE 293 CO 0.00 0.00 0.00 0.74 -0.05 0.00 0.00 176.76 177.45 2g3m h PHE 294 N 0.00 0.00 -3.25 1.38 0.04 -1.88 -3.44 116.94 109.80 2g3m h PHE 294 Ca 0.00 0.00 -0.57 0.00 2.80 0.00 0.00 57.97 60.20 2g3m h PHE 294 Cb 0.04 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.14 2g3m h PHE 294 CO 0.00 0.00 -0.03 1.03 -0.60 0.00 0.00 178.31 178.71 2g3m s ARG 295 N -3.46 4.22 0.17 1.51 0.52 -0.66 -4.36 118.95 116.88 2g3m s ARG 295 Ca 0.03 0.73 -0.12 0.00 -0.52 0.00 0.00 55.73 55.86 2g3m s ARG 295 Cb 0.09 -3.26 0.06 0.00 0.52 0.00 0.00 34.95 32.37 2g3m s ARG 295 CO 0.51 0.59 1.70 1.49 0.02 0.00 0.00 175.30 179.61 2g3m h GLU 296 N 4.74 0.89 0.00 3.54 4.81 -1.88 -2.07 114.58 124.60 2g3m h GLU 296 Ca -0.49 -0.19 -0.08 0.00 -0.13 0.00 0.00 59.36 58.48 2g3m h GLU 296 Cb 1.21 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 2g3m h GLU 296 CO 0.64 0.79 -0.37 0.38 -0.73 0.00 0.00 179.01 179.73 2g3m h ASP 297 N 0.81 0.00 -0.33 1.04 2.03 -1.94 -1.70 116.42 116.32 2g3m h ASP 297 Ca 0.19 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.36 2g3m h ASP 297 Cb 0.27 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.76 2g3m h ASP 297 CO -0.01 0.37 -0.27 0.74 -1.03 0.00 0.00 179.24 179.05 2g3m h THR 298 N 0.00 1.29 -0.56 1.15 2.02 -1.76 -2.20 112.91 112.85 2g3m h THR 298 Ca -0.00 -1.43 -0.03 0.00 0.77 0.00 0.00 66.41 65.72 2g3m h THR 298 Cb 0.71 1.46 -0.03 0.00 -1.74 0.00 0.00 68.15 68.56 2g3m h THR 298 CO 0.05 0.47 0.22 0.03 0.37 0.00 0.00 175.52 176.65 2g3m h ARG 299 N 0.55 0.81 -0.21 6.66 3.08 -0.94 -0.16 114.38 124.17 2g3m h ARG 299 Ca 0.06 -0.12 -0.18 0.00 0.07 0.00 0.00 59.98 59.81 2g3m h ARG 299 Cb 0.84 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.74 2g3m h ARG 299 CO 0.07 0.67 -0.58 0.93 -1.07 0.00 0.00 179.97 179.99 2g3m h GLU 300 N 0.80 0.67 -0.27 0.04 5.08 -1.18 -0.39 114.58 119.32 2g3m h GLU 300 Ca 0.19 -0.44 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 2g3m h GLU 300 Cb 0.17 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2g3m h GLU 300 CO -0.02 1.06 0.14 2.35 -1.00 0.00 0.00 179.01 181.54 2g3m h TRP 301 N 0.51 0.38 -0.57 4.33 7.01 -0.96 -1.68 115.95 124.95 2g3m h TRP 301 Ca 0.00 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 60.91 2g3m h TRP 301 Cb 1.15 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 28.07 2g3m h TRP 301 CO 0.06 0.34 0.07 2.35 -2.79 0.00 0.00 178.44 178.46 2g3m h TRP 302 N 0.31 1.04 -0.91 2.65 2.91 -0.94 -2.52 115.95 118.49 2g3m h TRP 302 Ca 0.09 -0.16 0.05 0.00 1.13 0.00 0.00 58.89 60.01 2g3m h TRP 302 Cb 0.10 -0.28 -0.06 0.00 -0.51 0.00 0.00 29.16 28.41 2g3m h TRP 302 CO -0.03 0.92 0.59 0.00 -1.03 0.00 0.00 178.44 178.89 2g3m h ALA 303 N 0.99 1.47 -0.37 2.65 0.00 -0.84 -0.19 119.26 122.97 2g3m h ALA 303 Ca 0.17 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2g3m h ALA 303 Cb 0.46 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2g3m h ALA 303 CO 0.02 0.41 0.15 0.78 0.00 0.00 0.00 179.25 180.61 2g3m h GLY 304 N 1.08 0.59 1.02 0.00 0.00 -0.90 0.14 103.07 104.99 2g3m h GLY 304 Ca 0.38 -0.31 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 2g3m h GLY 304 CO -0.13 0.30 0.03 1.41 0.00 0.00 0.00 176.54 178.15 2g3m h LEU 305 N 0.45 0.88 -0.12 3.11 3.38 -1.01 -0.85 115.31 121.15 2g3m h LEU 305 Ca 0.12 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 57.80 2g3m h LEU 305 Cb 0.17 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2g3m h LEU 305 CO -0.01 0.95 0.07 0.40 0.09 0.00 0.00 178.44 179.94 2g3m h ILE 306 N 0.78 1.09 -0.51 1.22 1.08 -0.84 0.09 117.51 120.42 2g3m h ILE 306 Ca 0.15 -0.26 0.05 0.00 -0.39 0.00 0.00 64.86 64.41 2g3m h ILE 306 Cb 0.48 1.04 -0.04 0.00 -3.07 0.00 0.00 36.82 35.23 2g3m h ILE 306 CO 0.02 0.08 0.25 -1.28 -0.69 0.00 0.00 178.15 176.54 2g3m h SER 307 N 0.10 0.36 -0.90 1.72 0.87 -0.57 0.35 113.55 115.47 2g3m h SER 307 Ca 0.04 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 2g3m h SER 307 Cb 0.08 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 61.96 2g3m h SER 307 CO -0.01 0.25 0.49 -0.08 -0.53 0.00 0.00 176.83 176.95 2g3m h GLU 308 N 0.49 1.27 -0.50 2.24 4.81 -0.96 -0.40 114.58 121.52 2g3m h GLU 308 Ca 0.22 -0.15 -0.12 0.00 -0.13 0.00 0.00 59.36 59.18 2g3m h GLU 308 Cb 0.14 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.26 2g3m h GLU 308 CO -0.16 0.93 -0.15 2.35 -0.73 0.00 0.00 179.01 181.24 2g3m h TRP 309 N 1.27 1.09 -0.04 0.92 2.91 0.19 -2.96 115.95 119.33 2g3m h TRP 309 Ca 0.32 -0.24 -0.10 0.00 1.13 0.00 0.00 58.89 60.00 2g3m h TRP 309 Cb 0.03 -0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 28.41 2g3m h TRP 309 CO 0.01 1.04 -0.42 -0.07 -1.03 0.00 0.00 178.44 177.97 2g3m h LEU 310 N 0.85 0.09 -1.16 0.65 3.38 0.25 -3.12 115.31 116.25 2g3m h LEU 310 Ca 0.13 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2g3m h LEU 310 Cb 0.71 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2g3m h LEU 310 CO 0.05 0.51 0.00 -1.54 0.09 0.00 0.00 178.44 177.55 2g3m n SER 311 N -4.03 0.50 0.19 -0.43 3.41 -0.21 -1.00 113.62 112.05 2g3m n SER 311 Ca -0.02 0.72 0.13 0.00 -0.26 0.00 0.00 58.87 59.44 2g3m n SER 311 Cb 0.46 -0.79 0.38 0.00 -0.26 0.00 0.00 64.21 64.00 2g3m n SER 311 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 2g3m h GLN 312 N 0.00 0.00 0.00 4.33 4.20 -1.67 -3.46 115.11 118.51 2g3m h GLN 312 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2g3m h GLN 312 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.83 2g3m h GLN 312 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 2g3m n GLY 313 N 0.81 1.47 3.73 3.46 0.00 -0.17 -4.97 105.19 109.52 2g3m n GLY 313 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2g3m n GLY 313 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g3m s VAL 314 N -2.00 3.37 -0.13 1.61 1.01 -1.15 -4.80 120.40 118.32 2g3m s VAL 314 Ca 0.00 1.08 0.18 0.00 0.00 0.00 0.00 61.98 63.23 2g3m s VAL 314 Cb 0.00 -3.69 -0.15 0.00 0.00 0.00 0.00 36.38 32.54 2g3m s VAL 314 CO 0.00 0.14 0.75 0.47 0.00 0.00 0.00 175.10 176.46 2g3m n ASP 315 N 3.05 0.74 -3.84 3.32 8.00 0.50 -4.73 116.55 123.58 2g3m n ASP 315 Ca 0.07 0.32 -0.09 0.00 0.71 0.00 0.00 54.79 55.81 2g3m n ASP 315 Cb 0.43 0.35 -0.07 0.00 -0.02 0.00 0.00 41.12 41.82 2g3m n ASP 315 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2g3m s GLY 316 N -4.81 0.11 -0.12 0.44 0.00 -0.77 -4.39 107.32 97.78 2g3m s GLY 316 Ca -0.04 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.13 2g3m s GLY 316 CO 0.82 -0.73 -0.22 -0.42 0.00 0.00 0.00 173.10 172.54 2g3m s ILE 317 N -3.87 2.15 -0.43 0.90 -1.09 -0.49 -2.06 121.20 116.30 2g3m s ILE 317 Ca 0.07 -0.97 -0.06 0.00 -2.23 0.00 0.00 60.65 57.46 2g3m s ILE 317 Cb 0.04 -1.84 0.11 0.00 -1.58 0.00 0.00 42.46 39.19 2g3m s ILE 317 CO -0.09 0.55 0.27 0.86 -1.23 0.00 0.00 174.94 175.30 2g3m s TRP 318 N 0.54 3.50 -0.34 3.97 -0.00 -0.52 -1.13 118.94 124.96 2g3m s TRP 318 Ca -0.13 -2.13 -0.27 0.00 -0.00 0.00 0.00 56.10 53.57 2g3m s TRP 318 Cb -0.17 -3.31 0.01 0.00 -0.00 0.00 0.00 33.47 30.00 2g3m s TRP 318 CO 0.04 -0.97 0.96 -0.51 -0.00 0.00 0.00 176.95 176.47 2g3m s LEU 319 N 1.25 3.98 0.33 5.86 1.43 0.23 -0.18 118.68 131.58 2g3m s LEU 319 Ca 0.07 0.80 0.09 0.00 -1.03 0.00 0.00 54.13 54.05 2g3m s LEU 319 Cb -0.24 -3.35 -0.06 0.00 0.03 0.00 0.00 46.19 42.57 2g3m s LEU 319 CO -0.02 -0.82 -0.08 -0.62 0.23 0.00 0.00 176.35 175.03 2g3m s ASP 320 N 1.74 3.46 -0.99 2.29 2.15 -1.16 -2.44 116.67 121.72 2g3m s ASP 320 Ca 0.40 -1.20 0.00 0.00 0.43 0.00 0.00 52.55 52.18 2g3m s ASP 320 Cb -0.12 -0.30 0.00 0.00 -0.30 0.00 0.00 42.92 42.20 2g3m s ASP 320 CO 0.16 -0.25 0.00 0.23 -0.17 0.00 0.00 175.17 175.15 2g3m n MET 321 N -0.74 -1.71 -0.55 4.34 2.81 -1.26 -4.18 117.12 115.83 2g3m n MET 321 Ca -0.05 0.78 -0.10 0.00 -1.81 0.00 0.00 57.70 56.52 2g3m n MET 321 Cb 0.63 -5.10 0.05 0.00 -0.71 0.00 0.00 33.22 28.10 2g3m n MET 321 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 2g3m n ASN 322 N -0.86 4.20 -0.32 7.83 6.94 -1.26 -1.62 115.26 130.16 2g3m n ASN 322 Ca -0.09 -2.68 0.03 0.00 -0.02 0.00 0.00 54.58 51.82 2g3m n ASN 322 Cb 0.53 -0.77 0.22 0.00 -2.36 0.00 0.00 39.78 37.40 2g3m n ASN 322 CO 0.00 0.00 0.00 -0.33 -1.03 0.00 0.00 177.26 175.90 2g3m h GLU 323 N 0.67 1.05 -6.65 -3.83 3.07 -1.90 -3.29 114.58 103.71 2g3m h GLU 323 Ca 0.22 -0.06 -0.51 0.00 -0.50 0.00 0.00 59.36 58.52 2g3m h GLU 323 Cb 1.44 -0.24 -0.03 0.00 -0.84 0.00 0.00 28.75 29.08 2g3m h GLU 323 CO 0.45 0.70 0.13 -1.25 -1.40 0.00 0.00 179.01 177.64 2g3m s PRO 324 N -5.95 4.22 0.00 2.33 0.04 -1.26 -4.59 135.00 129.80 2g3m s PRO 324 Ca -0.12 0.87 -0.01 0.00 0.04 0.00 0.00 61.00 61.79 2g3m s PRO 324 Cb 0.20 -2.74 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 2g3m s PRO 324 CO 0.80 0.31 0.12 0.99 0.04 0.00 0.00 177.00 179.27 2g3m s THR 325 N -1.66 4.97 -0.08 1.26 2.01 -0.64 -4.05 115.64 117.45 2g3m s THR 325 Ca 0.47 -0.35 -0.07 0.00 0.31 0.00 0.00 61.69 62.05 2g3m s THR 325 Cb -0.15 -3.31 0.02 0.00 0.01 0.00 0.00 72.50 69.08 2g3m s THR 325 CO 0.20 0.32 0.21 -0.62 -0.69 0.00 0.00 174.62 174.04 2g3m s ASP 326 N -1.88 -0.22 0.00 3.53 2.15 0.28 -4.96 116.67 115.57 2g3m s ASP 326 Ca 0.25 0.42 0.18 0.00 0.43 0.00 0.00 52.55 53.84 2g3m s ASP 326 Cb -0.12 0.41 0.35 0.00 -0.30 0.00 0.00 42.92 43.26 2g3m s ASP 326 CO 0.17 -0.09 1.27 0.49 -0.17 0.00 0.00 175.17 176.85 2g3m n PHE 327 N 3.16 0.43 -0.33 -5.34 3.72 0.19 -4.36 117.46 114.93 2g3m n PHE 327 Ca -0.15 -0.28 -0.01 0.00 -0.05 0.00 0.00 57.45 56.96 2g3m n PHE 327 Cb 0.58 -0.01 0.12 0.00 -0.94 0.00 0.00 39.48 39.23 2g3m n PHE 327 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2g3m h SER 328 N 3.46 0.97 -0.05 4.37 4.64 -1.90 -1.28 113.55 123.77 2g3m h SER 328 Ca 0.00 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2g3m h SER 328 Cb 0.83 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2g3m h SER 328 CO 0.00 0.66 0.00 0.03 -0.87 0.00 0.00 176.83 176.65 2g3m h ARG 329 N 1.13 0.09 -0.59 4.77 -0.00 -1.82 -1.40 114.38 116.55 2g3m h ARG 329 Ca 0.37 -0.03 0.06 0.00 -0.50 0.00 0.00 59.98 59.88 2g3m h ARG 329 Cb 0.02 -0.01 -0.05 0.00 0.00 0.00 0.00 29.97 29.93 2g3m h ARG 329 CO -0.13 0.37 0.29 0.00 0.00 0.00 0.00 179.97 180.51 2g3m h ALA 330 N 0.72 0.78 -0.06 0.04 0.00 -1.73 -1.66 119.26 117.35 2g3m h ALA 330 Ca 0.01 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.86 2g3m h ALA 330 Cb 0.33 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2g3m h ALA 330 CO 0.00 -0.06 -0.43 0.82 0.00 0.00 0.00 179.25 179.58 2g3m h ILE 331 N 0.55 1.32 -0.19 0.00 2.04 -1.23 -2.73 117.51 117.27 2g3m h ILE 331 Ca 0.27 -1.55 -0.01 0.00 1.00 0.00 0.00 64.86 64.58 2g3m h ILE 331 Cb 0.21 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 2g3m h ILE 331 CO -0.20 0.45 0.09 -0.08 0.00 0.00 0.00 178.15 178.42 2g3m h GLU 332 N 0.12 0.28 -0.97 2.37 4.81 -0.37 -1.58 114.58 119.23 2g3m h GLU 332 Ca 0.01 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2g3m h GLU 332 Cb 0.82 -0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.10 2g3m h GLU 332 CO 0.06 0.31 0.64 0.82 -0.73 0.00 0.00 179.01 180.11 2g3m h ILE 333 N 0.18 1.24 -0.10 2.32 2.04 -1.22 -2.47 117.51 119.50 2g3m h ILE 333 Ca 0.07 -0.45 -0.12 0.00 1.00 0.00 0.00 64.86 65.36 2g3m h ILE 333 Cb 0.12 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.01 2g3m h ILE 333 CO -0.01 0.24 -0.47 0.03 0.00 0.00 0.00 178.15 177.94 2g3m h ARG 334 N 1.30 0.24 -0.23 2.37 3.08 -1.21 -0.96 114.38 118.98 2g3m h ARG 334 Ca 0.36 -0.13 -0.12 0.00 0.07 0.00 0.00 59.98 60.16 2g3m h ARG 334 Cb -0.13 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2g3m h ARG 334 CO -0.08 0.67 -0.38 -0.44 -1.07 0.00 0.00 179.97 178.66 2g3m h ASP 335 N 0.20 0.53 0.22 7.04 3.32 -0.86 -1.61 116.42 125.26 2g3m h ASP 335 Ca 0.01 -0.23 -0.35 0.00 0.02 0.00 0.00 57.03 56.49 2g3m h ASP 335 Cb 0.91 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.31 2g3m h ASP 335 CO 0.07 0.86 -1.79 0.58 -1.72 0.00 0.00 179.24 177.24 2g3m h VAL 336 N 0.42 0.88 -0.59 -1.35 2.07 -1.37 -3.37 116.25 112.94 2g3m h VAL 336 Ca 0.04 -2.51 -0.21 0.00 0.82 0.00 0.00 66.70 64.85 2g3m h VAL 336 Cb 0.85 2.69 -0.12 0.00 -1.52 0.00 0.00 31.29 33.19 2g3m h VAL 336 CO 0.07 0.85 0.19 0.18 0.02 0.00 0.00 177.57 178.89 2g3m n LEU 337 N -3.53 5.32 0.02 2.57 4.77 -0.37 -4.64 117.00 121.14 2g3m n LEU 337 Ca -0.25 -3.36 -0.12 0.00 -0.03 0.00 0.00 56.01 52.25 2g3m n LEU 337 Cb 1.06 -0.70 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2g3m n LEU 337 CO 0.49 0.92 0.85 -1.28 -1.33 0.00 0.00 177.39 177.04 2g3m h SER 338 N 1.91 0.04 -0.98 -1.43 0.87 -1.45 -3.15 113.55 109.36 2g3m h SER 338 Ca 0.25 -0.06 0.05 0.00 -1.23 0.00 0.00 61.79 60.81 2g3m h SER 338 Cb 2.09 -0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 63.98 2g3m h SER 338 CO 0.61 0.09 0.64 0.77 -0.53 0.00 0.00 176.83 178.40 2g3m h SER 339 N -0.01 1.04 -2.51 6.23 4.64 -1.85 -3.44 113.55 117.65 2g3m h SER 339 Ca 0.01 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.78 2g3m h SER 339 Cb 0.06 -0.22 0.06 0.00 -0.31 0.00 0.00 62.40 61.98 2g3m h SER 339 CO -0.00 0.69 0.91 0.18 -0.87 0.00 0.00 176.83 177.74 2g3m n LEU 340 N -4.49 3.61 -2.17 5.97 4.32 -1.19 -4.88 117.00 118.17 2g3m n LEU 340 Ca 0.14 1.07 -0.19 0.00 -0.02 0.00 0.00 56.01 57.02 2g3m n LEU 340 Cb 0.14 -1.51 -0.08 0.00 -1.62 0.00 0.00 43.42 40.35 2g3m n LEU 340 CO 0.33 -0.03 1.50 -0.81 -1.22 0.00 0.00 177.39 177.16 2g3m n PRO 341 N 3.66 2.08 -4.44 3.23 -0.04 -1.26 -4.89 135.00 133.34 2g3m n PRO 341 Ca 0.16 -1.62 -0.22 0.00 -0.04 0.00 0.00 63.50 61.78 2g3m n PRO 341 Cb 0.32 -1.93 -0.10 0.00 -0.04 0.00 0.00 33.50 31.75 2g3m n PRO 341 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2g3m s VAL 342 N -1.03 2.20 -0.13 0.52 -7.23 -1.26 -5.12 120.40 108.35 2g3m s VAL 342 Ca 0.53 -2.32 -0.18 0.00 -1.81 0.00 0.00 61.98 58.20 2g3m s VAL 342 Cb 0.31 -2.26 -0.04 0.00 0.56 0.00 0.00 36.38 34.95 2g3m s VAL 342 CO -0.10 -0.44 0.47 -1.10 -0.31 0.00 0.00 175.10 173.63 2g3m s GLN 343 N -3.57 4.33 0.36 4.82 -0.21 -1.26 -5.06 119.66 119.07 2g3m s GLN 343 Ca 0.28 0.44 -0.25 0.00 0.02 0.00 0.00 55.36 55.85 2g3m s GLN 343 Cb -0.03 -3.44 -0.10 0.00 1.00 0.00 0.00 33.01 30.44 2g3m s GLN 343 CO 0.13 0.14 0.99 -0.06 -2.12 0.00 0.00 175.29 174.36 2g3m s PHE 344 N 0.69 3.48 0.01 0.91 0.08 -1.26 -4.99 117.98 116.89 2g3m s PHE 344 Ca 0.26 1.71 -0.30 0.00 0.12 0.00 0.00 56.93 58.71 2g3m s PHE 344 Cb -0.15 -3.00 -0.04 0.00 -0.57 0.00 0.00 43.02 39.26 2g3m s PHE 344 CO 0.10 -0.17 1.08 -0.98 -0.10 0.00 0.00 175.22 175.15 2g3m s ARG 345 N -2.34 4.48 -0.65 0.44 1.70 -1.26 -4.94 118.95 116.38 2g3m s ARG 345 Ca 0.54 1.56 -0.27 0.00 -0.47 0.00 0.00 55.73 57.09 2g3m s ARG 345 Cb -0.19 -3.44 0.01 0.00 -0.57 0.00 0.00 34.95 30.77 2g3m s ARG 345 CO 0.24 -0.18 1.43 0.34 -1.08 0.00 0.00 175.30 176.06 2g3m s ASP 346 N 1.08 5.98 -0.30 -2.89 -1.08 -1.26 -4.96 116.67 113.24 2g3m s ASP 346 Ca 0.54 -0.04 -0.06 0.00 -0.52 0.00 0.00 52.55 52.47 2g3m s ASP 346 Cb -0.24 -2.55 0.02 0.00 -1.46 0.00 0.00 42.92 38.69 2g3m s ASP 346 CO 0.27 -1.89 0.07 -0.62 0.52 0.00 0.00 175.17 173.51 2g3m s ASP 347 N 4.79 5.06 0.28 -0.34 2.15 -1.26 -4.97 116.67 122.39 2g3m s ASP 347 Ca 0.47 -0.86 0.09 0.00 0.43 0.00 0.00 52.55 52.69 2g3m s ASP 347 Cb -0.10 -1.84 0.41 0.00 -0.30 0.00 0.00 42.92 41.08 2g3m s ASP 347 CO 0.20 -0.22 1.65 0.03 -0.17 0.00 0.00 175.17 176.65 2g3m h ARG 348 N 8.19 0.07 0.00 4.34 2.47 -1.93 -2.89 114.38 124.63 2g3m h ARG 348 Ca -0.29 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.39 2g3m h ARG 348 Cb 1.11 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 2g3m h ARG 348 CO 0.60 0.60 0.00 -0.07 0.56 0.00 0.00 179.97 181.66 2g3m h LEU 349 N 0.05 0.00 -1.37 3.04 3.38 -1.93 -0.90 115.31 117.58 2g3m h LEU 349 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g3m h LEU 349 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2g3m h LEU 349 CO 0.08 0.00 0.00 1.62 0.09 0.00 0.00 178.44 180.23 2g3m h VAL 350 N 0.00 0.00 -0.06 1.22 3.04 -1.92 -2.83 116.25 115.69 2g3m h VAL 350 Ca 0.00 -0.41 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 2g3m h VAL 350 Cb 0.09 1.34 0.00 0.00 -2.01 0.00 0.00 31.29 30.70 2g3m h VAL 350 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 176.91 2g3m n THR 351 N -2.88 0.07 -2.21 3.17 -2.24 -0.34 -4.44 114.28 105.41 2g3m n THR 351 Ca 0.01 -0.22 -0.27 0.00 -2.27 0.00 0.00 64.05 61.30 2g3m n THR 351 Cb 0.27 0.22 0.12 0.00 -2.10 0.00 0.00 70.33 68.84 2g3m n THR 351 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2g3m s THR 352 N -1.93 2.13 0.43 4.28 -4.23 -1.07 -0.56 115.64 114.69 2g3m s THR 352 Ca 0.36 -0.26 -0.24 0.00 -1.18 0.00 0.00 61.69 60.37 2g3m s THR 352 Cb 0.19 -2.87 -0.08 0.00 1.34 0.00 0.00 72.50 71.08 2g3m s THR 352 CO 0.30 0.00 1.18 -0.36 -0.54 0.00 0.00 174.62 175.20 2g3m s PHE 353 N -3.46 2.96 0.94 3.99 0.40 -1.26 -4.50 117.98 117.05 2g3m s PHE 353 Ca 0.67 1.53 -0.11 0.00 -0.60 0.00 0.00 56.93 58.42 2g3m s PHE 353 Cb -0.07 -3.41 0.16 0.00 0.51 0.00 0.00 43.02 40.21 2g3m s PHE 353 CO 0.48 -1.47 1.09 -1.25 0.70 0.00 0.00 175.22 174.77 2g3m s PRO 354 N -2.46 0.87 0.62 0.24 0.04 -1.26 -4.92 135.00 128.13 2g3m s PRO 354 Ca 0.60 1.06 0.40 0.00 0.04 0.00 0.00 61.00 63.10 2g3m s PRO 354 Cb -0.30 -1.75 2.00 0.00 0.04 0.00 0.00 34.50 34.49 2g3m s PRO 354 CO 0.38 -2.58 2.21 -0.44 0.04 0.00 0.00 177.00 176.61 2g3m h ASP 355 N -1.80 0.00 -0.37 6.66 3.32 -2.02 -3.03 116.42 119.17 2g3m h ASP 355 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2g3m h ASP 355 Cb 1.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.83 2g3m h ASP 355 CO 0.50 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.56 2g3m n ASN 356 N -3.06 2.10 -4.76 6.45 6.94 -1.26 -4.70 115.26 116.96 2g3m n ASN 356 Ca -0.02 -1.97 -0.39 0.00 -0.02 0.00 0.00 54.58 52.19 2g3m n ASN 356 Cb 0.16 -0.25 -0.06 0.00 -2.36 0.00 0.00 39.78 37.27 2g3m n ASN 356 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 2g3m s VAL 357 N -1.50 4.14 0.15 3.53 1.01 -1.15 0.44 120.40 127.01 2g3m s VAL 357 Ca 0.27 1.98 0.05 0.00 0.00 0.00 0.00 61.98 64.28 2g3m s VAL 357 Cb 0.14 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2g3m s VAL 357 CO 0.19 0.40 -0.11 0.68 0.00 0.00 0.00 175.10 176.27 2g3m s VAL 358 N -1.30 1.22 0.23 2.92 -7.23 0.25 -0.74 120.40 115.75 2g3m s VAL 358 Ca 0.43 -2.01 0.01 0.00 -1.81 0.00 0.00 61.98 58.60 2g3m s VAL 358 Cb -0.24 -1.80 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 2g3m s VAL 358 CO 0.29 -0.69 0.08 -1.00 -0.31 0.00 0.00 175.10 173.47 2g3m s HIS 359 N -3.11 1.42 -0.36 2.82 3.76 -0.12 -3.35 115.29 116.34 2g3m s HIS 359 Ca 0.16 -1.16 0.02 0.00 -0.15 0.00 0.00 55.06 53.92 2g3m s HIS 359 Cb 0.01 -0.81 0.10 0.00 1.11 0.00 0.00 32.58 32.99 2g3m s HIS 359 CO 0.01 -0.34 0.10 0.71 -0.85 0.00 0.00 174.74 174.38 2g3m s TYR 360 N -3.77 3.71 -0.30 1.40 1.51 -1.26 -0.45 117.35 118.18 2g3m s TYR 360 Ca 0.34 -2.81 -0.12 0.00 -1.01 0.00 0.00 57.07 53.47 2g3m s TYR 360 Cb 0.07 -3.03 -0.04 0.00 -0.11 0.00 0.00 41.96 38.86 2g3m s TYR 360 CO 0.11 -0.96 0.21 -1.17 -1.11 0.00 0.00 175.55 172.63 2g3m s LEU 361 N 0.97 4.21 -1.46 -1.29 2.96 0.55 -3.68 118.68 120.94 2g3m s LEU 361 Ca 0.10 -0.18 -0.06 0.00 -0.22 0.00 0.00 54.13 53.77 2g3m s LEU 361 Cb -0.20 -2.12 0.04 0.00 0.50 0.00 0.00 46.19 44.41 2g3m s LEU 361 CO -0.07 -0.12 0.62 0.54 -1.32 0.00 0.00 176.35 176.00 2g3m n ARG 362 N 5.07 -3.91 0.00 1.98 1.74 -1.26 -0.80 116.66 119.49 2g3m n ARG 362 Ca -0.13 0.47 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 2g3m n ARG 362 Cb 0.51 -4.90 0.00 0.00 -1.02 0.00 0.00 32.46 27.05 2g3m n ARG 362 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2g3m n GLY 363 N -1.76 2.82 3.78 -0.13 0.00 -1.26 -5.00 105.19 103.64 2g3m n GLY 363 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 2g3m n GLY 363 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2g3m s LYS 364 N 0.00 3.99 -0.01 1.61 2.20 0.02 -5.03 119.74 122.52 2g3m s LYS 364 Ca 0.00 -0.08 -0.30 0.00 -0.36 0.00 0.00 55.97 55.23 2g3m s LYS 364 Cb 0.00 -3.35 -0.04 0.00 -1.51 0.00 0.00 37.83 32.93 2g3m s LYS 364 CO 0.00 0.44 1.17 0.50 -0.36 0.00 0.00 175.35 177.09 2g3m s ARG 365 N -0.07 4.40 0.06 4.03 3.52 -1.26 -0.33 118.95 129.30 2g3m s ARG 365 Ca 0.13 1.67 0.01 0.00 -0.13 0.00 0.00 55.73 57.41 2g3m s ARG 365 Cb -0.12 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.76 2g3m s ARG 365 CO 0.02 -0.33 -0.06 0.14 -0.81 0.00 0.00 175.30 174.26 2g3m s VAL 366 N 1.68 0.46 0.38 7.11 -7.23 0.40 -4.95 120.40 118.25 2g3m s VAL 366 Ca 0.56 -1.52 -0.25 0.00 -1.81 0.00 0.00 61.98 58.96 2g3m s VAL 366 Cb -0.26 -1.14 -0.09 0.00 0.56 0.00 0.00 36.38 35.45 2g3m s VAL 366 CO 0.25 -0.71 1.07 -0.54 -0.31 0.00 0.00 175.10 174.85 2g3m s LYS 367 N -2.89 4.22 0.22 4.82 1.02 -1.26 -0.94 119.74 124.93 2g3m s LYS 367 Ca 0.01 1.58 -0.08 0.00 0.02 0.00 0.00 55.97 57.50 2g3m s LYS 367 Cb -0.01 -2.65 0.29 0.00 -0.52 0.00 0.00 37.83 34.95 2g3m s LYS 367 CO -0.04 -0.11 1.80 1.25 -0.92 0.00 0.00 175.35 177.33 2g3m h HIS 368 N 2.70 0.70 0.00 3.18 -0.00 -1.22 -1.96 115.15 118.56 2g3m h HIS 368 Ca -0.48 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 59.92 2g3m h HIS 368 Cb 1.22 -0.21 0.00 0.00 -0.00 0.00 0.00 27.41 28.42 2g3m h HIS 368 CO 0.58 0.30 0.00 1.05 -0.00 0.00 0.00 177.93 179.86 2g3m h GLU 369 N 0.68 0.00 0.00 5.26 4.11 -1.87 0.32 114.58 123.08 2g3m h GLU 369 Ca 0.33 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.60 2g3m h GLU 369 Cb 0.26 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 2g3m h GLU 369 CO -0.22 0.00 -1.13 0.87 0.07 0.00 0.00 179.01 178.60 2g3m h LYS 370 N 0.00 0.00 0.00 1.06 1.79 -1.66 -3.34 116.57 114.41 2g3m h LYS 370 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2g3m h LYS 370 Cb 0.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.69 2g3m h LYS 370 CO 0.00 0.44 0.00 1.33 -1.08 0.00 0.00 179.45 180.14 2g3m n VAL 371 N -3.05 0.43 -0.38 0.50 0.24 -0.81 -2.70 118.33 112.57 2g3m n VAL 371 Ca -0.06 -0.55 -0.06 0.00 -2.04 0.00 0.00 64.34 61.63 2g3m n VAL 371 Cb 0.84 0.90 -0.03 0.00 -1.47 0.00 0.00 33.84 34.08 2g3m n VAL 371 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 2g3m n ARG 372 N -0.22 -0.33 0.31 7.34 0.63 0.11 -1.55 116.66 122.95 2g3m n ARG 372 Ca 0.00 1.43 0.19 0.00 -0.92 0.00 0.00 57.85 58.55 2g3m n ARG 372 Cb 0.25 -2.11 1.02 0.00 0.45 0.00 0.00 32.46 32.07 2g3m n ARG 372 CO 0.00 0.00 0.00 -0.91 -2.51 0.00 0.00 177.63 174.21 2g3m h ASN 373 N 0.00 0.00 0.52 6.15 2.35 -1.65 -1.17 115.58 121.78 2g3m h ASN 373 Ca 0.23 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 2g3m h ASN 373 Cb 0.46 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.83 2g3m h ASN 373 CO -0.90 0.00 -0.20 0.00 -1.65 0.00 0.00 177.43 174.68 2g3m n ALA 374 N -2.11 2.90 -0.02 -0.83 0.00 -0.59 -4.10 120.51 115.75 2g3m n ALA 374 Ca -0.02 -0.26 -0.09 0.00 0.00 0.00 0.00 53.44 53.07 2g3m n ALA 374 Cb 0.20 -1.29 -0.02 0.00 0.00 0.00 0.00 19.45 18.33 2g3m n ALA 374 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 2g3m h TYR 375 N 0.36 -0.60 -0.02 0.00 3.20 -1.30 -0.89 116.97 117.72 2g3m h TYR 375 Ca 0.00 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.88 2g3m h TYR 375 Cb 0.44 0.29 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 2g3m h TYR 375 CO 0.00 -0.31 -0.12 -1.00 -1.64 0.00 0.00 178.16 175.10 2g3m h PRO 376 N -0.26 0.03 -0.10 1.82 0.13 -1.73 -1.43 132.00 130.46 2g3m h PRO 376 Ca 0.12 -0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2g3m h PRO 376 Cb 0.44 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.56 2g3m h PRO 376 CO -0.33 0.15 0.06 1.25 -0.23 0.00 0.00 178.00 178.90 2g3m h LEU 377 N 0.03 0.12 -0.92 1.56 5.85 -1.43 0.23 115.31 120.76 2g3m h LEU 377 Ca 0.01 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.58 2g3m h LEU 377 Cb 0.23 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2g3m h LEU 377 CO 0.02 0.12 -0.40 1.88 -0.34 0.00 0.00 178.44 179.72 2g3m h TYR 378 N 0.12 0.34 -0.44 1.25 0.05 -0.88 -0.37 116.97 117.04 2g3m h TYR 378 Ca 0.04 -0.09 -0.11 0.00 0.05 0.00 0.00 58.73 58.61 2g3m h TYR 378 Cb 0.02 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 2g3m h TYR 378 CO -0.06 0.65 -0.16 1.49 -1.05 0.00 0.00 178.16 179.03 2g3m h GLU 379 N 0.25 0.89 -0.60 4.88 4.81 -1.02 -1.27 114.58 122.53 2g3m h GLU 379 Ca 0.02 -0.37 -0.07 0.00 -0.13 0.00 0.00 59.36 58.82 2g3m h GLU 379 Cb 0.81 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.13 2g3m h GLU 379 CO 0.06 1.02 0.09 0.00 -0.73 0.00 0.00 179.01 179.45 2g3m h ALA 380 N 0.85 1.04 -0.28 2.92 0.00 -0.69 -0.74 119.26 122.35 2g3m h ALA 380 Ca 0.11 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2g3m h ALA 380 Cb 0.72 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2g3m h ALA 380 CO 0.05 0.62 0.18 1.98 0.00 0.00 0.00 179.25 182.08 2g3m h MET 381 N 0.91 0.38 -0.44 0.00 1.85 -0.84 0.90 114.93 117.69 2g3m h MET 381 Ca 0.18 -0.03 -0.08 0.00 -0.61 0.00 0.00 59.70 59.17 2g3m h MET 381 Cb 0.40 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 32.33 2g3m h MET 381 CO 0.01 0.28 -0.04 0.00 -0.40 0.00 0.00 176.91 176.76 2g3m h ALA 382 N 1.08 1.09 -0.45 0.39 0.00 -0.95 -1.31 119.26 119.11 2g3m h ALA 382 Ca 0.10 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 2g3m h ALA 382 Cb -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2g3m h ALA 382 CO -0.02 0.57 -0.25 1.15 0.00 0.00 0.00 179.25 180.70 2g3m h THR 383 N 0.70 1.27 -0.44 0.00 2.02 -0.71 -1.73 112.91 114.03 2g3m h THR 383 Ca 0.13 -1.41 -0.01 0.00 0.77 0.00 0.00 66.41 65.89 2g3m h THR 383 Cb 0.49 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 2g3m h THR 383 CO 0.03 0.48 0.24 0.15 0.37 0.00 0.00 175.52 176.78 2g3m h PHE 384 N 0.81 0.61 -0.15 3.16 3.57 -0.55 -0.61 116.94 123.78 2g3m h PHE 384 Ca 0.10 -0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.63 2g3m h PHE 384 Cb 0.82 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 2g3m h PHE 384 CO 0.05 0.47 0.11 -0.22 -2.23 0.00 0.00 178.31 176.48 2g3m h LYS 385 N 0.57 0.00 -0.72 1.11 3.64 -0.95 0.42 116.57 120.63 2g3m h LYS 385 Ca 0.15 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.49 2g3m h LYS 385 Cb 0.06 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 2g3m h LYS 385 CO -0.02 0.00 0.29 0.78 -2.27 0.00 0.00 179.45 178.23 2g3m h GLY 386 N 0.00 1.14 0.98 5.01 0.00 -0.19 -0.06 103.07 109.96 2g3m h GLY 386 Ca 0.07 -0.60 -0.10 0.00 0.00 0.00 0.00 47.33 46.70 2g3m h GLY 386 CO -0.00 0.56 -0.19 0.74 0.00 0.00 0.00 176.54 177.66 2g3m h PHE 387 N 1.04 0.87 -0.62 5.60 -1.00 -0.69 -2.30 116.94 119.83 2g3m h PHE 387 Ca 0.24 -0.22 0.03 0.00 2.81 0.00 0.00 57.97 60.83 2g3m h PHE 387 Cb 0.19 -0.20 -0.04 0.00 3.61 0.00 0.00 35.95 39.51 2g3m h PHE 387 CO 0.02 0.95 0.39 0.00 -1.61 0.00 0.00 178.31 178.06 2g3m h ARG 388 N 0.54 0.74 -0.26 1.51 2.47 -1.04 -0.92 114.38 117.41 2g3m h ARG 388 Ca 0.08 -0.04 0.01 0.00 -1.26 0.00 0.00 59.98 58.77 2g3m h ARG 388 Cb 0.73 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 28.87 2g3m h ARG 388 CO 0.05 0.49 0.17 1.15 0.56 0.00 0.00 179.97 182.40 2g3m h THR 389 N 0.76 1.04 -0.09 2.04 2.02 -0.85 -0.10 112.91 117.72 2g3m h THR 389 Ca 0.25 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.33 2g3m h THR 389 Cb 0.01 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2g3m h THR 389 CO -0.10 0.05 0.00 -1.20 0.37 0.00 0.00 175.52 174.65 2g3m n SER 390 N -4.50 1.22 -2.88 4.18 7.64 -0.47 -4.90 113.62 113.91 2g3m n SER 390 Ca 0.01 -1.56 -0.22 0.00 1.01 0.00 0.00 58.87 58.11 2g3m n SER 390 Cb 0.11 -0.06 0.02 0.00 -1.01 0.00 0.00 64.21 63.28 2g3m n SER 390 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2g3m n HIS 391 N -0.00 -1.72 -3.23 1.43 -0.00 -0.05 -4.93 115.22 106.72 2g3m n HIS 391 Ca 0.17 0.38 -0.42 0.00 -0.00 0.00 0.00 57.72 57.85 2g3m n HIS 391 Cb 0.27 -4.22 -0.08 0.00 -0.00 0.00 0.00 29.99 25.96 2g3m n HIS 391 CO 0.00 0.00 0.00 0.50 -0.00 0.00 0.00 176.34 176.84 2g3m s ARG 392 N -5.55 3.41 0.08 -0.41 6.06 -0.49 -4.94 118.95 117.11 2g3m s ARG 392 Ca 0.23 -0.36 0.10 0.00 -2.50 0.00 0.00 55.73 53.20 2g3m s ARG 392 Cb -0.10 -3.88 -0.19 0.00 0.06 0.00 0.00 34.95 30.84 2g3m s ARG 392 CO 0.28 -0.78 1.06 -0.91 -2.50 0.00 0.00 175.30 172.45 2g3m h ASN 393 N 8.63 0.00 -2.92 -2.12 2.35 -1.91 -3.41 115.58 116.19 2g3m h ASN 393 Ca -0.27 0.00 -0.64 0.00 -0.55 0.00 0.00 56.30 54.84 2g3m h ASN 393 Cb 1.11 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.33 2g3m h ASN 393 CO 0.81 0.93 0.41 -1.61 -1.65 0.00 0.00 177.43 176.32 2g3m s GLU 394 N -2.71 3.16 -0.16 0.81 2.02 -1.26 -4.90 118.70 115.66 2g3m s GLU 394 Ca -0.01 -0.76 -0.06 0.00 0.02 0.00 0.00 54.97 54.16 2g3m s GLU 394 Cb 0.09 -4.17 -0.04 0.00 0.10 0.00 0.00 34.13 30.11 2g3m s GLU 394 CO 0.81 -1.60 0.05 0.42 0.02 0.00 0.00 175.26 174.96 2g3m s ILE 395 N 3.62 4.70 -0.12 -1.63 1.01 -1.26 -4.95 121.20 122.57 2g3m s ILE 395 Ca 0.22 -0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.76 2g3m s ILE 395 Cb -0.17 -3.08 0.04 0.00 0.01 0.00 0.00 42.46 39.26 2g3m s ILE 395 CO 0.12 0.50 0.05 0.12 0.00 0.00 0.00 174.94 175.73 2g3m s PHE 396 N 0.05 0.46 -0.06 3.97 5.36 -1.26 -4.29 117.98 122.21 2g3m s PHE 396 Ca 0.05 -0.25 0.01 0.00 -0.96 0.00 0.00 56.93 55.77 2g3m s PHE 396 Cb -0.12 -0.74 0.02 0.00 -0.34 0.00 0.00 43.02 41.84 2g3m s PHE 396 CO 0.01 -0.41 -0.04 0.42 -1.46 0.00 0.00 175.22 173.74 2g3m s ILE 397 N 2.04 0.59 -0.09 3.12 1.01 -1.26 -1.40 121.20 125.21 2g3m s ILE 397 Ca 0.03 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.57 2g3m s ILE 397 Cb -0.14 -0.63 -0.02 0.00 0.01 0.00 0.00 42.46 41.68 2g3m s ILE 397 CO -0.06 0.25 -0.11 -0.22 0.00 0.00 0.00 174.94 174.80 2g3m s LEU 398 N 1.16 2.91 0.03 2.97 0.20 -0.29 -0.02 118.68 125.64 2g3m s LEU 398 Ca -0.07 -0.18 0.03 0.00 0.69 0.00 0.00 54.13 54.60 2g3m s LEU 398 Cb -0.14 -1.64 -0.02 0.00 -0.43 0.00 0.00 46.19 43.97 2g3m s LEU 398 CO -0.01 0.27 -0.11 -0.55 -0.29 0.00 0.00 176.35 175.67 2g3m s SER 399 N -0.29 1.22 -0.14 3.68 0.15 -0.11 0.74 113.70 118.96 2g3m s SER 399 Ca 0.03 -0.43 -0.15 0.00 0.70 0.00 0.00 55.95 56.10 2g3m s SER 399 Cb -0.13 -0.05 -0.25 0.00 -1.71 0.00 0.00 66.02 63.88 2g3m s SER 399 CO 0.03 -0.04 0.42 -0.09 1.20 0.00 0.00 173.24 174.76 2g3m h ARG 400 N 4.96 0.18 -6.43 5.44 2.43 -1.78 -3.24 114.38 115.94 2g3m h ARG 400 Ca -0.36 -0.30 -0.44 0.00 -0.81 0.00 0.00 59.98 58.07 2g3m h ARG 400 Cb 1.19 0.11 0.01 0.00 -0.42 0.00 0.00 29.97 30.87 2g3m h ARG 400 CO 0.44 1.15 -0.25 0.00 -1.51 0.00 0.00 179.97 179.79 2g3m s ALA 401 N -2.46 4.50 0.02 2.80 0.00 -1.26 -4.50 121.76 120.86 2g3m s ALA 401 Ca -0.23 -1.76 -0.28 0.00 0.00 0.00 0.00 51.96 49.69 2g3m s ALA 401 Cb 0.05 -1.51 0.10 0.00 0.00 0.00 0.00 23.12 21.76 2g3m s ALA 401 CO 0.72 -0.36 1.24 0.20 0.00 0.00 0.00 175.76 177.55 2g3m s GLY 402 N -4.37 -0.15 0.26 0.00 0.00 -1.25 -4.84 107.32 96.96 2g3m s GLY 402 Ca 0.55 0.12 -0.13 0.00 0.00 0.00 0.00 44.72 45.26 2g3m s GLY 402 CO 0.33 3.64 0.50 -0.47 0.00 0.00 0.00 173.10 177.10 2g3m s TYR 403 N -2.17 0.35 0.15 1.90 5.04 -1.26 -2.17 117.35 119.20 2g3m s TYR 403 Ca 0.24 -0.72 -0.34 0.00 -2.44 0.00 0.00 57.07 53.81 2g3m s TYR 403 Cb 0.00 0.22 -0.15 0.00 0.35 0.00 0.00 41.96 42.38 2g3m s TYR 403 CO -0.00 -1.02 1.35 0.00 -1.34 0.00 0.00 175.55 174.53 2g3m n ALA 404 N -0.40 -0.11 0.00 3.97 0.00 -1.25 -0.94 120.51 121.79 2g3m n ALA 404 Ca -0.02 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.89 2g3m n ALA 404 Cb 0.62 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.92 2g3m n ALA 404 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g3m n GLY 405 N 2.49 0.93 0.31 0.00 0.00 -1.26 -4.93 105.19 102.72 2g3m n GLY 405 Ca 0.16 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.33 2g3m n GLY 405 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2g3m h ILE 406 N 0.00 0.59 0.00 -0.61 6.09 -1.38 -1.08 117.51 121.11 2g3m h ILE 406 Ca 0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2g3m h ILE 406 Cb 0.00 0.92 -0.00 0.00 0.47 0.00 0.00 36.82 38.21 2g3m h ILE 406 CO 0.00 0.00 -0.00 0.06 -3.07 0.00 0.00 178.15 175.14 2g3m h GLN 407 N 0.00 0.00 -0.04 2.19 -0.00 -1.82 -1.32 115.11 114.11 2g3m h GLN 407 Ca 0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.66 2g3m h GLN 407 Cb 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.72 2g3m h GLN 407 CO -0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 178.83 178.66 2g3m h ARG 408 N 0.00 0.06 0.00 0.06 3.08 -1.37 -3.03 114.38 113.19 2g3m h ARG 408 Ca -0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2g3m h ARG 408 Cb 0.01 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2g3m h ARG 408 CO 0.00 0.23 -0.33 0.66 -1.07 0.00 0.00 179.97 179.46 2g3m n TYR 409 N -4.31 0.00 -3.68 3.04 4.01 -0.56 -3.61 117.16 112.05 2g3m n TYR 409 Ca -0.02 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.62 2g3m n TYR 409 Cb 0.25 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.24 2g3m n TYR 409 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2g3m s ALA 410 N -1.17 -0.91 0.58 -0.72 0.00 -0.87 -4.49 121.76 114.18 2g3m s ALA 410 Ca 0.00 -0.14 -0.08 0.00 0.00 0.00 0.00 51.96 51.74 2g3m s ALA 410 Cb 0.00 0.78 -0.02 0.00 0.00 0.00 0.00 23.12 23.88 2g3m s ALA 410 CO 0.00 -0.72 0.92 -0.06 0.00 0.00 0.00 175.76 175.91 2g3m s PHE 411 N -3.84 3.47 -0.02 0.00 0.40 0.97 -4.58 117.98 114.38 2g3m s PHE 411 Ca 0.06 0.93 0.01 0.00 -0.60 0.00 0.00 56.93 57.33 2g3m s PHE 411 Cb 0.01 -2.63 0.02 0.00 0.51 0.00 0.00 43.02 40.93 2g3m s PHE 411 CO -0.08 -0.65 -0.01 0.42 0.70 0.00 0.00 175.22 175.61 2g3m s ILE 412 N -3.00 0.19 0.19 0.64 1.01 -0.30 -0.94 121.20 118.99 2g3m s ILE 412 Ca 0.52 0.04 0.09 0.00 0.00 0.00 0.00 60.65 61.30 2g3m s ILE 412 Cb -0.11 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.06 2g3m s ILE 412 CO 0.48 0.13 -0.08 -1.66 0.00 0.00 0.00 174.94 173.81 2g3m s TRP 413 N 0.77 2.66 -1.13 3.97 -2.14 -1.22 -2.62 118.94 119.23 2g3m s TRP 413 Ca -0.08 -0.21 0.00 0.00 2.66 0.00 0.00 56.10 58.47 2g3m s TRP 413 Cb -0.11 -1.29 0.00 0.00 -3.10 0.00 0.00 33.47 28.97 2g3m s TRP 413 CO -0.01 0.52 0.36 0.25 -2.66 0.00 0.00 176.95 175.41 2g3m n THR 414 N -0.05 0.00 -4.36 0.66 -2.24 -0.58 -4.79 114.28 102.92 2g3m n THR 414 Ca -0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.68 2g3m n THR 414 Cb 0.56 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.49 2g3m n THR 414 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g3m n GLY 415 N 0.18 -0.09 2.63 3.38 0.00 -1.26 -4.48 105.19 105.55 2g3m n GLY 415 Ca 0.00 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.62 2g3m n GLY 415 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2g3m n ASP 416 N -0.62 5.04 -4.78 1.61 8.00 -1.26 -4.64 116.55 119.89 2g3m n ASP 416 Ca 0.00 -2.78 -0.32 0.00 0.71 0.00 0.00 54.79 52.40 2g3m n ASP 416 Cb 0.00 -1.63 0.06 0.00 -0.02 0.00 0.00 41.12 39.52 2g3m n ASP 416 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2g3m s ASN 417 N 2.93 5.04 -0.21 -2.24 4.22 -1.26 -4.30 114.94 119.12 2g3m s ASN 417 Ca 0.52 1.87 -0.06 0.00 -2.14 0.00 0.00 52.86 53.05 2g3m s ASN 417 Cb 0.15 -2.53 -0.03 0.00 1.28 0.00 0.00 41.25 40.12 2g3m s ASN 417 CO -0.08 -1.68 0.04 -0.89 -2.04 0.00 0.00 177.10 172.45 2g3m s THR 418 N -2.62 4.28 0.08 0.54 2.01 -1.26 -1.30 115.64 117.38 2g3m s THR 418 Ca 0.64 -0.20 -0.31 0.00 0.31 0.00 0.00 61.69 62.13 2g3m s THR 418 Cb -0.18 -2.95 -0.08 0.00 0.01 0.00 0.00 72.50 69.30 2g3m s THR 418 CO 0.47 0.41 1.57 -2.16 -0.69 0.00 0.00 174.62 174.23 2g3m s PRO 419 N 0.97 4.23 -0.15 4.92 0.04 -1.26 -4.65 135.00 139.10 2g3m s PRO 419 Ca 0.03 2.26 -0.34 0.00 0.04 0.00 0.00 61.00 62.99 2g3m s PRO 419 Cb -0.14 -3.46 0.13 0.00 0.04 0.00 0.00 34.50 31.07 2g3m s PRO 419 CO 0.02 -0.65 1.21 -1.54 0.04 0.00 0.00 177.00 176.08 2g3m s SER 420 N 1.93 -0.13 0.31 6.66 1.04 -1.26 -1.43 113.70 120.81 2g3m s SER 420 Ca 0.71 -0.03 0.01 0.00 0.48 0.00 0.00 55.95 57.12 2g3m s SER 420 Cb -0.39 0.16 0.49 0.00 0.10 0.00 0.00 66.02 66.38 2g3m s SER 420 CO 0.31 -0.27 1.86 -0.50 0.98 0.00 0.00 173.24 175.62 2g3m h TRP 421 N 2.00 0.74 -0.09 5.02 4.06 -1.93 -2.20 115.95 123.54 2g3m h TRP 421 Ca -0.13 -0.06 -0.06 0.00 2.06 0.00 0.00 58.89 60.70 2g3m h TRP 421 Cb 1.18 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 29.11 2g3m h TRP 421 CO 0.29 0.63 -0.21 -0.44 -3.56 0.00 0.00 178.44 175.15 2g3m h ASP 422 N 0.70 0.14 0.12 -3.49 3.32 -1.95 -2.50 116.42 112.76 2g3m h ASP 422 Ca 0.16 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2g3m h ASP 422 Cb 0.27 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 2g3m h ASP 422 CO -0.00 0.37 -0.10 -0.78 -1.72 0.00 0.00 179.24 177.01 2g3m h ASP 423 N 0.14 0.00 -0.56 6.45 3.58 -1.66 -2.21 116.42 122.16 2g3m h ASP 423 Ca 0.03 0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.53 2g3m h ASP 423 Cb 0.46 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.46 2g3m h ASP 423 CO 0.03 0.10 0.28 -0.07 -2.88 0.00 0.00 179.24 176.70 2g3m h LEU 424 N 0.00 0.39 -0.36 2.28 3.38 -1.46 0.24 115.31 119.78 2g3m h LEU 424 Ca -0.00 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.86 2g3m h LEU 424 Cb 0.19 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2g3m h LEU 424 CO 0.01 0.26 -0.35 0.11 0.09 0.00 0.00 178.44 178.57 2g3m h LYS 425 N 0.53 0.87 -0.21 1.13 1.57 -1.56 -2.96 116.57 115.95 2g3m h LYS 425 Ca 0.25 -0.46 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2g3m h LYS 425 Cb 0.18 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2g3m h LYS 425 CO -0.18 1.10 0.14 1.25 -0.57 0.00 0.00 179.45 181.19 2g3m h LEU 426 N 0.67 0.25 -1.21 2.94 6.46 -0.84 -2.29 115.31 121.29 2g3m h LEU 426 Ca 0.06 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.85 2g3m h LEU 426 Cb 0.94 -0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 40.76 2g3m h LEU 426 CO 0.09 0.18 0.55 1.56 -0.62 0.00 0.00 178.44 180.20 2g3m h GLN 427 N 0.29 0.96 -0.42 1.25 1.08 -0.56 -0.34 115.11 117.37 2g3m h GLN 427 Ca 0.08 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 2g3m h GLN 427 Cb -0.03 -0.22 -0.02 0.00 -0.05 0.00 0.00 27.48 27.16 2g3m h GLN 427 CO -0.02 0.64 0.22 1.25 -0.95 0.00 0.00 178.83 179.97 2g3m h LEU 428 N 0.99 0.53 -0.58 1.46 5.85 -1.29 -0.34 115.31 121.93 2g3m h LEU 428 Ca 0.34 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.92 2g3m h LEU 428 Cb 0.10 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 2g3m h LEU 428 CO -0.11 0.48 0.20 1.56 -0.34 0.00 0.00 178.44 180.23 2g3m h GLN 429 N 0.54 0.89 0.40 1.25 4.20 -0.79 -1.49 115.11 120.12 2g3m h GLN 429 Ca 0.15 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 2g3m h GLN 429 Cb 0.07 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.72 2g3m h GLN 429 CO -0.02 0.79 -0.19 -0.07 -0.67 0.00 0.00 178.83 178.66 2g3m h LEU 430 N 0.82 -0.46 -1.12 1.46 4.07 -0.74 0.86 115.31 120.20 2g3m h LEU 430 Ca 0.19 -0.03 -0.08 0.00 0.08 0.00 0.00 57.88 58.04 2g3m h LEU 430 Cb 0.25 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 2g3m h LEU 430 CO -0.01 -0.26 -0.23 -0.37 -1.08 0.00 0.00 178.44 176.49 2g3m h VAL 431 N -0.63 1.24 -0.02 1.22 -1.51 -1.07 -1.86 116.25 113.63 2g3m h VAL 431 Ca -0.06 -1.13 -0.17 0.00 -1.23 0.00 0.00 66.70 64.11 2g3m h VAL 431 Cb 0.47 1.36 -0.01 0.00 -2.13 0.00 0.00 31.29 30.97 2g3m h VAL 431 CO 0.09 0.35 -0.78 -0.07 -1.23 0.00 0.00 177.57 175.94 2g3m h LEU 432 N 0.30 0.20 -0.49 4.19 3.38 -1.23 -0.83 115.31 120.84 2g3m h LEU 432 Ca 0.05 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2g3m h LEU 432 Cb 0.58 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2g3m h LEU 432 CO 0.04 0.90 0.18 1.23 0.09 0.00 0.00 178.44 180.88 2g3m h GLY 433 N 1.84 0.79 0.81 0.83 0.00 -0.36 0.05 103.07 107.04 2g3m h GLY 433 Ca -0.03 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.83 2g3m h GLY 433 CO 0.12 0.42 0.00 1.41 0.00 0.00 0.00 176.54 178.49 2g3m h LEU 434 N 0.65 0.31 -0.39 3.11 4.07 -1.29 -2.87 115.31 118.90 2g3m h LEU 434 Ca 0.16 -0.30 0.04 0.00 0.08 0.00 0.00 57.88 57.86 2g3m h LEU 434 Cb 0.23 -0.08 -0.04 0.00 1.08 0.00 0.00 40.66 41.84 2g3m h LEU 434 CO -0.01 0.54 0.15 -1.28 -1.08 0.00 0.00 178.44 176.76 2g3m h SER 435 N 0.07 0.18 0.46 -0.43 0.87 -0.94 -0.57 113.55 113.19 2g3m h SER 435 Ca 0.05 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2g3m h SER 435 Cb 0.38 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.35 2g3m h SER 435 CO 0.01 0.14 0.00 0.00 -0.53 0.00 0.00 176.83 176.45 2g3m n ILE 436 N -4.99 0.34 -1.01 2.23 0.13 -0.01 -2.90 119.36 113.14 2g3m n ILE 436 Ca 0.02 0.08 0.06 0.00 -1.10 0.00 0.00 62.75 61.82 2g3m n ILE 436 Cb 0.13 -0.72 0.29 0.00 -0.84 0.00 0.00 39.64 38.51 2g3m n ILE 436 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 2g3m n SER 437 N -1.31 4.29 0.00 9.51 7.64 -0.29 -4.81 113.62 128.64 2g3m n SER 437 Ca 0.10 -3.07 0.00 0.00 1.01 0.00 0.00 58.87 56.91 2g3m n SER 437 Cb 0.19 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 2g3m n SER 437 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2g3m n GLY 438 N -0.28 0.70 3.13 0.23 0.00 -1.14 -4.90 105.19 102.92 2g3m n GLY 438 Ca 0.25 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.89 2g3m n GLY 438 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g3m s VAL 439 N -2.65 3.79 0.11 1.61 1.01 -0.77 -4.67 120.40 118.83 2g3m s VAL 439 Ca 0.00 -2.56 -0.14 0.00 0.00 0.00 0.00 61.98 59.28 2g3m s VAL 439 Cb 0.00 -3.49 -0.07 0.00 0.00 0.00 0.00 36.38 32.82 2g3m s VAL 439 CO 0.00 -0.83 1.45 1.55 0.00 0.00 0.00 175.10 177.28 2g3m h PRO 440 N 7.51 0.73 -5.21 2.72 0.13 -1.82 -3.15 132.00 132.91 2g3m h PRO 440 Ca -0.06 -0.35 -0.67 0.00 -0.87 0.00 0.00 66.00 64.05 2g3m h PRO 440 Cb 1.00 -0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.96 2g3m h PRO 440 CO 0.73 0.96 0.89 -0.06 -0.23 0.00 0.00 178.00 180.29 2g3m s PHE 441 N -4.49 2.99 0.19 1.56 0.08 -1.26 -4.53 117.98 112.53 2g3m s PHE 441 Ca -0.12 -1.22 0.02 0.00 0.12 0.00 0.00 56.93 55.73 2g3m s PHE 441 Cb 0.09 -4.34 -0.05 0.00 -0.57 0.00 0.00 43.02 38.16 2g3m s PHE 441 CO 0.83 -1.57 0.00 0.14 -0.10 0.00 0.00 175.22 174.52 2g3m s VAL 442 N 3.14 0.80 0.08 -0.44 -7.23 -1.26 -1.15 120.40 114.33 2g3m s VAL 442 Ca 0.33 -2.00 -0.25 0.00 -1.81 0.00 0.00 61.98 58.25 2g3m s VAL 442 Cb -0.06 -2.20 0.09 0.00 0.56 0.00 0.00 36.38 34.77 2g3m s VAL 442 CO -0.07 -0.42 1.17 0.61 -0.31 0.00 0.00 175.10 176.08 2g3m n GLY 443 N -0.30 0.39 3.35 2.32 0.00 -1.08 -1.48 105.19 108.39 2g3m n GLY 443 Ca -0.06 -1.10 -0.18 0.00 0.00 0.00 0.00 46.02 44.69 2g3m n GLY 443 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g3m s ASP 445 N -3.34 6.60 -0.08 0.00 1.01 -1.26 -4.39 116.67 115.21 2g3m s ASP 445 Ca 0.34 1.16 -0.29 0.00 0.71 0.00 0.00 52.55 54.47 2g3m s ASP 445 Cb 0.07 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.41 2g3m s ASP 445 CO 0.12 -1.15 1.68 -0.63 0.21 0.00 0.00 175.17 175.40 2g3m s ILE 446 N 4.60 3.56 0.00 0.77 1.01 0.76 -1.41 121.20 130.49 2g3m s ILE 446 Ca 0.58 0.67 0.00 0.00 0.00 0.00 0.00 60.65 61.90 2g3m s ILE 446 Cb -0.16 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.84 2g3m s ILE 446 CO 0.25 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.70 2g3m n GLY 447 N 4.29 0.26 0.14 6.18 0.00 -1.26 -3.74 105.19 111.07 2g3m n GLY 447 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2g3m n GLY 447 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g3m n GLY 448 N -2.00 -3.19 0.10 -0.02 0.00 -0.50 -4.58 105.19 95.00 2g3m n GLY 448 Ca 0.00 -1.09 -0.12 0.00 0.00 0.00 0.00 46.02 44.81 2g3m n GLY 448 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2g3m h PHE 449 N 0.17 -0.10 -2.03 1.61 3.57 -1.33 -3.42 116.94 115.40 2g3m h PHE 449 Ca 0.00 -0.00 -0.64 0.00 3.53 0.00 0.00 57.97 60.86 2g3m h PHE 449 Cb 0.00 0.03 0.08 0.00 2.79 0.00 0.00 35.95 38.86 2g3m h PHE 449 CO 0.00 0.44 0.27 1.04 -2.23 0.00 0.00 178.31 177.84 2g3m n GLN 450 N -4.84 1.23 0.00 1.11 1.13 -0.83 -0.10 117.38 115.08 2g3m n GLN 450 Ca -0.08 0.44 0.00 0.00 -1.94 0.00 0.00 57.00 55.42 2g3m n GLN 450 Cb 0.29 -1.93 0.00 0.00 0.11 0.00 0.00 30.24 28.71 2g3m n GLN 450 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g3m n GLY 451 N 1.96 0.74 2.77 1.08 0.00 -1.26 -4.68 105.19 105.79 2g3m n GLY 451 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 2g3m n GLY 451 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g3m n ARG 452 N 0.00 1.56 0.00 1.61 1.74 -1.25 -4.69 116.66 115.64 2g3m n ARG 452 Ca 0.00 -2.56 0.14 0.00 -0.77 0.00 0.00 57.85 54.66 2g3m n ARG 452 Cb 0.00 -0.76 0.45 0.00 -1.02 0.00 0.00 32.46 31.13 2g3m n ARG 452 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2g3m n ASN 453 N -0.97 1.42 -3.64 0.55 6.94 -1.26 -4.90 115.26 113.40 2g3m n ASN 453 Ca -0.03 -1.33 -0.11 0.00 -0.02 0.00 0.00 54.58 53.08 2g3m n ASN 453 Cb 0.83 0.05 -0.05 0.00 -2.36 0.00 0.00 39.78 38.25 2g3m n ASN 453 CO 0.00 0.00 0.00 0.72 -1.03 0.00 0.00 177.26 176.95 2g3m s PHE 454 N -2.16 -0.23 0.33 -2.53 -0.71 -1.26 -5.09 117.98 106.33 2g3m s PHE 454 Ca 0.33 0.03 0.03 0.00 -1.04 0.00 0.00 56.93 56.27 2g3m s PHE 454 Cb 0.20 0.25 0.57 0.00 -1.21 0.00 0.00 43.02 42.83 2g3m s PHE 454 CO 0.39 -0.65 1.89 0.00 -1.34 0.00 0.00 175.22 175.51 2g3m h ALA 455 N 2.61 1.37 0.00 1.99 0.00 -2.00 -3.33 119.26 119.90 2g3m h ALA 455 Ca -0.33 -0.17 -0.15 0.00 0.00 0.00 0.00 54.91 54.26 2g3m h ALA 455 Cb 1.24 -0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 2g3m h ALA 455 CO 0.46 0.45 -0.29 0.39 0.00 0.00 0.00 179.25 180.26 2g3m n GLU 456 N -4.31 1.75 -4.39 0.00 4.71 -1.26 -4.79 120.64 112.35 2g3m n GLU 456 Ca 0.03 -0.79 -0.31 0.00 -0.01 0.00 0.00 57.16 56.08 2g3m n GLU 456 Cb 0.20 -1.82 -0.16 0.00 -1.01 0.00 0.00 31.44 28.65 2g3m n GLU 456 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 2g3m s ILE 457 N 0.92 1.79 -0.46 -3.67 1.01 -1.25 -4.89 121.20 114.65 2g3m s ILE 457 Ca 0.53 -0.80 -0.14 0.00 0.00 0.00 0.00 60.65 60.24 2g3m s ILE 457 Cb 0.25 -1.62 0.07 0.00 0.01 0.00 0.00 42.46 41.18 2g3m s ILE 457 CO 0.00 0.50 0.37 -0.62 0.00 0.00 0.00 174.94 175.18 2g3m s ASP 458 N 1.07 6.06 -0.31 3.58 -1.08 -0.51 -4.94 116.67 120.55 2g3m s ASP 458 Ca -0.03 -1.33 0.11 0.00 -0.52 0.00 0.00 52.55 50.78 2g3m s ASP 458 Cb -0.14 -2.15 0.72 0.00 -1.46 0.00 0.00 42.92 39.88 2g3m s ASP 458 CO -0.05 -0.62 1.75 0.59 0.52 0.00 0.00 175.17 177.36 2g3m n ASN 459 N 5.15 4.63 -4.76 -0.34 3.02 -1.26 -4.42 115.26 117.29 2g3m n ASN 459 Ca -0.12 -3.24 -0.37 0.00 -0.03 0.00 0.00 54.58 50.82 2g3m n ASN 459 Cb 0.44 -0.72 0.02 0.00 -0.61 0.00 0.00 39.78 38.91 2g3m n ASN 459 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2g3m s SER 460 N -1.22 5.52 0.27 6.41 1.04 -1.26 -4.93 113.70 119.53 2g3m s SER 460 Ca 0.53 2.53 0.06 0.00 0.48 0.00 0.00 55.95 59.56 2g3m s SER 460 Cb 0.43 -2.62 0.39 0.00 0.10 0.00 0.00 66.02 64.32 2g3m s SER 460 CO 0.12 -1.38 1.65 0.24 0.98 0.00 0.00 173.24 174.85 2g3m h MET 461 N 1.50 0.24 0.00 4.02 0.00 -2.00 -2.67 114.93 116.02 2g3m h MET 461 Ca -0.50 -0.13 -0.08 0.00 0.00 0.00 0.00 59.70 58.98 2g3m h MET 461 Cb 1.28 0.01 -0.01 0.00 0.00 0.00 0.00 31.60 32.88 2g3m h MET 461 CO 0.58 0.67 -0.39 0.38 0.00 0.00 0.00 176.91 178.15 2g3m h ASP 462 N 0.20 0.00 -0.19 1.22 2.03 -2.00 -1.86 116.42 115.83 2g3m h ASP 462 Ca 0.01 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.17 2g3m h ASP 462 Cb 0.91 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.41 2g3m h ASP 462 CO 0.07 0.39 -0.45 0.25 -1.03 0.00 0.00 179.24 178.48 2g3m h LEU 463 N 0.00 0.71 -0.78 0.15 6.46 -1.92 -2.31 115.31 117.63 2g3m h LEU 463 Ca -0.00 -0.57 0.07 0.00 -0.12 0.00 0.00 57.88 57.26 2g3m h LEU 463 Cb 0.80 -0.21 -0.06 0.00 -0.73 0.00 0.00 40.66 40.46 2g3m h LEU 463 CO 0.05 1.15 0.46 0.25 -0.62 0.00 0.00 178.44 179.73 2g3m h LEU 464 N 0.31 0.68 -0.75 2.25 5.85 -1.12 -0.70 115.31 121.83 2g3m h LEU 464 Ca -0.00 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.72 2g3m h LEU 464 Cb 1.06 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 2g3m h LEU 464 CO 0.10 0.42 0.35 0.58 -0.34 0.00 0.00 178.44 179.55 2g3m h VAL 465 N 0.81 1.24 0.00 1.05 2.07 -1.24 -1.87 116.25 118.32 2g3m h VAL 465 Ca 0.36 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 67.15 2g3m h VAL 465 Cb 0.25 0.31 -0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2g3m h VAL 465 CO -0.20 0.29 -0.14 0.11 0.02 0.00 0.00 177.57 177.65 2g3m h LYS 466 N 1.06 0.00 -0.10 1.57 1.79 -0.60 -0.75 116.57 119.53 2g3m h LYS 466 Ca 0.26 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.69 2g3m h LYS 466 Cb 0.13 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.78 2g3m h LYS 466 CO -0.03 0.14 -0.08 1.88 -1.08 0.00 0.00 179.45 180.28 2g3m h TYR 467 N 0.00 0.28 -0.96 -1.35 0.05 -0.39 0.23 116.97 114.83 2g3m h TYR 467 Ca -0.00 -0.08 0.05 0.00 0.05 0.00 0.00 58.73 58.74 2g3m h TYR 467 Cb 0.34 -0.06 -0.06 0.00 1.01 0.00 0.00 36.73 37.96 2g3m h TYR 467 CO 0.00 0.64 0.62 1.88 -1.05 0.00 0.00 178.16 180.25 2g3m h TYR 468 N -0.15 1.16 -0.31 4.88 0.05 -0.95 -1.79 116.97 119.86 2g3m h TYR 468 Ca 0.02 0.03 -0.18 0.00 0.05 0.00 0.00 58.73 58.65 2g3m h TYR 468 Cb 0.58 -0.38 -0.00 0.00 1.01 0.00 0.00 36.73 37.94 2g3m h TYR 468 CO 0.08 0.64 -0.49 0.00 -1.05 0.00 0.00 178.16 177.34 2g3m h ALA 469 N 1.41 0.53 -0.30 3.88 0.00 -1.06 -2.92 119.26 120.80 2g3m h ALA 469 Ca 0.39 -0.49 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2g3m h ALA 469 Cb 0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2g3m h ALA 469 CO -0.14 0.68 0.19 1.25 0.00 0.00 0.00 179.25 181.23 2g3m h LEU 470 N 0.68 0.31 -0.46 0.00 5.85 0.05 -2.62 115.31 119.13 2g3m h LEU 470 Ca 0.03 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2g3m h LEU 470 Cb 1.09 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.05 2g3m h LEU 470 CO 0.11 0.23 0.00 0.00 -0.34 0.00 0.00 178.44 178.44 2g3m n ALA 471 N -2.19 2.53 -0.33 1.25 0.00 -0.73 -4.50 120.51 116.54 2g3m n ALA 471 Ca -0.01 -0.25 0.18 0.00 0.00 0.00 0.00 53.44 53.36 2g3m n ALA 471 Cb 0.04 -1.10 0.34 0.00 0.00 0.00 0.00 19.45 18.73 2g3m n ALA 471 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2g3m n LEU 472 N -0.24 -0.01 -0.69 0.00 7.94 -0.99 -0.70 117.00 122.31 2g3m n LEU 472 Ca 0.10 1.61 0.06 0.00 -1.11 0.00 0.00 56.01 56.67 2g3m n LEU 472 Cb 0.14 -0.63 0.17 0.00 0.53 0.00 0.00 43.42 43.62 2g3m n LEU 472 CO 0.07 -1.67 0.64 0.49 -1.11 0.00 0.00 177.39 175.81 2g3m n PHE 473 N -5.36 0.51 -2.14 1.96 3.72 -1.26 -4.77 117.46 110.11 2g3m n PHE 473 Ca 0.25 -0.51 -0.38 0.00 -0.05 0.00 0.00 57.45 56.76 2g3m n PHE 473 Cb 0.84 -0.03 -0.00 0.00 -0.94 0.00 0.00 39.48 39.35 2g3m n PHE 473 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2g3m s PHE 474 N -1.05 2.84 0.16 1.38 0.08 0.12 -4.83 117.98 116.67 2g3m s PHE 474 Ca 0.25 1.48 -0.16 0.00 0.12 0.00 0.00 56.93 58.62 2g3m s PHE 474 Cb 0.13 -3.53 0.02 0.00 -0.57 0.00 0.00 43.02 39.08 2g3m s PHE 474 CO 0.16 -1.81 1.81 -1.35 -0.10 0.00 0.00 175.22 173.93 2g3m h PRO 475 N 2.33 0.53 -4.96 0.24 0.11 -1.84 -3.39 132.00 125.02 2g3m h PRO 475 Ca -0.49 -0.03 -0.64 0.00 0.11 0.00 0.00 66.00 64.94 2g3m h PRO 475 Cb 1.25 -0.12 -0.17 0.00 0.11 0.00 0.00 31.00 32.08 2g3m h PRO 475 CO 0.61 0.35 -0.39 0.12 -0.21 0.00 0.00 178.00 178.48 2g3m s PHE 476 N -6.16 3.23 -0.59 0.65 5.36 -0.55 -4.53 117.98 115.39 2g3m s PHE 476 Ca -0.13 0.14 0.02 0.00 -0.96 0.00 0.00 56.93 56.01 2g3m s PHE 476 Cb 0.11 -2.50 0.15 0.00 -0.34 0.00 0.00 43.02 40.44 2g3m s PHE 476 CO 0.72 -0.25 0.36 -0.47 -1.46 0.00 0.00 175.22 174.12 2g3m s TYR 477 N 1.89 3.31 -0.01 10.12 5.04 -1.26 -4.31 117.35 132.14 2g3m s TYR 477 Ca 0.10 -3.10 0.03 0.00 -2.44 0.00 0.00 57.07 51.66 2g3m s TYR 477 Cb -0.16 -2.90 -0.01 0.00 0.35 0.00 0.00 41.96 39.23 2g3m s TYR 477 CO 0.11 -0.73 -0.11 0.50 -1.34 0.00 0.00 175.55 173.97 2g3m s ARG 478 N -0.47 0.88 -0.23 4.97 3.52 -1.26 -1.27 118.95 125.09 2g3m s ARG 478 Ca 0.19 -0.40 -0.09 0.00 -0.13 0.00 0.00 55.73 55.29 2g3m s ARG 478 Cb -0.21 -0.85 -0.05 0.00 -1.56 0.00 0.00 34.95 32.28 2g3m s ARG 478 CO -0.04 0.23 0.13 0.45 -0.81 0.00 0.00 175.30 175.27 2g3m s SER 479 N -0.29 5.89 -0.01 -2.12 0.15 -0.49 -0.17 113.70 116.66 2g3m s SER 479 Ca 0.04 0.07 -0.03 0.00 0.70 0.00 0.00 55.95 56.73 2g3m s SER 479 Cb -0.04 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.21 2g3m s SER 479 CO -0.00 0.08 0.06 -2.28 1.20 0.00 0.00 173.24 172.30 2g3m s HIS 480 N 0.98 0.02 -0.01 3.44 5.04 -1.24 -0.18 115.29 123.33 2g3m s HIS 480 Ca 0.06 -0.02 -0.08 0.00 -1.54 0.00 0.00 55.06 53.48 2g3m s HIS 480 Cb -0.13 -0.04 0.01 0.00 0.04 0.00 0.00 32.58 32.46 2g3m s HIS 480 CO 0.04 -0.12 0.15 0.21 -2.34 0.00 0.00 174.74 172.68 2g3m s LYS 481 N -0.56 0.45 0.80 2.88 2.47 -1.25 -4.05 119.74 120.48 2g3m s LYS 481 Ca -0.06 -0.28 -0.11 0.00 -1.56 0.00 0.00 55.97 53.96 2g3m s LYS 481 Cb -0.04 0.19 0.07 0.00 -1.46 0.00 0.00 37.83 36.59 2g3m s LYS 481 CO 0.00 -0.10 1.09 0.00 0.16 0.00 0.00 175.35 176.50 2g3m s ALA 482 N -1.13 2.11 0.24 3.13 0.00 0.86 -1.10 121.76 125.85 2g3m s ALA 482 Ca -0.12 0.20 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 2g3m s ALA 482 Cb -0.06 -3.26 0.42 0.00 0.00 0.00 0.00 23.12 20.22 2g3m s ALA 482 CO 0.02 -1.89 1.72 1.15 0.00 0.00 0.00 175.76 176.75 2g3m h THR 483 N -1.22 0.63 -0.33 0.00 2.02 -1.63 -1.70 112.91 110.68 2g3m h THR 483 Ca -0.45 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.61 2g3m h THR 483 Cb 1.24 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2g3m h THR 483 CO 0.52 0.07 0.00 -0.90 0.37 0.00 0.00 175.52 175.58 2g3m n ASP 484 N -5.06 2.05 -4.89 4.18 5.75 -1.26 -4.91 116.55 112.42 2g3m n ASP 484 Ca 0.13 -2.07 -0.29 0.00 -0.01 0.00 0.00 54.79 52.54 2g3m n ASP 484 Cb 0.40 -0.29 -0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2g3m n ASP 484 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2g3m s GLY 485 N -0.89 1.64 0.88 6.12 0.00 -0.64 -3.78 107.32 110.64 2g3m s GLY 485 Ca 0.23 -0.28 -0.11 0.00 0.00 0.00 0.00 44.72 44.56 2g3m s GLY 485 CO 0.14 -0.07 1.10 -0.26 0.00 0.00 0.00 173.10 174.01 2g3m s ILE 486 N -2.85 2.71 -0.08 0.90 -4.36 -1.26 -4.92 121.20 111.34 2g3m s ILE 486 Ca 0.51 0.23 -0.30 0.00 -0.26 0.00 0.00 60.65 60.84 2g3m s ILE 486 Cb -0.11 -2.58 -0.04 0.00 1.25 0.00 0.00 42.46 40.99 2g3m s ILE 486 CO 0.46 -0.30 1.43 -1.81 0.24 0.00 0.00 174.94 174.95 2g3m s ASP 487 N -3.17 6.83 0.00 4.36 1.01 -1.26 -4.90 116.67 119.55 2g3m s ASP 487 Ca 0.64 1.98 0.19 0.00 0.71 0.00 0.00 52.55 56.06 2g3m s ASP 487 Cb -0.19 -2.54 0.28 0.00 1.01 0.00 0.00 42.92 41.47 2g3m s ASP 487 CO 0.57 -0.80 1.21 0.35 0.21 0.00 0.00 175.17 176.72 2g3m n THR 488 N 5.21 0.35 -1.85 -1.27 -2.24 -1.26 -4.93 114.28 108.30 2g3m n THR 488 Ca 0.15 -0.67 -0.41 0.00 -2.27 0.00 0.00 64.05 60.84 2g3m n THR 488 Cb 0.44 1.08 -0.01 0.00 -2.10 0.00 0.00 70.33 69.74 2g3m n THR 488 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2g3m s GLU 489 N -1.37 4.16 0.43 -0.78 8.01 -1.26 -4.87 118.70 123.02 2g3m s GLU 489 Ca 0.28 2.50 0.22 0.00 0.01 0.00 0.00 54.97 57.98 2g3m s GLU 489 Cb 0.17 -3.03 1.20 0.00 -4.31 0.00 0.00 34.13 28.16 2g3m s GLU 489 CO 0.25 -0.55 1.79 -1.35 0.01 0.00 0.00 175.26 175.41 2g3m h PRO 490 N 4.44 0.30 0.00 0.39 0.11 -1.97 -0.77 132.00 134.50 2g3m h PRO 490 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2g3m h PRO 490 Cb 1.22 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2g3m h PRO 490 CO 0.75 0.20 0.00 1.33 -0.21 0.00 0.00 178.00 180.07 2g3m n VAL 491 N -4.52 1.37 0.46 3.15 0.24 -1.26 -1.30 118.33 116.47 2g3m n VAL 491 Ca 0.24 0.43 0.11 0.00 -2.04 0.00 0.00 64.34 63.08 2g3m n VAL 491 Cb 0.92 -1.35 0.16 0.00 -1.47 0.00 0.00 33.84 32.10 2g3m n VAL 491 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2g3m n PHE 492 N -1.74 0.31 -3.34 6.34 3.72 -0.30 -4.96 117.46 117.49 2g3m n PHE 492 Ca 0.01 -0.17 -0.31 0.00 -0.05 0.00 0.00 57.45 56.92 2g3m n PHE 492 Cb 0.09 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.58 2g3m n PHE 492 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2g3m s LEU 493 N -1.52 4.12 0.65 4.37 1.43 -0.42 -5.05 118.68 122.25 2g3m s LEU 493 Ca 0.32 0.94 -0.18 0.00 -1.03 0.00 0.00 54.13 54.18 2g3m s LEU 493 Cb 0.20 -3.72 -0.01 0.00 0.03 0.00 0.00 46.19 42.69 2g3m s LEU 493 CO 0.28 -0.12 1.26 -2.84 0.23 0.00 0.00 176.35 175.16 2g3m s PRO 494 N -3.00 2.59 0.31 1.29 0.02 -1.26 -4.49 135.00 130.46 2g3m s PRO 494 Ca 0.48 1.96 0.04 0.00 0.02 0.00 0.00 61.00 63.50 2g3m s PRO 494 Cb -0.11 -1.86 0.79 0.00 0.02 0.00 0.00 34.50 33.34 2g3m s PRO 494 CO 0.23 -1.54 1.60 -0.44 -0.33 0.00 0.00 177.00 176.52 2g3m h ASP 495 N 0.51 -0.23 -0.36 2.53 3.32 -1.96 -0.30 116.42 119.92 2g3m h ASP 495 Ca -0.50 0.25 0.07 0.00 0.02 0.00 0.00 57.03 56.87 2g3m h ASP 495 Cb 1.32 0.39 -0.07 0.00 0.22 0.00 0.00 39.33 41.18 2g3m h ASP 495 CO 0.53 -0.29 -0.13 0.22 -1.72 0.00 0.00 179.24 177.85 2g3m h TYR 496 N 0.07 -0.31 0.09 4.55 3.20 -2.01 -0.84 116.97 121.73 2g3m h TYR 496 Ca 0.60 0.04 -0.25 0.00 3.14 0.00 0.00 58.73 62.26 2g3m h TYR 496 Cb 1.29 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.74 2g3m h TYR 496 CO -0.36 -0.20 -1.15 1.88 -1.64 0.00 0.00 178.16 176.68 2g3m h TYR 497 N -0.06 0.39 -0.80 -3.82 0.05 -1.58 -3.23 116.97 107.92 2g3m h TYR 497 Ca 0.18 -0.27 0.01 0.00 0.05 0.00 0.00 58.73 58.69 2g3m h TYR 497 Cb 0.33 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.01 2g3m h TYR 497 CO -0.36 1.20 0.53 -0.22 -1.05 0.00 0.00 178.16 178.25 2g3m h LYS 498 N 0.07 1.04 -0.64 4.88 3.64 -0.81 -2.15 116.57 122.60 2g3m h LYS 498 Ca -0.10 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.16 2g3m h LYS 498 Cb 1.88 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 33.44 2g3m h LYS 498 CO 0.18 0.69 0.18 0.93 -2.27 0.00 0.00 179.45 179.16 2g3m h GLU 499 N 1.07 1.00 -0.51 1.90 4.39 -1.23 -1.18 114.58 120.02 2g3m h GLU 499 Ca 0.29 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.74 2g3m h GLU 499 Cb -0.11 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.37 2g3m h GLU 499 CO -0.07 0.87 0.16 0.87 -1.16 0.00 0.00 179.01 179.68 2g3m h LYS 500 N 0.96 0.80 -0.37 2.33 1.57 -1.44 -1.33 116.57 119.08 2g3m h LYS 500 Ca 0.21 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2g3m h LYS 500 Cb 0.31 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.49 2g3m h LYS 500 CO -0.00 0.74 0.02 0.28 -0.57 0.00 0.00 179.45 179.92 2g3m h VAL 501 N 0.70 1.25 -0.48 0.50 2.07 -1.21 -2.21 116.25 116.88 2g3m h VAL 501 Ca 0.17 -0.94 0.08 0.00 0.82 0.00 0.00 66.70 66.83 2g3m h VAL 501 Cb 0.27 1.14 -0.06 0.00 -1.52 0.00 0.00 31.29 31.12 2g3m h VAL 501 CO -0.01 0.31 0.12 0.50 0.02 0.00 0.00 177.57 178.52 2g3m h LYS 502 N 0.46 0.26 -0.64 1.57 3.64 -1.01 -0.09 116.57 120.77 2g3m h LYS 502 Ca 0.11 -0.02 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 2g3m h LYS 502 Cb 0.42 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 2g3m h LYS 502 CO 0.01 0.17 0.08 0.93 -2.27 0.00 0.00 179.45 178.38 2g3m h GLU 503 N 0.27 1.06 -0.32 1.90 5.08 -1.12 -0.92 114.58 120.53 2g3m h GLU 503 Ca 0.24 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2g3m h GLU 503 Cb 0.29 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2g3m h GLU 503 CO -0.29 0.99 0.12 0.82 -1.00 0.00 0.00 179.01 179.65 2g3m h ILE 504 N 0.99 1.19 -0.69 3.13 2.04 -0.75 0.40 117.51 123.81 2g3m h ILE 504 Ca 0.19 -0.60 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 2g3m h ILE 504 Cb 0.46 0.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 2g3m h ILE 504 CO 0.02 0.21 0.27 0.58 0.00 0.00 0.00 178.15 179.23 2g3m h VAL 505 N 0.37 1.24 -0.59 1.67 2.07 -0.87 -0.88 116.25 119.26 2g3m h VAL 505 Ca 0.11 -0.77 -0.05 0.00 0.82 0.00 0.00 66.70 66.81 2g3m h VAL 505 Cb 0.21 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2g3m h VAL 505 CO -0.01 0.31 0.18 -0.33 0.02 0.00 0.00 177.57 177.74 2g3m h GLU 506 N 0.99 0.90 -0.37 1.57 5.08 -0.90 -1.80 114.58 120.06 2g3m h GLU 506 Ca 0.23 -0.17 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 2g3m h GLU 506 Cb 0.21 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.31 2g3m h GLU 506 CO -0.02 0.78 -0.12 1.25 -1.00 0.00 0.00 179.01 179.90 2g3m h LEU 507 N 0.87 0.63 -0.40 1.33 5.85 -0.30 -1.06 115.31 122.22 2g3m h LEU 507 Ca 0.20 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 2g3m h LEU 507 Cb 0.26 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2g3m h LEU 507 CO -0.01 0.77 0.10 -0.09 -0.34 0.00 0.00 178.44 178.87 2g3m h ARG 508 N 0.59 0.65 0.00 1.25 2.43 -0.46 -2.20 114.38 116.63 2g3m h ARG 508 Ca 0.10 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 59.07 2g3m h ARG 508 Cb 0.54 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2g3m h ARG 508 CO 0.03 0.67 -0.24 1.88 -1.51 0.00 0.00 179.97 180.80 2g3m h TYR 509 N 0.51 0.00 -0.35 2.20 0.05 -1.04 0.72 116.97 119.07 2g3m h TYR 509 Ca 0.13 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.81 2g3m h TYR 509 Cb 0.31 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.04 2g3m h TYR 509 CO 0.02 0.24 -0.17 -0.22 -1.05 0.00 0.00 178.16 176.98 2g3m h LYS 510 N 0.00 0.63 -0.02 4.88 3.64 -0.70 -2.79 116.57 122.22 2g3m h LYS 510 Ca -0.00 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2g3m h LYS 510 Cb 0.45 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 2g3m h LYS 510 CO 0.03 0.77 -0.11 1.19 -2.27 0.00 0.00 179.45 179.06 2g3m n PHE 511 N -4.15 0.00 -0.29 1.91 3.72 -0.71 -0.10 117.46 117.84 2g3m n PHE 511 Ca 0.01 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.48 2g3m n PHE 511 Cb 0.38 -0.03 0.22 0.00 -0.94 0.00 0.00 39.48 39.11 2g3m n PHE 511 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2g3m h LEU 512 N 2.60 0.47 -1.33 4.37 5.85 -0.59 -0.99 115.31 125.68 2g3m h LEU 512 Ca 0.00 0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.90 2g3m h LEU 512 Cb 0.63 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.64 2g3m h LEU 512 CO 0.00 0.19 0.51 -0.65 -0.34 0.00 0.00 178.44 178.14 2g3m h PRO 513 N 0.58 0.76 -0.04 5.25 0.11 -1.78 0.27 132.00 137.14 2g3m h PRO 513 Ca 0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.51 2g3m h PRO 513 Cb 0.68 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 2g3m h PRO 513 CO -0.38 0.50 -0.04 -0.92 -0.21 0.00 0.00 178.00 176.95 2g3m h TYR 514 N 0.78 0.13 -0.40 0.65 3.20 -1.06 -1.66 116.97 118.62 2g3m h TYR 514 Ca 0.34 -0.04 0.05 0.00 3.14 0.00 0.00 58.73 62.22 2g3m h TYR 514 Cb 0.33 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.53 2g3m h TYR 514 CO -0.00 0.57 0.14 0.82 -1.64 0.00 0.00 178.16 178.05 2g3m h ILE 515 N -0.36 0.88 -0.14 1.81 2.04 -0.64 -0.99 117.51 120.11 2g3m h ILE 515 Ca 0.01 -0.10 -0.07 0.00 1.00 0.00 0.00 64.86 65.69 2g3m h ILE 515 Cb 0.55 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 2g3m h ILE 515 CO 0.01 0.05 -0.22 0.22 0.00 0.00 0.00 178.15 178.21 2g3m h TYR 516 N 0.30 0.26 -0.59 1.37 3.20 -0.50 -0.70 116.97 120.31 2g3m h TYR 516 Ca 0.18 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.93 2g3m h TYR 516 Cb 0.16 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2g3m h TYR 516 CO -0.15 0.46 0.05 0.77 -1.64 0.00 0.00 178.16 177.65 2g3m h SER 517 N 0.22 0.95 0.38 -2.11 0.02 -0.41 -0.75 113.55 111.85 2g3m h SER 517 Ca 0.04 -0.23 -0.09 0.00 -0.84 0.00 0.00 61.79 60.67 2g3m h SER 517 Cb 0.52 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2g3m h SER 517 CO 0.04 0.97 -0.41 -0.07 -1.14 0.00 0.00 176.83 176.22 2g3m h LEU 518 N 0.92 0.04 -0.58 5.07 3.38 -0.45 -1.36 115.31 122.32 2g3m h LEU 518 Ca 0.18 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 2g3m h LEU 518 Cb 0.46 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2g3m h LEU 518 CO 0.02 0.44 0.05 0.00 0.09 0.00 0.00 178.44 179.05 2g3m h ALA 519 N 1.56 0.78 -0.46 1.53 0.00 -0.18 0.54 119.26 123.02 2g3m h ALA 519 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2g3m h ALA 519 Cb 0.74 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2g3m h ALA 519 CO 0.05 0.56 0.26 1.25 0.00 0.00 0.00 179.25 181.37 2g3m h LEU 520 N 0.88 0.57 -0.90 0.00 5.85 -0.60 -0.74 115.31 120.37 2g3m h LEU 520 Ca 0.17 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.86 2g3m h LEU 520 Cb 0.48 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2g3m h LEU 520 CO 0.02 0.49 0.57 -0.08 -0.34 0.00 0.00 178.44 179.10 2g3m h GLU 521 N 0.61 1.03 -0.50 1.25 4.81 -0.82 -1.04 114.58 119.91 2g3m h GLU 521 Ca 0.16 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.30 2g3m h GLU 521 Cb 0.04 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.17 2g3m h GLU 521 CO -0.03 0.68 0.18 0.00 -0.73 0.00 0.00 179.01 179.11 2g3m h ALA 522 N 1.40 0.65 0.00 2.92 0.00 -0.21 0.16 119.26 124.19 2g3m h ALA 522 Ca 0.38 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2g3m h ALA 522 Cb 0.12 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2g3m h ALA 522 CO -0.16 0.28 0.00 0.66 0.00 0.00 0.00 179.25 180.03 2g3m h SER 523 N 0.67 0.00 0.02 0.00 4.64 -0.40 0.50 113.55 118.97 2g3m h SER 523 Ca 0.16 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.09 2g3m h SER 523 Cb 0.23 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.26 2g3m h SER 523 CO -0.01 0.00 -2.25 -0.62 -0.87 0.00 0.00 176.83 173.08 2g3m n GLU 524 N -3.01 0.63 -0.00 4.77 1.02 -0.47 -4.44 120.64 119.14 2g3m n GLU 524 Ca 0.01 0.28 0.07 0.00 -0.02 0.00 0.00 57.16 57.50 2g3m n GLU 524 Cb 0.34 -1.57 -0.09 0.00 -0.02 0.00 0.00 31.44 30.10 2g3m n GLU 524 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2g3m n LYS 525 N -3.87 1.80 -1.16 3.49 4.01 0.53 -5.00 118.16 117.96 2g3m n LYS 525 Ca -0.45 -0.04 0.00 0.00 -0.51 0.00 0.00 58.31 57.30 2g3m n LYS 525 Cb 0.91 -1.21 0.00 0.00 -0.51 0.00 0.00 35.03 34.22 2g3m n LYS 525 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2g3m n GLY 526 N 1.45 0.43 3.76 0.72 0.00 0.17 -4.43 105.19 107.28 2g3m n GLY 526 Ca 0.01 -0.99 -0.39 0.00 0.00 0.00 0.00 46.02 44.65 2g3m n GLY 526 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2g3m s HIS 527 N -2.00 3.74 0.61 1.61 3.76 -1.26 -4.58 115.29 117.17 2g3m s HIS 527 Ca 0.00 1.38 -0.16 0.00 -0.15 0.00 0.00 55.06 56.13 2g3m s HIS 527 Cb 0.00 -2.72 -0.03 0.00 1.11 0.00 0.00 32.58 30.94 2g3m s HIS 527 CO 0.00 0.34 1.10 -1.25 -0.85 0.00 0.00 174.74 174.08 2g3m s PRO 528 N -0.26 3.10 -0.05 8.40 0.04 -1.26 -3.85 135.00 141.11 2g3m s PRO 528 Ca 0.35 1.40 -0.09 0.00 0.04 0.00 0.00 61.00 62.70 2g3m s PRO 528 Cb -0.20 -1.99 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 2g3m s PRO 528 CO 0.21 -1.02 0.41 0.28 0.04 0.00 0.00 177.00 176.92 2g3m h VAL 529 N 0.48 0.00 -3.03 -0.36 2.07 -1.85 -3.44 116.25 110.12 2g3m h VAL 529 Ca -0.48 -0.67 -0.61 0.00 0.82 0.00 0.00 66.70 65.77 2g3m h VAL 529 Cb 1.24 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.96 2g3m h VAL 529 CO 0.56 0.00 -0.24 0.27 0.02 0.00 0.00 177.57 178.18 2g3m s ILE 530 N -2.63 5.09 0.01 4.57 -4.36 -1.26 -0.36 121.20 122.25 2g3m s ILE 530 Ca -0.05 0.63 0.01 0.00 -0.26 0.00 0.00 60.65 60.98 2g3m s ILE 530 Cb 0.00 -3.66 -0.01 0.00 1.25 0.00 0.00 42.46 40.04 2g3m s ILE 530 CO 0.15 0.46 -0.03 -0.13 0.24 0.00 0.00 174.94 175.63 2g3m s ARG 531 N -1.42 0.22 0.65 0.37 0.52 0.11 -4.80 118.95 114.60 2g3m s ARG 531 Ca 0.27 -0.31 -0.15 0.00 -0.52 0.00 0.00 55.73 55.02 2g3m s ARG 531 Cb -0.15 -0.06 -0.00 0.00 0.52 0.00 0.00 34.95 35.25 2g3m s ARG 531 CO 0.15 0.01 1.10 -1.25 0.02 0.00 0.00 175.30 175.33 2g3m s PRO 532 N -0.66 2.85 0.35 3.54 0.04 -1.26 0.41 135.00 140.26 2g3m s PRO 532 Ca -0.06 1.37 0.08 0.00 0.04 0.00 0.00 61.00 62.43 2g3m s PRO 532 Cb -0.05 -1.96 0.78 0.00 0.04 0.00 0.00 34.50 33.32 2g3m s PRO 532 CO -0.00 -1.21 1.88 -0.07 0.04 0.00 0.00 177.00 177.63 2g3m h LEU 533 N 0.05 0.68 -0.14 -3.56 3.38 -1.83 -1.04 115.31 112.85 2g3m h LEU 533 Ca -0.47 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.54 2g3m h LEU 533 Cb 1.24 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2g3m h LEU 533 CO 0.54 0.36 0.00 2.22 0.09 0.00 0.00 178.44 181.66 2g3m n PHE 534 N -4.55 0.10 -0.11 1.13 1.16 -1.26 -1.80 117.46 112.13 2g3m n PHE 534 Ca 0.17 0.05 -0.13 0.00 -1.87 0.00 0.00 57.45 55.66 2g3m n PHE 534 Cb 0.42 -0.57 -0.03 0.00 -1.61 0.00 0.00 39.48 37.69 2g3m n PHE 534 CO 0.00 0.00 0.00 -0.92 -1.87 0.00 0.00 176.76 173.97 2g3m h TYR 535 N 0.00 0.99 0.00 2.97 5.03 -1.54 -1.10 116.97 123.33 2g3m h TYR 535 Ca 0.00 -0.30 -0.01 0.00 2.58 0.00 0.00 58.73 61.00 2g3m h TYR 535 Cb 0.12 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.19 2g3m h TYR 535 CO 0.00 1.09 -0.94 0.93 -1.32 0.00 0.00 178.16 177.92 2g3m h GLU 536 N 0.61 0.00 -1.95 1.82 4.39 -1.53 -3.40 114.58 114.52 2g3m h GLU 536 Ca 0.05 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.26 2g3m h GLU 536 Cb 0.92 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 29.17 2g3m h GLU 536 CO 0.08 0.02 -1.05 1.19 -1.16 0.00 0.00 179.01 178.09 2g3m n PHE 537 N -2.73 1.31 0.28 4.33 3.01 -0.75 -4.93 117.46 117.99 2g3m n PHE 537 Ca -0.00 -3.73 0.15 0.00 1.01 0.00 0.00 57.45 54.88 2g3m n PHE 537 Cb 0.56 -0.42 0.75 0.00 -0.01 0.00 0.00 39.48 40.36 2g3m n PHE 537 CO 0.00 0.00 0.00 -0.56 1.01 0.00 0.00 176.76 177.21 2g3m h GLN 538 N 2.98 0.00 -0.00 -1.08 3.07 -1.41 -2.55 115.11 116.13 2g3m h GLN 538 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.83 2g3m h GLN 538 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.44 2g3m h GLN 538 CO 0.59 0.00 -0.16 -0.40 0.09 0.00 0.00 178.83 178.95 2g3m n ASP 539 N -2.61 0.23 -4.34 0.06 5.75 -1.26 -4.66 116.55 109.71 2g3m n ASP 539 Ca -0.01 0.05 -0.42 0.00 -0.01 0.00 0.00 54.79 54.39 2g3m n ASP 539 Cb 0.13 -0.19 -0.09 0.00 -1.03 0.00 0.00 41.12 39.94 2g3m n ASP 539 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2g3m s ASP 540 N -2.87 5.92 0.49 -1.12 2.15 -0.96 -4.89 116.67 115.38 2g3m s ASP 540 Ca 0.17 -1.36 0.23 0.00 0.43 0.00 0.00 52.55 52.02 2g3m s ASP 540 Cb 0.19 -2.09 1.28 0.00 -0.30 0.00 0.00 42.92 42.00 2g3m s ASP 540 CO 0.56 -0.58 1.94 0.44 -0.17 0.00 0.00 175.17 177.37 2g3m h ASP 541 N 8.59 0.15 -0.77 -0.34 3.32 -1.86 -1.28 116.42 124.23 2g3m h ASP 541 Ca -0.26 0.01 0.10 0.00 0.02 0.00 0.00 57.03 56.90 2g3m h ASP 541 Cb 1.10 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.58 2g3m h ASP 541 CO 0.81 0.07 0.51 0.44 -1.72 0.00 0.00 179.24 179.35 2g3m h ASP 542 N 0.16 0.61 0.09 6.45 5.19 -1.94 -2.20 116.42 124.77 2g3m h ASP 542 Ca 0.34 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.76 2g3m h ASP 542 Cb 1.10 -0.11 -0.00 0.00 0.18 0.00 0.00 39.33 40.50 2g3m h ASP 542 CO -0.05 0.36 -0.02 0.24 -3.12 0.00 0.00 179.24 176.65 2g3m h MET 543 N 0.67 0.00 0.00 3.56 2.86 -1.54 -2.22 114.93 118.27 2g3m h MET 543 Ca 0.36 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.00 2g3m h MET 543 Cb 0.49 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.15 2g3m h MET 543 CO -0.13 0.02 0.00 0.66 1.06 0.00 0.00 176.91 178.51 2g3m n TYR 544 N -3.51 0.00 0.50 -0.22 4.02 -0.83 -2.96 117.16 114.16 2g3m n TYR 544 Ca -0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.92 2g3m n TYR 544 Cb 0.11 -0.15 -0.01 0.00 -0.02 0.00 0.00 39.34 39.26 2g3m n TYR 544 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2g3m n ARG 545 N -1.15 2.32 -3.06 -0.72 5.12 -0.83 -4.41 116.66 113.93 2g3m n ARG 545 Ca 0.18 -0.50 -0.42 0.00 -1.93 0.00 0.00 57.85 55.17 2g3m n ARG 545 Cb 0.17 -1.10 -0.06 0.00 -1.16 0.00 0.00 32.46 30.31 2g3m n ARG 545 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2g3m s ILE 546 N -1.60 4.80 0.00 0.55 1.09 -1.16 -4.87 121.20 120.01 2g3m s ILE 546 Ca 0.08 0.48 0.00 0.00 -1.10 0.00 0.00 60.65 60.11 2g3m s ILE 546 Cb 0.09 -4.18 0.00 0.00 -1.06 0.00 0.00 42.46 37.31 2g3m s ILE 546 CO 0.32 -0.49 0.22 -0.62 -0.10 0.00 0.00 174.94 174.27 2g3m n GLU 547 N 6.30 2.38 -0.94 2.79 1.02 -1.26 -4.63 120.64 126.31 2g3m n GLU 547 Ca 0.00 -0.22 0.01 0.00 -0.02 0.00 0.00 57.16 56.93 2g3m n GLU 547 Cb 0.48 -0.68 0.35 0.00 -0.02 0.00 0.00 31.44 31.58 2g3m n GLU 547 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2g3m n ASP 548 N -0.40 5.23 -3.97 1.62 5.68 -1.26 -4.71 116.55 118.73 2g3m n ASP 548 Ca 0.00 -3.08 -0.09 0.00 -0.50 0.00 0.00 54.79 51.11 2g3m n ASP 548 Cb 0.02 -0.71 -0.11 0.00 -1.14 0.00 0.00 41.12 39.19 2g3m n ASP 548 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 2g3m s GLU 549 N -2.89 0.34 0.00 0.11 2.02 -1.26 -3.87 118.70 113.15 2g3m s GLU 549 Ca 0.54 -0.60 -0.18 0.00 0.02 0.00 0.00 54.97 54.75 2g3m s GLU 549 Cb 0.43 0.12 0.03 0.00 0.10 0.00 0.00 34.13 34.81 2g3m s GLU 549 CO 0.14 -0.06 0.40 1.52 0.02 0.00 0.00 175.26 177.28 2g3m s TYR 550 N -1.51 -0.27 0.05 1.61 -0.85 -0.51 -4.51 117.35 111.35 2g3m s TYR 550 Ca -0.15 0.35 -0.14 0.00 -0.52 0.00 0.00 57.07 56.61 2g3m s TYR 550 Cb -0.09 0.18 -0.06 0.00 0.38 0.00 0.00 41.96 42.37 2g3m s TYR 550 CO -0.01 -0.49 0.44 -1.64 -1.52 0.00 0.00 175.55 172.33 2g3m s MET 551 N -1.79 3.92 -0.31 -3.49 -1.94 0.16 -1.14 119.30 114.72 2g3m s MET 551 Ca -0.10 0.40 -0.06 0.00 -1.71 0.00 0.00 55.69 54.22 2g3m s MET 551 Cb -0.03 -3.13 0.03 0.00 2.01 0.00 0.00 34.83 33.71 2g3m s MET 551 CO 0.02 0.63 0.07 0.08 -0.01 0.00 0.00 175.02 175.81 2g3m s VAL 552 N -1.21 3.71 0.00 -6.03 1.01 0.12 0.06 120.40 118.05 2g3m s VAL 552 Ca 0.28 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2g3m s VAL 552 Cb -0.16 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.23 2g3m s VAL 552 CO 0.16 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.85 2g3m n GLY 553 N 4.81 0.65 0.02 4.51 0.00 0.51 -2.70 105.19 112.98 2g3m n GLY 553 Ca -0.14 -0.82 0.11 0.00 0.00 0.00 0.00 46.02 45.18 2g3m n GLY 553 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2g3m n LYS 554 N 0.00 0.19 -0.06 1.61 4.81 -1.26 -4.59 118.16 118.86 2g3m n LYS 554 Ca 0.00 -0.01 -0.04 0.00 -0.87 0.00 0.00 58.31 57.39 2g3m n LYS 554 Cb 0.00 -1.55 -0.13 0.00 0.02 0.00 0.00 35.03 33.38 2g3m n LYS 554 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 2g3m n TYR 555 N -1.78 0.00 -4.15 5.64 4.01 -1.24 -4.89 117.16 114.75 2g3m n TYR 555 Ca 0.03 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.42 2g3m n TYR 555 Cb 0.40 -0.67 -0.10 0.00 -0.31 0.00 0.00 39.34 38.66 2g3m n TYR 555 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2g3m s LEU 556 N -4.90 3.68 -0.15 7.72 0.20 -1.10 -1.38 118.68 122.75 2g3m s LEU 556 Ca -0.07 0.06 -0.02 0.00 0.69 0.00 0.00 54.13 54.79 2g3m s LEU 556 Cb 0.06 -1.91 -0.01 0.00 -0.43 0.00 0.00 46.19 43.90 2g3m s LEU 556 CO 0.66 0.22 -0.10 -0.22 -0.29 0.00 0.00 176.35 176.61 2g3m s LEU 557 N 0.11 2.83 -0.11 -0.68 0.20 0.63 0.13 118.68 121.79 2g3m s LEU 557 Ca 0.03 -0.31 0.02 0.00 0.69 0.00 0.00 54.13 54.56 2g3m s LEU 557 Cb -0.13 -1.66 0.01 0.00 -0.43 0.00 0.00 46.19 43.98 2g3m s LEU 557 CO 0.01 0.12 -0.18 -0.47 -0.29 0.00 0.00 176.35 175.55 2g3m s TYR 558 N 0.60 2.22 -0.74 5.38 5.04 -0.29 -1.03 117.35 128.53 2g3m s TYR 558 Ca -0.06 -1.04 0.03 0.00 -2.44 0.00 0.00 57.07 53.56 2g3m s TYR 558 Cb -0.15 -1.55 0.18 0.00 0.35 0.00 0.00 41.96 40.79 2g3m s TYR 558 CO 0.03 -0.50 0.56 0.00 -1.34 0.00 0.00 175.55 174.30 2g3m s ALA 559 N 0.83 3.90 0.49 3.97 0.00 -0.57 -1.42 121.76 128.96 2g3m s ALA 559 Ca -0.09 -3.78 -0.24 0.00 0.00 0.00 0.00 51.96 47.85 2g3m s ALA 559 Cb -0.16 -2.38 -0.07 0.00 0.00 0.00 0.00 23.12 20.52 2g3m s ALA 559 CO 0.00 -2.11 1.40 -1.25 0.00 0.00 0.00 175.76 173.81 2g3m s PRO 560 N -1.30 3.45 -0.42 0.00 0.04 -1.25 -4.19 135.00 131.33 2g3m s PRO 560 Ca 0.25 2.35 -0.29 0.00 0.04 0.00 0.00 61.00 63.35 2g3m s PRO 560 Cb -0.07 -2.49 0.03 0.00 0.04 0.00 0.00 34.50 32.00 2g3m s PRO 560 CO -0.14 -0.98 1.10 0.42 0.04 0.00 0.00 177.00 177.44 2g3m s ILE 561 N -1.24 4.33 -0.26 0.56 1.01 -1.26 -4.85 121.20 119.48 2g3m s ILE 561 Ca 0.66 1.36 0.11 0.00 0.00 0.00 0.00 60.65 62.77 2g3m s ILE 561 Cb -0.43 -4.53 0.51 0.00 0.01 0.00 0.00 42.46 38.02 2g3m s ILE 561 CO 0.53 -0.82 1.45 1.33 0.00 0.00 0.00 174.94 177.43 2g3m n VAL 562 N 6.49 2.48 -4.39 2.92 0.24 -1.26 -4.92 118.33 119.89 2g3m n VAL 562 Ca 0.12 -2.55 -0.21 0.00 -2.04 0.00 0.00 64.34 59.66 2g3m n VAL 562 Cb 0.48 -0.31 -0.09 0.00 -1.47 0.00 0.00 33.84 32.46 2g3m n VAL 562 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2g3m s SER 563 N -2.42 1.97 0.20 -1.34 0.15 -1.26 -4.92 113.70 106.09 2g3m s SER 563 Ca 0.44 -1.58 0.25 0.00 0.70 0.00 0.00 55.95 55.77 2g3m s SER 563 Cb 0.39 0.37 0.67 0.00 -1.71 0.00 0.00 66.02 65.75 2g3m s SER 563 CO 0.02 -0.88 1.66 0.11 1.20 0.00 0.00 173.24 175.35 2g3m h LYS 564 N 2.08 0.00 -7.20 5.44 6.56 -1.98 -3.47 116.57 118.01 2g3m h LYS 564 Ca -0.34 0.00 -0.49 0.00 -1.06 0.00 0.00 60.65 58.75 2g3m h LYS 564 Cb 1.25 0.00 0.21 0.00 -0.57 0.00 0.00 32.23 33.12 2g3m h LYS 564 CO 0.55 0.00 0.10 0.39 -2.06 0.00 0.00 179.45 178.42 2g3m n GLU 565 N -2.29 -1.16 0.08 3.15 1.02 -1.26 -4.95 120.64 115.24 2g3m n GLU 565 Ca 0.05 -0.29 0.02 0.00 -0.02 0.00 0.00 57.16 56.92 2g3m n GLU 565 Cb 0.44 -2.28 -0.03 0.00 -0.02 0.00 0.00 31.44 29.55 2g3m n GLU 565 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2g3m h GLU 566 N -2.17 0.00 -3.98 3.49 5.08 -2.01 -3.47 114.58 111.52 2g3m h GLU 566 Ca -0.50 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 57.76 2g3m h GLU 566 Cb 1.29 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.40 2g3m h GLU 566 CO 0.43 0.34 -0.45 -1.54 -1.00 0.00 0.00 179.01 176.79 2g3m s SER 567 N -6.01 0.20 0.33 1.42 1.04 -1.26 -4.71 113.70 104.70 2g3m s SER 567 Ca 0.00 -0.82 0.04 0.00 0.48 0.00 0.00 55.95 55.65 2g3m s SER 567 Cb 0.08 0.32 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 2g3m s SER 567 CO 0.78 -0.73 0.17 0.00 0.98 0.00 0.00 173.24 174.44 2g3m s ARG 568 N -3.91 1.68 0.04 4.02 1.70 -1.26 -4.92 118.95 116.29 2g3m s ARG 568 Ca 0.10 -1.97 -0.18 0.00 -0.47 0.00 0.00 55.73 53.20 2g3m s ARG 568 Cb 0.05 -0.12 -0.06 0.00 -0.57 0.00 0.00 34.95 34.26 2g3m s ARG 568 CO -0.07 -0.49 0.53 -0.51 -1.08 0.00 0.00 175.30 173.68 2g3m s LEU 569 N -3.41 4.49 -0.11 -1.89 1.43 -1.26 -0.26 118.68 117.67 2g3m s LEU 569 Ca 0.34 1.16 0.03 0.00 -1.03 0.00 0.00 54.13 54.63 2g3m s LEU 569 Cb 0.04 -2.81 0.01 0.00 0.03 0.00 0.00 46.19 43.46 2g3m s LEU 569 CO 0.19 0.26 -0.21 -0.69 0.23 0.00 0.00 176.35 176.13 2g3m s VAL 570 N -0.91 1.86 -0.19 -1.59 1.01 0.27 -4.91 120.40 115.94 2g3m s VAL 570 Ca 0.28 -0.88 -0.16 0.00 0.00 0.00 0.00 61.98 61.21 2g3m s VAL 570 Cb -0.18 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 2g3m s VAL 570 CO 0.17 0.51 0.42 -0.89 0.00 0.00 0.00 175.10 175.32 2g3m s THR 571 N 0.62 5.19 -0.14 3.92 2.01 -1.26 -0.94 115.64 125.04 2g3m s THR 571 Ca -0.13 0.77 -0.03 0.00 0.31 0.00 0.00 61.69 62.61 2g3m s THR 571 Cb -0.17 -3.75 -0.03 0.00 0.01 0.00 0.00 72.50 68.56 2g3m s THR 571 CO 0.03 0.26 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.42 2g3m s LEU 572 N 1.22 3.26 1.10 4.42 1.43 -0.08 -5.00 118.68 125.03 2g3m s LEU 572 Ca 0.21 -0.10 -0.16 0.00 -1.03 0.00 0.00 54.13 53.04 2g3m s LEU 572 Cb -0.15 -1.77 0.24 0.00 0.03 0.00 0.00 46.19 44.54 2g3m s LEU 572 CO 0.08 0.21 1.12 -2.84 0.23 0.00 0.00 176.35 175.15 2g3m s PRO 573 N 0.15 -0.42 0.53 1.29 0.02 -1.26 -0.16 135.00 135.14 2g3m s PRO 573 Ca -0.01 0.13 -0.21 0.00 0.02 0.00 0.00 61.00 60.93 2g3m s PRO 573 Cb -0.14 -1.67 -0.08 0.00 0.02 0.00 0.00 34.50 32.64 2g3m s PRO 573 CO 0.03 -3.22 0.91 -2.13 -0.33 0.00 0.00 177.00 172.26 2g3m n ARG 574 N -4.45 1.02 0.00 5.54 0.63 -1.26 -1.26 116.66 116.88 2g3m n ARG 574 Ca 0.10 0.38 0.00 0.00 -0.92 0.00 0.00 57.85 57.41 2g3m n ARG 574 Cb 0.59 -2.05 0.00 0.00 0.45 0.00 0.00 32.46 31.45 2g3m n ARG 574 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2g3m n GLY 575 N 1.32 1.18 3.84 5.14 0.00 -1.26 -4.76 105.19 110.65 2g3m n GLY 575 Ca 0.12 -2.09 -0.37 0.00 0.00 0.00 0.00 46.02 43.68 2g3m n GLY 575 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g3m s LYS 576 N -1.59 3.97 -0.03 1.61 1.02 -1.26 0.34 119.74 123.80 2g3m s LYS 576 Ca 0.00 0.46 0.04 0.00 0.02 0.00 0.00 55.97 56.49 2g3m s LYS 576 Cb 0.00 -3.09 -0.00 0.00 -0.52 0.00 0.00 37.83 34.22 2g3m s LYS 576 CO 0.00 0.59 -0.15 -1.58 -0.92 0.00 0.00 175.35 173.29 2g3m s TRP 577 N -1.27 1.48 -0.27 3.18 0.52 0.57 -1.56 118.94 121.59 2g3m s TRP 577 Ca 0.31 -0.40 -0.09 0.00 0.02 0.00 0.00 56.10 55.94 2g3m s TRP 577 Cb -0.16 -1.00 -0.04 0.00 -1.15 0.00 0.00 33.47 31.12 2g3m s TRP 577 CO 0.17 -0.13 0.14 -0.47 0.02 0.00 0.00 176.95 176.68 2g3m s TYR 578 N 0.02 3.16 -0.45 -1.98 5.04 0.15 -0.28 117.35 123.00 2g3m s TYR 578 Ca -0.02 -0.16 -0.28 0.00 -2.44 0.00 0.00 57.07 54.17 2g3m s TYR 578 Cb -0.10 -2.32 -0.01 0.00 0.35 0.00 0.00 41.96 39.88 2g3m s TYR 578 CO 0.01 -0.27 1.69 1.21 -1.34 0.00 0.00 175.55 176.85 2g3m s ASN 579 N 1.69 5.85 0.38 4.32 3.84 0.73 -0.93 114.94 130.81 2g3m s ASN 579 Ca 0.07 0.81 0.14 0.00 0.21 0.00 0.00 52.86 54.09 2g3m s ASN 579 Cb -0.16 -2.53 0.99 0.00 -0.55 0.00 0.00 41.25 39.00 2g3m s ASN 579 CO 0.08 -1.83 1.81 0.22 -2.79 0.00 0.00 177.10 174.58 2g3m h TYR 580 N 12.75 0.73 0.04 0.43 3.20 -1.75 0.17 116.97 132.55 2g3m h TYR 580 Ca -0.29 0.02 -0.29 0.00 3.14 0.00 0.00 58.73 61.31 2g3m h TYR 580 Cb 1.14 -0.22 -0.03 0.00 1.54 0.00 0.00 36.73 39.16 2g3m h TYR 580 CO 0.99 0.15 -1.58 -1.49 -1.64 0.00 0.00 178.16 174.60 2g3m h TRP 581 N 0.51 0.16 -0.01 -3.82 4.06 -1.90 -3.40 115.95 111.56 2g3m h TRP 581 Ca 0.54 -0.12 0.00 0.00 2.06 0.00 0.00 58.89 61.37 2g3m h TRP 581 Cb 1.18 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 2g3m h TRP 581 CO -0.00 1.18 0.00 0.27 -3.56 0.00 0.00 178.44 176.33 2g3m n ASN 582 N -3.24 1.30 0.00 -3.49 0.23 -1.15 -5.02 115.26 103.88 2g3m n ASN 582 Ca -0.16 -1.17 0.00 0.00 -0.53 0.00 0.00 54.58 52.72 2g3m n ASN 582 Cb 1.03 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.73 2g3m n ASN 582 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2g3m n GLY 583 N 0.14 0.79 3.76 4.83 0.00 0.60 -4.54 105.19 110.76 2g3m n GLY 583 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2g3m n GLY 583 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2g3m s GLU 584 N -0.26 4.50 -0.21 1.61 2.12 -1.26 -4.42 118.70 120.79 2g3m s GLU 584 Ca 0.00 2.00 -0.05 0.00 0.36 0.00 0.00 54.97 57.28 2g3m s GLU 584 Cb 0.00 -3.14 -0.02 0.00 0.26 0.00 0.00 34.13 31.23 2g3m s GLU 584 CO 0.00 0.01 -0.00 0.42 -0.54 0.00 0.00 175.26 175.15 2g3m s ILE 585 N -1.08 3.87 0.07 -3.70 1.01 -1.26 -0.19 121.20 119.93 2g3m s ILE 585 Ca 0.47 -0.34 0.08 0.00 0.00 0.00 0.00 60.65 60.87 2g3m s ILE 585 Cb -0.36 -2.76 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 2g3m s ILE 585 CO 0.46 0.41 -0.20 -0.63 0.00 0.00 0.00 174.94 174.99 2g3m s ILE 586 N 1.19 2.69 -0.08 2.92 1.01 0.61 -4.92 121.20 124.62 2g3m s ILE 586 Ca 0.03 -1.36 -0.29 0.00 0.00 0.00 0.00 60.65 59.03 2g3m s ILE 586 Cb -0.14 -2.16 -0.02 0.00 0.01 0.00 0.00 42.46 40.15 2g3m s ILE 586 CO 0.01 0.24 0.99 0.20 0.00 0.00 0.00 174.94 176.38 2g3m s ASN 587 N -1.69 7.26 0.94 3.58 0.01 -1.26 -0.32 114.94 123.46 2g3m s ASN 587 Ca 0.15 1.54 -0.11 0.00 -0.71 0.00 0.00 52.86 53.74 2g3m s ASN 587 Cb -0.10 -2.55 0.13 0.00 0.41 0.00 0.00 41.25 39.14 2g3m s ASN 587 CO 0.06 -0.39 0.98 0.61 -1.51 0.00 0.00 177.10 176.86 2g3m n GLY 588 N 3.06 -0.81 2.10 0.66 0.00 1.06 -4.26 105.19 107.00 2g3m n GLY 588 Ca 0.08 -0.75 -0.05 0.00 0.00 0.00 0.00 46.02 45.30 2g3m n GLY 588 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2g3m n LYS 589 N -3.78 -0.76 -3.82 1.61 3.00 0.77 -4.44 118.16 110.74 2g3m n LYS 589 Ca 0.10 0.32 -0.07 0.00 -0.00 0.00 0.00 58.31 58.66 2g3m n LYS 589 Cb 0.53 -2.99 -0.02 0.00 0.00 0.00 0.00 35.03 32.54 2g3m n LYS 589 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2g3m s SER 590 N -3.11 -0.28 -0.15 3.14 1.04 -1.10 -4.99 113.70 108.25 2g3m s SER 590 Ca 0.15 -0.55 0.02 0.00 0.48 0.00 0.00 55.95 56.05 2g3m s SER 590 Cb -0.02 0.71 0.01 0.00 0.10 0.00 0.00 66.02 66.82 2g3m s SER 590 CO 0.25 -1.30 -0.20 -0.69 0.98 0.00 0.00 173.24 172.29 2g3m s VAL 591 N -3.88 1.94 0.30 5.02 1.01 -1.26 -0.90 120.40 122.64 2g3m s VAL 591 Ca 0.10 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.25 2g3m s VAL 591 Cb -0.05 -1.74 -0.06 0.00 0.00 0.00 0.00 36.38 34.52 2g3m s VAL 591 CO 0.05 0.53 -0.03 0.68 0.00 0.00 0.00 175.10 176.32 2g3m s VAL 592 N 1.04 1.64 -0.03 2.92 -7.23 -0.12 -4.90 120.40 113.72 2g3m s VAL 592 Ca -0.02 -2.10 -0.14 0.00 -1.81 0.00 0.00 61.98 57.91 2g3m s VAL 592 Cb -0.14 -2.58 -0.05 0.00 0.56 0.00 0.00 36.38 34.16 2g3m s VAL 592 CO -0.06 -0.21 0.37 -0.75 -0.31 0.00 0.00 175.10 174.14 2g3m s LYS 593 N -3.75 3.88 0.69 4.82 2.20 -1.26 0.97 119.74 127.30 2g3m s LYS 593 Ca 0.32 0.32 -0.15 0.00 -0.36 0.00 0.00 55.97 56.10 2g3m s LYS 593 Cb 0.05 -3.24 0.02 0.00 -1.51 0.00 0.00 37.83 33.15 2g3m s LYS 593 CO 0.13 0.66 1.14 -1.54 -0.36 0.00 0.00 175.35 175.38 2g3m s SER 594 N -0.92 4.78 0.00 1.43 1.04 0.64 -4.90 113.70 115.77 2g3m s SER 594 Ca 0.22 2.10 0.00 0.00 0.48 0.00 0.00 55.95 58.75 2g3m s SER 594 Cb -0.16 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.40 2g3m s SER 594 CO 0.11 -1.86 0.63 0.35 0.98 0.00 0.00 173.24 173.46 2g3m n THR 595 N -2.57 0.35 -3.93 2.02 -2.24 -1.26 -4.67 114.28 101.99 2g3m n THR 595 Ca 0.11 -0.60 -0.09 0.00 -2.27 0.00 0.00 64.05 61.20 2g3m n THR 595 Cb 0.51 0.91 -0.07 0.00 -2.10 0.00 0.00 70.33 69.59 2g3m n THR 595 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2g3m s HIS 596 N -0.35 0.32 0.32 4.78 2.46 -1.26 -5.04 115.29 116.52 2g3m s HIS 596 Ca 0.00 -0.69 0.25 0.00 0.47 0.00 0.00 55.06 55.09 2g3m s HIS 596 Cb 0.00 -0.03 1.22 0.00 -0.13 0.00 0.00 32.58 33.64 2g3m s HIS 596 CO 0.00 -0.70 1.97 0.93 -2.47 0.00 0.00 174.74 174.47 2g3m h GLU 597 N 2.55 0.00 -3.26 2.88 5.08 -1.98 -3.33 114.58 116.52 2g3m h GLU 597 Ca -0.32 0.00 -0.64 0.00 -1.00 0.00 0.00 59.36 57.40 2g3m h GLU 597 Cb 1.23 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.07 2g3m h GLU 597 CO 0.49 0.18 -0.57 -0.51 -1.00 0.00 0.00 179.01 177.60 2g3m s LEU 598 N -7.18 4.63 -0.78 1.33 1.43 -1.26 -4.49 118.68 112.35 2g3m s LEU 598 Ca -0.02 -3.39 -0.25 0.00 -1.03 0.00 0.00 54.13 49.44 2g3m s LEU 598 Cb 0.12 -1.66 -0.14 0.00 0.03 0.00 0.00 46.19 44.54 2g3m s LEU 598 CO 0.61 -0.17 2.41 -2.65 0.23 0.00 0.00 176.35 176.78 2g3m n PRO 599 N 2.61 0.57 -4.84 1.29 -0.02 -1.25 -4.94 135.00 128.41 2g3m n PRO 599 Ca 0.12 -0.76 -0.33 0.00 -2.02 0.00 0.00 63.50 60.51 2g3m n PRO 599 Cb 0.34 -3.57 -0.14 0.00 -0.02 0.00 0.00 33.50 30.12 2g3m n PRO 599 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2g3m s ILE 600 N 14.08 3.06 0.01 4.25 1.01 -1.26 -1.51 121.20 140.84 2g3m s ILE 600 Ca 0.95 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 60.92 2g3m s ILE 600 Cb -0.17 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 2g3m s ILE 600 CO 0.12 0.56 -0.05 -0.31 0.00 0.00 0.00 174.94 175.26 2g3m s TYR 601 N -0.30 0.44 -0.10 3.97 1.51 -0.20 -2.10 117.35 120.58 2g3m s TYR 601 Ca 0.02 -0.21 0.00 0.00 -1.01 0.00 0.00 57.07 55.87 2g3m s TYR 601 Cb -0.13 -0.28 -0.02 0.00 -0.11 0.00 0.00 41.96 41.42 2g3m s TYR 601 CO 0.03 -0.04 -0.09 -0.51 -1.11 0.00 0.00 175.55 173.82 2g3m s LEU 602 N -0.58 2.97 0.41 -1.29 1.43 -0.11 -0.27 118.68 121.24 2g3m s LEU 602 Ca -0.03 -0.16 -0.12 0.00 -1.03 0.00 0.00 54.13 52.79 2g3m s LEU 602 Cb -0.04 -1.66 -0.07 0.00 0.03 0.00 0.00 46.19 44.45 2g3m s LEU 602 CO -0.00 0.26 0.80 0.00 0.23 0.00 0.00 176.35 177.64 2g3m s ARG 603 N -0.23 3.84 -0.02 1.70 1.70 -0.48 0.30 118.95 125.76 2g3m s ARG 603 Ca 0.02 0.58 -0.31 0.00 -0.47 0.00 0.00 55.73 55.56 2g3m s ARG 603 Cb -0.13 -2.36 -0.09 0.00 -0.57 0.00 0.00 34.95 31.80 2g3m s ARG 603 CO 0.03 -0.04 2.00 -1.91 -1.08 0.00 0.00 175.30 174.30 2g3m n GLU 604 N -1.18 2.63 0.00 3.89 2.13 -0.60 -3.37 120.64 124.13 2g3m n GLU 604 Ca 0.03 0.94 0.00 0.00 0.66 0.00 0.00 57.16 58.79 2g3m n GLU 604 Cb 0.54 -2.98 0.00 0.00 0.27 0.00 0.00 31.44 29.27 2g3m n GLU 604 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2g3m n GLY 605 N 4.72 0.82 3.01 8.31 0.00 0.39 -4.85 105.19 117.59 2g3m n GLY 605 Ca 0.22 -0.80 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 2g3m n GLY 605 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2g3m s SER 606 N -1.70 0.62 -0.07 1.61 0.01 0.16 -4.76 113.70 109.57 2g3m s SER 606 Ca 0.00 -0.41 -0.01 0.00 1.31 0.00 0.00 55.95 56.84 2g3m s SER 606 Cb 0.00 0.02 0.03 0.00 0.21 0.00 0.00 66.02 66.28 2g3m s SER 606 CO 0.00 -0.15 0.00 -0.63 0.41 0.00 0.00 173.24 172.87 2g3m s ILE 607 N -1.03 0.35 -0.19 1.44 1.01 -1.26 -0.29 121.20 121.23 2g3m s ILE 607 Ca -0.08 0.12 -0.01 0.00 0.00 0.00 0.00 60.65 60.68 2g3m s ILE 607 Cb -0.08 -0.50 0.05 0.00 0.01 0.00 0.00 42.46 41.94 2g3m s ILE 607 CO -0.00 0.25 -0.03 -0.63 0.00 0.00 0.00 174.94 174.52 2g3m s ILE 608 N 1.86 1.07 0.17 2.92 1.01 0.01 -4.99 121.20 123.24 2g3m s ILE 608 Ca 0.03 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 59.64 2g3m s ILE 608 Cb -0.12 -1.34 -0.07 0.00 0.01 0.00 0.00 42.46 40.93 2g3m s ILE 608 CO -0.05 0.01 1.08 -2.84 0.00 0.00 0.00 174.94 173.14 2g3m s PRO 609 N 1.63 4.61 0.34 2.79 0.02 -1.26 -1.60 135.00 141.53 2g3m s PRO 609 Ca -0.01 1.68 0.07 0.00 0.02 0.00 0.00 61.00 62.76 2g3m s PRO 609 Cb -0.16 -3.29 -0.07 0.00 0.02 0.00 0.00 34.50 31.00 2g3m s PRO 609 CO -0.07 0.10 -0.04 -0.51 -0.33 0.00 0.00 177.00 176.15 2g3m s LEU 610 N -0.35 2.63 0.50 -5.54 1.43 -0.66 -2.84 118.68 113.84 2g3m s LEU 610 Ca 0.49 -1.26 -0.23 0.00 -1.03 0.00 0.00 54.13 52.11 2g3m s LEU 610 Cb -0.29 -0.80 -0.07 0.00 0.03 0.00 0.00 46.19 45.07 2g3m s LEU 610 CO 0.34 -0.35 1.22 1.21 0.23 0.00 0.00 176.35 179.01 2g3m n GLU 611 N -0.76 1.59 -2.20 1.70 2.13 0.85 -2.76 120.64 121.20 2g3m n GLU 611 Ca -0.05 0.58 -0.08 0.00 0.66 0.00 0.00 57.16 58.27 2g3m n GLU 611 Cb 0.65 -2.38 -0.00 0.00 0.27 0.00 0.00 31.44 29.97 2g3m n GLU 611 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2g3m n GLY 612 N 0.92 0.04 2.57 8.31 0.00 -1.26 -3.25 105.19 112.52 2g3m n GLY 612 Ca 0.10 -0.52 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 2g3m n GLY 612 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2g3m n ASP 613 N 0.36 -5.26 -4.75 1.61 8.00 -1.13 -4.46 116.55 110.92 2g3m n ASP 613 Ca -0.10 0.40 -0.30 0.00 0.71 0.00 0.00 54.79 55.50 2g3m n ASP 613 Cb 0.57 -4.19 0.11 0.00 -0.02 0.00 0.00 41.12 37.59 2g3m n ASP 613 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2g3m s GLU 614 N -3.35 1.85 -0.18 -1.24 2.02 -1.11 -2.30 118.70 114.39 2g3m s GLU 614 Ca 0.00 0.98 -0.09 0.00 0.02 0.00 0.00 54.97 55.88 2g3m s GLU 614 Cb 0.00 -1.86 0.06 0.00 0.10 0.00 0.00 34.13 32.43 2g3m s GLU 614 CO 0.00 -1.88 0.42 -1.17 0.02 0.00 0.00 175.26 172.65 2g3m s LEU 615 N -6.03 -0.19 -0.09 1.80 2.96 -0.35 -1.66 118.68 115.12 2g3m s LEU 615 Ca 0.62 0.92 0.00 0.00 -0.22 0.00 0.00 54.13 55.45 2g3m s LEU 615 Cb -0.17 1.38 -0.03 0.00 0.50 0.00 0.00 46.19 47.87 2g3m s LEU 615 CO 0.56 -0.20 -0.09 -0.63 -1.32 0.00 0.00 176.35 174.67 2g3m s ILE 616 N 1.56 3.47 -0.05 6.68 1.01 -0.63 -0.56 121.20 132.68 2g3m s ILE 616 Ca -0.09 -0.55 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2g3m s ILE 616 Cb -0.09 -2.44 0.03 0.00 0.01 0.00 0.00 42.46 39.97 2g3m s ILE 616 CO -0.13 0.56 -0.01 -0.69 0.00 0.00 0.00 174.94 174.67 2g3m s VAL 617 N -0.32 0.34 -0.28 2.92 1.01 -0.24 -0.81 120.40 123.01 2g3m s VAL 617 Ca 0.04 0.05 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 2g3m s VAL 617 Cb -0.13 -0.44 0.10 0.00 0.00 0.00 0.00 36.38 35.91 2g3m s VAL 617 CO 0.02 0.21 0.11 -0.47 0.00 0.00 0.00 175.10 174.98 2g3m s TYR 618 N 1.35 0.77 0.00 5.22 5.04 0.60 -2.14 117.35 128.19 2g3m s TYR 618 Ca -0.05 -1.10 0.00 0.00 -2.44 0.00 0.00 57.07 53.48 2g3m s TYR 618 Cb -0.13 -1.14 0.00 0.00 0.35 0.00 0.00 41.96 41.04 2g3m s TYR 618 CO -0.02 -0.81 0.00 0.41 -1.34 0.00 0.00 175.55 173.78 2g3m n GLY 619 N 5.12 -1.72 3.51 8.97 0.00 -1.26 0.15 105.19 119.96 2g3m n GLY 619 Ca -0.05 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 44.01 2g3m n GLY 619 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g3m s GLU 620 N 0.00 3.48 -0.05 1.61 2.02 -1.26 -4.63 118.70 119.86 2g3m s GLU 620 Ca 0.00 -0.53 -0.31 0.00 0.02 0.00 0.00 54.97 54.16 2g3m s GLU 620 Cb 0.00 -2.84 0.12 0.00 0.10 0.00 0.00 34.13 31.51 2g3m s GLU 620 CO 0.00 0.33 1.34 -0.08 0.02 0.00 0.00 175.26 176.88 2g3m s THR 621 N 0.11 0.00 0.10 3.63 -1.32 -1.06 -4.51 115.64 112.59 2g3m s THR 621 Ca -0.01 -0.11 0.09 0.00 -1.21 0.00 0.00 61.69 60.44 2g3m s THR 621 Cb -0.14 -2.43 -0.03 0.00 -1.51 0.00 0.00 72.50 68.39 2g3m s THR 621 CO 0.03 0.00 -0.23 -0.55 -2.21 0.00 0.00 174.62 171.66 2g3m s SER 622 N -3.38 2.84 -0.23 8.08 0.15 -1.26 -1.12 113.70 118.78 2g3m s SER 622 Ca 0.22 -0.67 -0.11 0.00 0.70 0.00 0.00 55.95 56.08 2g3m s SER 622 Cb 0.03 -0.19 0.08 0.00 -1.71 0.00 0.00 66.02 64.23 2g3m s SER 622 CO -0.04 0.13 0.54 0.12 1.20 0.00 0.00 173.24 175.19 2g3m s PHE 623 N -1.03 -0.87 -0.30 3.44 5.36 -0.08 -4.98 117.98 119.52 2g3m s PHE 623 Ca 0.10 1.73 -0.16 0.00 -0.96 0.00 0.00 56.93 57.64 2g3m s PHE 623 Cb -0.10 0.46 -0.02 0.00 -0.34 0.00 0.00 43.02 43.02 2g3m s PHE 623 CO 0.04 -0.46 0.43 0.21 -1.46 0.00 0.00 175.22 173.98 2g3m s LYS 624 N 1.80 3.87 0.66 10.12 2.20 -1.26 -0.38 119.74 136.74 2g3m s LYS 624 Ca -0.08 -0.03 -0.12 0.00 -0.36 0.00 0.00 55.97 55.37 2g3m s LYS 624 Cb -0.08 -3.71 -0.01 0.00 -1.51 0.00 0.00 37.83 32.52 2g3m s LYS 624 CO -0.16 -0.41 1.06 0.50 -0.36 0.00 0.00 175.35 175.98 2g3m s ARG 625 N 2.17 3.08 0.63 4.03 3.52 0.35 -4.88 118.95 127.86 2g3m s ARG 625 Ca 0.16 1.03 0.29 0.00 -0.13 0.00 0.00 55.73 57.08 2g3m s ARG 625 Cb -0.16 -2.01 1.57 0.00 -1.56 0.00 0.00 34.95 32.80 2g3m s ARG 625 CO 0.11 -0.99 1.93 0.10 -0.81 0.00 0.00 175.30 175.64 2g3m h TYR 626 N -0.33 0.00 -0.55 5.12 -0.00 -1.83 0.15 116.97 119.54 2g3m h TYR 626 Ca -0.45 0.00 -0.13 0.00 0.00 0.00 0.00 58.73 58.15 2g3m h TYR 626 Cb 1.21 0.00 -0.08 0.00 0.00 0.00 0.00 36.73 37.87 2g3m h TYR 626 CO 0.61 0.00 0.16 -0.40 -0.00 0.00 0.00 178.16 178.53 2g3m n ASP 627 N -3.33 4.31 0.00 0.10 5.75 -1.26 -4.90 116.55 117.22 2g3m n ASP 627 Ca 0.03 -2.88 0.00 0.00 -0.01 0.00 0.00 54.79 51.92 2g3m n ASP 627 Cb 0.49 -0.68 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 2g3m n ASP 627 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 2g3m n ASN 628 N 0.08 0.00 -4.65 -1.12 0.23 0.04 -4.99 115.26 104.85 2g3m n ASN 628 Ca 0.29 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.92 2g3m n ASN 628 Cb 1.12 -0.20 -0.03 0.00 -2.08 0.00 0.00 39.78 38.59 2g3m n ASN 628 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2g3m s ALA 629 N -2.24 3.47 -0.03 -2.53 0.00 -1.25 -4.70 121.76 114.49 2g3m s ALA 629 Ca 0.00 0.85 -0.15 0.00 0.00 0.00 0.00 51.96 52.66 2g3m s ALA 629 Cb 0.00 -3.80 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 2g3m s ALA 629 CO 0.00 -1.64 0.40 -1.21 0.00 0.00 0.00 175.76 173.31 2g3m s GLU 630 N 4.38 3.96 -0.15 0.00 2.02 -1.26 -0.49 118.70 127.16 2g3m s GLU 630 Ca 0.76 0.37 0.00 0.00 0.02 0.00 0.00 54.97 56.12 2g3m s GLU 630 Cb -0.32 -3.26 0.02 0.00 0.10 0.00 0.00 34.13 30.68 2g3m s GLU 630 CO 0.31 0.61 -0.15 0.42 0.02 0.00 0.00 175.26 176.47 2g3m s ILE 631 N -0.79 1.60 -0.11 -1.63 1.01 0.49 -0.81 121.20 120.97 2g3m s ILE 631 Ca 0.23 -0.65 0.02 0.00 0.00 0.00 0.00 60.65 60.25 2g3m s ILE 631 Cb -0.16 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 2g3m s ILE 631 CO 0.12 0.46 -0.19 -0.89 0.00 0.00 0.00 174.94 174.44 2g3m s THR 632 N 1.46 2.53 -0.08 2.92 2.01 -0.78 -0.90 115.64 122.79 2g3m s THR 632 Ca 0.05 -0.86 0.03 0.00 0.31 0.00 0.00 61.69 61.22 2g3m s THR 632 Cb -0.13 -2.01 -0.02 0.00 0.01 0.00 0.00 72.50 70.35 2g3m s THR 632 CO -0.11 0.55 -0.17 -0.94 -0.69 0.00 0.00 174.62 173.26 2g3m s SER 633 N 0.25 3.76 0.00 3.53 1.04 -0.27 0.06 113.70 122.06 2g3m s SER 633 Ca -0.13 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 55.97 2g3m s SER 633 Cb -0.16 -1.13 0.00 0.00 0.10 0.00 0.00 66.02 64.83 2g3m s SER 633 CO 0.07 0.25 0.00 -1.54 0.98 0.00 0.00 173.24 173.00 2g3m n SER 634 N 2.92 1.28 0.00 7.02 3.41 0.86 -2.55 113.62 126.56 2g3m n SER 634 Ca -0.18 -0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.26 2g3m n SER 634 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2g3m n SER 634 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2g3m n SER 635 N -0.30 0.00 -2.18 4.04 3.41 -1.26 -3.58 113.62 113.75 2g3m n SER 635 Ca 0.00 0.49 -0.06 0.00 -0.26 0.00 0.00 58.87 59.05 2g3m n SER 635 Cb 0.00 -0.15 0.05 0.00 -0.26 0.00 0.00 64.21 63.85 2g3m n SER 635 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2g3m n ASN 636 N -1.64 2.48 -3.79 4.04 3.02 -1.26 -5.04 115.26 113.07 2g3m n ASN 636 Ca 0.00 -2.71 -0.13 0.00 -0.03 0.00 0.00 54.58 51.72 2g3m n ASN 636 Cb 0.00 -0.42 -0.11 0.00 -0.61 0.00 0.00 39.78 38.64 2g3m n ASN 636 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2g3m s GLU 637 N -3.12 0.35 -0.19 3.52 2.12 -1.23 -1.12 118.70 119.02 2g3m s GLU 637 Ca 0.36 0.21 0.01 0.00 0.36 0.00 0.00 54.97 55.91 2g3m s GLU 637 Cb 0.36 0.16 0.04 0.00 0.26 0.00 0.00 34.13 34.95 2g3m s GLU 637 CO -0.04 -0.06 -0.11 0.42 -0.54 0.00 0.00 175.26 174.93 2g3m s ILE 638 N -0.18 1.67 0.19 -3.70 1.01 0.33 -0.10 121.20 120.42 2g3m s ILE 638 Ca -0.03 -0.98 0.03 0.00 0.00 0.00 0.00 60.65 59.67 2g3m s ILE 638 Cb -0.03 -1.71 -0.03 0.00 0.01 0.00 0.00 42.46 40.69 2g3m s ILE 638 CO 0.01 0.22 0.33 -0.54 0.00 0.00 0.00 174.94 174.96 2g3m s LYS 639 N 1.39 3.45 -0.06 2.79 1.02 0.11 -1.05 119.74 127.39 2g3m s LYS 639 Ca -0.00 -0.59 0.02 0.00 0.02 0.00 0.00 55.97 55.41 2g3m s LYS 639 Cb -0.16 -2.91 0.02 0.00 -0.52 0.00 0.00 37.83 34.26 2g3m s LYS 639 CO -0.09 0.46 -0.10 -0.06 -0.92 0.00 0.00 175.35 174.64 2g3m s PHE 640 N -1.85 1.29 0.52 3.18 0.40 0.12 -1.87 117.98 119.76 2g3m s PHE 640 Ca 0.35 -0.47 0.42 0.00 -0.60 0.00 0.00 56.93 56.63 2g3m s PHE 640 Cb -0.10 -0.98 2.16 0.00 0.51 0.00 0.00 43.02 44.61 2g3m s PHE 640 CO 0.29 -0.27 2.27 0.66 0.70 0.00 0.00 175.22 178.88 2g3m h SER 641 N 7.06 0.00 -5.03 1.36 4.64 -1.29 -3.44 113.55 116.86 2g3m h SER 641 Ca -0.32 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.06 2g3m h SER 641 Cb 1.18 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 2g3m h SER 641 CO 0.47 0.00 0.27 0.00 -0.87 0.00 0.00 176.83 176.70 2g3m s ARG 642 N -4.02 1.58 0.10 4.77 1.70 -1.26 -4.94 118.95 116.87 2g3m s ARG 642 Ca -0.03 -0.82 -0.31 0.00 -0.47 0.00 0.00 55.73 54.10 2g3m s ARG 642 Cb 0.12 0.57 -0.10 0.00 -0.57 0.00 0.00 34.95 34.97 2g3m s ARG 642 CO 0.44 -0.72 1.83 -2.00 -1.08 0.00 0.00 175.30 173.78 2g3m s GLU 643 N -3.78 4.14 0.02 3.89 2.12 -1.24 -4.82 118.70 119.05 2g3m s GLU 643 Ca 0.09 2.56 -0.04 0.00 0.36 0.00 0.00 54.97 57.94 2g3m s GLU 643 Cb -0.04 -3.72 -0.01 0.00 0.26 0.00 0.00 34.13 30.61 2g3m s GLU 643 CO 0.02 -0.85 0.06 0.96 -0.54 0.00 0.00 175.26 174.90 2g3m s ILE 644 N 3.11 0.12 0.12 -3.70 -4.36 -1.05 -4.92 121.20 110.52 2g3m s ILE 644 Ca 0.82 -0.99 -0.23 0.00 -0.26 0.00 0.00 60.65 59.98 2g3m s ILE 644 Cb -0.44 -0.63 -0.07 0.00 1.25 0.00 0.00 42.46 42.57 2g3m s ILE 644 CO 0.37 -0.55 0.70 -0.47 0.24 0.00 0.00 174.94 175.23 2g3m s TYR 645 N -2.04 3.85 -0.08 1.37 5.04 -1.26 -0.01 117.35 124.22 2g3m s TYR 645 Ca -0.10 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.01 2g3m s TYR 645 Cb -0.05 -2.67 0.02 0.00 0.35 0.00 0.00 41.96 39.61 2g3m s TYR 645 CO -0.02 0.52 -0.06 0.08 -1.34 0.00 0.00 175.55 174.72 2g3m s VAL 646 N -1.01 0.80 0.00 3.14 1.01 -0.07 -4.91 120.40 119.36 2g3m s VAL 646 Ca 0.33 -0.20 0.00 0.00 0.00 0.00 0.00 61.98 62.11 2g3m s VAL 646 Cb -0.21 -0.82 0.00 0.00 0.00 0.00 0.00 36.38 35.34 2g3m s VAL 646 CO 0.23 0.31 0.00 -1.54 0.00 0.00 0.00 175.10 174.10 2g3m n SER 647 N 4.53 0.00 -4.83 3.32 3.41 -0.97 -0.59 113.62 118.50 2g3m n SER 647 Ca -0.17 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.08 2g3m n SER 647 Cb 0.51 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.39 2g3m n SER 647 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2g3m s LYS 648 N 0.06 3.73 -0.15 4.33 2.20 -1.26 -1.18 119.74 127.47 2g3m s LYS 648 Ca 0.00 -0.06 0.01 0.00 -0.36 0.00 0.00 55.97 55.57 2g3m s LYS 648 Cb 0.00 -3.26 0.01 0.00 -1.51 0.00 0.00 37.83 33.06 2g3m s LYS 648 CO 0.00 0.62 -0.18 -1.17 -0.36 0.00 0.00 175.35 174.25 2g3m s LEU 649 N -0.61 2.29 -0.15 5.43 2.96 -0.46 -1.21 118.68 126.93 2g3m s LEU 649 Ca 0.15 -0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 2g3m s LEU 649 Cb -0.12 -1.51 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 2g3m s LEU 649 CO 0.04 0.07 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.18 2g3m s THR 650 N 0.90 3.57 -0.16 3.68 2.01 0.27 -0.98 115.64 124.93 2g3m s THR 650 Ca -0.04 -0.47 0.01 0.00 0.31 0.00 0.00 61.69 61.50 2g3m s THR 650 Cb -0.15 -2.55 0.02 0.00 0.01 0.00 0.00 72.50 69.83 2g3m s THR 650 CO -0.03 0.50 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.58 2g3m s ILE 651 N 0.41 1.94 -0.19 1.82 1.01 0.79 -1.07 121.20 125.90 2g3m s ILE 651 Ca -0.06 -0.88 -0.10 0.00 0.00 0.00 0.00 60.65 59.61 2g3m s ILE 651 Cb -0.15 -1.75 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 2g3m s ILE 651 CO 0.04 0.52 0.12 0.42 0.00 0.00 0.00 174.94 176.04 2g3m s THR 652 N 1.15 5.33 -0.21 2.92 -4.23 -0.91 -0.61 115.64 119.08 2g3m s THR 652 Ca 0.00 0.16 -0.27 0.00 -1.18 0.00 0.00 61.69 60.40 2g3m s THR 652 Cb -0.14 -3.42 0.09 0.00 1.34 0.00 0.00 72.50 70.37 2g3m s THR 652 CO -0.08 0.45 0.83 -0.55 -0.54 0.00 0.00 174.62 174.73 2g3m s SER 653 N 0.32 -0.60 0.30 3.99 0.15 0.92 -4.36 113.70 114.42 2g3m s SER 653 Ca 0.08 1.00 0.16 0.00 0.70 0.00 0.00 55.95 57.89 2g3m s SER 653 Cb -0.11 0.96 0.26 0.00 -1.71 0.00 0.00 66.02 65.42 2g3m s SER 653 CO -0.02 -0.31 1.53 -0.33 1.20 0.00 0.00 173.24 175.32 2g3m h GLU 654 N 4.04 0.00 -5.74 5.44 5.08 -1.98 -3.38 114.58 118.04 2g3m h GLU 654 Ca -0.27 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.51 2g3m h GLU 654 Cb 1.16 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.33 2g3m h GLU 654 CO 0.17 0.48 -0.19 0.15 -1.00 0.00 0.00 179.01 178.62 2g3m s LYS 655 N -3.15 4.24 0.37 2.33 1.02 -1.26 -4.97 119.74 118.32 2g3m s LYS 655 Ca 0.03 0.37 -0.27 0.00 0.02 0.00 0.00 55.97 56.12 2g3m s LYS 655 Cb 0.09 -3.39 -0.12 0.00 -0.52 0.00 0.00 37.83 33.89 2g3m s LYS 655 CO 0.73 0.28 1.18 -0.35 -0.92 0.00 0.00 175.35 176.27 2g3m n PRO 656 N 3.29 1.79 -4.82 -1.68 -0.04 -1.26 -5.01 135.00 127.26 2g3m n PRO 656 Ca -0.09 0.63 -0.31 0.00 -0.04 0.00 0.00 63.50 63.69 2g3m n PRO 656 Cb 0.52 -2.20 -0.17 0.00 -0.04 0.00 0.00 33.50 31.61 2g3m n PRO 656 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2g3m s VAL 657 N -1.15 1.86 -0.18 0.52 1.01 -1.26 -4.99 120.40 116.20 2g3m s VAL 657 Ca 0.59 -0.88 0.08 0.00 0.00 0.00 0.00 61.98 61.77 2g3m s VAL 657 Cb -0.57 -1.65 -0.17 0.00 0.00 0.00 0.00 36.38 33.99 2g3m s VAL 657 CO 0.60 0.51 -0.06 -1.54 0.00 0.00 0.00 175.10 174.61 2g3m n SER 658 N 3.88 1.65 -3.69 3.32 3.41 0.12 -4.88 113.62 117.43 2g3m n SER 658 Ca -0.20 -0.05 -0.08 0.00 -0.26 0.00 0.00 58.87 58.28 2g3m n SER 658 Cb 0.52 0.31 -0.02 0.00 -0.26 0.00 0.00 64.21 64.76 2g3m n SER 658 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2g3m s LYS 659 N -2.41 1.52 0.08 4.33 -2.85 -1.02 -3.08 119.74 116.31 2g3m s LYS 659 Ca -0.18 -0.75 0.06 0.00 -1.00 0.00 0.00 55.97 54.10 2g3m s LYS 659 Cb 0.06 0.57 -0.03 0.00 -2.06 0.00 0.00 37.83 36.37 2g3m s LYS 659 CO 0.58 -0.69 -0.17 0.96 0.10 0.00 0.00 175.35 176.13 2g3m s ILE 660 N -3.76 1.38 -0.16 3.79 -4.36 -0.94 0.32 121.20 117.47 2g3m s ILE 660 Ca 0.08 -1.36 0.00 0.00 -0.26 0.00 0.00 60.65 59.11 2g3m s ILE 660 Cb -0.04 -1.28 -0.00 0.00 1.25 0.00 0.00 42.46 42.39 2g3m s ILE 660 CO -0.01 -0.11 -0.15 -0.63 0.24 0.00 0.00 174.94 174.28 2g3m s ILE 661 N -1.15 2.64 -0.38 8.37 1.01 0.58 -0.93 121.20 131.35 2g3m s ILE 661 Ca 0.02 -0.78 -0.17 0.00 0.00 0.00 0.00 60.65 59.72 2g3m s ILE 661 Cb -0.10 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.26 2g3m s ILE 661 CO 0.03 0.52 0.45 -0.69 0.00 0.00 0.00 174.94 175.24 2g3m s VAL 662 N 0.83 5.08 -1.41 2.92 1.01 0.13 -0.81 120.40 128.14 2g3m s VAL 662 Ca -0.05 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 2g3m s VAL 662 Cb -0.15 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.29 2g3m s VAL 662 CO -0.00 -0.26 1.08 0.47 0.00 0.00 0.00 175.10 176.38 2g3m n ASP 663 N 5.61 -6.19 0.00 3.32 8.00 0.13 -2.56 116.55 124.87 2g3m n ASP 663 Ca -0.07 -0.52 0.00 0.00 0.71 0.00 0.00 54.79 54.91 2g3m n ASP 663 Cb 0.48 -4.89 0.00 0.00 -0.02 0.00 0.00 41.12 36.69 2g3m n ASP 663 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2g3m n ASP 664 N -2.92 0.00 0.00 -2.24 8.00 -1.26 -4.79 116.55 113.34 2g3m n ASP 664 Ca -0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.49 2g3m n ASP 664 Cb 0.57 -0.98 0.00 0.00 -0.02 0.00 0.00 41.12 40.68 2g3m n ASP 664 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2g3m n SER 665 N 0.00 0.00 -4.57 -2.24 3.41 -1.06 -5.04 113.62 104.12 2g3m n SER 665 Ca 0.00 0.00 -0.46 0.00 -0.26 0.00 0.00 58.87 58.15 2g3m n SER 665 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 2g3m n SER 665 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2g3m n LYS 666 N 0.00 1.19 -4.36 4.33 4.81 -1.22 -4.64 118.16 118.28 2g3m n LYS 666 Ca 0.00 0.42 -0.31 0.00 -0.87 0.00 0.00 58.31 57.55 2g3m n LYS 666 Cb 0.00 -1.81 -0.10 0.00 0.02 0.00 0.00 35.03 33.14 2g3m n LYS 666 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2g3m s GLU 667 N -1.06 2.43 -0.04 1.64 2.02 -1.26 0.17 118.70 122.60 2g3m s GLU 667 Ca 0.65 -0.82 0.02 0.00 0.02 0.00 0.00 54.97 54.83 2g3m s GLU 667 Cb -0.77 -2.45 0.01 0.00 0.10 0.00 0.00 34.13 31.02 2g3m s GLU 667 CO 0.57 0.57 -0.07 0.42 0.02 0.00 0.00 175.26 176.76 2g3m s ILE 668 N -1.10 0.70 0.23 -1.63 1.01 -0.10 -4.97 121.20 115.34 2g3m s ILE 668 Ca 0.19 -0.27 -0.30 0.00 0.00 0.00 0.00 60.65 60.28 2g3m s ILE 668 Cb -0.11 -0.66 -0.09 0.00 0.01 0.00 0.00 42.46 41.61 2g3m s ILE 668 CO 0.11 0.24 1.27 -1.10 0.00 0.00 0.00 174.94 175.45 2g3m s GLN 669 N 0.53 4.43 0.03 2.79 -1.52 -1.26 -2.23 119.66 122.43 2g3m s GLN 669 Ca -0.08 2.03 0.02 0.00 -1.95 0.00 0.00 55.36 55.38 2g3m s GLN 669 Cb -0.12 -3.18 -0.04 0.00 -0.22 0.00 0.00 33.01 29.46 2g3m s GLN 669 CO 0.01 -0.16 0.01 0.08 -0.25 0.00 0.00 175.29 174.99 2g3m s VAL 670 N -0.33 4.19 -0.13 1.09 1.01 -1.18 -4.51 120.40 120.55 2g3m s VAL 670 Ca 0.53 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2g3m s VAL 670 Cb -0.36 -2.92 0.01 0.00 0.00 0.00 0.00 36.38 33.11 2g3m s VAL 670 CO 0.41 0.28 -0.18 -0.70 0.00 0.00 0.00 175.10 174.92 2g3m s GLU 671 N -1.85 2.56 -0.57 2.72 2.12 0.12 -4.88 118.70 118.91 2g3m s GLU 671 Ca 0.22 -0.68 -0.28 0.00 0.36 0.00 0.00 54.97 54.59 2g3m s GLU 671 Cb -0.12 -2.15 0.03 0.00 0.26 0.00 0.00 34.13 32.16 2g3m s GLU 671 CO 0.14 -0.07 1.18 0.21 -0.54 0.00 0.00 175.26 176.17 2g3m s LYS 672 N 0.99 3.51 0.05 4.30 2.20 -1.26 -0.02 119.74 129.52 2g3m s LYS 672 Ca -0.05 0.24 -0.05 0.00 -0.36 0.00 0.00 55.97 55.75 2g3m s LYS 672 Cb -0.15 -4.01 -0.29 0.00 -1.51 0.00 0.00 37.83 31.87 2g3m s LYS 672 CO -0.03 -1.66 1.06 1.79 -0.36 0.00 0.00 175.35 176.14 2g3m h THR 673 N 6.15 1.39 -3.08 3.43 1.35 -1.69 -3.49 112.91 116.97 2g3m h THR 673 Ca -0.25 -2.97 0.04 0.00 -0.55 0.00 0.00 66.41 62.69 2g3m h THR 673 Cb 1.06 2.91 -0.05 0.00 -1.73 0.00 0.00 68.15 70.34 2g3m h THR 673 CO 1.18 0.87 0.19 0.00 -0.25 0.00 0.00 175.52 177.51 2g3m s MET 674 N -2.64 1.82 0.14 4.72 0.00 -1.23 -5.05 119.30 117.06 2g3m s MET 674 Ca -0.06 -1.08 -0.34 0.00 0.00 0.00 0.00 55.69 54.22 2g3m s MET 674 Cb 0.07 0.60 -0.17 0.00 0.00 0.00 0.00 34.83 35.33 2g3m s MET 674 CO 0.88 -0.83 1.07 0.00 0.00 0.00 0.00 175.02 176.14 2g3m n GLN 675 N -0.46 0.78 -0.53 3.16 10.64 -1.26 -0.38 117.38 129.32 2g3m n GLN 675 Ca -0.04 0.28 0.00 0.00 -1.83 0.00 0.00 57.00 55.41 2g3m n GLN 675 Cb 0.59 -1.72 0.00 0.00 -0.86 0.00 0.00 30.24 28.25 2g3m n GLN 675 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2g3m n ASN 676 N 1.94 0.00 -4.29 2.61 3.02 -1.26 -4.52 115.26 112.76 2g3m n ASN 676 Ca 0.17 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.37 2g3m n ASN 676 Cb 0.21 -2.12 -0.14 0.00 -0.61 0.00 0.00 39.78 37.12 2g3m n ASN 676 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2g3m s THR 677 N -1.39 3.21 -0.13 3.41 2.01 0.49 -0.06 115.64 123.18 2g3m s THR 677 Ca 0.00 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.47 2g3m s THR 677 Cb 0.00 -2.45 0.01 0.00 0.01 0.00 0.00 72.50 70.08 2g3m s THR 677 CO 0.00 0.44 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.87 2g3m s TYR 678 N 1.39 2.38 0.02 4.92 1.51 0.22 -1.66 117.35 126.13 2g3m s TYR 678 Ca 0.05 -1.18 0.02 0.00 -1.01 0.00 0.00 57.07 54.95 2g3m s TYR 678 Cb -0.14 -1.65 -0.04 0.00 -0.11 0.00 0.00 41.96 40.02 2g3m s TYR 678 CO -0.04 -0.57 -0.00 0.08 -1.11 0.00 0.00 175.55 173.91 2g3m s VAL 679 N 0.92 4.10 -0.07 0.71 1.01 0.97 -0.15 120.40 127.89 2g3m s VAL 679 Ca -0.06 -0.71 -0.02 0.00 0.00 0.00 0.00 61.98 61.18 2g3m s VAL 679 Cb -0.15 -2.86 0.04 0.00 0.00 0.00 0.00 36.38 33.40 2g3m s VAL 679 CO -0.02 0.31 0.06 0.00 0.00 0.00 0.00 175.10 175.44 2g3m s ALA 680 N -1.14 0.35 -0.77 5.51 0.00 -0.16 0.11 121.76 125.66 2g3m s ALA 680 Ca 0.21 0.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.98 2g3m s ALA 680 Cb -0.12 -0.72 0.06 0.00 0.00 0.00 0.00 23.12 22.35 2g3m s ALA 680 CO 0.12 -0.61 1.15 0.15 0.00 0.00 0.00 175.76 176.57 2g3m s LYS 681 N 2.13 3.27 -0.13 0.00 1.02 -1.26 -1.36 119.74 123.41 2g3m s LYS 681 Ca 0.04 -0.84 -0.22 0.00 0.02 0.00 0.00 55.97 54.98 2g3m s LYS 681 Cb -0.13 -4.48 -0.26 0.00 -0.52 0.00 0.00 37.83 32.45 2g3m s LYS 681 CO -0.04 -1.96 0.59 0.82 -0.92 0.00 0.00 175.35 173.83 2g3m h ILE 682 N 6.09 1.29 -7.01 2.17 2.04 -1.37 -3.49 117.51 117.23 2g3m h ILE 682 Ca -0.15 -2.36 -0.60 0.00 1.00 0.00 0.00 64.86 62.75 2g3m h ILE 682 Cb 1.05 2.86 -0.09 0.00 -0.74 0.00 0.00 36.82 39.91 2g3m h ILE 682 CO 1.24 0.59 -0.98 0.59 0.00 0.00 0.00 178.15 179.59 2g3m n ASN 683 N -4.26 -2.21 -3.62 1.72 3.02 0.25 -4.92 115.26 105.24 2g3m n ASN 683 Ca -0.21 -1.28 -0.03 0.00 -0.03 0.00 0.00 54.58 53.03 2g3m n ASN 683 Cb 0.72 -1.55 -0.00 0.00 -0.61 0.00 0.00 39.78 38.34 2g3m n ASN 683 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2g3m s GLN 684 N -7.41 1.22 0.36 3.52 -2.07 -0.78 -4.97 119.66 109.53 2g3m s GLN 684 Ca 0.31 -0.71 -0.21 0.00 -1.82 0.00 0.00 55.36 52.93 2g3m s GLN 684 Cb -0.17 0.39 -0.10 0.00 -1.09 0.00 0.00 33.01 32.03 2g3m s GLN 684 CO 0.96 -0.56 0.89 0.15 -1.32 0.00 0.00 175.29 175.41 2g3m s LYS 685 N -2.90 4.29 -0.26 9.60 1.02 -1.26 -0.89 119.74 129.34 2g3m s LYS 685 Ca 0.15 1.07 0.01 0.00 0.02 0.00 0.00 55.97 57.23 2g3m s LYS 685 Cb -0.01 -2.46 0.07 0.00 -0.52 0.00 0.00 37.83 34.90 2g3m s LYS 685 CO 0.03 0.13 -0.02 0.42 -0.92 0.00 0.00 175.35 174.99 2g3m s ILE 686 N -1.92 1.59 0.15 2.17 1.01 0.98 -4.93 121.20 120.24 2g3m s ILE 686 Ca 0.55 -1.43 -0.19 0.00 0.00 0.00 0.00 60.65 59.59 2g3m s ILE 686 Cb -0.13 -1.93 0.04 0.00 0.01 0.00 0.00 42.46 40.45 2g3m s ILE 686 CO 0.17 -0.24 1.68 0.03 0.00 0.00 0.00 174.94 176.58 2g3m h ARG 687 N 7.91 -0.04 0.00 2.79 3.08 -1.90 -2.80 114.38 123.43 2g3m h ARG 687 Ca -0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.90 2g3m h ARG 687 Cb 1.06 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.11 2g3m h ARG 687 CO 0.44 -0.02 0.00 0.41 -1.07 0.00 0.00 179.97 179.72 2g3m n GLY 688 N -1.27 0.00 3.69 0.04 0.00 -1.26 -3.61 105.19 102.77 2g3m n GLY 688 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 2g3m n GLY 688 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g3m s LYS 689 N -0.53 1.32 -0.01 1.61 -2.85 -1.26 -0.71 119.74 117.31 2g3m s LYS 689 Ca 0.00 -0.66 0.02 0.00 -1.00 0.00 0.00 55.97 54.32 2g3m s LYS 689 Cb 0.00 0.49 0.00 0.00 -2.06 0.00 0.00 37.83 36.26 2g3m s LYS 689 CO 0.00 -0.60 -0.05 0.42 0.10 0.00 0.00 175.35 175.22 2g3m s ILE 690 N -3.52 0.44 0.15 3.79 1.01 -0.22 -0.69 121.20 122.16 2g3m s ILE 690 Ca 0.09 -0.20 0.10 0.00 0.00 0.00 0.00 60.65 60.64 2g3m s ILE 690 Cb -0.03 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 42.01 2g3m s ILE 690 CO -0.01 0.14 -0.23 0.20 0.00 0.00 0.00 174.94 175.05 2g3m s ASN 691 N 0.11 3.55 -0.06 3.58 -0.87 0.01 -0.51 114.94 120.76 2g3m s ASN 691 Ca -0.01 -0.73 0.05 0.00 -1.57 0.00 0.00 52.86 50.60 2g3m s ASN 691 Cb -0.05 -0.34 -0.02 0.00 -0.02 0.00 0.00 41.25 40.82 2g3m s ASN 691 CO -0.00 0.16 -0.20 -0.76 -2.57 0.00 0.00 177.10 173.73 2g3m s LEU 692 N -2.32 2.39 0.00 0.60 1.02 -0.28 -0.30 118.68 119.79 2g3m s LEU 692 Ca 0.18 -0.36 0.04 0.00 0.02 0.00 0.00 54.13 54.00 2g3m s LEU 692 Cb -0.09 -1.46 0.03 0.00 0.02 0.00 0.00 46.19 44.68 2g3m s LEU 692 CO 0.09 0.28 0.63 -0.62 0.02 0.00 0.00 176.35 176.75