#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 1.60 -0.02 1.39 2.96 -1.26 -0.52 118.68 122.84 2g3m s LEU 4 Ca 0.00 -0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 53.71 2g3m s LEU 4 Cb 0.00 -0.60 0.02 0.00 0.50 0.00 0.00 46.19 46.11 2g3m s LEU 4 CO 0.00 0.02 0.03 -0.54 -1.32 0.00 0.00 176.35 174.54 2g3m s LYS 5 N 0.55 -0.01 -0.09 1.98 1.02 -0.79 -5.00 119.74 117.41 2g3m s LYS 5 Ca -0.09 0.14 0.02 0.00 0.02 0.00 0.00 55.97 56.06 2g3m s LYS 5 Cb -0.13 -0.16 0.01 0.00 -0.52 0.00 0.00 37.83 37.04 2g3m s LYS 5 CO 0.01 -0.11 -0.15 0.42 -0.92 0.00 0.00 175.35 174.60 2g3m s ILE 6 N 0.71 1.42 0.26 2.17 1.01 -1.26 -0.39 121.20 125.12 2g3m s ILE 6 Ca -0.06 -0.63 0.11 0.00 0.00 0.00 0.00 60.65 60.07 2g3m s ILE 6 Cb -0.08 -1.28 -0.05 0.00 0.01 0.00 0.00 42.46 41.06 2g3m s ILE 6 CO -0.02 0.42 -0.11 -0.31 0.00 0.00 0.00 174.94 174.92 2g3m s TYR 7 N 0.72 2.51 0.02 3.97 1.51 -0.31 -0.93 117.35 124.84 2g3m s TYR 7 Ca -0.13 -0.27 0.00 0.00 -1.01 0.00 0.00 57.07 55.67 2g3m s TYR 7 Cb -0.16 -1.12 -0.01 0.00 -0.11 0.00 0.00 41.96 40.55 2g3m s TYR 7 CO 0.03 0.64 -0.03 -2.00 -1.11 0.00 0.00 175.55 173.07 2g3m s GLU 8 N -3.43 0.27 -0.30 -0.62 -6.30 -0.02 -0.60 118.70 107.69 2g3m s GLU 8 Ca 0.29 -0.46 -0.17 0.00 -2.50 0.00 0.00 54.97 52.14 2g3m s GLU 8 Cb -0.06 -0.00 0.18 0.00 0.00 0.00 0.00 34.13 34.25 2g3m s GLU 8 CO 0.17 -0.02 1.16 1.21 0.02 0.00 0.00 175.26 177.81 2g3m s ASN 9 N -1.05 -0.25 -1.29 -1.70 3.04 -0.68 -3.73 114.94 109.27 2g3m s ASN 9 Ca -0.10 0.22 -0.04 0.00 0.04 0.00 0.00 52.86 52.98 2g3m s ASN 9 Cb -0.07 1.24 0.01 0.00 -1.54 0.00 0.00 41.25 40.89 2g3m s ASN 9 CO -0.01 -0.05 0.99 1.17 -3.04 0.00 0.00 177.10 176.17 2g3m n LYS 10 N 5.17 -6.56 -1.18 0.43 4.81 -1.26 -2.55 118.16 117.02 2g3m n LYS 10 Ca -0.08 0.78 -0.06 0.00 -0.87 0.00 0.00 58.31 58.08 2g3m n LYS 10 Cb 0.54 -5.71 -0.03 0.00 0.02 0.00 0.00 35.03 29.86 2g3m n LYS 10 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2g3m n GLY 11 N -1.49 0.84 3.06 3.14 0.00 -1.26 -4.96 105.19 104.52 2g3m n GLY 11 Ca -0.19 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 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 -2.18 1.58 -0.24 1.61 1.01 -1.06 -1.13 120.40 119.99 2g3m s VAL 12 Ca 0.00 -0.67 -0.08 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 34.90 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 1.11 3.18 -0.36 5.22 1.51 0.04 -1.69 117.35 126.36 2g3m s TYR 13 Ca -0.03 -0.10 -0.13 0.00 -1.01 0.00 0.00 57.07 55.80 2g3m s TYR 13 Cb -0.14 -2.23 -0.00 0.00 -0.11 0.00 0.00 41.96 39.48 2g3m s TYR 13 CO -0.04 -0.13 0.25 0.21 -1.11 0.00 0.00 175.55 174.73 2g3m s LYS 14 N 1.24 3.26 -0.27 -0.62 2.20 0.23 -0.80 119.74 124.97 2g3m s LYS 14 Ca 0.06 -0.81 -0.11 0.00 -0.36 0.00 0.00 55.97 54.75 2g3m s LYS 14 Cb -0.14 -3.84 -0.05 0.00 -1.51 0.00 0.00 37.83 32.28 2g3m s LYS 14 CO 0.05 -0.57 0.18 0.08 -0.36 0.00 0.00 175.35 174.73 2g3m s VAL 15 N 1.69 5.31 -0.20 4.02 1.01 0.15 -1.16 120.40 131.22 2g3m s VAL 15 Ca 0.05 0.17 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 2g3m s VAL 15 Cb -0.18 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 2g3m s VAL 15 CO 0.10 0.27 -0.02 -0.69 0.00 0.00 0.00 175.10 174.76 2g3m s VAL 16 N 1.62 3.77 -0.18 2.92 1.01 0.48 -1.38 120.40 128.63 2g3m s VAL 16 Ca 0.07 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.66 2g3m s VAL 16 Cb -0.15 -2.70 -0.01 0.00 0.00 0.00 0.00 36.38 33.52 2g3m s VAL 16 CO 0.10 0.43 -0.09 -0.63 0.00 0.00 0.00 175.10 174.91 2g3m s ILE 17 N 1.05 3.10 0.00 2.22 -1.09 0.05 -1.88 121.20 124.65 2g3m s ILE 17 Ca 0.01 -0.61 0.00 0.00 -2.23 0.00 0.00 60.65 57.83 2g3m s ILE 17 Cb -0.14 -2.36 0.00 0.00 -1.58 0.00 0.00 42.46 38.38 2g3m s ILE 17 CO 0.01 0.48 0.00 0.61 -1.23 0.00 0.00 174.94 174.81 2g3m n GLY 18 N 4.26 2.13 2.80 6.18 0.00 0.32 -1.89 105.19 118.99 2g3m n GLY 18 Ca -0.18 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.01 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 2.00 0.59 1.61 2.02 -1.26 -4.88 118.70 118.78 2g3m s GLU 19 Ca 0.00 -2.89 -0.19 0.00 0.02 0.00 0.00 54.97 51.91 2g3m s GLU 19 Cb 0.00 -2.95 -0.03 0.00 0.10 0.00 0.00 34.13 31.24 2g3m s GLU 19 CO 0.00 -1.26 1.25 -2.14 0.02 0.00 0.00 175.26 173.12 2g3m s PRO 20 N -0.84 2.95 -0.55 0.39 0.02 -1.26 -4.86 135.00 130.85 2g3m s PRO 20 Ca 0.24 1.94 0.04 0.00 0.02 0.00 0.00 61.00 63.24 2g3m s PRO 20 Cb -0.08 -1.99 0.16 0.00 0.02 0.00 0.00 34.50 32.61 2g3m s PRO 20 CO -0.13 -1.25 0.39 0.12 -0.33 0.00 0.00 177.00 175.80 2g3m s PHE 21 N -1.50 2.42 0.54 6.54 5.36 -1.26 -5.01 117.98 125.07 2g3m s PHE 21 Ca 0.77 -2.83 -0.20 0.00 -0.96 0.00 0.00 56.93 53.71 2g3m s PHE 21 Cb -0.33 -1.93 -0.07 0.00 -0.34 0.00 0.00 43.02 40.34 2g3m s PHE 21 CO 0.37 -0.69 0.90 -2.30 -1.46 0.00 0.00 175.22 172.04 2g3m n PRO 22 N 2.55 0.98 0.09 10.12 -0.02 -1.26 -4.89 135.00 142.57 2g3m n PRO 22 Ca 0.21 0.37 0.05 0.00 -2.02 0.00 0.00 63.50 62.11 2g3m n PRO 22 Cb 0.39 -2.05 0.49 0.00 -0.02 0.00 0.00 33.50 32.31 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 0.35 -2.50 0.52 0.11 -1.92 -3.43 132.00 125.91 2g3m h PRO 23 Ca -0.47 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 2g3m h PRO 23 Cb 1.36 -0.08 -0.20 0.00 0.11 0.00 0.00 31.00 32.20 2g3m h PRO 23 CO 0.52 0.25 -0.03 -1.50 -0.21 0.00 0.00 178.00 177.03 2g3m s ILE 24 N -5.29 0.03 -0.21 4.15 2.07 -1.26 -5.05 121.20 115.63 2g3m s ILE 24 Ca -0.07 -0.22 -0.10 0.00 -1.41 0.00 0.00 60.65 58.85 2g3m s ILE 24 Cb 0.17 -0.81 -0.05 0.00 0.13 0.00 0.00 42.46 41.90 2g3m s ILE 24 CO 0.71 -0.12 0.13 -1.61 -1.91 0.00 0.00 174.94 172.14 2g3m s GLU 25 N -1.21 4.09 -0.21 3.50 2.02 -1.26 -5.08 118.70 120.55 2g3m s GLU 25 Ca -0.12 -0.27 -0.09 0.00 0.02 0.00 0.00 54.97 54.51 2g3m s GLU 25 Cb -0.03 -3.43 -0.05 0.00 0.10 0.00 0.00 34.13 30.73 2g3m s GLU 25 CO 0.07 0.19 0.11 -0.06 0.02 0.00 0.00 175.26 175.59 2g3m s PHE 26 N 0.68 3.32 0.25 1.61 0.08 -1.26 -5.06 117.98 117.58 2g3m s PHE 26 Ca 0.07 0.18 -0.30 0.00 0.12 0.00 0.00 56.93 57.00 2g3m s PHE 26 Cb -0.12 -2.17 -0.10 0.00 -0.57 0.00 0.00 43.02 40.05 2g3m s PHE 26 CO 0.01 0.15 1.50 -2.14 -0.10 0.00 0.00 175.22 174.64 2g3m s PRO 27 N 0.63 4.22 -0.25 0.24 0.02 -1.26 -5.01 135.00 133.59 2g3m s PRO 27 Ca 0.06 2.38 -0.04 0.00 0.02 0.00 0.00 61.00 63.42 2g3m s PRO 27 Cb -0.12 -3.10 0.01 0.00 0.02 0.00 0.00 34.50 31.31 2g3m s PRO 27 CO 0.01 -0.50 -0.01 -0.51 -0.33 0.00 0.00 177.00 175.65 2g3m s LEU 28 N -0.15 3.26 0.24 -5.54 1.43 -1.26 -4.90 118.68 111.76 2g3m s LEU 28 Ca 0.62 -0.62 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 2g3m s LEU 28 Cb -0.44 -1.76 0.34 0.00 0.03 0.00 0.00 46.19 44.36 2g3m s LEU 28 CO 0.42 -0.10 1.59 -0.33 0.23 0.00 0.00 176.35 178.17 2g3m h GLU 29 N 8.12 -0.01 -1.77 1.70 5.08 -1.97 -3.37 114.58 122.36 2g3m h GLU 29 Ca -0.36 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 57.81 2g3m h GLU 29 Cb 1.14 0.00 -0.29 0.00 0.50 0.00 0.00 28.75 30.10 2g3m h GLU 29 CO 0.59 -0.00 -0.53 -0.65 -1.00 0.00 0.00 179.01 177.42 2g3m s GLN 30 N -6.23 0.39 -0.60 2.33 -0.21 -1.26 -5.09 119.66 108.98 2g3m s GLN 30 Ca -0.15 0.19 -0.27 0.00 0.02 0.00 0.00 55.36 55.16 2g3m s GLN 30 Cb 0.23 -0.36 -0.02 0.00 1.00 0.00 0.00 33.01 33.86 2g3m s GLN 30 CO 0.75 -0.96 1.82 0.15 -2.12 0.00 0.00 175.29 174.94 2g3m s LYS 31 N 2.53 2.71 -0.18 2.91 1.02 -1.26 -4.74 119.74 122.73 2g3m s LYS 31 Ca 0.10 0.60 -0.04 0.00 0.02 0.00 0.00 55.97 56.65 2g3m s LYS 31 Cb -0.13 -4.36 -0.02 0.00 -0.52 0.00 0.00 37.83 32.79 2g3m s LYS 31 CO -0.28 -2.64 -0.03 0.42 -0.92 0.00 0.00 175.35 171.90 2g3m s ILE 32 N 8.73 3.79 0.49 2.17 1.01 -1.24 -5.00 121.20 131.15 2g3m s ILE 32 Ca 0.66 -0.38 -0.23 0.00 0.00 0.00 0.00 60.65 60.70 2g3m s ILE 32 Cb -0.13 -2.69 -0.07 0.00 0.01 0.00 0.00 42.46 39.58 2g3m s ILE 32 CO 0.21 0.46 1.30 -1.20 0.00 0.00 0.00 174.94 175.71 2g3m n SER 33 N 4.01 2.57 -4.54 3.58 7.64 -1.26 -0.84 113.62 124.76 2g3m n SER 33 Ca -0.17 1.03 -0.24 0.00 1.01 0.00 0.00 58.87 60.50 2g3m n SER 33 Cb 0.52 -1.54 -0.09 0.00 -1.01 0.00 0.00 64.21 62.09 2g3m n SER 33 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2g3m s SER 34 N -0.74 4.01 0.00 6.43 0.15 -0.10 -4.66 113.70 118.79 2g3m s SER 34 Ca 0.67 -0.84 0.21 0.00 0.70 0.00 0.00 55.95 56.69 2g3m s SER 34 Cb -0.45 -0.54 -0.07 0.00 -1.71 0.00 0.00 66.02 63.24 2g3m s SER 34 CO 0.53 0.03 1.00 0.59 1.20 0.00 0.00 173.24 176.60 2g3m n ASN 35 N -0.65 1.69 -4.74 5.45 3.02 -1.26 -4.79 115.26 113.98 2g3m n ASN 35 Ca -0.06 -1.35 -0.42 0.00 -0.03 0.00 0.00 54.58 52.72 2g3m n ASN 35 Cb 0.59 0.63 -0.01 0.00 -0.61 0.00 0.00 39.78 40.38 2g3m n ASN 35 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2g3m n LYS 36 N -0.44 2.54 -3.70 3.52 4.76 -1.26 -5.00 118.16 118.57 2g3m n LYS 36 Ca 0.07 0.90 -0.21 0.00 -2.87 0.00 0.00 58.31 56.20 2g3m n LYS 36 Cb 0.41 -2.61 -0.03 0.00 -1.84 0.00 0.00 35.03 30.96 2g3m n LYS 36 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2g3m s SER 37 N 0.10 5.37 0.26 4.39 1.04 -1.26 -4.93 113.70 118.65 2g3m s SER 37 Ca 0.59 -0.48 -0.04 0.00 0.48 0.00 0.00 55.95 56.50 2g3m s SER 37 Cb -0.51 -0.94 0.37 0.00 0.10 0.00 0.00 66.02 65.03 2g3m s SER 37 CO 0.57 -0.42 1.88 -0.07 0.98 0.00 0.00 173.24 176.18 2g3m h LEU 38 N 1.15 1.00 -1.12 2.42 4.07 -1.95 -1.87 115.31 119.02 2g3m h LEU 38 Ca -0.44 0.01 -0.08 0.00 0.08 0.00 0.00 57.88 57.44 2g3m h LEU 38 Cb 1.26 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.77 2g3m h LEU 38 CO 0.57 0.65 -0.24 0.77 -1.08 0.00 0.00 178.44 179.11 2g3m h SER 39 N 1.15 0.32 0.68 -0.43 4.64 -1.95 0.20 113.55 118.15 2g3m h SER 39 Ca 0.41 -0.10 -0.08 0.00 -0.47 0.00 0.00 61.79 61.56 2g3m h SER 39 Cb 0.12 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2g3m h SER 39 CO -0.16 0.57 -0.36 -0.33 -0.87 0.00 0.00 176.83 175.67 2g3m h GLU 40 N 0.29 0.00 -0.00 4.77 5.08 -1.73 -0.81 114.58 122.17 2g3m h GLU 40 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2g3m h GLU 40 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 2g3m h GLU 40 CO 0.04 0.36 -0.25 1.28 -1.00 0.00 0.00 179.01 179.45 2g3m n LEU 41 N -3.67 0.69 -1.24 1.33 4.32 -0.69 -4.94 117.00 112.81 2g3m n LEU 41 Ca -0.01 -0.08 -0.11 0.00 -0.02 0.00 0.00 56.01 55.79 2g3m n LEU 41 Cb 0.47 -0.19 -0.01 0.00 -1.62 0.00 0.00 43.42 42.07 2g3m n LEU 41 CO 0.37 0.14 -0.14 0.61 -1.22 0.00 0.00 177.39 177.14 2g3m n GLY 42 N 1.37 -0.01 3.47 -0.72 0.00 0.11 -5.02 105.19 104.38 2g3m n GLY 42 Ca 0.11 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.14 2.63 -0.03 0.99 1.43 0.47 -4.35 118.68 116.67 2g3m s LEU 43 Ca 0.00 -0.65 0.04 0.00 -1.03 0.00 0.00 54.13 52.50 2g3m s LEU 43 Cb 0.00 -1.44 -0.01 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 0.00 176.35 175.68 2g3m s THR 44 N -1.30 1.35 -0.00 5.49 2.01 -0.53 -4.01 115.64 118.65 2g3m s THR 44 Ca 0.19 -0.69 0.05 0.00 0.31 0.00 0.00 61.69 61.54 2g3m s THR 44 Cb -0.10 -1.15 -0.01 0.00 0.01 0.00 0.00 72.50 71.25 2g3m s THR 44 CO 0.10 0.39 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.64 2g3m s ILE 45 N -0.11 1.14 -0.03 1.82 1.01 -1.26 -0.49 121.20 123.29 2g3m s ILE 45 Ca -0.00 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 59.96 2g3m s ILE 45 Cb -0.10 -0.97 0.03 0.00 0.01 0.00 0.00 42.46 41.43 2g3m s ILE 45 CO 0.01 0.26 -0.01 -0.69 0.00 0.00 0.00 174.94 174.51 2g3m s VAL 46 N -0.44 0.25 -0.25 2.92 1.01 -0.27 -4.99 120.40 118.63 2g3m s VAL 46 Ca 0.05 0.04 -0.08 0.00 0.00 0.00 0.00 61.98 61.99 2g3m s VAL 46 Cb -0.06 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 2g3m s VAL 46 CO -0.00 0.16 0.09 -1.10 0.00 0.00 0.00 175.10 174.25 2g3m s GLN 47 N 1.01 3.72 0.00 2.72 -0.21 -1.26 -0.83 119.66 124.80 2g3m s GLN 47 Ca -0.10 -0.44 0.00 0.00 0.02 0.00 0.00 55.36 54.84 2g3m s GLN 47 Cb -0.14 -3.38 0.00 0.00 1.00 0.00 0.00 33.01 30.50 2g3m s GLN 47 CO -0.01 -0.17 0.00 1.04 -2.12 0.00 0.00 175.29 174.03 2g3m n GLN 48 N 4.89 2.72 -1.74 2.91 6.02 0.23 -4.99 117.38 127.42 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 -0.56 -1.39 1.08 0.00 -1.26 -3.27 107.32 101.92 2g3m s GLY 49 Ca 0.00 -1.23 -0.08 0.00 0.00 0.00 0.00 44.72 43.41 2g3m s GLY 49 CO 0.00 4.01 0.55 0.70 0.00 0.00 0.00 173.10 178.36 2g3m n ASN 50 N 17.42 -4.68 -3.87 1.64 3.02 -1.26 -4.95 115.26 122.57 2g3m n ASN 50 Ca 0.44 -0.36 -0.11 0.00 -0.03 0.00 0.00 54.58 54.52 2g3m n ASN 50 Cb 0.45 -3.82 -0.11 0.00 -0.61 0.00 0.00 39.78 35.69 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 -5.90 0.40 -0.12 3.52 1.02 -1.19 -2.00 119.74 115.47 2g3m s LYS 51 Ca 0.37 -0.30 0.02 0.00 0.02 0.00 0.00 55.97 56.08 2g3m s LYS 51 Cb -0.18 0.17 0.01 0.00 -0.52 0.00 0.00 37.83 37.30 2g3m s LYS 51 CO 0.45 -0.09 -0.19 0.08 -0.92 0.00 0.00 175.35 174.69 2g3m s VAL 52 N -1.09 1.77 -0.19 3.17 1.01 -0.45 -0.60 120.40 124.03 2g3m s VAL 52 Ca -0.12 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.03 2g3m s VAL 52 Cb -0.06 -1.58 0.00 0.00 0.00 0.00 0.00 36.38 34.74 2g3m s VAL 52 CO 0.01 0.50 -0.13 -0.63 0.00 0.00 0.00 175.10 174.85 2g3m s ILE 53 N 0.81 2.71 -0.17 2.22 1.01 -0.01 -0.83 121.20 126.94 2g3m s ILE 53 Ca -0.09 -0.73 -0.02 0.00 0.00 0.00 0.00 60.65 59.82 2g3m s ILE 53 Cb -0.16 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.12 2g3m s ILE 53 CO 0.00 0.49 -0.08 -0.69 0.00 0.00 0.00 174.94 174.65 2g3m s VAL 54 N 1.26 3.26 0.02 2.92 1.01 0.28 -1.11 120.40 128.05 2g3m s VAL 54 Ca 0.03 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.53 2g3m s VAL 54 Cb -0.14 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 2g3m s VAL 54 CO -0.06 0.48 -0.22 -1.61 0.00 0.00 0.00 175.10 173.69 2g3m s GLU 55 N 0.84 2.02 0.02 2.72 2.02 0.36 -0.45 118.70 126.23 2g3m s GLU 55 Ca -0.03 -0.99 0.01 0.00 0.02 0.00 0.00 54.97 53.98 2g3m s GLU 55 Cb -0.15 -2.11 -0.02 0.00 0.10 0.00 0.00 34.13 31.95 2g3m s GLU 55 CO 0.01 0.54 -0.04 0.21 0.02 0.00 0.00 175.26 176.00 2g3m s LYS 56 N -1.18 0.34 0.77 1.61 2.20 -0.59 -1.46 119.74 121.43 2g3m s LYS 56 Ca 0.13 -0.57 -0.11 0.00 -0.36 0.00 0.00 55.97 55.05 2g3m s LYS 56 Cb -0.10 -0.03 0.05 0.00 -1.51 0.00 0.00 37.83 36.24 2g3m s LYS 56 CO 0.03 -0.01 1.09 -1.54 -0.36 0.00 0.00 175.35 174.55 2g3m s SER 57 N -1.28 4.75 -0.11 1.43 1.04 -1.26 -0.70 113.70 117.57 2g3m s SER 57 Ca -0.12 1.33 -0.03 0.00 0.48 0.00 0.00 55.95 57.61 2g3m s SER 57 Cb -0.09 -2.10 0.04 0.00 0.10 0.00 0.00 66.02 63.98 2g3m s SER 57 CO -0.01 -1.81 0.07 -0.22 0.98 0.00 0.00 173.24 172.26 2g3m s LEU 58 N -5.69 0.31 0.57 2.42 2.96 0.01 -4.54 118.68 114.72 2g3m s LEU 58 Ca 0.60 -0.28 -0.06 0.00 -0.22 0.00 0.00 54.13 54.16 2g3m s LEU 58 Cb -0.14 -0.23 -0.01 0.00 0.50 0.00 0.00 46.19 46.31 2g3m s LEU 58 CO 0.54 -0.29 0.89 -1.81 -1.32 0.00 0.00 176.35 174.36 2g3m s ASP 59 N 2.13 5.85 0.28 3.68 1.01 -1.26 -4.45 116.67 123.91 2g3m s ASP 59 Ca 0.03 0.87 -0.02 0.00 0.71 0.00 0.00 52.55 54.14 2g3m s ASP 59 Cb -0.14 -1.96 0.41 0.00 1.01 0.00 0.00 42.92 42.24 2g3m s ASP 59 CO -0.06 -0.91 1.91 -0.07 0.21 0.00 0.00 175.17 176.26 2g3m h LEU 60 N -0.09 1.02 -0.72 1.23 3.38 -1.99 -2.47 115.31 115.66 2g3m h LEU 60 Ca -0.46 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2g3m h LEU 60 Cb 1.23 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2g3m h LEU 60 CO 0.61 0.69 -0.28 0.29 0.09 0.00 0.00 178.44 179.84 2g3m n LYS 61 N -4.45 1.07 -2.12 1.13 4.76 -1.26 -4.94 118.16 112.35 2g3m n LYS 61 Ca 0.13 -0.72 -0.41 0.00 -2.87 0.00 0.00 58.31 54.44 2g3m n LYS 61 Cb 0.12 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 31.80 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 -2.43 4.35 -0.09 1.97 2.12 -0.93 -4.90 118.70 118.78 2g3m s GLU 62 Ca 0.24 2.20 -0.02 0.00 0.36 0.00 0.00 54.97 57.75 2g3m s GLU 62 Cb 0.19 -3.10 -0.03 0.00 0.26 0.00 0.00 34.13 31.45 2g3m s GLU 62 CO 0.51 -0.24 0.00 -1.01 -0.54 0.00 0.00 175.26 173.99 2g3m s HIS 63 N -0.71 3.17 -0.17 5.30 3.76 -0.77 -4.87 115.29 121.00 2g3m s HIS 63 Ca 0.52 0.18 0.01 0.00 -0.15 0.00 0.00 55.06 55.62 2g3m s HIS 63 Cb -0.40 -1.80 0.02 0.00 1.11 0.00 0.00 32.58 31.51 2g3m s HIS 63 CO 0.48 0.45 -0.16 0.42 -0.85 0.00 0.00 174.74 175.08 2g3m s ILE 64 N -0.82 1.79 0.28 0.60 -1.09 -1.26 -1.14 121.20 119.57 2g3m s ILE 64 Ca 0.12 -0.80 0.05 0.00 -2.23 0.00 0.00 60.65 57.80 2g3m s ILE 64 Cb -0.11 -1.66 -0.06 0.00 -1.58 0.00 0.00 42.46 39.04 2g3m s ILE 64 CO 0.02 0.47 -0.01 0.27 -1.23 0.00 0.00 174.94 174.46 2g3m s ILE 65 N 1.39 1.38 0.00 2.92 -4.36 -0.31 0.19 121.20 122.41 2g3m s ILE 65 Ca 0.04 -2.06 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 2g3m s ILE 65 Cb -0.13 -2.54 0.00 0.00 1.25 0.00 0.00 42.46 41.04 2g3m s ILE 65 CO -0.11 -0.21 0.00 0.61 0.24 0.00 0.00 174.94 175.46 2g3m n GLY 66 N -0.58 0.37 2.41 6.27 0.00 -1.26 0.09 105.19 112.49 2g3m n GLY 66 Ca -0.04 -1.82 -0.03 0.00 0.00 0.00 0.00 46.02 44.12 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 0.08 0.00 0.99 4.77 0.22 -4.86 117.00 118.19 2g3m n LEU 67 Ca 0.00 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2g3m n LEU 67 Cb 0.00 -1.50 0.00 0.00 -2.33 0.00 0.00 43.42 39.59 2g3m n LEU 67 CO 0.00 -0.48 0.00 0.61 -1.33 0.00 0.00 177.39 176.19 2g3m n GLY 68 N -1.34 2.97 3.56 -0.72 0.00 -1.25 -4.42 105.19 103.99 2g3m n GLY 68 Ca -0.03 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 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 2.97 -0.04 1.61 2.12 -1.26 -3.58 118.70 120.52 2g3m s GLU 69 Ca 0.00 -0.59 0.04 0.00 0.36 0.00 0.00 54.97 54.79 2g3m s GLU 69 Cb 0.00 -5.14 -0.00 0.00 0.26 0.00 0.00 34.13 29.24 2g3m s GLU 69 CO 0.00 -2.88 -0.18 0.15 -0.54 0.00 0.00 175.26 171.81 2g3m s LYS 70 N 6.20 1.81 -0.49 4.30 -0.14 -1.26 -4.56 119.74 125.59 2g3m s LYS 70 Ca 0.60 -0.62 -0.06 0.00 -1.36 0.00 0.00 55.97 54.53 2g3m s LYS 70 Cb -0.04 -1.57 -0.12 0.00 -1.68 0.00 0.00 37.83 34.41 2g3m s LYS 70 CO -0.03 0.26 3.20 0.00 -0.76 0.00 0.00 175.35 178.01 2g3m n ALA 71 N 3.11 6.63 -2.37 5.17 0.00 -1.26 -4.40 120.51 127.39 2g3m n ALA 71 Ca -0.18 -2.61 -0.13 0.00 0.00 0.00 0.00 53.44 50.52 2g3m n ALA 71 Cb 0.53 -2.48 -0.09 0.00 0.00 0.00 0.00 19.45 17.41 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 0.30 1.18 0.59 0.00 0.40 -1.26 -0.60 117.98 118.59 2g3m s PHE 72 Ca 0.64 -1.36 -0.19 0.00 -0.60 0.00 0.00 56.93 55.42 2g3m s PHE 72 Cb 0.30 -0.47 -0.04 0.00 0.51 0.00 0.00 43.02 43.32 2g3m s PHE 72 CO -0.08 -0.76 1.14 0.39 0.70 0.00 0.00 175.22 176.61 2g3m n GLU 73 N -0.37 1.14 -0.14 0.44 4.71 -1.26 -4.88 120.64 120.29 2g3m n GLU 73 Ca 0.03 0.44 0.06 0.00 -0.01 0.00 0.00 57.16 57.68 2g3m n GLU 73 Cb 0.65 -2.34 0.38 0.00 -1.01 0.00 0.00 31.44 29.11 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 0.75 0.60 -8.77 -4.62 4.07 -1.93 -3.35 115.31 102.07 2g3m h LEU 74 Ca -0.49 0.00 -0.60 0.00 0.08 0.00 0.00 57.88 56.87 2g3m h LEU 74 Cb 1.34 -0.13 -0.10 0.00 1.08 0.00 0.00 40.66 42.85 2g3m h LEU 74 CO 0.53 0.40 0.53 -0.62 -1.08 0.00 0.00 178.44 178.20 2g3m s ASP 75 N -6.30 6.58 0.00 -0.43 -1.08 -1.26 -4.41 116.67 109.77 2g3m s ASP 75 Ca -0.09 0.36 0.24 0.00 -0.52 0.00 0.00 52.55 52.53 2g3m s ASP 75 Cb 0.19 -2.44 1.26 0.00 -1.46 0.00 0.00 42.92 40.47 2g3m s ASP 75 CO 0.76 -0.89 1.78 0.54 0.52 0.00 0.00 175.17 177.89 2g3m n ARG 76 N 6.81 0.46 -1.49 4.34 5.12 0.13 -4.95 116.66 127.07 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 0.05 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 -1.20 0.59 -2.99 5.56 5.02 -1.26 -3.91 118.16 119.97 2g3m n LYS 77 Ca 0.13 0.24 -0.12 0.00 -2.02 0.00 0.00 58.31 56.54 2g3m n LYS 77 Cb 0.16 -1.87 0.05 0.00 -0.02 0.00 0.00 35.03 33.34 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 -0.49 -4.12 -3.58 1.97 5.12 0.14 -5.02 116.66 110.68 2g3m n ARG 78 Ca 0.12 0.46 -0.17 0.00 -1.93 0.00 0.00 57.85 56.34 2g3m n ARG 78 Cb 0.48 -4.35 -0.07 0.00 -1.16 0.00 0.00 32.46 27.36 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 -5.38 0.94 -0.41 5.56 2.47 -1.08 -4.87 119.74 116.98 2g3m s LYS 79 Ca 0.21 0.30 -0.09 0.00 -1.56 0.00 0.00 55.97 54.83 2g3m s LYS 79 Cb -0.09 0.44 0.07 0.00 -1.46 0.00 0.00 37.83 36.79 2g3m s LYS 79 CO 0.40 -0.26 0.24 0.50 0.16 0.00 0.00 175.35 176.39 2g3m s ARG 80 N -0.94 2.61 0.03 4.03 3.52 -1.26 -1.08 118.95 125.86 2g3m s ARG 80 Ca -0.09 -1.42 -0.14 0.00 -0.13 0.00 0.00 55.73 53.95 2g3m s ARG 80 Cb -0.02 -3.75 -0.06 0.00 -1.56 0.00 0.00 34.95 29.57 2g3m s ARG 80 CO 0.07 -0.91 0.43 0.71 -0.81 0.00 0.00 175.30 174.79 2g3m s TYR 81 N 1.43 3.70 -0.16 5.12 1.51 0.87 -4.92 117.35 124.90 2g3m s TYR 81 Ca 0.03 0.98 -0.05 0.00 -1.01 0.00 0.00 57.07 57.03 2g3m s TYR 81 Cb -0.22 -2.29 -0.03 0.00 -0.11 0.00 0.00 41.96 39.31 2g3m s TYR 81 CO 0.02 0.60 -0.01 0.08 -1.11 0.00 0.00 175.55 175.13 2g3m s VAL 82 N -1.16 4.10 -0.69 0.71 1.01 -1.26 -0.95 120.40 122.15 2g3m s VAL 82 Ca 0.27 -0.28 -0.12 0.00 0.00 0.00 0.00 61.98 61.84 2g3m s VAL 82 Cb -0.16 -2.81 0.18 0.00 0.00 0.00 0.00 36.38 33.59 2g3m s VAL 82 CO 0.15 0.48 0.61 -0.32 0.00 0.00 0.00 175.10 176.03 2g3m s MET 83 N 0.37 3.19 -0.28 2.72 1.75 -0.09 -4.49 119.30 122.48 2g3m s MET 83 Ca -0.02 -2.22 -0.01 0.00 -1.25 0.00 0.00 55.69 52.19 2g3m s MET 83 Cb -0.14 -4.24 0.17 0.00 2.84 0.00 0.00 34.83 33.46 2g3m s MET 83 CO 0.02 -1.27 0.50 -0.47 -0.65 0.00 0.00 175.02 173.15 2g3m s TYR 84 N 0.59 -1.29 0.13 4.11 5.04 -1.26 -3.46 117.35 121.21 2g3m s TYR 84 Ca 0.13 1.18 -0.35 0.00 -2.44 0.00 0.00 57.07 55.59 2g3m s TYR 84 Cb -0.18 0.27 -0.15 0.00 0.35 0.00 0.00 41.96 42.25 2g3m s TYR 84 CO -0.05 -0.86 1.46 0.09 -1.34 0.00 0.00 175.55 174.86 2g3m n ASN 85 N 5.40 2.41 -3.63 4.32 3.02 -1.26 -4.54 115.26 120.98 2g3m n ASN 85 Ca -0.01 1.10 -0.15 0.00 -0.03 0.00 0.00 54.58 55.49 2g3m n ASN 85 Cb 0.51 -1.32 -0.07 0.00 -0.61 0.00 0.00 39.78 38.28 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 0.67 0.02 -0.57 2.41 0.11 -0.69 -4.82 120.40 117.53 2g3m s VAL 86 Ca 0.81 -0.14 -0.27 0.00 -2.93 0.00 0.00 61.98 59.44 2g3m s VAL 86 Cb -0.80 -0.83 -0.01 0.00 -1.53 0.00 0.00 36.38 33.21 2g3m s VAL 86 CO 0.42 -0.08 1.66 -0.62 -3.33 0.00 0.00 175.10 173.16 2g3m s ASP 87 N -0.85 5.70 0.00 3.54 -1.08 -1.26 -3.28 116.67 119.44 2g3m s ASP 87 Ca -0.09 0.39 0.19 0.00 -0.52 0.00 0.00 52.55 52.52 2g3m s ASP 87 Cb -0.03 -2.54 0.95 0.00 -1.46 0.00 0.00 42.92 39.84 2g3m s ASP 87 CO 0.06 -2.03 1.61 0.00 0.52 0.00 0.00 175.17 175.33 2g3m n ALA 88 N 11.12 2.00 -0.83 3.66 0.00 -1.26 -4.86 120.51 130.33 2g3m n ALA 88 Ca 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2g3m n ALA 88 Cb 0.50 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.64 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 0.40 1.45 3.12 0.00 0.00 -1.26 -3.41 105.19 105.49 2g3m n GLY 89 Ca 0.08 -0.60 -0.43 0.00 0.00 0.00 0.00 46.02 45.07 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 6.45 4.65 -1.75 4.61 0.00 -1.26 -4.64 120.51 128.56 2g3m n ALA 90 Ca 0.00 -3.94 -0.37 0.00 0.00 0.00 0.00 53.44 49.13 2g3m n ALA 90 Cb 0.00 -3.48 0.04 0.00 0.00 0.00 0.00 19.45 16.01 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 3.21 2.32 0.45 0.00 -0.85 -1.22 -5.01 117.35 116.25 2g3m s TYR 91 Ca 0.49 1.47 0.05 0.00 -0.52 0.00 0.00 57.07 58.55 2g3m s TYR 91 Cb 0.09 -3.62 -0.05 0.00 0.38 0.00 0.00 41.96 38.75 2g3m s TYR 91 CO -0.01 -2.53 0.01 0.15 -1.52 0.00 0.00 175.55 171.65 2g3m s LYS 92 N -3.17 2.05 0.59 -3.49 1.02 -1.26 -4.65 119.74 110.83 2g3m s LYS 92 Ca 0.76 -2.22 -0.18 0.00 0.02 0.00 0.00 55.97 54.36 2g3m s LYS 92 Cb -0.35 -1.61 -0.03 0.00 -0.52 0.00 0.00 37.83 35.32 2g3m s LYS 92 CO 0.39 -0.17 1.12 -1.59 -0.92 0.00 0.00 175.35 174.18 2g3m s LYS 93 N -3.78 3.11 -0.04 1.68 -2.85 -1.26 -2.81 119.74 113.80 2g3m s LYS 93 Ca 0.24 1.53 0.00 0.00 -1.00 0.00 0.00 55.97 56.74 2g3m s LYS 93 Cb 0.07 -1.98 0.00 0.00 -2.06 0.00 0.00 37.83 33.86 2g3m s LYS 93 CO 0.12 -1.03 0.00 0.66 0.10 0.00 0.00 175.35 175.21 2g3m n TYR 94 N -1.77 0.00 -3.15 1.78 4.01 0.24 -5.00 117.16 113.27 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 -0.68 -0.06 0.00 -0.31 0.00 0.00 39.34 38.80 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 -0.74 4.36 -0.13 -0.72 0.74 -1.12 -5.01 119.66 117.04 2g3m s GLN 95 Ca 0.00 0.91 -0.17 0.00 0.05 0.00 0.00 55.36 56.15 2g3m s GLN 95 Cb 0.00 -3.26 0.04 0.00 1.10 0.00 0.00 33.01 30.89 2g3m s GLN 95 CO 0.00 0.58 0.44 0.34 -0.55 0.00 0.00 175.29 176.10 2g3m s ASP 96 N -1.01 -0.43 0.83 6.67 2.15 -1.26 -4.23 116.67 119.38 2g3m s ASP 96 Ca 0.32 0.74 -0.06 0.00 0.43 0.00 0.00 52.55 53.98 2g3m s ASP 96 Cb -0.21 0.78 0.17 0.00 -0.30 0.00 0.00 42.92 43.36 2g3m s ASP 96 CO 0.22 -0.25 1.14 -2.16 -0.17 0.00 0.00 175.17 173.95 2g3m s PRO 97 N -0.17 1.13 0.00 4.34 0.04 -1.26 -4.97 135.00 134.10 2g3m s PRO 97 Ca -0.03 -1.01 0.00 0.00 0.04 0.00 0.00 61.00 59.99 2g3m s PRO 97 Cb -0.03 -2.16 0.00 0.00 0.04 0.00 0.00 34.50 32.35 2g3m s PRO 97 CO 0.02 -1.91 0.00 1.28 0.04 0.00 0.00 177.00 176.43 2g3m n LEU 98 N -3.22 0.00 0.10 -3.56 4.77 -1.26 -4.81 117.00 109.02 2g3m n LEU 98 Ca 0.17 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.11 2g3m n LEU 98 Cb 0.60 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.84 2g3m n LEU 98 CO 0.42 0.00 0.49 1.88 -1.33 0.00 0.00 177.39 178.85 2g3m h TYR 99 N 0.00 0.20 -3.70 -1.77 0.05 -1.87 -1.84 116.97 108.05 2g3m h TYR 99 Ca 0.00 -0.08 -0.68 0.00 0.05 0.00 0.00 58.73 58.03 2g3m h TYR 99 Cb 0.00 -0.04 -0.18 0.00 1.01 0.00 0.00 36.73 37.52 2g3m h TYR 99 CO 0.00 0.72 -0.73 0.08 -1.05 0.00 0.00 178.16 177.18 2g3m s VAL 100 N -3.73 3.41 -0.31 -2.88 1.01 -1.26 -3.78 120.40 112.86 2g3m s VAL 100 Ca -0.03 -0.91 0.00 0.00 0.00 0.00 0.00 61.98 61.04 2g3m s VAL 100 Cb 0.12 -2.48 0.09 0.00 0.00 0.00 0.00 36.38 34.12 2g3m s VAL 100 CO 0.78 0.36 0.07 -0.44 0.00 0.00 0.00 175.10 175.88 2g3m s SER 101 N -1.48 4.14 -0.43 3.32 0.01 -0.92 -4.48 113.70 113.87 2g3m s SER 101 Ca 0.17 -1.69 -0.04 0.00 1.31 0.00 0.00 55.95 55.70 2g3m s SER 101 Cb -0.11 -1.06 0.11 0.00 0.21 0.00 0.00 66.02 65.18 2g3m s SER 101 CO 0.07 -0.39 0.24 -0.63 0.41 0.00 0.00 173.24 172.94 2g3m s ILE 102 N 1.44 3.45 -0.05 1.44 -1.09 -1.26 -3.78 121.20 121.36 2g3m s ILE 102 Ca 0.08 -2.04 -0.03 0.00 -2.23 0.00 0.00 60.65 56.43 2g3m s ILE 102 Cb -0.18 -3.35 -0.14 0.00 -1.58 0.00 0.00 42.46 37.21 2g3m s ILE 102 CO -0.19 -0.71 2.18 -2.65 -1.23 0.00 0.00 174.94 172.33 2g3m n PRO 103 N 4.61 1.12 -4.53 2.79 -0.02 -1.26 -3.97 135.00 133.73 2g3m n PRO 103 Ca -0.03 -0.58 -0.23 0.00 -2.02 0.00 0.00 63.50 60.64 2g3m n PRO 103 Cb 0.41 -1.80 -0.16 0.00 -0.02 0.00 0.00 33.50 31.93 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 0.00 1.73 0.03 2.45 2.96 -1.26 -1.57 118.68 123.02 2g3m s LEU 104 Ca 0.36 -0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.03 2g3m s LEU 104 Cb 0.17 -0.72 -0.02 0.00 0.50 0.00 0.00 46.19 46.11 2g3m s LEU 104 CO -0.00 0.06 -0.06 0.72 -1.32 0.00 0.00 176.35 175.76 2g3m s PHE 105 N 0.38 0.48 -0.06 5.38 -0.12 -0.77 0.69 117.98 123.96 2g3m s PHE 105 Ca -0.08 -0.50 0.05 0.00 -0.05 0.00 0.00 56.93 56.36 2g3m s PHE 105 Cb -0.12 -0.30 -0.02 0.00 -0.63 0.00 0.00 43.02 41.95 2g3m s PHE 105 CO 0.02 -0.13 -0.21 0.42 -0.05 0.00 0.00 175.22 175.27 2g3m s ILE 106 N -1.36 2.38 -0.16 -4.49 1.01 0.11 -0.82 121.20 117.88 2g3m s ILE 106 Ca -0.12 -0.95 -0.05 0.00 0.00 0.00 0.00 60.65 59.53 2g3m s ILE 106 Cb -0.10 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 2g3m s ILE 106 CO -0.00 0.57 0.01 -0.55 0.00 0.00 0.00 174.94 174.97 2g3m s SER 107 N -0.26 5.26 -0.29 3.58 0.15 0.77 -1.16 113.70 121.75 2g3m s SER 107 Ca -0.00 0.01 0.02 0.00 0.70 0.00 0.00 55.95 56.68 2g3m s SER 107 Cb -0.13 -1.83 0.07 0.00 -1.71 0.00 0.00 66.02 62.42 2g3m s SER 107 CO 0.03 0.20 -0.04 -0.69 1.20 0.00 0.00 173.24 173.94 2g3m s VAL 108 N 0.17 2.42 -0.11 4.45 1.01 -0.29 -0.53 120.40 127.51 2g3m s VAL 108 Ca 0.02 -1.74 0.02 0.00 0.00 0.00 0.00 61.98 60.28 2g3m s VAL 108 Cb -0.13 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.77 2g3m s VAL 108 CO 0.02 -0.19 -0.18 -0.75 0.00 0.00 0.00 175.10 174.00 2g3m s LYS 109 N 1.10 2.49 -1.47 2.72 2.20 -0.16 -1.85 119.74 124.77 2g3m s LYS 109 Ca -0.04 -0.67 -0.07 0.00 -0.36 0.00 0.00 55.97 54.83 2g3m s LYS 109 Cb -0.20 -2.04 0.03 0.00 -1.51 0.00 0.00 37.83 34.11 2g3m s LYS 109 CO -0.05 -0.01 0.72 -0.25 -0.36 0.00 0.00 175.35 175.41 2g3m n ASP 110 N 4.03 -5.54 0.00 1.43 8.00 -1.26 -1.05 116.55 122.16 2g3m n ASP 110 Ca -0.20 -0.40 0.00 0.00 0.71 0.00 0.00 54.79 54.90 2g3m n ASP 110 Cb 0.52 -4.47 0.00 0.00 -0.02 0.00 0.00 41.12 37.15 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 -1.55 1.61 3.69 0.44 0.00 -1.26 -5.00 105.19 103.11 2g3m n GLY 111 Ca -0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.31 5.26 -0.06 1.61 1.01 -0.21 -4.72 120.40 119.97 2g3m s VAL 112 Ca 0.00 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 2g3m s VAL 112 Cb 0.00 -3.41 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 2g3m s VAL 112 CO 0.00 0.43 0.29 0.00 0.00 0.00 0.00 175.10 175.81 2g3m s ALA 113 N 0.51 3.77 -0.02 5.51 0.00 0.12 -0.99 121.76 130.66 2g3m s ALA 113 Ca 0.07 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 51.62 2g3m s ALA 113 Cb -0.12 -2.21 0.02 0.00 0.00 0.00 0.00 23.12 20.82 2g3m s ALA 113 CO -0.00 0.53 0.04 0.99 0.00 0.00 0.00 175.76 177.32 2g3m s THR 114 N -1.01 -0.04 0.11 0.00 2.01 0.31 -2.02 115.64 115.00 2g3m s THR 114 Ca 0.20 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.37 2g3m s THR 114 Cb -0.15 -0.09 -0.04 0.00 0.01 0.00 0.00 72.50 72.24 2g3m s THR 114 CO 0.09 0.07 0.23 -0.83 -0.69 0.00 0.00 174.62 173.48 2g3m s GLY 115 N 0.81 1.93 -0.17 4.40 0.00 0.14 -0.16 107.32 114.27 2g3m s GLY 115 Ca -0.07 -0.96 -0.03 0.00 0.00 0.00 0.00 44.72 43.66 2g3m s GLY 115 CO -0.03 -0.95 0.03 -0.19 0.00 0.00 0.00 173.10 171.96 2g3m s TYR 116 N -1.62 0.94 -0.21 1.90 1.51 0.00 -0.04 117.35 119.83 2g3m s TYR 116 Ca 0.34 -0.70 0.00 0.00 -1.01 0.00 0.00 57.07 55.70 2g3m s TYR 116 Cb -0.12 -0.98 0.02 0.00 -0.11 0.00 0.00 41.96 40.78 2g3m s TYR 116 CO 0.27 -0.55 -0.14 0.12 -1.11 0.00 0.00 175.55 174.15 2g3m s PHE 117 N 1.89 2.94 -0.43 2.71 5.36 -0.15 -1.84 117.98 128.46 2g3m s PHE 117 Ca 0.00 -1.65 -0.14 0.00 -0.96 0.00 0.00 56.93 54.18 2g3m s PHE 117 Cb -0.16 -1.98 0.05 0.00 -0.34 0.00 0.00 43.02 40.59 2g3m s PHE 117 CO -0.07 -0.77 0.32 -0.06 -1.46 0.00 0.00 175.22 173.17 2g3m s PHE 118 N 1.29 3.25 -1.42 10.12 0.40 -0.61 0.41 117.98 131.42 2g3m s PHE 118 Ca 0.02 -0.86 -0.15 0.00 -0.60 0.00 0.00 56.93 55.34 2g3m s PHE 118 Cb -0.15 -2.81 0.05 0.00 0.51 0.00 0.00 43.02 40.62 2g3m s PHE 118 CO -0.09 -0.70 2.11 -1.71 0.70 0.00 0.00 175.22 175.54 2g3m n ASN 119 N 5.13 4.14 -3.82 1.36 5.15 -0.78 -4.69 115.26 121.75 2g3m n ASN 119 Ca -0.12 -2.87 -0.15 0.00 -0.60 0.00 0.00 54.58 50.84 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 3.32 0.24 -0.23 1.20 0.15 -1.26 -4.43 113.70 112.70 2g3m s SER 120 Ca 0.48 -0.00 0.14 0.00 0.70 0.00 0.00 55.95 57.26 2g3m s SER 120 Cb 0.12 -0.12 0.80 0.00 -1.71 0.00 0.00 66.02 65.11 2g3m s SER 120 CO -0.05 -0.08 1.72 0.00 1.20 0.00 0.00 173.24 176.02 2g3m n ALA 121 N 3.91 3.85 -2.07 5.45 0.00 -1.26 -4.86 120.51 125.53 2g3m n ALA 121 Ca -0.24 -1.86 -0.07 0.00 0.00 0.00 0.00 53.44 51.26 2g3m n ALA 121 Cb 0.52 -1.12 0.05 0.00 0.00 0.00 0.00 19.45 18.89 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 0.62 0.32 -3.79 0.00 3.41 -1.12 -2.00 113.62 111.06 2g3m n SER 122 Ca 0.27 -1.31 -0.42 0.00 -0.26 0.00 0.00 58.87 57.16 2g3m n SER 122 Cb 1.17 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 64.87 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 -1.67 2.49 -2.34 4.33 4.81 -1.25 -4.76 118.16 119.77 2g3m n LYS 123 Ca 0.05 -2.45 -0.41 0.00 -0.87 0.00 0.00 58.31 54.63 2g3m n LYS 123 Cb 0.19 -3.22 -0.03 0.00 0.02 0.00 0.00 35.03 31.98 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 3.94 3.34 -0.17 3.15 1.01 -1.22 -4.47 120.40 125.97 2g3m s VAL 124 Ca 0.51 1.22 -0.03 0.00 0.00 0.00 0.00 61.98 63.68 2g3m s VAL 124 Cb 0.13 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 2g3m s VAL 124 CO -0.02 0.24 -0.06 -0.63 0.00 0.00 0.00 175.10 174.63 2g3m s ILE 125 N -0.55 3.47 -0.43 2.22 -1.09 0.03 -0.91 121.20 123.94 2g3m s ILE 125 Ca 0.50 -0.49 -0.05 0.00 -2.23 0.00 0.00 60.65 58.38 2g3m s ILE 125 Cb -0.34 -2.53 0.11 0.00 -1.58 0.00 0.00 42.46 38.12 2g3m s ILE 125 CO 0.41 0.47 0.25 -0.36 -1.23 0.00 0.00 174.94 174.48 2g3m s PHE 126 N 0.80 3.54 -0.66 3.97 0.08 -0.12 -0.78 117.98 124.81 2g3m s PHE 126 Ca -0.02 -2.26 -0.18 0.00 0.12 0.00 0.00 56.93 54.59 2g3m s PHE 126 Cb -0.15 -3.31 0.12 0.00 -0.57 0.00 0.00 43.02 39.12 2g3m s PHE 126 CO 0.01 -0.98 0.77 0.34 -0.10 0.00 0.00 175.22 175.27 2g3m s ASP 127 N 2.08 6.30 -0.84 1.36 -1.08 0.19 -0.09 116.67 124.59 2g3m s ASP 127 Ca 0.07 -1.64 -0.18 0.00 -0.52 0.00 0.00 52.55 50.29 2g3m s ASP 127 Cb -0.24 -2.31 0.14 0.00 -1.46 0.00 0.00 42.92 39.06 2g3m s ASP 127 CO -0.03 -1.06 0.98 -0.69 0.52 0.00 0.00 175.17 174.88 2g3m s VAL 128 N 2.45 4.91 -1.63 1.11 1.01 -0.24 -0.90 120.40 127.11 2g3m s VAL 128 Ca 0.15 -1.61 -0.02 0.00 0.00 0.00 0.00 61.98 60.50 2g3m s VAL 128 Cb -0.20 -4.66 0.00 0.00 0.00 0.00 0.00 36.38 31.52 2g3m s VAL 128 CO 0.03 -1.35 0.18 0.61 0.00 0.00 0.00 175.10 174.58 2g3m n GLY 129 N 5.11 -0.51 0.31 4.51 0.00 0.55 0.26 105.19 115.43 2g3m n GLY 129 Ca 0.15 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 46.10 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 -3.30 1.70 -0.08 0.99 -0.00 -1.26 -4.11 117.00 110.93 2g3m n LEU 130 Ca -0.19 0.28 -0.10 0.00 -0.00 0.00 0.00 56.01 55.99 2g3m n LEU 130 Cb 0.66 -0.65 -0.03 0.00 -0.00 0.00 0.00 43.42 43.40 2g3m n LEU 130 CO 0.33 -0.19 0.85 -0.08 -0.00 0.00 0.00 177.39 178.31 2g3m h GLU 131 N -0.77 0.41 -4.03 1.96 4.81 -1.90 -3.39 114.58 111.66 2g3m h GLU 131 Ca -0.13 -0.09 -0.56 0.00 -0.13 0.00 0.00 59.36 58.46 2g3m h GLU 131 Cb 0.94 -0.06 -0.38 0.00 0.63 0.00 0.00 28.75 29.88 2g3m h GLU 131 CO -0.08 0.48 -0.78 -2.00 -0.73 0.00 0.00 179.01 175.90 2g3m s GLU 132 N -5.39 1.25 0.48 1.92 2.56 -1.26 -5.02 118.70 113.23 2g3m s GLU 132 Ca -0.14 -0.60 0.29 0.00 0.00 0.00 0.00 54.97 54.52 2g3m s GLU 132 Cb 0.08 -2.16 1.37 0.00 2.00 0.00 0.00 34.13 35.42 2g3m s GLU 132 CO 0.73 -0.53 1.79 -0.92 -0.56 0.00 0.00 175.26 175.77 2g3m h TYR 133 N 8.11 0.29 -0.61 5.30 3.20 -1.77 -0.34 116.97 131.15 2g3m h TYR 133 Ca -0.20 0.01 -0.22 0.00 3.14 0.00 0.00 58.73 61.45 2g3m h TYR 133 Cb 1.10 -0.08 -0.13 0.00 1.54 0.00 0.00 36.73 39.16 2g3m h TYR 133 CO 0.42 0.01 0.21 -0.40 -1.64 0.00 0.00 178.16 176.76 2g3m n ASP 134 N -4.39 3.94 -3.82 -2.11 5.75 -1.26 -4.69 116.55 109.97 2g3m n ASP 134 Ca 0.26 -3.39 -0.11 0.00 -0.01 0.00 0.00 54.79 51.54 2g3m n ASP 134 Cb 1.10 -0.70 -0.09 0.00 -1.03 0.00 0.00 41.12 40.40 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 -3.08 0.66 -0.26 0.11 1.02 -0.14 -0.81 119.74 117.24 2g3m s LYS 135 Ca 0.51 -0.48 -0.04 0.00 0.02 0.00 0.00 55.97 55.98 2g3m s LYS 135 Cb 0.42 0.28 0.02 0.00 -0.52 0.00 0.00 37.83 38.03 2g3m s LYS 135 CO 0.09 -0.19 -0.01 0.08 -0.92 0.00 0.00 175.35 174.41 2g3m s VAL 136 N -2.08 3.29 -0.22 3.17 1.01 0.12 -0.33 120.40 125.36 2g3m s VAL 136 Ca -0.09 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 60.99 2g3m s VAL 136 Cb -0.03 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.68 2g3m s VAL 136 CO -0.01 0.17 -0.09 -0.63 0.00 0.00 0.00 175.10 174.54 2g3m s ILE 137 N 1.39 2.95 -0.20 2.22 1.01 -0.08 -1.54 121.20 126.95 2g3m s ILE 137 Ca 0.01 -0.70 -0.05 0.00 0.00 0.00 0.00 60.65 59.91 2g3m s ILE 137 Cb -0.17 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 2g3m s ILE 137 CO -0.02 0.41 0.01 -0.69 0.00 0.00 0.00 174.94 174.65 2g3m s VAL 138 N 1.40 4.06 -0.21 2.92 1.01 0.40 -0.63 120.40 129.35 2g3m s VAL 138 Ca 0.05 -0.28 -0.03 0.00 0.00 0.00 0.00 61.98 61.72 2g3m s VAL 138 Cb -0.14 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.40 2g3m s VAL 138 CO -0.06 0.43 -0.08 -0.89 0.00 0.00 0.00 175.10 174.50 2g3m s THR 139 N 0.94 3.02 -0.26 3.92 2.01 0.04 -0.55 115.64 124.75 2g3m s THR 139 Ca 0.02 -0.64 -0.07 0.00 0.31 0.00 0.00 61.69 61.31 2g3m s THR 139 Cb -0.14 -2.36 -0.02 0.00 0.01 0.00 0.00 72.50 69.99 2g3m s THR 139 CO 0.02 0.44 0.07 -0.63 -0.69 0.00 0.00 174.62 173.83 2g3m s ILE 140 N 1.42 4.19 -0.70 1.82 1.09 -0.01 -0.79 121.20 128.23 2g3m s ILE 140 Ca 0.05 -0.33 -0.06 0.00 -1.10 0.00 0.00 60.65 59.21 2g3m s ILE 140 Cb -0.14 -3.02 -0.13 0.00 -1.06 0.00 0.00 42.46 38.11 2g3m s ILE 140 CO -0.06 0.26 2.73 -0.81 -0.10 0.00 0.00 174.94 176.97 2g3m n PRO 141 N 4.91 2.30 -3.84 2.79 -0.04 -1.26 -1.34 135.00 138.52 2g3m n PRO 141 Ca -0.16 -1.36 -0.11 0.00 -0.04 0.00 0.00 63.50 61.83 2g3m n PRO 141 Cb 0.50 -2.29 -0.09 0.00 -0.04 0.00 0.00 33.50 31.58 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 2.17 0.65 0.23 0.54 2.02 -0.85 -4.85 118.70 118.61 2g3m s GLU 142 Ca 0.54 -0.52 0.25 0.00 0.02 0.00 0.00 54.97 55.26 2g3m s GLU 142 Cb 0.19 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 0.93 0.73 -4.11 -0.19 5.68 -1.23 -2.76 116.55 115.60 2g3m n ASP 143 Ca -0.20 0.62 -0.09 0.00 -0.50 0.00 0.00 54.79 54.62 2g3m n ASP 143 Cb 0.58 -0.80 -0.10 0.00 -1.14 0.00 0.00 41.12 39.66 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 -4.37 0.72 -0.12 -1.12 0.01 -1.26 -4.75 113.70 102.80 2g3m s SER 144 Ca 0.08 -0.96 -0.30 0.00 1.31 0.00 0.00 55.95 56.08 2g3m s SER 144 Cb 0.11 0.15 0.12 0.00 0.21 0.00 0.00 66.02 66.61 2g3m s SER 144 CO 0.50 -0.52 0.99 0.54 0.41 0.00 0.00 173.24 175.15 2g3m s VAL 145 N -3.59 0.00 -0.08 3.43 0.11 -0.79 -4.80 120.40 114.68 2g3m s VAL 145 Ca 0.07 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.16 2g3m s VAL 145 Cb 0.05 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.91 2g3m s VAL 145 CO -0.07 0.00 -0.20 -1.83 -3.33 0.00 0.00 175.10 169.66 2g3m s GLU 146 N -1.76 2.52 0.18 1.54 -1.05 -1.26 -0.77 118.70 118.10 2g3m s GLU 146 Ca 0.01 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.10 2g3m s GLU 146 Cb -0.01 -1.98 -0.04 0.00 -0.44 0.00 0.00 34.13 31.66 2g3m s GLU 146 CO -0.02 0.17 0.06 -0.59 0.95 0.00 0.00 175.26 175.83 2g3m s PHE 147 N 0.34 1.17 -0.03 4.83 -0.12 -0.48 -1.86 117.98 121.83 2g3m s PHE 147 Ca -0.15 -1.19 0.04 0.00 -0.05 0.00 0.00 56.93 55.58 2g3m s PHE 147 Cb -0.16 -0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 41.57 2g3m s PHE 147 CO 0.06 -0.42 -0.15 0.71 -0.05 0.00 0.00 175.22 175.38 2g3m s TYR 148 N -3.90 1.44 -0.33 3.49 1.51 0.17 -0.67 117.35 119.05 2g3m s TYR 148 Ca 0.30 -0.34 -0.11 0.00 -1.01 0.00 0.00 57.07 55.91 2g3m s TYR 148 Cb 0.07 -0.96 -0.01 0.00 -0.11 0.00 0.00 41.96 40.96 2g3m s TYR 148 CO 0.07 -0.09 0.18 0.08 -1.11 0.00 0.00 175.55 174.68 2g3m s VAL 149 N -0.12 4.79 -0.39 0.71 1.01 0.02 -0.98 120.40 125.45 2g3m s VAL 149 Ca 0.01 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 2g3m s VAL 149 Cb -0.08 -3.48 0.06 0.00 0.00 0.00 0.00 36.38 32.88 2g3m s VAL 149 CO 0.01 0.01 0.22 -0.63 0.00 0.00 0.00 175.10 174.70 2g3m s ILE 150 N 1.64 4.25 0.61 2.22 1.01 0.94 -0.78 121.20 131.10 2g3m s ILE 150 Ca 0.05 -1.20 -0.18 0.00 0.00 0.00 0.00 60.65 59.32 2g3m s ILE 150 Cb -0.17 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.77 2g3m s ILE 150 CO 0.07 -0.37 1.22 -0.70 0.00 0.00 0.00 174.94 175.16 2g3m s GLU 151 N 1.46 2.84 0.00 2.79 2.56 -0.29 0.23 118.70 128.29 2g3m s GLU 151 Ca 0.02 1.84 0.00 0.00 0.00 0.00 0.00 54.97 56.82 2g3m s GLU 151 Cb -0.21 -1.91 0.00 0.00 2.00 0.00 0.00 34.13 34.01 2g3m s GLU 151 CO 0.04 -1.31 0.00 0.41 -0.56 0.00 0.00 175.26 173.83 2g3m n GLY 152 N 0.51 0.58 0.21 -1.50 0.00 -0.86 -4.15 105.19 99.99 2g3m n GLY 152 Ca 0.14 0.00 0.10 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 -6.91 1.61 0.13 -1.96 -3.43 132.00 121.43 2g3m h PRO 153 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.21 1.03 -0.23 0.00 0.00 178.00 179.13 2g3m s ARG 154 N -3.22 4.03 0.32 0.86 0.52 -1.26 0.13 118.95 120.34 2g3m s ARG 154 Ca 0.06 0.82 0.01 0.00 -0.52 0.00 0.00 55.73 56.10 2g3m s ARG 154 Cb 0.06 -2.30 0.57 0.00 0.52 0.00 0.00 34.95 33.79 2g3m s ARG 154 CO 0.67 0.01 1.97 0.82 0.02 0.00 0.00 175.30 178.79 2g3m h ILE 155 N 1.67 1.14 -0.35 1.52 2.04 -1.90 -0.10 117.51 121.53 2g3m h ILE 155 Ca -0.48 -0.33 -0.03 0.00 1.00 0.00 0.00 64.86 65.02 2g3m h ILE 155 Cb 1.18 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 2g3m h ILE 155 CO 0.63 0.18 0.08 -0.08 0.00 0.00 0.00 178.15 178.96 2g3m h GLU 156 N 0.97 0.51 -0.38 2.37 4.81 -1.92 -1.70 114.58 119.24 2g3m h GLU 156 Ca 0.30 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 2g3m h GLU 156 Cb 0.02 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2g3m h GLU 156 CO -0.08 0.48 0.10 -0.44 -0.73 0.00 0.00 179.01 178.34 2g3m h ASP 157 N 0.51 0.56 -0.21 1.04 3.32 -1.34 -0.85 116.42 119.44 2g3m h ASP 157 Ca 0.12 -0.22 0.01 0.00 0.02 0.00 0.00 57.03 56.95 2g3m h ASP 157 Cb 0.21 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 2g3m h ASP 157 CO -0.00 0.64 0.13 0.58 -1.72 0.00 0.00 179.24 178.87 2g3m h VAL 158 N 0.46 1.04 -0.32 -1.35 2.07 -0.90 -1.56 116.25 115.68 2g3m h VAL 158 Ca 0.12 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 2g3m h VAL 158 Cb 0.29 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2g3m h VAL 158 CO -0.00 0.05 -0.07 -0.07 0.02 0.00 0.00 177.57 177.50 2g3m h LEU 159 N 0.27 0.51 -0.07 2.57 3.38 -1.20 0.17 115.31 120.94 2g3m h LEU 159 Ca 0.08 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2g3m h LEU 159 Cb -0.02 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.59 2g3m h LEU 159 CO -0.03 0.63 0.03 -0.33 0.09 0.00 0.00 178.44 178.83 2g3m h GLU 160 N 0.50 0.11 -0.52 1.13 5.08 -0.80 0.18 114.58 120.27 2g3m h GLU 160 Ca 0.10 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2g3m h GLU 160 Cb 0.43 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2g3m h GLU 160 CO 0.02 0.26 0.17 0.87 -1.00 0.00 0.00 179.01 179.33 2g3m h LYS 161 N -0.06 0.80 -0.85 2.33 1.57 -1.02 -0.30 116.57 119.04 2g3m h LYS 161 Ca 0.02 -0.17 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 2g3m h LYS 161 Cb 0.19 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.35 2g3m h LYS 161 CO -0.00 0.73 0.51 -0.92 -0.57 0.00 0.00 179.45 179.20 2g3m h TYR 162 N 0.70 1.13 -0.36 -1.35 3.20 -0.51 -0.78 116.97 119.00 2g3m h TYR 162 Ca 0.17 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 61.91 2g3m h TYR 162 Cb 0.26 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2g3m h TYR 162 CO 0.01 0.75 -0.29 1.15 -1.64 0.00 0.00 178.16 178.15 2g3m h THR 163 N 1.17 1.28 -0.87 1.81 2.02 -0.36 -0.23 112.91 117.73 2g3m h THR 163 Ca 0.31 -1.43 -0.02 0.00 0.77 0.00 0.00 66.41 66.03 2g3m h THR 163 Cb -0.04 1.31 -0.04 0.00 -1.74 0.00 0.00 68.15 67.64 2g3m h THR 163 CO -0.06 0.47 0.45 -0.08 0.37 0.00 0.00 175.52 176.68 2g3m h GLU 164 N 0.66 1.23 0.13 6.66 4.57 -0.52 0.40 114.58 127.70 2g3m h GLU 164 Ca 0.08 -0.16 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2g3m h GLU 164 Cb 0.82 -0.23 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 2g3m h GLU 164 CO 0.07 0.91 -0.06 1.25 -1.18 0.00 0.00 179.01 180.00 2g3m h LEU 165 N 1.22 -0.15 0.00 1.64 6.46 -0.81 -3.36 115.31 120.32 2g3m h LEU 165 Ca 0.30 -0.39 0.00 0.00 -0.12 0.00 0.00 57.88 57.67 2g3m h LEU 165 Cb 0.07 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.03 2g3m h LEU 165 CO -0.04 0.37 -0.62 0.35 -0.62 0.00 0.00 178.44 177.87 2g3m n THR 166 N -4.93 0.06 0.00 1.05 -2.24 -0.13 -4.49 114.28 103.61 2g3m n THR 166 Ca -0.08 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 2g3m n THR 166 Cb 0.27 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 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 1.47 3.93 3.76 3.38 0.00 0.14 -4.52 105.19 113.35 2g3m n GLY 167 Ca 0.05 -1.29 -0.40 0.00 0.00 0.00 0.00 46.02 44.38 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 -5.45 4.52 0.40 1.61 -0.14 -1.21 -4.61 119.74 114.86 2g3m s LYS 168 Ca 0.00 1.85 -0.27 0.00 -1.36 0.00 0.00 55.97 56.19 2g3m s LYS 168 Cb 0.00 -3.09 -0.10 0.00 -1.68 0.00 0.00 37.83 32.96 2g3m s LYS 168 CO 0.00 0.08 1.45 -2.14 -0.76 0.00 0.00 175.35 173.99 2g3m s PRO 169 N -1.64 4.00 0.75 -1.68 0.02 -1.26 -4.27 135.00 130.92 2g3m s PRO 169 Ca 0.47 2.49 -0.11 0.00 0.02 0.00 0.00 61.00 63.87 2g3m s PRO 169 Cb -0.32 -2.88 0.04 0.00 0.02 0.00 0.00 34.50 31.36 2g3m s PRO 169 CO 0.42 -0.59 1.09 -0.59 -0.33 0.00 0.00 177.00 177.00 2g3m s PHE 170 N -1.15 2.65 -0.47 6.54 -0.71 -1.15 -4.27 117.98 119.42 2g3m s PHE 170 Ca 0.55 1.54 -0.17 0.00 -1.04 0.00 0.00 56.93 57.81 2g3m s PHE 170 Cb -0.45 -3.05 0.06 0.00 -1.21 0.00 0.00 43.02 38.37 2g3m s PHE 170 CO 0.60 -1.71 0.46 -1.17 -1.34 0.00 0.00 175.22 172.06 2g3m s LEU 171 N -5.71 5.28 0.75 -1.99 2.96 -1.26 -4.76 118.68 113.94 2g3m s LEU 171 Ca 0.62 -1.07 -0.11 0.00 -0.22 0.00 0.00 54.13 53.35 2g3m s LEU 171 Cb -0.17 -2.29 0.05 0.00 0.50 0.00 0.00 46.19 44.28 2g3m s LEU 171 CO 0.54 -0.69 1.12 -2.16 -1.32 0.00 0.00 176.35 173.83 2g3m s PRO 172 N 2.00 2.36 0.73 0.98 0.04 -1.26 -4.78 135.00 135.07 2g3m s PRO 172 Ca 0.08 0.19 -0.11 0.00 0.04 0.00 0.00 61.00 61.20 2g3m s PRO 172 Cb -0.21 -2.02 0.03 0.00 0.04 0.00 0.00 34.50 32.34 2g3m s PRO 172 CO 0.09 -1.31 1.08 -1.25 0.04 0.00 0.00 177.00 175.66 2g3m s PRO 173 N -5.43 2.60 0.39 0.56 0.04 -1.26 -4.94 135.00 126.96 2g3m s PRO 173 Ca 0.60 1.10 0.07 0.00 0.04 0.00 0.00 61.00 62.81 2g3m s PRO 173 Cb -0.11 -1.94 0.81 0.00 0.04 0.00 0.00 34.50 33.30 2g3m s PRO 173 CO 0.49 -1.37 1.99 1.98 0.04 0.00 0.00 177.00 180.13 2g3m h MET 174 N -0.84 0.45 0.00 4.56 4.05 -1.99 -2.21 114.93 118.95 2g3m h MET 174 Ca -0.44 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 58.93 2g3m h MET 174 Cb 1.22 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 31.93 2g3m h MET 174 CO 0.54 0.39 0.00 0.11 0.23 0.00 0.00 176.91 178.18 2g3m h TRP 175 N 0.46 0.00 0.00 1.39 5.08 -1.99 -2.01 115.95 118.88 2g3m h TRP 175 Ca 0.11 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.08 2g3m h TRP 175 Cb 0.11 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.27 2g3m h TRP 175 CO 0.00 0.00 0.00 0.00 -1.28 0.00 0.00 178.44 177.16 2g3m h ALA 176 N 2.02 1.00 -0.56 0.11 0.00 -1.77 -1.36 119.26 118.70 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 0.20 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.99 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 -2.58 0.74 -1.57 0.00 3.01 -0.76 -4.75 117.46 111.55 2g3m n PHE 177 Ca 0.00 -0.41 -0.15 0.00 1.01 0.00 0.00 57.45 57.90 2g3m n PHE 177 Cb 0.20 -0.00 0.10 0.00 -0.01 0.00 0.00 39.48 39.77 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 1.42 -1.14 3.66 1.37 0.00 -0.52 -4.70 105.19 105.28 2g3m n GLY 178 Ca 0.21 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.44 3.25 -0.12 1.61 5.04 -1.26 -4.35 117.35 119.07 2g3m s TYR 179 Ca 0.39 1.38 -0.02 0.00 -2.44 0.00 0.00 57.07 56.39 2g3m s TYR 179 Cb -0.01 -3.32 -0.03 0.00 0.35 0.00 0.00 41.96 38.95 2g3m s TYR 179 CO 0.28 -0.70 -0.06 -1.64 -1.34 0.00 0.00 175.55 172.09 2g3m s MET 180 N 3.27 3.32 -0.04 4.97 -1.94 -0.50 -0.51 119.30 127.87 2g3m s MET 180 Ca 0.46 -0.54 0.01 0.00 -1.71 0.00 0.00 55.69 53.90 2g3m s MET 180 Cb -0.16 -2.77 -0.03 0.00 2.01 0.00 0.00 34.83 33.88 2g3m s MET 180 CO 0.08 0.39 -0.03 0.96 -0.01 0.00 0.00 175.02 176.41 2g3m s ILE 181 N -0.06 4.01 0.17 2.53 -4.36 -0.83 -1.45 121.20 121.21 2g3m s ILE 181 Ca 0.01 -0.52 -0.18 0.00 -0.26 0.00 0.00 60.65 59.70 2g3m s ILE 181 Cb -0.13 -2.72 0.04 0.00 1.25 0.00 0.00 42.46 40.89 2g3m s ILE 181 CO 0.03 0.48 0.50 -0.55 0.24 0.00 0.00 174.94 175.64 2g3m s SER 182 N -1.21 -0.30 0.12 4.36 0.15 0.73 -1.78 113.70 115.77 2g3m s SER 182 Ca 0.16 -0.36 -0.25 0.00 0.70 0.00 0.00 55.95 56.20 2g3m s SER 182 Cb -0.11 0.55 0.07 0.00 -1.71 0.00 0.00 66.02 64.82 2g3m s SER 182 CO 0.06 -0.98 0.84 -0.60 1.20 0.00 0.00 173.24 173.75 2g3m s ARG 183 N -3.83 1.16 -0.73 5.44 3.52 -1.26 -3.83 118.95 119.41 2g3m s ARG 183 Ca 0.06 -0.54 0.04 0.00 -0.13 0.00 0.00 55.73 55.16 2g3m s ARG 183 Cb -0.00 0.46 0.17 0.00 -1.56 0.00 0.00 34.95 34.02 2g3m s ARG 183 CO -0.07 -0.52 0.53 -0.47 -0.81 0.00 0.00 175.30 173.96 2g3m s TYR 184 N -3.40 3.62 0.24 5.12 5.04 -0.26 -3.96 117.35 123.76 2g3m s TYR 184 Ca 0.07 -3.32 -0.01 0.00 -2.44 0.00 0.00 57.07 51.38 2g3m s TYR 184 Cb -0.02 -2.76 -0.03 0.00 0.35 0.00 0.00 41.96 39.50 2g3m s TYR 184 CO -0.04 -0.56 0.22 -1.12 -1.34 0.00 0.00 175.55 172.71 2g3m s SER 185 N -1.35 0.46 -0.20 4.32 0.01 -1.26 -1.69 113.70 113.99 2g3m s SER 185 Ca 0.25 -1.41 -0.13 0.00 1.31 0.00 0.00 55.95 55.97 2g3m s SER 185 Cb -0.05 0.46 -0.05 0.00 0.21 0.00 0.00 66.02 66.60 2g3m s SER 185 CO -0.16 -0.95 0.26 -0.31 0.41 0.00 0.00 173.24 172.48 2g3m s TYR 186 N -3.93 3.38 -0.22 2.43 2.02 -1.25 -5.02 117.35 114.75 2g3m s TYR 186 Ca 0.37 0.44 -0.36 0.00 -0.37 0.00 0.00 57.07 57.15 2g3m s TYR 186 Cb 0.05 -2.35 0.15 0.00 -0.40 0.00 0.00 41.96 39.41 2g3m s TYR 186 CO 0.15 0.12 1.33 1.52 -1.57 0.00 0.00 175.55 177.10 2g3m s TYR 187 N 0.89 -0.05 0.78 2.71 1.13 -1.26 -4.83 117.35 116.72 2g3m s TYR 187 Ca 0.13 0.02 -0.13 0.00 -1.41 0.00 0.00 57.07 55.68 2g3m s TYR 187 Cb -0.13 0.51 0.19 0.00 -1.10 0.00 0.00 41.96 41.43 2g3m s TYR 187 CO 0.04 -0.10 0.82 -0.35 -2.51 0.00 0.00 175.55 173.45 2g3m n PRO 188 N -0.11 -1.89 -0.33 -3.49 -0.04 -1.26 -4.77 135.00 123.10 2g3m n PRO 188 Ca 0.01 -1.29 0.13 0.00 -0.04 0.00 0.00 63.50 62.32 2g3m n PRO 188 Cb 0.58 -1.06 0.32 0.00 -0.04 0.00 0.00 33.50 33.30 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 0.61 -0.33 0.54 3.07 -1.26 -0.75 115.11 116.99 2g3m h GLN 189 Ca -0.29 -0.04 -0.03 0.00 0.09 0.00 0.00 58.65 58.39 2g3m h GLN 189 Cb 0.85 -0.14 -0.02 0.00 0.08 0.00 0.00 27.48 28.25 2g3m h GLN 189 CO 0.19 0.40 0.08 -0.44 0.09 0.00 0.00 178.83 179.16 2g3m h ASP 190 N 0.63 0.43 -0.09 0.06 3.32 -1.95 -1.82 116.42 117.01 2g3m h ASP 190 Ca 0.58 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.49 2g3m h ASP 190 Cb 0.99 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 2g3m h ASP 190 CO -0.43 0.44 -0.21 0.11 -1.72 0.00 0.00 179.24 177.43 2g3m h LYS 191 N 0.47 0.49 -0.16 3.56 1.79 -1.44 -0.72 116.57 120.57 2g3m h LYS 191 Ca 0.11 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.42 2g3m h LYS 191 Cb 0.18 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.78 2g3m h LYS 191 CO -0.00 0.67 0.10 0.28 -1.08 0.00 0.00 179.45 179.42 2g3m h VAL 192 N 0.44 1.04 -0.45 0.50 2.07 -1.14 -0.64 116.25 118.07 2g3m h VAL 192 Ca 0.07 -0.08 -0.13 0.00 0.82 0.00 0.00 66.70 67.38 2g3m h VAL 192 Cb 0.61 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 2g3m h VAL 192 CO 0.04 0.04 -0.23 0.58 0.02 0.00 0.00 177.57 178.02 2g3m h VAL 193 N 0.21 1.27 -0.65 2.57 2.07 -1.28 -2.29 116.25 118.14 2g3m h VAL 193 Ca 0.06 -1.39 0.02 0.00 0.82 0.00 0.00 66.70 66.21 2g3m h VAL 193 Cb -0.02 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2g3m h VAL 193 CO -0.01 0.47 0.41 -0.33 0.02 0.00 0.00 177.57 178.14 2g3m h GLU 194 N 0.80 0.80 -0.41 1.57 5.08 -0.87 -0.76 114.58 120.79 2g3m h GLU 194 Ca 0.10 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2g3m h GLU 194 Cb 0.80 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.85 2g3m h GLU 194 CO 0.07 0.53 0.05 1.25 -1.00 0.00 0.00 179.01 179.90 2g3m h LEU 195 N 0.82 0.67 -0.93 1.33 5.85 -0.99 -2.04 115.31 120.03 2g3m h LEU 195 Ca 0.25 -0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.71 2g3m h LEU 195 Cb -0.02 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 40.78 2g3m h LEU 195 CO -0.09 0.78 0.62 0.58 -0.34 0.00 0.00 178.44 179.99 2g3m h VAL 196 N 0.54 1.24 -0.34 1.05 2.07 -1.09 -0.99 116.25 118.74 2g3m h VAL 196 Ca 0.12 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 2g3m h VAL 196 Cb 0.41 -0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.03 2g3m h VAL 196 CO 0.01 0.23 0.16 0.44 0.02 0.00 0.00 177.57 178.43 2g3m h ASP 197 N 1.26 0.46 -0.75 0.57 3.32 -0.87 -0.81 116.42 119.60 2g3m h ASP 197 Ca 0.34 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.22 2g3m h ASP 197 Cb -0.15 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 2g3m h ASP 197 CO -0.07 0.47 0.33 0.40 -1.72 0.00 0.00 179.24 178.65 2g3m h ILE 198 N 0.42 1.25 -0.07 0.35 2.04 -1.03 0.18 117.51 120.64 2g3m h ILE 198 Ca 0.12 -0.74 -0.00 0.00 1.00 0.00 0.00 64.86 65.24 2g3m h ILE 198 Cb 0.14 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2g3m h ILE 198 CO -0.01 0.30 0.04 0.24 0.00 0.00 0.00 178.15 178.72 2g3m h MET 199 N 1.07 0.10 -0.48 2.37 2.86 -0.95 -1.35 114.93 118.55 2g3m h MET 199 Ca 0.25 -0.01 -0.10 0.00 -2.06 0.00 0.00 59.70 57.78 2g3m h MET 199 Cb 0.16 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.79 2g3m h MET 199 CO -0.03 0.11 -0.11 1.96 1.06 0.00 0.00 176.91 179.90 2g3m h GLN 200 N 0.06 0.92 -0.17 1.72 4.20 -0.93 -0.47 115.11 120.43 2g3m h GLN 200 Ca 0.03 -0.35 -0.02 0.00 0.06 0.00 0.00 58.65 58.37 2g3m h GLN 200 Cb 0.04 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2g3m h GLN 200 CO -0.00 1.00 0.02 -0.22 -0.67 0.00 0.00 178.83 178.96 2g3m h LYS 201 N 0.77 0.25 -0.46 1.46 3.64 -0.53 -1.93 116.57 119.77 2g3m h LYS 201 Ca 0.12 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2g3m h LYS 201 Cb 0.66 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.43 2g3m h LYS 201 CO 0.05 0.25 0.00 0.39 -2.27 0.00 0.00 179.45 177.87 2g3m n GLU 202 N -4.41 2.08 -0.31 1.90 1.02 -0.52 -4.93 120.64 115.46 2g3m n GLU 202 Ca -0.00 -1.65 0.00 0.00 -0.02 0.00 0.00 57.16 55.49 2g3m n GLU 202 Cb 0.15 -1.36 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 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 1.22 0.82 3.59 0.62 0.00 -0.72 -5.06 105.19 105.65 2g3m n GLY 203 Ca 0.15 -0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 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 3.23 -0.64 1.61 0.08 -0.21 -5.01 117.98 115.04 2g3m s PHE 204 Ca 0.00 0.06 -0.25 0.00 0.12 0.00 0.00 56.93 56.86 2g3m s PHE 204 Cb 0.00 -2.30 0.05 0.00 -0.57 0.00 0.00 43.02 40.19 2g3m s PHE 204 CO 0.00 -0.10 1.07 0.50 -0.10 0.00 0.00 175.22 176.59 2g3m s ARG 205 N 1.43 3.25 -0.32 0.44 3.52 -1.26 -3.86 118.95 122.16 2g3m s ARG 205 Ca 0.07 -0.37 -0.16 0.00 -0.13 0.00 0.00 55.73 55.14 2g3m s ARG 205 Cb -0.15 -4.14 -0.02 0.00 -1.56 0.00 0.00 34.95 29.09 2g3m s ARG 205 CO 0.07 -1.79 0.42 0.08 -0.81 0.00 0.00 175.30 173.27 2g3m s VAL 206 N 4.60 5.12 0.08 7.11 1.01 -1.26 -4.31 120.40 132.74 2g3m s VAL 206 Ca 0.31 0.35 -0.12 0.00 0.00 0.00 0.00 61.98 62.51 2g3m s VAL 206 Cb -0.12 -3.83 -0.25 0.00 0.00 0.00 0.00 36.38 32.19 2g3m s VAL 206 CO 0.16 -0.04 1.18 0.00 0.00 0.00 0.00 175.10 176.39 2g3m h ALA 207 N 8.34 0.12 -2.77 5.51 0.00 -1.12 -3.43 119.26 125.91 2g3m h ALA 207 Ca -0.30 -0.73 0.04 0.00 0.00 0.00 0.00 54.91 53.92 2g3m h ALA 207 Cb 1.14 0.06 -0.11 0.00 0.00 0.00 0.00 17.79 18.88 2g3m h ALA 207 CO 0.70 0.72 0.30 0.20 0.00 0.00 0.00 179.25 181.18 2g3m s GLY 208 N -4.38 -0.47 -0.04 0.00 0.00 -1.22 -1.02 107.32 100.19 2g3m s GLY 208 Ca -0.09 0.47 0.06 0.00 0.00 0.00 0.00 44.72 45.17 2g3m s GLY 208 CO 0.92 0.15 -0.23 -1.34 0.00 0.00 0.00 173.10 172.60 2g3m s VAL 209 N -3.58 1.90 -0.17 1.40 -7.23 -0.53 -1.96 120.40 110.23 2g3m s VAL 209 Ca 0.04 -1.00 -0.09 0.00 -1.81 0.00 0.00 61.98 59.13 2g3m s VAL 209 Cb -0.02 -1.60 -0.05 0.00 0.56 0.00 0.00 36.38 35.28 2g3m s VAL 209 CO -0.08 0.53 0.13 -0.36 -0.31 0.00 0.00 175.10 175.01 2g3m s PHE 210 N -0.28 3.47 -0.27 2.82 0.40 -0.73 -1.51 117.98 121.87 2g3m s PHE 210 Ca 0.01 0.39 -0.08 0.00 -0.60 0.00 0.00 56.93 56.65 2g3m s PHE 210 Cb -0.12 -2.07 -0.01 0.00 0.51 0.00 0.00 43.02 41.34 2g3m s PHE 210 CO 0.02 0.45 0.09 -0.51 0.70 0.00 0.00 175.22 175.97 2g3m s LEU 211 N -0.18 3.67 0.82 -0.37 1.02 0.10 -4.29 118.68 119.46 2g3m s LEU 211 Ca 0.10 -0.43 -0.08 0.00 0.02 0.00 0.00 54.13 53.75 2g3m s LEU 211 Cb -0.11 -1.92 0.15 0.00 0.02 0.00 0.00 46.19 44.33 2g3m s LEU 211 CO 0.00 -0.11 1.13 -0.62 0.02 0.00 0.00 176.35 176.78 2g3m s ASP 212 N 1.58 3.88 0.33 2.29 -1.08 -1.26 -1.60 116.67 120.81 2g3m s ASP 212 Ca 0.05 -0.01 0.07 0.00 -0.52 0.00 0.00 52.55 52.13 2g3m s ASP 212 Cb -0.16 -0.26 0.35 0.00 -1.46 0.00 0.00 42.92 41.40 2g3m s ASP 212 CO 0.04 -2.20 1.02 2.30 0.52 0.00 0.00 175.17 176.85 2g3m n ILE 213 N -3.24 0.30 0.44 4.11 -5.35 -1.26 -2.04 119.36 112.32 2g3m n ILE 213 Ca 0.14 0.75 0.10 0.00 -0.27 0.00 0.00 62.75 63.47 2g3m n ILE 213 Cb 0.60 -1.75 0.44 0.00 -1.74 0.00 0.00 39.64 37.19 2g3m n ILE 213 CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 2g3m n HIS 214 N -1.90 0.56 0.29 4.28 8.25 -1.26 -2.63 115.22 122.82 2g3m n HIS 214 Ca -0.00 0.22 0.13 0.00 -0.26 0.00 0.00 57.72 57.80 2g3m n HIS 214 Cb 0.54 -0.85 0.27 0.00 1.12 0.00 0.00 29.99 31.06 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 -4.46 4.41 -0.00 -1.74 -3.45 116.97 111.73 2g3m h TYR 215 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 58.73 58.24 2g3m h TYR 215 Cb 0.34 0.00 0.08 0.00 0.00 0.00 0.00 36.73 37.15 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 2.90 -0.46 0.10 -1.94 -1.08 0.70 119.30 116.28 2g3m s MET 216 Ca 0.07 0.50 -0.20 0.00 -1.71 0.00 0.00 55.69 54.36 2g3m s MET 216 Cb 0.07 -2.02 0.03 0.00 2.01 0.00 0.00 34.83 34.92 2g3m s MET 216 CO 0.64 -1.01 0.61 0.34 -0.01 0.00 0.00 175.02 175.58 2g3m s ASP 217 N -4.32 6.27 -1.46 3.03 2.15 -1.26 -3.89 116.67 117.19 2g3m s ASP 217 Ca 0.58 -0.59 -0.11 0.00 0.43 0.00 0.00 52.55 52.86 2g3m s ASP 217 Cb -0.11 -2.29 0.05 0.00 -0.30 0.00 0.00 42.92 40.26 2g3m s ASP 217 CO 0.52 -0.79 0.98 -1.20 -0.17 0.00 0.00 175.17 174.51 2g3m n SER 218 N 6.14 -5.52 -1.34 -0.34 7.64 -1.26 -1.37 113.62 117.57 2g3m n SER 218 Ca -0.04 -0.60 -0.17 0.00 1.01 0.00 0.00 58.87 59.07 2g3m n SER 218 Cb 0.47 -4.39 -0.07 0.00 -1.01 0.00 0.00 64.21 59.20 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 -4.74 -0.04 -2.69 1.43 4.01 -1.26 -4.56 117.16 109.31 2g3m n TYR 219 Ca 0.01 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 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 -3.42 4.44 0.51 -0.72 1.02 -0.47 -4.32 119.74 116.77 2g3m s LYS 220 Ca 0.00 1.40 -0.23 0.00 0.02 0.00 0.00 55.97 57.16 2g3m s LYS 220 Cb 0.00 -3.53 -0.07 0.00 -0.52 0.00 0.00 37.83 33.71 2g3m s LYS 220 CO 0.00 -0.29 1.29 1.28 -0.92 0.00 0.00 175.35 176.72 2g3m n LEU 221 N 4.89 4.82 -3.57 3.17 4.77 -1.26 -3.15 117.00 126.66 2g3m n LEU 221 Ca 0.08 1.01 -0.24 0.00 -0.03 0.00 0.00 56.01 56.84 2g3m n LEU 221 Cb 0.49 -1.53 0.08 0.00 -2.33 0.00 0.00 43.42 40.12 2g3m n LEU 221 CO 0.52 -0.71 0.24 0.49 -1.33 0.00 0.00 177.39 176.61 2g3m n PHE 222 N -0.78 -2.85 -4.10 -1.77 3.72 -1.26 -4.97 117.46 105.44 2g3m n PHE 222 Ca 0.09 1.01 -0.08 0.00 -0.05 0.00 0.00 57.45 58.42 2g3m n PHE 222 Cb 0.43 -5.02 -0.10 0.00 -0.94 0.00 0.00 39.48 33.85 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 0.26 -0.07 4.37 -4.23 -1.19 -5.09 115.64 106.38 2g3m s THR 223 Ca 0.57 -1.83 0.04 0.00 -1.18 0.00 0.00 61.69 59.29 2g3m s THR 223 Cb -0.25 -1.59 -0.02 0.00 1.34 0.00 0.00 72.50 71.99 2g3m s THR 223 CO 0.72 -0.94 -0.19 0.26 -0.54 0.00 0.00 174.62 173.93 2g3m s TRP 224 N -3.90 2.59 0.04 3.99 0.52 -1.26 -4.15 118.94 116.77 2g3m s TRP 224 Ca 0.09 -0.50 -0.30 0.00 0.02 0.00 0.00 56.10 55.41 2g3m s TRP 224 Cb 0.08 -1.65 -0.09 0.00 -1.15 0.00 0.00 33.47 30.66 2g3m s TRP 224 CO -0.08 -0.07 1.93 -1.58 0.02 0.00 0.00 176.95 177.17 2g3m s HIS 225 N -0.29 1.43 0.62 -1.98 5.65 0.22 -4.27 115.29 116.66 2g3m s HIS 225 Ca 0.01 -0.37 0.31 0.00 0.25 0.00 0.00 55.06 55.25 2g3m s HIS 225 Cb -0.13 -4.22 1.68 0.00 -1.18 0.00 0.00 32.58 28.73 2g3m s HIS 225 CO 0.03 -5.41 2.03 -1.00 -0.65 0.00 0.00 174.74 169.73 2g3m h PRO 226 N 10.27 0.00 0.00 2.88 0.13 -1.90 0.37 132.00 143.76 2g3m h PRO 226 Ca -0.49 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.41 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 -1.87 0.66 -0.23 0.00 0.00 178.00 177.50 2g3m n TYR 227 N -3.46 0.00 0.02 1.56 4.01 -1.26 -4.00 117.16 114.03 2g3m n TYR 227 Ca 0.02 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.68 2g3m n TYR 227 Cb 0.40 -0.62 -0.13 0.00 -0.31 0.00 0.00 39.34 38.68 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 -2.09 -0.72 3.08 -1.93 -3.39 114.38 109.33 2g3m h ARG 228 Ca -0.34 0.00 -0.52 0.00 0.07 0.00 0.00 59.98 59.18 2g3m h ARG 228 Cb 1.70 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.34 2g3m h ARG 228 CO -0.01 0.70 -1.01 1.19 -1.07 0.00 0.00 179.97 179.78 2g3m n PHE 229 N -3.17 1.40 -0.12 3.04 3.01 0.11 -0.73 117.46 120.99 2g3m n PHE 229 Ca -0.09 -3.86 -0.01 0.00 1.01 0.00 0.00 57.45 54.49 2g3m n PHE 229 Cb 0.99 -0.44 0.23 0.00 -0.01 0.00 0.00 39.48 40.25 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 3.12 0.81 -2.16 -1.08 0.11 -1.69 -3.33 132.00 127.77 2g3m h PRO 230 Ca 0.11 -0.13 -0.59 0.00 0.11 0.00 0.00 66.00 65.50 2g3m h PRO 230 Cb 0.81 -0.14 -0.42 0.00 0.11 0.00 0.00 31.00 31.37 2g3m h PRO 230 CO 0.60 0.68 -0.68 0.39 -0.21 0.00 0.00 178.00 178.78 2g3m n GLU 231 N -4.32 2.25 -0.31 1.05 1.02 -1.26 -4.94 120.64 114.13 2g3m n GLU 231 Ca 0.04 -4.44 0.10 0.00 -0.02 0.00 0.00 57.16 52.84 2g3m n GLU 231 Cb 0.17 -2.09 0.32 0.00 -0.02 0.00 0.00 31.44 29.83 2g3m n GLU 231 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2g3m h PRO 232 N 4.12 0.79 -0.57 3.49 0.13 -1.98 -1.39 132.00 136.59 2g3m h PRO 232 Ca 0.18 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 65.24 2g3m h PRO 232 Cb 0.69 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.62 2g3m h PRO 232 CO 0.78 0.52 0.26 -0.22 -0.23 0.00 0.00 178.00 179.11 2g3m h LYS 233 N 0.82 0.80 -0.25 0.86 3.64 -1.93 0.79 116.57 121.29 2g3m h LYS 233 Ca 0.47 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.69 2g3m h LYS 233 Cb 0.62 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.28 2g3m h LYS 233 CO -0.23 0.63 -0.08 -0.22 -2.27 0.00 0.00 179.45 177.28 2g3m h LYS 234 N 0.80 0.49 0.03 1.90 3.64 -1.70 -0.75 116.57 120.99 2g3m h LYS 234 Ca 0.20 -0.20 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 2g3m h LYS 234 Cb 0.10 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2g3m h LYS 234 CO -0.02 0.73 -0.14 1.25 -2.27 0.00 0.00 179.45 178.99 2g3m h LEU 235 N 0.23 -0.40 -0.52 5.20 5.85 -0.79 0.28 115.31 125.16 2g3m h LEU 235 Ca 0.06 0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.88 2g3m h LEU 235 Cb 0.56 0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 2g3m h LEU 235 CO 0.03 -0.20 0.28 0.40 -0.34 0.00 0.00 178.44 178.61 2g3m h ILE 236 N -0.25 0.98 -0.60 4.05 2.04 -0.83 -1.17 117.51 121.73 2g3m h ILE 236 Ca 0.04 -0.19 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 2g3m h ILE 236 Cb 0.29 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2g3m h ILE 236 CO -0.11 0.10 0.29 0.44 0.00 0.00 0.00 178.15 178.86 2g3m h ASP 237 N 0.54 0.78 -0.40 1.72 3.32 -0.73 -1.76 116.42 119.89 2g3m h ASP 237 Ca 0.23 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 2g3m h ASP 237 Cb 0.11 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 2g3m h ASP 237 CO -0.14 0.69 0.23 -0.33 -1.72 0.00 0.00 179.24 177.97 2g3m h GLU 238 N 0.82 0.55 -0.42 3.56 5.08 -0.58 0.23 114.58 123.82 2g3m h GLU 238 Ca 0.21 -0.05 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 2g3m h GLU 238 Cb 0.12 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2g3m h GLU 238 CO -0.03 0.42 0.12 -0.07 -1.00 0.00 0.00 179.01 178.46 2g3m h LEU 239 N 0.52 0.62 -0.58 1.33 3.38 -1.07 -2.13 115.31 117.37 2g3m h LEU 239 Ca 0.14 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2g3m h LEU 239 Cb 0.02 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2g3m h LEU 239 CO -0.03 0.67 0.13 0.45 0.09 0.00 0.00 178.44 179.76 2g3m h HIS 240 N 0.54 0.99 -0.29 1.13 3.86 -1.15 0.82 115.15 121.04 2g3m h HIS 240 Ca 0.13 -0.12 0.08 0.00 -1.16 0.00 0.00 60.37 59.31 2g3m h HIS 240 Cb 0.28 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 2g3m h HIS 240 CO 0.01 0.84 0.30 -0.22 0.86 0.00 0.00 177.93 179.73 2g3m h LYS 241 N 0.84 0.00 -0.61 2.45 3.64 -0.31 0.44 116.57 123.02 2g3m h LYS 241 Ca 0.18 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2g3m h LYS 241 Cb 0.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2g3m h LYS 241 CO 0.00 0.00 0.00 0.54 -2.27 0.00 0.00 179.45 177.72 2g3m n ARG 242 N -3.84 3.49 -2.97 1.90 1.74 -0.40 -4.95 116.66 111.62 2g3m n ARG 242 Ca 0.04 -2.79 -0.20 0.00 -0.77 0.00 0.00 57.85 54.14 2g3m n ARG 242 Cb 0.45 -1.79 0.04 0.00 -1.02 0.00 0.00 32.46 30.13 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 1.03 -5.61 -4.28 0.55 4.05 0.15 -5.01 115.26 106.14 2g3m n ASN 243 Ca 0.24 -0.27 -0.32 0.00 0.45 0.00 0.00 54.58 54.67 2g3m n ASN 243 Cb 0.82 -4.42 -0.16 0.00 1.23 0.00 0.00 39.78 37.24 2g3m n ASN 243 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2g3m s VAL 244 N -3.12 2.50 0.57 3.44 1.01 0.15 -4.83 120.40 120.12 2g3m s VAL 244 Ca 0.29 -0.86 -0.15 0.00 0.00 0.00 0.00 61.98 61.26 2g3m s VAL 244 Cb -0.13 -2.00 -0.06 0.00 0.00 0.00 0.00 36.38 34.19 2g3m s VAL 244 CO 0.36 0.54 1.01 -0.54 0.00 0.00 0.00 175.10 176.48 2g3m s LYS 245 N 0.36 3.68 -0.17 2.72 -0.14 -0.18 -3.70 119.74 122.31 2g3m s LYS 245 Ca -0.15 0.95 0.01 0.00 -1.36 0.00 0.00 55.97 55.42 2g3m s LYS 245 Cb -0.17 -2.09 0.01 0.00 -1.68 0.00 0.00 37.83 33.90 2g3m s LYS 245 CO 0.07 -0.50 -0.19 -1.17 -0.76 0.00 0.00 175.35 172.80 2g3m s LEU 246 N -4.52 2.22 -0.17 3.17 2.96 -1.26 -1.45 118.68 119.63 2g3m s LEU 246 Ca 0.59 -0.60 0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2g3m s LEU 246 Cb -0.12 -1.50 0.00 0.00 0.50 0.00 0.00 46.19 45.08 2g3m s LEU 246 CO 0.39 0.03 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.67 2g3m s ILE 247 N 1.11 2.59 -0.10 6.68 1.09 -0.57 -0.48 121.20 131.52 2g3m s ILE 247 Ca 0.00 -0.78 -0.02 0.00 -1.10 0.00 0.00 60.65 58.75 2g3m s ILE 247 Cb -0.14 -2.10 -0.03 0.00 -1.06 0.00 0.00 42.46 39.13 2g3m s ILE 247 CO -0.08 0.51 -0.03 0.42 -0.10 0.00 0.00 174.94 175.66 2g3m s THR 248 N 0.98 3.98 0.39 2.92 -4.23 -0.84 -0.72 115.64 118.12 2g3m s THR 248 Ca -0.02 -0.36 -0.25 0.00 -1.18 0.00 0.00 61.69 59.88 2g3m s THR 248 Cb -0.15 -2.68 -0.09 0.00 1.34 0.00 0.00 72.50 70.92 2g3m s THR 248 CO -0.03 0.56 1.10 -0.51 -0.54 0.00 0.00 174.62 175.21 2g3m s ILE 249 N -0.42 3.46 -0.11 2.99 2.07 -0.63 -1.45 121.20 127.11 2g3m s ILE 249 Ca 0.07 1.18 -0.03 0.00 -1.41 0.00 0.00 60.65 60.46 2g3m s ILE 249 Cb -0.12 -3.64 0.05 0.00 0.13 0.00 0.00 42.46 38.87 2g3m s ILE 249 CO 0.02 0.07 0.10 -0.69 -1.91 0.00 0.00 174.94 172.53 2g3m s VAL 250 N -1.52 -0.14 0.13 4.00 1.01 0.67 -4.84 120.40 119.71 2g3m s VAL 250 Ca 0.57 0.16 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 2g3m s VAL 250 Cb -0.26 -0.36 0.03 0.00 0.00 0.00 0.00 36.38 35.78 2g3m s VAL 250 CO 0.33 -0.02 0.18 0.47 0.00 0.00 0.00 175.10 176.06 2g3m n ASP 251 N 5.30 0.09 -0.31 3.32 8.00 -1.26 -3.03 116.55 128.66 2g3m n ASP 251 Ca -0.05 -1.12 0.05 0.00 0.71 0.00 0.00 54.79 54.39 2g3m n ASP 251 Cb 0.50 -0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.48 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 -2.01 0.00 -3.13 1.24 1.44 -1.26 -4.91 115.22 106.60 2g3m n HIS 252 Ca 0.03 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.34 2g3m n HIS 252 Cb 0.09 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.14 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 -1.19 2.14 -0.30 -1.39 0.00 -1.26 -4.31 107.32 101.01 2g3m s GLY 253 Ca 0.10 -0.22 -0.13 0.00 0.00 0.00 0.00 44.72 44.47 2g3m s GLY 253 CO 0.21 1.25 0.28 -0.42 0.00 0.00 0.00 173.10 174.42 2g3m s ILE 254 N 1.67 5.24 0.20 0.90 -1.09 -0.16 -4.66 121.20 123.30 2g3m s ILE 254 Ca 0.29 0.20 -0.31 0.00 -2.23 0.00 0.00 60.65 58.60 2g3m s ILE 254 Cb -0.16 -3.66 -0.11 0.00 -1.58 0.00 0.00 42.46 36.95 2g3m s ILE 254 CO 0.11 0.12 1.62 -0.60 -1.23 0.00 0.00 174.94 174.96 2g3m s ARG 255 N 1.89 4.18 -1.17 2.79 3.52 -1.26 -0.85 118.95 128.05 2g3m s ARG 255 Ca 0.10 2.47 -0.21 0.00 -0.13 0.00 0.00 55.73 57.96 2g3m s ARG 255 Cb -0.16 -3.11 0.03 0.00 -1.56 0.00 0.00 34.95 30.15 2g3m s ARG 255 CO 0.11 -0.65 1.69 0.08 -0.81 0.00 0.00 175.30 175.72 2g3m s VAL 256 N 0.99 3.93 -0.09 7.11 1.01 -0.36 -4.68 120.40 128.31 2g3m s VAL 256 Ca 0.71 -1.30 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2g3m s VAL 256 Cb -0.46 -4.97 0.02 0.00 0.00 0.00 0.00 36.38 30.96 2g3m s VAL 256 CO 0.34 -1.77 -0.09 -0.62 0.00 0.00 0.00 175.10 172.96 2g3m s ASP 257 N 5.08 1.93 0.59 3.32 -1.08 -1.26 -4.95 116.67 120.30 2g3m s ASP 257 Ca 0.55 -0.28 0.29 0.00 -0.52 0.00 0.00 52.55 52.59 2g3m s ASP 257 Cb 0.01 -0.79 1.63 0.00 -1.46 0.00 0.00 42.92 42.31 2g3m s ASP 257 CO 0.02 -0.07 2.05 1.56 0.52 0.00 0.00 175.17 179.25 2g3m h GLN 258 N 7.72 0.00 -0.01 4.34 4.20 -2.02 -2.25 115.11 127.10 2g3m h GLN 258 Ca -0.30 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.40 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 0.43 0.00 -0.07 0.09 -0.67 0.00 0.00 178.83 178.60 2g3m n ASN 259 N -3.72 2.30 -4.42 1.46 4.13 -1.26 -4.95 115.26 108.80 2g3m n ASN 259 Ca 0.03 -3.21 -0.43 0.00 1.68 0.00 0.00 54.58 52.65 2g3m n ASN 259 Cb 0.40 -0.45 -0.10 0.00 -1.54 0.00 0.00 39.78 38.10 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 -2.93 3.25 0.22 3.10 5.04 -0.85 -5.00 117.35 120.18 2g3m s TYR 260 Ca 0.33 -0.78 -0.18 0.00 -2.44 0.00 0.00 57.07 54.01 2g3m s TYR 260 Cb 0.30 -2.69 0.22 0.00 0.35 0.00 0.00 41.96 40.14 2g3m s TYR 260 CO 0.02 -0.65 1.57 1.03 -1.34 0.00 0.00 175.55 176.17 2g3m h SER 261 N 8.60 -1.21 -0.43 4.32 0.87 -1.92 -0.82 113.55 122.96 2g3m h SER 261 Ca -0.27 0.27 0.07 0.00 -1.23 0.00 0.00 61.79 60.63 2g3m h SER 261 Cb 1.11 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 0.29 -0.65 -0.53 0.00 0.00 176.83 176.39 2g3m h PRO 262 N -0.07 0.28 -0.31 2.24 0.11 -1.94 0.72 132.00 133.03 2g3m h PRO 262 Ca 0.31 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.34 2g3m h PRO 262 Cb 0.58 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 2g3m h PRO 262 CO -0.85 0.19 -0.05 0.35 -0.21 0.00 0.00 178.00 177.43 2g3m h PHE 263 N 0.29 0.65 -0.32 0.65 3.57 -1.43 -0.23 116.94 120.12 2g3m h PHE 263 Ca 0.19 -0.13 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 2g3m h PHE 263 Cb 0.38 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 2g3m h PHE 263 CO -0.00 0.75 -0.26 -0.07 -2.23 0.00 0.00 178.31 176.50 2g3m h LEU 264 N 0.36 0.78 -0.38 0.59 3.38 -1.00 -2.72 115.31 116.33 2g3m h LEU 264 Ca 0.08 -0.45 -0.10 0.00 0.09 0.00 0.00 57.88 57.50 2g3m h LEU 264 Cb 0.53 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 2g3m h LEU 264 CO 0.03 1.07 -0.46 0.77 0.09 0.00 0.00 178.44 179.93 2g3m h SER 265 N 0.50 0.00 1.17 -0.43 4.64 -0.91 -3.14 113.55 115.39 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 0.83 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 2g3m h SER 265 CO 0.07 0.46 -0.20 0.61 -0.87 0.00 0.00 176.83 176.90 2g3m n GLY 266 N 0.84 -1.57 3.60 -0.77 0.00 -0.10 -4.90 105.19 102.29 2g3m n GLY 266 Ca 0.01 -0.12 -0.53 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.05 1.10 0.00 1.61 0.00 -1.03 -0.49 117.12 116.26 2g3m n MET 267 Ca 0.05 0.40 0.00 0.00 0.00 0.00 0.00 57.70 58.15 2g3m n MET 267 Cb 0.41 -2.04 0.00 0.00 0.00 0.00 0.00 33.22 31.59 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 2.63 2.71 0.47 -5.12 0.00 -1.26 -4.89 105.19 99.73 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 -1.72 2.82 -2.80 1.61 5.02 0.36 -5.04 118.16 118.41 2g3m n LYS 269 Ca 0.00 -2.05 -0.26 0.00 -2.02 0.00 0.00 58.31 53.99 2g3m n LYS 269 Cb 0.00 -1.29 0.01 0.00 -0.02 0.00 0.00 35.03 33.72 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 -1.37 3.41 0.49 2.13 0.08 -1.25 -1.18 117.98 120.29 2g3m s PHE 270 Ca 0.20 0.57 -0.22 0.00 0.12 0.00 0.00 56.93 57.60 2g3m s PHE 270 Cb 0.13 -2.32 -0.07 0.00 -0.57 0.00 0.00 43.02 40.19 2g3m s PHE 270 CO 0.10 -0.33 1.13 0.00 -0.10 0.00 0.00 175.22 176.02 2g3m s GLU 272 N -2.94 2.17 0.32 0.00 2.02 -1.22 -1.04 118.70 118.02 2g3m s GLU 272 Ca 0.67 -2.38 0.09 0.00 0.02 0.00 0.00 54.97 53.37 2g3m s GLU 272 Cb -0.25 -1.39 -0.05 0.00 0.10 0.00 0.00 34.13 32.54 2g3m s GLU 272 CO 0.30 -0.39 0.03 0.96 0.02 0.00 0.00 175.26 176.17 2g3m s ILE 273 N -2.93 2.85 0.21 -1.63 -4.36 -0.57 -0.70 121.20 114.08 2g3m s ILE 273 Ca 0.07 -1.93 -0.15 0.00 -0.26 0.00 0.00 60.65 58.39 2g3m s ILE 273 Cb 0.01 -2.82 0.24 0.00 1.25 0.00 0.00 42.46 41.14 2g3m s ILE 273 CO 0.04 -0.24 1.38 -0.62 0.24 0.00 0.00 174.94 175.75 2g3m n GLU 274 N -0.97 -0.20 0.00 0.37 -0.58 0.24 -0.74 120.64 118.77 2g3m n GLU 274 Ca -0.04 1.37 0.04 0.00 -0.42 0.00 0.00 57.16 58.11 2g3m n GLU 274 Cb 0.61 -2.04 0.20 0.00 -0.57 0.00 0.00 31.44 29.65 2g3m n GLU 274 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2g3m n SER 275 N -5.33 0.00 0.00 1.62 3.41 -1.26 -4.87 113.62 107.20 2g3m n SER 275 Ca 0.10 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 2g3m n SER 275 Cb 0.37 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 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 -0.61 2.83 3.81 5.00 0.00 0.08 -5.09 105.19 111.21 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 -0.51 0.97 0.57 1.61 8.01 -1.26 -4.76 118.70 123.33 2g3m s GLU 277 Ca 0.00 0.13 -0.17 0.00 0.01 0.00 0.00 54.97 54.94 2g3m s GLU 277 Cb 0.00 -1.83 -0.05 0.00 -4.31 0.00 0.00 34.13 27.94 2g3m s GLU 277 CO 0.00 -2.28 1.07 -0.51 0.01 0.00 0.00 175.26 173.54 2g3m s LEU 278 N -6.03 3.59 -0.44 1.80 1.43 -1.26 -1.51 118.68 116.26 2g3m s LEU 278 Ca 0.66 1.90 -0.25 0.00 -1.03 0.00 0.00 54.13 55.41 2g3m s LEU 278 Cb -0.12 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.58 2g3m s LEU 278 CO 0.53 -1.13 0.89 0.12 0.23 0.00 0.00 176.35 176.98 2g3m s PHE 279 N -2.26 2.97 -0.24 0.29 5.36 -0.20 -4.56 117.98 119.33 2g3m s PHE 279 Ca 0.66 0.39 -0.07 0.00 -0.96 0.00 0.00 56.93 56.95 2g3m s PHE 279 Cb -0.17 -3.83 -0.03 0.00 -0.34 0.00 0.00 43.02 38.65 2g3m s PHE 279 CO 0.32 -1.02 0.06 0.08 -1.46 0.00 0.00 175.22 173.20 2g3m s VAL 280 N 3.58 4.28 0.00 3.12 1.01 -1.26 -4.30 120.40 126.82 2g3m s VAL 280 Ca 0.35 -0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2g3m s VAL 280 Cb -0.11 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.28 2g3m s VAL 280 CO 0.24 0.36 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2g3m n GLY 281 N 4.74 5.90 2.95 4.51 0.00 0.10 -4.94 105.19 118.46 2g3m n GLY 281 Ca -0.16 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 43.99 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 1.60 0.79 0.00 1.61 -0.14 -1.26 -1.07 119.74 121.27 2g3m s LYS 282 Ca 0.00 -0.21 0.00 0.00 -1.36 0.00 0.00 55.97 54.40 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 0.05 0.00 -0.12 -0.76 0.00 0.00 175.35 174.52 2g3m n MET 283 N 3.47 0.00 -0.27 1.68 1.56 -0.60 -0.67 117.12 122.29 2g3m n MET 283 Ca -0.20 0.00 0.07 0.00 -0.27 0.00 0.00 57.70 57.30 2g3m n MET 283 Cb 0.54 0.00 0.19 0.00 2.15 0.00 0.00 33.22 36.10 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 0.93 0.05 0.00 1.12 -0.00 -1.96 0.11 115.95 116.20 2g3m h TRP 284 Ca 0.00 0.05 0.00 0.00 -0.00 0.00 0.00 58.89 58.94 2g3m h TRP 284 Cb 0.00 0.10 0.00 0.00 -0.00 0.00 0.00 29.16 29.26 2g3m h TRP 284 CO 0.00 -0.23 0.00 -2.30 -0.00 0.00 0.00 178.44 175.91 2g3m n PRO 285 N -5.31 0.05 0.00 0.49 -0.02 -1.26 -4.84 135.00 124.11 2g3m n PRO 285 Ca 0.15 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 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 -0.24 0.78 3.69 -1.23 0.00 0.40 -4.92 105.19 103.67 2g3m n GLY 286 Ca 0.04 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 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 3.04 0.07 2.61 2.01 -1.26 -1.56 115.64 120.55 2g3m s THR 287 Ca 0.00 0.50 -0.03 0.00 0.31 0.00 0.00 61.69 62.47 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 -0.00 0.05 0.42 -0.69 0.00 0.00 174.62 174.40 2g3m s THR 288 N 2.57 0.19 0.31 -0.82 -4.23 -0.23 -1.22 115.64 112.19 2g3m s THR 288 Ca 0.73 -1.63 0.08 0.00 -1.18 0.00 0.00 61.69 59.70 2g3m s THR 288 Cb -0.40 -1.51 -0.06 0.00 1.34 0.00 0.00 72.50 71.87 2g3m s THR 288 CO 0.32 -0.85 -0.09 0.68 -0.54 0.00 0.00 174.62 174.14 2g3m s VAL 289 N -3.91 1.99 -0.02 2.29 -7.23 -0.03 0.02 120.40 113.52 2g3m s VAL 289 Ca 0.08 -2.19 0.05 0.00 -1.81 0.00 0.00 61.98 58.11 2g3m s VAL 289 Cb 0.07 -2.51 -0.01 0.00 0.56 0.00 0.00 36.38 34.49 2g3m s VAL 289 CO -0.09 -0.28 -0.17 -0.31 -0.31 0.00 0.00 175.10 173.94 2g3m s TYR 290 N -2.78 1.54 0.28 2.82 1.51 -1.26 -0.98 117.35 118.47 2g3m s TYR 290 Ca 0.31 -0.32 -0.29 0.00 -1.01 0.00 0.00 57.07 55.75 2g3m s TYR 290 Cb 0.02 -1.00 -0.10 0.00 -0.11 0.00 0.00 41.96 40.77 2g3m s TYR 290 CO 0.14 -0.05 1.26 -1.25 -1.11 0.00 0.00 175.55 174.54 2g3m s PRO 291 N -0.30 4.43 -1.16 -1.71 0.04 -1.26 0.37 135.00 135.40 2g3m s PRO 291 Ca 0.04 2.08 -0.17 0.00 0.04 0.00 0.00 61.00 62.99 2g3m s PRO 291 Cb -0.07 -3.13 0.12 0.00 0.04 0.00 0.00 34.50 31.45 2g3m s PRO 291 CO -0.00 -0.12 1.47 0.34 0.04 0.00 0.00 177.00 178.73 2g3m s ASP 292 N -0.34 6.86 0.08 6.66 2.15 -0.32 -4.64 116.67 127.12 2g3m s ASP 292 Ca 0.50 -2.49 0.05 0.00 0.43 0.00 0.00 52.55 51.05 2g3m s ASP 292 Cb -0.37 -2.47 0.28 0.00 -0.30 0.00 0.00 42.92 40.06 2g3m s ASP 292 CO 0.46 -1.01 1.15 0.49 -0.17 0.00 0.00 175.17 176.09 2g3m n PHE 293 N 6.98 0.18 0.34 -5.34 3.72 -1.26 -1.54 117.46 120.54 2g3m n PHE 293 Ca 0.37 0.09 0.15 0.00 -0.05 0.00 0.00 57.45 58.01 2g3m n PHE 293 Cb 0.46 -0.64 0.54 0.00 -0.94 0.00 0.00 39.48 38.90 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 -3.17 1.38 0.04 -1.88 -3.43 116.94 109.87 2g3m h PHE 294 Ca 0.00 0.00 -0.58 0.00 2.80 0.00 0.00 57.97 60.19 2g3m h PHE 294 Cb 0.02 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.12 2g3m h PHE 294 CO 0.00 0.00 -0.09 1.03 -0.60 0.00 0.00 178.31 178.65 2g3m s ARG 295 N -3.45 4.13 0.14 1.51 0.52 -0.59 -4.39 118.95 116.83 2g3m s ARG 295 Ca 0.04 0.61 -0.15 0.00 -0.52 0.00 0.00 55.73 55.71 2g3m s ARG 295 Cb 0.09 -3.25 0.02 0.00 0.52 0.00 0.00 34.95 32.32 2g3m s ARG 295 CO 0.51 0.60 1.72 0.93 0.02 0.00 0.00 175.30 179.09 2g3m h GLU 296 N 4.83 0.64 -0.59 3.54 5.08 -1.88 -1.76 114.58 124.44 2g3m h GLU 296 Ca -0.49 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 57.73 2g3m h GLU 296 Cb 1.21 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.32 2g3m h GLU 296 CO 0.64 0.55 0.22 0.38 -1.00 0.00 0.00 179.01 179.80 2g3m h ASP 297 N 0.57 0.79 -0.33 1.42 2.03 -1.94 -0.04 116.42 118.91 2g3m h ASP 297 Ca 0.15 -0.11 -0.03 0.00 -0.73 0.00 0.00 57.03 56.31 2g3m h ASP 297 Cb 0.13 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.41 2g3m h ASP 297 CO -0.02 0.72 0.09 0.74 -1.03 0.00 0.00 179.24 179.74 2g3m h THR 298 N 0.84 1.21 -0.96 1.15 2.02 -1.79 0.44 112.91 115.83 2g3m h THR 298 Ca 0.20 -0.71 0.01 0.00 0.77 0.00 0.00 66.41 66.68 2g3m h THR 298 Cb 0.19 1.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.61 2g3m h THR 298 CO -0.02 0.24 0.64 0.03 0.37 0.00 0.00 175.52 176.78 2g3m h ARG 299 N 0.38 1.25 -0.37 6.66 3.08 -0.75 0.28 114.38 124.91 2g3m h ARG 299 Ca 0.10 -0.08 -0.14 0.00 0.07 0.00 0.00 59.98 59.94 2g3m h ARG 299 Cb 0.28 -0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2g3m h ARG 299 CO -0.00 0.83 -0.32 1.49 -1.07 0.00 0.00 179.97 180.90 2g3m h GLU 300 N 1.29 0.86 -0.41 0.04 4.81 -0.67 -1.01 114.58 119.49 2g3m h GLU 300 Ca 0.36 -0.44 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2g3m h GLU 300 Cb -0.13 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2g3m h GLU 300 CO -0.08 1.08 0.23 2.35 -0.73 0.00 0.00 179.01 181.86 2g3m h TRP 301 N 0.66 0.56 -0.62 0.92 7.01 -0.36 -2.23 115.95 121.91 2g3m h TRP 301 Ca 0.06 -0.01 -0.08 0.00 2.11 0.00 0.00 58.89 60.97 2g3m h TRP 301 Cb 0.90 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.76 2g3m h TRP 301 CO 0.06 0.42 0.07 2.35 -2.79 0.00 0.00 178.44 178.56 2g3m h TRP 302 N 0.53 1.11 -0.97 2.65 2.91 -0.85 -2.36 115.95 118.98 2g3m h TRP 302 Ca 0.15 -0.17 0.05 0.00 1.13 0.00 0.00 58.89 60.05 2g3m h TRP 302 Cb 0.04 -0.30 -0.06 0.00 -0.51 0.00 0.00 29.16 28.33 2g3m h TRP 302 CO -0.03 0.96 0.63 0.00 -1.03 0.00 0.00 178.44 178.98 2g3m h ALA 303 N 1.01 1.41 -0.51 2.65 0.00 -1.00 0.88 119.26 123.71 2g3m h ALA 303 Ca 0.18 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2g3m h ALA 303 Cb 0.47 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2g3m h ALA 303 CO 0.02 0.46 0.03 0.78 0.00 0.00 0.00 179.25 180.53 2g3m h GLY 304 N 1.16 0.95 1.36 0.00 0.00 -1.05 0.25 103.07 105.75 2g3m h GLY 304 Ca 0.41 -0.68 -0.08 0.00 0.00 0.00 0.00 47.33 46.97 2g3m h GLY 304 CO -0.15 0.63 -0.06 1.41 0.00 0.00 0.00 176.54 178.37 2g3m h LEU 305 N 0.76 0.75 -0.00 3.11 3.38 -0.78 -0.37 115.31 122.15 2g3m h LEU 305 Ca 0.15 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 2g3m h LEU 305 Cb 0.48 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2g3m h LEU 305 CO 0.02 0.85 -0.00 0.40 0.09 0.00 0.00 178.44 179.80 2g3m h ILE 306 N 0.71 1.29 -0.90 1.22 1.08 -0.58 -1.04 117.51 119.29 2g3m h ILE 306 Ca 0.13 -0.84 0.08 0.00 -0.39 0.00 0.00 64.86 63.84 2g3m h ILE 306 Cb 0.52 1.85 -0.07 0.00 -3.07 0.00 0.00 36.82 36.05 2g3m h ILE 306 CO 0.03 0.22 0.55 -1.28 -0.69 0.00 0.00 178.15 176.98 2g3m h SER 307 N -0.35 0.84 -0.61 1.72 0.87 -0.35 0.43 113.55 116.11 2g3m h SER 307 Ca 0.00 0.03 -0.02 0.00 -1.23 0.00 0.00 61.79 60.56 2g3m h SER 307 Cb 0.36 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 62.15 2g3m h SER 307 CO 0.00 0.51 0.28 -0.08 -0.53 0.00 0.00 176.83 177.02 2g3m h GLU 308 N 0.96 0.88 -0.53 2.24 4.81 -0.94 -1.51 114.58 120.49 2g3m h GLU 308 Ca 0.41 -0.13 -0.11 0.00 -0.13 0.00 0.00 59.36 59.39 2g3m h GLU 308 Cb 0.27 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2g3m h GLU 308 CO -0.21 0.72 -0.10 2.35 -0.73 0.00 0.00 179.01 181.04 2g3m h TRP 309 N 0.83 1.10 -0.05 0.92 2.91 0.30 -2.94 115.95 119.03 2g3m h TRP 309 Ca 0.21 -0.22 -0.09 0.00 1.13 0.00 0.00 58.89 59.91 2g3m h TRP 309 Cb 0.13 -0.27 -0.01 0.00 -0.51 0.00 0.00 29.16 28.49 2g3m h TRP 309 CO 0.00 1.02 -0.41 -0.07 -1.03 0.00 0.00 178.44 177.95 2g3m h LEU 310 N 0.88 0.10 -1.06 0.65 3.38 0.03 -3.13 115.31 116.17 2g3m h LEU 310 Ca 0.14 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2g3m h LEU 310 Cb 0.65 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.38 2g3m h LEU 310 CO 0.05 0.51 0.00 -1.54 0.09 0.00 0.00 178.44 177.54 2g3m n SER 311 N -4.04 0.46 0.19 -0.43 3.41 -0.59 -0.97 113.62 111.65 2g3m n SER 311 Ca -0.02 0.70 0.13 0.00 -0.26 0.00 0.00 58.87 59.43 2g3m n SER 311 Cb 0.46 -0.77 0.36 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 -1.69 -3.46 115.11 118.50 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 0.87 1.46 3.73 3.46 0.00 -0.15 -4.98 105.19 109.58 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 3.41 -0.11 1.61 1.01 -1.15 -4.79 120.40 118.37 2g3m s VAL 314 Ca 0.00 1.10 0.17 0.00 0.00 0.00 0.00 61.98 63.25 2g3m s VAL 314 Cb 0.00 -3.71 -0.16 0.00 0.00 0.00 0.00 36.38 32.51 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 3.07 0.79 -3.86 3.32 8.00 0.37 -4.73 116.55 123.50 2g3m n ASP 315 Ca 0.07 0.35 -0.09 0.00 0.71 0.00 0.00 54.79 55.83 2g3m n ASP 315 Cb 0.43 0.24 -0.07 0.00 -0.02 0.00 0.00 41.12 41.70 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 -4.86 0.16 -0.11 0.44 0.00 -0.76 -4.41 107.32 97.78 2g3m s GLY 316 Ca -0.04 -0.63 0.03 0.00 0.00 0.00 0.00 44.72 44.08 2g3m s GLY 316 CO 0.82 -0.76 -0.23 -0.42 0.00 0.00 0.00 173.10 172.51 2g3m s ILE 317 N -3.88 2.14 -0.43 0.90 -1.09 -0.52 -2.00 121.20 116.33 2g3m s ILE 317 Ca 0.08 -0.98 -0.05 0.00 -2.23 0.00 0.00 60.65 57.47 2g3m s ILE 317 Cb 0.04 -1.83 0.11 0.00 -1.58 0.00 0.00 42.46 39.20 2g3m s ILE 317 CO -0.08 0.55 0.25 0.86 -1.23 0.00 0.00 174.94 175.29 2g3m s TRP 318 N 0.48 3.51 -0.34 3.97 -0.00 -0.53 -1.19 118.94 124.84 2g3m s TRP 318 Ca -0.15 -2.16 -0.27 0.00 -0.00 0.00 0.00 56.10 53.53 2g3m s TRP 318 Cb -0.17 -3.27 0.01 0.00 -0.00 0.00 0.00 33.47 30.05 2g3m s TRP 318 CO 0.06 -0.97 0.97 -0.51 -0.00 0.00 0.00 176.95 176.49 2g3m s LEU 319 N 1.24 3.98 0.32 5.86 1.43 0.21 -0.24 118.68 131.48 2g3m s LEU 319 Ca 0.07 0.77 0.09 0.00 -1.03 0.00 0.00 54.13 54.02 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 -0.03 -0.84 -0.09 -0.62 0.23 0.00 0.00 176.35 175.01 2g3m s ASP 320 N 1.77 3.39 -0.91 2.29 2.15 -1.17 -2.39 116.67 121.80 2g3m s ASP 320 Ca 0.40 -1.19 0.00 0.00 0.43 0.00 0.00 52.55 52.19 2g3m s ASP 320 Cb -0.12 -0.28 0.00 0.00 -0.30 0.00 0.00 42.92 42.21 2g3m s ASP 320 CO 0.17 -0.24 0.00 0.23 -0.17 0.00 0.00 175.17 175.16 2g3m n MET 321 N -0.71 -1.76 -0.53 4.34 2.81 -1.26 -4.19 117.12 115.82 2g3m n MET 321 Ca -0.05 0.77 -0.09 0.00 -1.81 0.00 0.00 57.70 56.52 2g3m n MET 321 Cb 0.63 -5.15 0.05 0.00 -0.71 0.00 0.00 33.22 28.04 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 -0.97 4.20 -0.32 7.83 6.94 -1.26 -1.61 115.26 130.06 2g3m n ASN 322 Ca -0.09 -2.65 0.02 0.00 -0.02 0.00 0.00 54.58 51.85 2g3m n ASN 322 Cb 0.55 -0.77 0.21 0.00 -2.36 0.00 0.00 39.78 37.41 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 1.08 -6.63 -3.83 3.07 -1.90 -3.29 114.58 103.75 2g3m h GLU 323 Ca 0.21 -0.07 -0.51 0.00 -0.50 0.00 0.00 59.36 58.50 2g3m h GLU 323 Cb 1.41 -0.24 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 2g3m h GLU 323 CO 0.43 0.72 0.10 -1.25 -1.40 0.00 0.00 179.01 177.61 2g3m s PRO 324 N -5.96 4.15 -0.00 2.33 0.04 -1.26 -4.59 135.00 129.71 2g3m s PRO 324 Ca -0.12 0.78 -0.01 0.00 0.04 0.00 0.00 61.00 61.70 2g3m s PRO 324 Cb 0.19 -2.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 2g3m s PRO 324 CO 0.80 0.30 0.10 0.99 0.04 0.00 0.00 177.00 179.23 2g3m s THR 325 N -1.71 4.85 -0.08 1.26 2.01 -0.64 -4.04 115.64 117.29 2g3m s THR 325 Ca 0.48 -0.38 -0.07 0.00 0.31 0.00 0.00 61.69 62.03 2g3m s THR 325 Cb -0.14 -3.23 0.02 0.00 0.01 0.00 0.00 72.50 69.16 2g3m s THR 325 CO 0.19 0.33 0.20 -0.62 -0.69 0.00 0.00 174.62 174.04 2g3m s ASP 326 N -1.81 -0.20 0.00 3.53 2.15 0.33 -4.96 116.67 115.70 2g3m s ASP 326 Ca 0.24 0.40 0.18 0.00 0.43 0.00 0.00 52.55 53.80 2g3m s ASP 326 Cb -0.12 0.39 0.34 0.00 -0.30 0.00 0.00 42.92 43.23 2g3m s ASP 326 CO 0.15 -0.08 1.27 0.49 -0.17 0.00 0.00 175.17 176.83 2g3m n PHE 327 N 3.10 0.42 -0.34 -5.34 3.72 0.16 -4.36 117.46 114.82 2g3m n PHE 327 Ca -0.14 -0.28 0.00 0.00 -0.05 0.00 0.00 57.45 56.99 2g3m n PHE 327 Cb 0.58 -0.01 0.14 0.00 -0.94 0.00 0.00 39.48 39.25 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 3.44 0.98 -0.22 4.37 4.64 -1.90 -1.32 113.55 123.54 2g3m h SER 328 Ca 0.00 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2g3m h SER 328 Cb 0.83 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.70 2g3m h SER 328 CO 0.00 0.66 -0.04 0.03 -0.87 0.00 0.00 176.83 176.60 2g3m h ARG 329 N 1.14 0.42 -0.31 4.77 -0.00 -1.82 -1.28 114.38 117.29 2g3m h ARG 329 Ca 0.38 -0.15 -0.00 0.00 -0.50 0.00 0.00 59.98 59.70 2g3m h ARG 329 Cb 0.07 -0.03 -0.01 0.00 0.00 0.00 0.00 29.97 30.00 2g3m h ARG 329 CO -0.14 0.65 0.18 0.00 0.00 0.00 0.00 179.97 180.65 2g3m h ALA 330 N 0.76 0.40 -0.52 0.04 0.00 -1.72 -1.49 119.26 116.73 2g3m h ALA 330 Ca 0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2g3m h ALA 330 Cb 0.49 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2g3m h ALA 330 CO 0.02 -0.08 0.21 0.82 0.00 0.00 0.00 179.25 180.21 2g3m h ILE 331 N 0.39 1.19 -0.10 0.00 2.04 -1.25 -1.87 117.51 117.91 2g3m h ILE 331 Ca 0.11 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2g3m h ILE 331 Cb 0.04 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 2g3m h ILE 331 CO -0.02 0.24 0.06 -0.08 0.00 0.00 0.00 178.15 178.35 2g3m h GLU 332 N 0.74 0.13 -0.49 2.37 4.81 -0.67 -0.63 114.58 120.84 2g3m h GLU 332 Ca 0.18 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 2g3m h GLU 332 Cb 0.15 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 2g3m h GLU 332 CO -0.02 0.11 0.30 0.82 -0.73 0.00 0.00 179.01 179.49 2g3m h ILE 333 N 0.11 1.14 -0.07 2.32 2.04 -1.00 -2.51 117.51 119.54 2g3m h ILE 333 Ca 0.03 -0.31 -0.02 0.00 1.00 0.00 0.00 64.86 65.56 2g3m h ILE 333 Cb 0.01 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.56 2g3m h ILE 333 CO -0.01 0.14 -0.06 -0.09 0.00 0.00 0.00 178.15 178.13 2g3m h ARG 334 N 0.65 0.10 -0.27 2.37 1.12 -0.99 -1.72 114.38 115.64 2g3m h ARG 334 Ca 0.18 -0.01 -0.19 0.00 -1.11 0.00 0.00 59.98 58.84 2g3m h ARG 334 Cb -0.03 -0.02 0.00 0.00 -0.01 0.00 0.00 29.97 29.92 2g3m h ARG 334 CO -0.03 0.18 -0.58 -0.44 -3.11 0.00 0.00 179.97 175.98 2g3m h ASP 335 N 0.10 0.97 0.09 -3.80 3.32 -0.69 -1.18 116.42 115.24 2g3m h ASP 335 Ca 0.02 -0.55 -0.27 0.00 0.02 0.00 0.00 57.03 56.25 2g3m h ASP 335 Cb 0.19 -0.28 0.03 0.00 0.22 0.00 0.00 39.33 39.48 2g3m h ASP 335 CO 0.01 1.34 -1.12 0.58 -1.72 0.00 0.00 179.24 178.33 2g3m h VAL 336 N 0.64 1.31 -0.45 -1.35 2.07 -1.29 -3.32 116.25 113.87 2g3m h VAL 336 Ca 0.00 -2.39 -0.01 0.00 0.82 0.00 0.00 66.70 65.12 2g3m h VAL 336 Cb 1.20 2.68 -0.01 0.00 -1.52 0.00 0.00 31.29 33.64 2g3m h VAL 336 CO 0.13 0.72 0.01 0.18 0.02 0.00 0.00 177.57 178.63 2g3m n LEU 337 N -3.87 4.98 -0.14 2.57 4.77 -0.67 -4.58 117.00 120.06 2g3m n LEU 337 Ca -0.13 -2.99 -0.03 0.00 -0.03 0.00 0.00 56.01 52.82 2g3m n LEU 337 Cb 0.93 -0.63 0.05 0.00 -2.33 0.00 0.00 43.42 41.44 2g3m n LEU 337 CO 0.56 0.66 0.90 -1.28 -1.33 0.00 0.00 177.39 176.91 2g3m h SER 338 N 3.00 -0.01 0.00 -1.43 0.87 -1.31 -3.21 113.55 111.46 2g3m h SER 338 Ca 0.01 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.65 2g3m h SER 338 Cb 1.77 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.85 2g3m h SER 338 CO 0.39 0.03 0.00 -1.54 -0.53 0.00 0.00 176.83 175.18 2g3m n SER 339 N -5.11 0.00 -1.17 6.23 3.41 -1.26 -4.81 113.62 110.91 2g3m n SER 339 Ca 0.04 0.83 -0.17 0.00 -0.26 0.00 0.00 58.87 59.32 2g3m n SER 339 Cb 0.22 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 63.78 2g3m n SER 339 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2g3m n LEU 340 N -1.56 0.27 -2.90 1.04 7.94 -1.21 -4.72 117.00 115.85 2g3m n LEU 340 Ca 0.00 0.26 -0.21 0.00 -1.11 0.00 0.00 56.01 54.95 2g3m n LEU 340 Cb 0.00 -0.23 -0.05 0.00 0.53 0.00 0.00 43.42 43.67 2g3m n LEU 340 CO 0.00 -0.21 2.24 -0.81 -1.11 0.00 0.00 177.39 177.50 2g3m n PRO 341 N 1.32 2.18 -4.33 1.96 -0.04 -1.26 -4.85 135.00 129.99 2g3m n PRO 341 Ca 0.10 -1.37 -0.21 0.00 -0.04 0.00 0.00 63.50 61.98 2g3m n PRO 341 Cb -0.01 -2.34 -0.11 0.00 -0.04 0.00 0.00 33.50 31.00 2g3m n PRO 341 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2g3m s VAL 342 N 2.64 1.77 -0.16 0.52 1.01 -1.26 -5.13 120.40 119.79 2g3m s VAL 342 Ca 0.47 -1.92 -0.16 0.00 0.00 0.00 0.00 61.98 60.37 2g3m s VAL 342 Cb 0.15 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2g3m s VAL 342 CO -0.03 -0.35 0.38 -1.58 0.00 0.00 0.00 175.10 173.52 2g3m s GLN 343 N -2.85 4.25 0.46 2.72 0.74 -1.26 -5.08 119.66 118.64 2g3m s GLN 343 Ca 0.16 0.22 -0.13 0.00 0.05 0.00 0.00 55.36 55.66 2g3m s GLN 343 Cb -0.05 -3.47 -0.07 0.00 1.10 0.00 0.00 33.01 30.52 2g3m s GLN 343 CO 0.06 0.12 0.87 -0.06 -0.55 0.00 0.00 175.29 175.73 2g3m s PHE 344 N 0.80 3.48 -0.15 1.67 0.08 -1.26 -5.04 117.98 117.56 2g3m s PHE 344 Ca 0.20 1.21 -0.19 0.00 0.12 0.00 0.00 56.93 58.26 2g3m s PHE 344 Cb -0.14 -2.58 -0.04 0.00 -0.57 0.00 0.00 43.02 39.69 2g3m s PHE 344 CO 0.07 -0.24 0.55 -0.98 -0.10 0.00 0.00 175.22 174.51 2g3m s ARG 345 N -4.04 4.29 -0.98 0.44 1.70 -1.26 -4.99 118.95 114.11 2g3m s ARG 345 Ca 0.54 0.53 -0.23 0.00 -0.47 0.00 0.00 55.73 56.10 2g3m s ARG 345 Cb -0.10 -3.50 0.06 0.00 -0.57 0.00 0.00 34.95 30.84 2g3m s ARG 345 CO 0.33 -0.01 1.39 0.34 -1.08 0.00 0.00 175.30 176.28 2g3m s ASP 346 N 0.89 6.49 -0.54 -2.89 -1.08 -1.26 -4.93 116.67 113.34 2g3m s ASP 346 Ca 0.28 -1.44 -0.21 0.00 -0.52 0.00 0.00 52.55 50.65 2g3m s ASP 346 Cb -0.16 -2.55 0.06 0.00 -1.46 0.00 0.00 42.92 38.81 2g3m s ASP 346 CO 0.11 -1.48 0.78 -0.62 0.52 0.00 0.00 175.17 174.48 2g3m s ASP 347 N 4.71 6.26 0.39 -0.34 2.15 -1.26 -4.92 116.67 123.65 2g3m s ASP 347 Ca 0.43 -0.76 0.07 0.00 0.43 0.00 0.00 52.55 52.72 2g3m s ASP 347 Cb -0.01 -2.36 0.80 0.00 -0.30 0.00 0.00 42.92 41.05 2g3m s ASP 347 CO -0.08 -1.09 2.01 0.03 -0.17 0.00 0.00 175.17 175.87 2g3m h ARG 348 N 9.18 0.64 0.00 4.34 2.47 -1.92 -1.48 114.38 127.61 2g3m h ARG 348 Ca -0.27 -0.04 0.00 0.00 -1.26 0.00 0.00 59.98 58.41 2g3m h ARG 348 Cb 1.08 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 2g3m h ARG 348 CO 1.04 0.42 0.00 1.28 0.56 0.00 0.00 179.97 183.27 2g3m n LEU 349 N -4.47 0.16 0.21 3.04 4.77 -1.26 -1.22 117.00 118.23 2g3m n LEU 349 Ca 0.07 0.57 0.14 0.00 -0.03 0.00 0.00 56.01 56.76 2g3m n LEU 349 Cb 0.16 -0.58 0.49 0.00 -2.33 0.00 0.00 43.42 41.15 2g3m n LEU 349 CO 0.35 -0.58 0.91 1.62 -1.33 0.00 0.00 177.39 178.36 2g3m h VAL 350 N 0.00 0.00 -0.04 4.08 3.04 -1.68 -2.98 116.25 118.67 2g3m h VAL 350 Ca 0.00 -0.55 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 2g3m h VAL 350 Cb 0.05 1.49 0.00 0.00 -2.01 0.00 0.00 31.29 30.82 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 -2.79 0.03 -2.16 3.17 -2.24 -0.36 -4.43 114.28 105.52 2g3m n THR 351 Ca 0.02 -0.22 -0.27 0.00 -2.27 0.00 0.00 64.05 61.32 2g3m n THR 351 Cb 0.36 0.30 0.12 0.00 -2.10 0.00 0.00 70.33 69.00 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 -1.97 2.13 0.44 4.28 -4.23 -1.13 -0.52 115.64 114.64 2g3m s THR 352 Ca 0.38 -0.22 -0.24 0.00 -1.18 0.00 0.00 61.69 60.43 2g3m s THR 352 Cb 0.20 -2.91 -0.08 0.00 1.34 0.00 0.00 72.50 71.06 2g3m s THR 352 CO 0.33 0.00 1.20 -0.36 -0.54 0.00 0.00 174.62 175.25 2g3m s PHE 353 N -3.47 2.89 0.93 3.99 0.40 -1.26 -4.51 117.98 116.95 2g3m s PHE 353 Ca 0.66 1.51 -0.11 0.00 -0.60 0.00 0.00 56.93 58.39 2g3m s PHE 353 Cb -0.07 -3.46 0.15 0.00 0.51 0.00 0.00 43.02 40.15 2g3m s PHE 353 CO 0.48 -1.62 1.10 -1.25 0.70 0.00 0.00 175.22 174.62 2g3m s PRO 354 N -2.50 0.95 0.61 0.24 0.04 -1.26 -4.92 135.00 128.16 2g3m s PRO 354 Ca 0.61 1.09 0.38 0.00 0.04 0.00 0.00 61.00 63.12 2g3m s PRO 354 Cb -0.32 -1.75 1.96 0.00 0.04 0.00 0.00 34.50 34.43 2g3m s PRO 354 CO 0.39 -2.53 2.21 -0.44 0.04 0.00 0.00 177.00 176.68 2g3m h ASP 355 N -1.77 0.00 -0.29 6.66 3.32 -2.01 -3.00 116.42 119.32 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 0.02 0.00 -0.46 -1.72 0.00 0.00 179.24 177.57 2g3m n ASN 356 N -3.21 1.77 -4.76 6.45 6.94 -1.26 -4.69 115.26 116.50 2g3m n ASN 356 Ca -0.02 -1.91 -0.40 0.00 -0.02 0.00 0.00 54.58 52.24 2g3m n ASN 356 Cb 0.16 -0.19 -0.06 0.00 -2.36 0.00 0.00 39.78 37.33 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 -1.62 4.03 0.16 3.53 1.01 -1.14 0.83 120.40 127.21 2g3m s VAL 357 Ca 0.26 1.98 0.06 0.00 0.00 0.00 0.00 61.98 64.28 2g3m s VAL 357 Cb 0.14 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.23 2g3m s VAL 357 CO 0.19 0.43 -0.12 0.68 0.00 0.00 0.00 175.10 176.28 2g3m s VAL 358 N -1.25 1.37 0.23 2.92 -7.23 0.12 -0.69 120.40 115.87 2g3m s VAL 358 Ca 0.43 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.54 2g3m s VAL 358 Cb -0.25 -1.87 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 2g3m s VAL 358 CO 0.32 -0.66 0.07 -1.00 -0.31 0.00 0.00 175.10 173.51 2g3m s HIS 359 N -3.08 1.41 -0.36 2.82 3.76 0.05 -3.40 115.29 116.49 2g3m s HIS 359 Ca 0.18 -1.14 0.01 0.00 -0.15 0.00 0.00 55.06 53.96 2g3m s HIS 359 Cb 0.01 -0.82 0.10 0.00 1.11 0.00 0.00 32.58 32.98 2g3m s HIS 359 CO 0.03 -0.31 0.10 0.71 -0.85 0.00 0.00 174.74 174.42 2g3m s TYR 360 N -3.74 3.68 -0.28 1.40 1.51 -1.26 -0.57 117.35 118.08 2g3m s TYR 360 Ca 0.33 -2.74 -0.11 0.00 -1.01 0.00 0.00 57.07 53.55 2g3m s TYR 360 Cb 0.07 -3.00 -0.05 0.00 -0.11 0.00 0.00 41.96 38.88 2g3m s TYR 360 CO 0.10 -0.95 0.18 -1.17 -1.11 0.00 0.00 175.55 172.60 2g3m s LEU 361 N 1.01 3.98 -1.54 -1.29 2.96 0.79 -3.65 118.68 120.94 2g3m s LEU 361 Ca 0.09 -0.04 -0.09 0.00 -0.22 0.00 0.00 54.13 53.87 2g3m s LEU 361 Cb -0.20 -2.10 0.07 0.00 0.50 0.00 0.00 46.19 44.46 2g3m s LEU 361 CO -0.06 -0.05 0.63 0.54 -1.32 0.00 0.00 176.35 176.08 2g3m n ARG 362 N 5.05 -3.53 0.00 1.98 1.74 -1.26 -0.53 116.66 120.11 2g3m n ARG 362 Ca -0.14 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.35 2g3m n ARG 362 Cb 0.52 -4.87 0.00 0.00 -1.02 0.00 0.00 32.46 27.09 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 -1.72 2.95 3.84 -0.13 0.00 -1.26 -5.00 105.19 103.87 2g3m n GLY 363 Ca -0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.53 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 3.85 -0.12 1.61 2.20 0.31 -5.02 119.74 122.57 2g3m s LYS 364 Ca 0.00 0.27 -0.28 0.00 -0.36 0.00 0.00 55.97 55.60 2g3m s LYS 364 Cb 0.00 -3.23 -0.01 0.00 -1.51 0.00 0.00 37.83 33.07 2g3m s LYS 364 CO 0.00 0.66 0.94 0.50 -0.36 0.00 0.00 175.35 177.10 2g3m s ARG 365 N -0.91 4.38 0.06 4.03 3.52 -1.26 -0.15 118.95 128.63 2g3m s ARG 365 Ca 0.21 1.26 0.02 0.00 -0.13 0.00 0.00 55.73 57.10 2g3m s ARG 365 Cb -0.15 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.66 2g3m s ARG 365 CO 0.11 -0.31 -0.08 0.14 -0.81 0.00 0.00 175.30 174.35 2g3m s VAL 366 N 2.02 0.65 0.39 7.11 -7.23 0.26 -4.96 120.40 118.64 2g3m s VAL 366 Ca 0.45 -1.39 -0.25 0.00 -1.81 0.00 0.00 61.98 58.98 2g3m s VAL 366 Cb -0.18 -1.01 -0.09 0.00 0.56 0.00 0.00 36.38 35.67 2g3m s VAL 366 CO 0.16 -0.53 1.12 -0.54 -0.31 0.00 0.00 175.10 175.01 2g3m s LYS 367 N -2.34 4.11 0.22 4.82 1.02 -1.26 -0.77 119.74 125.54 2g3m s LYS 367 Ca -0.02 1.73 -0.08 0.00 0.02 0.00 0.00 55.97 57.62 2g3m s LYS 367 Cb -0.05 -2.65 0.28 0.00 -0.52 0.00 0.00 37.83 34.89 2g3m s LYS 367 CO -0.01 -0.24 1.80 1.25 -0.92 0.00 0.00 175.35 177.23 2g3m h HIS 368 N 2.64 0.67 0.00 3.18 -0.00 -1.18 -1.98 115.15 118.48 2g3m h HIS 368 Ca -0.48 0.03 0.00 0.00 -0.00 0.00 0.00 60.37 59.91 2g3m h HIS 368 Cb 1.23 -0.20 0.00 0.00 -0.00 0.00 0.00 27.41 28.44 2g3m h HIS 368 CO 0.56 0.29 0.00 1.05 -0.00 0.00 0.00 177.93 179.83 2g3m h GLU 369 N 0.66 0.00 0.00 5.26 4.11 -1.87 0.37 114.58 123.11 2g3m h GLU 369 Ca 0.32 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.61 2g3m h GLU 369 Cb 0.26 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2g3m h GLU 369 CO -0.22 0.00 -1.11 0.87 0.07 0.00 0.00 179.01 178.62 2g3m h LYS 370 N 0.00 0.00 0.00 1.06 1.79 -1.67 -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 0.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.68 2g3m h LYS 370 CO 0.00 0.36 0.00 1.33 -1.08 0.00 0.00 179.45 180.06 2g3m n VAL 371 N -2.99 0.36 -0.37 0.50 0.24 -0.80 -2.80 118.33 112.47 2g3m n VAL 371 Ca -0.06 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.34 61.67 2g3m n VAL 371 Cb 0.80 0.98 -0.06 0.00 -1.47 0.00 0.00 33.84 34.09 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 -0.18 -0.35 0.29 7.34 0.63 0.12 -1.58 116.66 122.93 2g3m n ARG 372 Ca 0.00 1.35 0.19 0.00 -0.92 0.00 0.00 57.85 58.47 2g3m n ARG 372 Cb 0.23 -1.99 0.96 0.00 0.45 0.00 0.00 32.46 32.11 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 0.50 6.15 2.35 -1.66 -0.91 115.58 122.00 2g3m h ASN 373 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2g3m h ASN 373 Cb 0.40 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2g3m h ASN 373 CO -0.85 0.00 -0.18 0.00 -1.65 0.00 0.00 177.43 174.75 2g3m n ALA 374 N -2.12 2.86 0.02 -0.83 0.00 -0.62 -4.12 120.51 115.70 2g3m n ALA 374 Ca -0.01 -0.26 -0.11 0.00 0.00 0.00 0.00 53.44 53.06 2g3m n ALA 374 Cb 0.25 -1.30 -0.04 0.00 0.00 0.00 0.00 19.45 18.36 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 0.40 -0.79 -0.11 0.00 3.20 -1.25 -1.10 116.97 117.32 2g3m h TYR 375 Ca 0.00 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 2g3m h TYR 375 Cb 0.42 0.36 -0.01 0.00 1.54 0.00 0.00 36.73 39.05 2g3m h TYR 375 CO 0.00 -0.38 0.02 -1.00 -1.64 0.00 0.00 178.16 175.16 2g3m h PRO 376 N -0.39 0.15 -0.13 1.82 0.13 -1.72 -1.28 132.00 130.57 2g3m h PRO 376 Ca 0.08 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2g3m h PRO 376 Cb 0.52 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 2g3m h PRO 376 CO -0.30 0.15 0.08 1.25 -0.23 0.00 0.00 178.00 178.95 2g3m h LEU 377 N 0.15 0.14 -0.93 1.56 5.85 -1.46 0.27 115.31 120.90 2g3m h LEU 377 Ca 0.04 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 2g3m h LEU 377 Cb 0.08 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2g3m h LEU 377 CO -0.00 0.10 -0.42 1.88 -0.34 0.00 0.00 178.44 179.67 2g3m h TYR 378 N 0.17 0.29 -0.43 1.25 0.05 -0.80 -0.71 116.97 116.79 2g3m h TYR 378 Ca 0.05 -0.08 -0.10 0.00 0.05 0.00 0.00 58.73 58.64 2g3m h TYR 378 Cb -0.02 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.64 2g3m h TYR 378 CO -0.07 0.63 -0.14 1.49 -1.05 0.00 0.00 178.16 179.02 2g3m h GLU 379 N 0.21 0.85 -0.51 4.88 4.81 -0.95 -1.23 114.58 122.65 2g3m h GLU 379 Ca 0.02 -0.34 -0.07 0.00 -0.13 0.00 0.00 59.36 58.84 2g3m h GLU 379 Cb 0.83 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.14 2g3m h GLU 379 CO 0.07 0.98 0.04 0.00 -0.73 0.00 0.00 179.01 179.37 2g3m h ALA 380 N 0.85 1.11 -0.27 2.92 0.00 -0.72 -0.61 119.26 122.54 2g3m h ALA 380 Ca 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2g3m h ALA 380 Cb 0.69 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2g3m h ALA 380 CO 0.05 0.57 0.15 1.98 0.00 0.00 0.00 179.25 182.00 2g3m h MET 381 N 0.78 0.37 -0.39 0.00 1.85 -0.88 0.12 114.93 116.78 2g3m h MET 381 Ca 0.16 -0.04 -0.08 0.00 -0.61 0.00 0.00 59.70 59.12 2g3m h MET 381 Cb 0.41 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.35 2g3m h MET 381 CO 0.01 0.32 -0.09 0.00 -0.40 0.00 0.00 176.91 176.75 2g3m h ALA 382 N 1.03 1.10 -0.42 0.39 0.00 -0.90 -1.20 119.26 119.25 2g3m h ALA 382 Ca 0.09 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 2g3m h ALA 382 Cb 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2g3m h ALA 382 CO -0.02 0.56 -0.30 1.15 0.00 0.00 0.00 179.25 180.64 2g3m h THR 383 N 0.63 1.27 -0.46 0.00 2.02 -0.75 -1.77 112.91 113.85 2g3m h THR 383 Ca 0.11 -1.47 0.00 0.00 0.77 0.00 0.00 66.41 65.82 2g3m h THR 383 Cb 0.53 1.29 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 2g3m h THR 383 CO 0.03 0.50 0.29 0.15 0.37 0.00 0.00 175.52 176.86 2g3m h PHE 384 N 0.77 0.60 -0.17 3.16 3.57 -0.48 -0.17 116.94 124.23 2g3m h PHE 384 Ca 0.08 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.63 2g3m h PHE 384 Cb 0.89 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 2g3m h PHE 384 CO 0.06 0.40 0.12 -0.22 -2.23 0.00 0.00 178.31 176.45 2g3m h LYS 385 N 0.62 0.02 -0.76 1.11 3.64 -0.96 0.30 116.57 120.53 2g3m h LYS 385 Ca 0.17 -0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 2g3m h LYS 385 Cb -0.03 -0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.75 2g3m h LYS 385 CO -0.03 0.02 0.34 0.78 -2.27 0.00 0.00 179.45 178.28 2g3m h GLY 386 N 0.02 1.19 0.97 5.01 0.00 -0.13 -0.18 103.07 109.95 2g3m h GLY 386 Ca 0.08 -0.61 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 2g3m h GLY 386 CO -0.00 0.57 -0.08 0.74 0.00 0.00 0.00 176.54 177.77 2g3m h PHE 387 N 1.10 0.83 -0.70 5.60 -1.00 -0.67 -2.25 116.94 119.84 2g3m h PHE 387 Ca 0.26 -0.18 0.03 0.00 2.81 0.00 0.00 57.97 60.89 2g3m h PHE 387 Cb 0.15 -0.20 -0.04 0.00 3.61 0.00 0.00 35.95 39.47 2g3m h PHE 387 CO 0.02 0.87 0.44 0.00 -1.61 0.00 0.00 178.31 178.03 2g3m h ARG 388 N 0.55 0.85 -0.24 1.51 2.47 -1.01 -0.88 114.38 117.62 2g3m h ARG 388 Ca 0.10 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 58.77 2g3m h ARG 388 Cb 0.60 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.72 2g3m h ARG 388 CO 0.04 0.56 0.14 1.15 0.56 0.00 0.00 179.97 182.42 2g3m h THR 389 N 0.88 1.08 -0.14 2.04 2.02 -0.86 0.44 112.91 118.36 2g3m h THR 389 Ca 0.28 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.28 2g3m h THR 389 Cb -0.01 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.14 2g3m h THR 389 CO -0.10 0.08 0.00 -1.20 0.37 0.00 0.00 175.52 174.67 2g3m n SER 390 N -4.48 1.31 -3.88 4.18 7.64 -0.46 -4.90 113.62 113.03 2g3m n SER 390 Ca 0.01 -1.66 -0.27 0.00 1.01 0.00 0.00 58.87 57.95 2g3m n SER 390 Cb 0.09 -0.09 0.02 0.00 -1.01 0.00 0.00 64.21 63.22 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 0.09 -2.03 -3.49 1.43 -0.00 0.14 -4.93 115.22 106.45 2g3m n HIS 391 Ca 0.15 0.85 -0.42 0.00 -0.00 0.00 0.00 57.72 58.31 2g3m n HIS 391 Cb 0.27 -3.99 -0.10 0.00 -0.00 0.00 0.00 29.99 26.17 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 -6.43 3.24 0.12 -0.41 6.06 -0.49 -4.97 118.95 116.08 2g3m s ARG 392 Ca 0.35 -0.82 0.00 0.00 -2.50 0.00 0.00 55.73 52.77 2g3m s ARG 392 Cb -0.18 -3.89 -0.15 0.00 0.06 0.00 0.00 34.95 30.79 2g3m s ARG 392 CO 0.84 -0.60 1.27 -0.91 -2.50 0.00 0.00 175.30 173.40 2g3m h ASN 393 N 8.56 0.29 -2.99 -2.12 2.35 -1.91 -3.42 115.58 116.34 2g3m h ASN 393 Ca -0.29 -0.27 -0.66 0.00 -0.55 0.00 0.00 56.30 54.52 2g3m h ASN 393 Cb 1.14 -0.09 -0.17 0.00 0.05 0.00 0.00 38.32 39.25 2g3m h ASN 393 CO 0.68 1.15 0.28 -1.61 -1.65 0.00 0.00 177.43 176.28 2g3m s GLU 394 N -2.93 3.13 -0.16 0.81 2.02 -1.26 -4.90 118.70 115.41 2g3m s GLU 394 Ca -0.03 -0.89 -0.07 0.00 0.02 0.00 0.00 54.97 54.01 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 0.85 -1.51 0.06 0.42 0.02 0.00 0.00 175.26 175.10 2g3m s ILE 395 N 3.24 4.79 -0.10 -1.63 1.01 -1.26 -4.95 121.20 122.30 2g3m s ILE 395 Ca 0.18 -0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.77 2g3m s ILE 395 Cb -0.19 -3.13 0.04 0.00 0.01 0.00 0.00 42.46 39.19 2g3m s ILE 395 CO 0.11 0.50 0.05 0.12 0.00 0.00 0.00 174.94 175.72 2g3m s PHE 396 N 0.05 0.39 -0.05 3.97 5.36 -1.26 -4.29 117.98 122.15 2g3m s PHE 396 Ca 0.05 -0.16 0.01 0.00 -0.96 0.00 0.00 56.93 55.88 2g3m s PHE 396 Cb -0.12 -0.70 0.02 0.00 -0.34 0.00 0.00 43.02 41.89 2g3m s PHE 396 CO 0.01 -0.37 -0.04 0.42 -1.46 0.00 0.00 175.22 173.78 2g3m s ILE 397 N 2.07 0.52 -0.10 3.12 1.01 -1.26 -1.43 121.20 125.13 2g3m s ILE 397 Ca 0.03 -0.09 0.01 0.00 0.00 0.00 0.00 60.65 60.60 2g3m s ILE 397 Cb -0.14 -0.56 -0.02 0.00 0.01 0.00 0.00 42.46 41.75 2g3m s ILE 397 CO -0.06 0.23 -0.13 -0.22 0.00 0.00 0.00 174.94 174.76 2g3m s LEU 398 N 1.05 2.78 0.04 2.97 0.20 -0.33 0.09 118.68 125.48 2g3m s LEU 398 Ca -0.09 -0.25 0.04 0.00 0.69 0.00 0.00 54.13 54.53 2g3m s LEU 398 Cb -0.14 -1.60 -0.02 0.00 -0.43 0.00 0.00 46.19 44.00 2g3m s LEU 398 CO -0.01 0.25 -0.12 -0.55 -0.29 0.00 0.00 176.35 175.63 2g3m s SER 399 N -0.14 1.47 -0.13 3.68 0.15 -0.02 0.68 113.70 119.39 2g3m s SER 399 Ca -0.01 -0.47 -0.15 0.00 0.70 0.00 0.00 55.95 56.02 2g3m s SER 399 Cb -0.13 -0.07 -0.25 0.00 -1.71 0.00 0.00 66.02 63.85 2g3m s SER 399 CO 0.03 -0.02 0.45 -0.09 1.20 0.00 0.00 173.24 174.81 2g3m h ARG 400 N 4.85 0.19 -6.42 5.44 2.43 -1.78 -3.25 114.38 115.85 2g3m h ARG 400 Ca -0.37 -0.33 -0.45 0.00 -0.81 0.00 0.00 59.98 58.02 2g3m h ARG 400 Cb 1.19 0.12 0.01 0.00 -0.42 0.00 0.00 29.97 30.87 2g3m h ARG 400 CO 0.43 1.16 -0.26 0.00 -1.51 0.00 0.00 179.97 179.79 2g3m s ALA 401 N -2.47 4.48 0.03 2.80 0.00 -1.26 -4.50 121.76 120.85 2g3m s ALA 401 Ca -0.22 -1.77 -0.27 0.00 0.00 0.00 0.00 51.96 49.70 2g3m s ALA 401 Cb 0.05 -1.48 0.10 0.00 0.00 0.00 0.00 23.12 21.78 2g3m s ALA 401 CO 0.73 -0.36 1.23 0.20 0.00 0.00 0.00 175.76 177.55 2g3m s GLY 402 N -4.36 -0.13 0.24 0.00 0.00 -1.25 -4.85 107.32 96.98 2g3m s GLY 402 Ca 0.54 0.08 -0.14 0.00 0.00 0.00 0.00 44.72 45.20 2g3m s GLY 402 CO 0.33 3.77 0.51 -0.47 0.00 0.00 0.00 173.10 177.24 2g3m s TYR 403 N -2.16 0.23 0.11 1.90 5.04 -1.26 -2.17 117.35 119.04 2g3m s TYR 403 Ca 0.25 -0.60 -0.36 0.00 -2.44 0.00 0.00 57.07 53.91 2g3m s TYR 403 Cb 0.00 0.29 -0.16 0.00 0.35 0.00 0.00 41.96 42.43 2g3m s TYR 403 CO 0.00 -1.02 1.36 0.00 -1.34 0.00 0.00 175.55 174.56 2g3m n ALA 404 N -0.38 -0.54 0.00 3.97 0.00 -1.25 -0.91 120.51 121.40 2g3m n ALA 404 Ca -0.03 0.50 0.00 0.00 0.00 0.00 0.00 53.44 53.91 2g3m n ALA 404 Cb 0.61 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.95 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 2.61 0.85 0.31 0.00 0.00 -1.26 -4.93 105.19 102.77 2g3m n GLY 405 Ca 0.18 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.35 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 0.57 0.00 -0.61 6.09 -1.37 -1.06 117.51 121.13 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 0.01 0.06 -3.07 0.00 0.00 178.15 175.15 2g3m h GLN 407 N 0.00 0.00 -0.05 2.19 -0.00 -1.82 -1.24 115.11 114.19 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 0.26 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.73 2g3m h GLN 407 CO -0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 178.83 178.66 2g3m h ARG 408 N 0.00 0.07 0.00 0.06 3.08 -1.37 -3.04 114.38 113.18 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 0.02 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2g3m h ARG 408 CO 0.00 0.24 -0.37 0.66 -1.07 0.00 0.00 179.97 179.43 2g3m n TYR 409 N -4.31 0.00 -3.75 3.04 4.01 -0.52 -3.62 117.16 112.01 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 -0.05 0.00 -0.31 0.00 0.00 39.34 39.23 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 -1.18 -0.71 0.57 -0.72 0.00 -0.86 -4.48 121.76 114.38 2g3m s ALA 410 Ca 0.00 -0.31 -0.07 0.00 0.00 0.00 0.00 51.96 51.58 2g3m s ALA 410 Cb 0.00 0.77 -0.02 0.00 0.00 0.00 0.00 23.12 23.87 2g3m s ALA 410 CO 0.00 -0.69 0.90 -0.06 0.00 0.00 0.00 175.76 175.91 2g3m s PHE 411 N -3.86 3.45 -0.02 0.00 0.40 0.11 -4.59 117.98 113.48 2g3m s PHE 411 Ca 0.08 0.88 0.01 0.00 -0.60 0.00 0.00 56.93 57.30 2g3m s PHE 411 Cb 0.01 -2.60 0.02 0.00 0.51 0.00 0.00 43.02 40.96 2g3m s PHE 411 CO -0.06 -0.63 -0.01 0.42 0.70 0.00 0.00 175.22 175.64 2g3m s ILE 412 N -2.97 0.22 0.19 0.64 1.01 -0.25 -0.84 121.20 119.20 2g3m s ILE 412 Ca 0.52 0.01 0.09 0.00 0.00 0.00 0.00 60.65 61.28 2g3m s ILE 412 Cb -0.11 -0.27 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 2g3m s ILE 412 CO 0.48 0.13 -0.09 -1.66 0.00 0.00 0.00 174.94 173.79 2g3m s TRP 413 N 0.72 2.63 -1.15 3.97 -2.14 -1.23 -2.55 118.94 119.19 2g3m s TRP 413 Ca -0.07 -0.23 0.00 0.00 2.66 0.00 0.00 56.10 58.46 2g3m s TRP 413 Cb -0.11 -1.27 0.00 0.00 -3.10 0.00 0.00 33.47 29.00 2g3m s TRP 413 CO -0.01 0.53 0.39 0.25 -2.66 0.00 0.00 176.95 175.45 2g3m n THR 414 N -0.08 0.00 -4.34 0.66 -2.24 -0.57 -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 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 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 0.17 -0.19 2.66 3.38 0.00 -1.26 -4.48 105.19 105.47 2g3m n GLY 415 Ca 0.00 -1.02 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.58 4.75 -4.78 1.61 8.00 -1.26 -4.64 116.55 119.64 2g3m n ASP 416 Ca 0.00 -2.80 -0.32 0.00 0.71 0.00 0.00 54.79 52.37 2g3m n ASP 416 Cb 0.00 -1.64 0.04 0.00 -0.02 0.00 0.00 41.12 39.51 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 2.95 5.22 -0.21 -2.24 4.22 -1.26 -4.31 114.94 119.31 2g3m s ASN 417 Ca 0.51 1.89 -0.07 0.00 -2.14 0.00 0.00 52.86 53.05 2g3m s ASN 417 Cb 0.15 -2.54 -0.04 0.00 1.28 0.00 0.00 41.25 40.10 2g3m s ASN 417 CO -0.08 -1.55 0.06 -0.89 -2.04 0.00 0.00 177.10 172.60 2g3m s THR 418 N -2.51 4.54 0.06 0.54 2.01 -1.26 -1.19 115.64 117.82 2g3m s THR 418 Ca 0.64 -0.11 -0.31 0.00 0.31 0.00 0.00 61.69 62.23 2g3m s THR 418 Cb -0.18 -3.08 -0.08 0.00 0.01 0.00 0.00 72.50 69.17 2g3m s THR 418 CO 0.44 0.40 1.58 -2.16 -0.69 0.00 0.00 174.62 174.19 2g3m s PRO 419 N 0.99 4.22 -0.14 4.92 0.04 -1.26 -4.65 135.00 139.12 2g3m s PRO 419 Ca 0.04 2.24 -0.33 0.00 0.04 0.00 0.00 61.00 62.98 2g3m s PRO 419 Cb -0.14 -3.57 0.13 0.00 0.04 0.00 0.00 34.50 30.96 2g3m s PRO 419 CO 0.03 -0.69 1.17 -1.54 0.04 0.00 0.00 177.00 176.01 2g3m s SER 420 N 2.20 -0.16 0.30 6.66 1.04 -1.26 -1.30 113.70 121.19 2g3m s SER 420 Ca 0.71 -0.03 -0.00 0.00 0.48 0.00 0.00 55.95 57.11 2g3m s SER 420 Cb -0.38 0.19 0.46 0.00 0.10 0.00 0.00 66.02 66.39 2g3m s SER 420 CO 0.31 -0.31 1.88 -0.50 0.98 0.00 0.00 173.24 175.60 2g3m h TRP 421 N 2.00 0.84 -0.06 5.02 4.06 -1.93 -2.03 115.95 123.85 2g3m h TRP 421 Ca -0.14 -0.05 -0.05 0.00 2.06 0.00 0.00 58.89 60.71 2g3m h TRP 421 Cb 1.18 -0.26 -0.01 0.00 -1.00 0.00 0.00 29.16 29.08 2g3m h TRP 421 CO 0.29 0.66 -0.21 -0.44 -3.56 0.00 0.00 178.44 175.17 2g3m h ASP 422 N 0.82 0.09 0.14 -3.49 3.32 -1.95 -2.49 116.42 112.86 2g3m h ASP 422 Ca 0.19 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 2g3m h ASP 422 Cb 0.18 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 2g3m h ASP 422 CO -0.02 0.31 -0.12 -0.78 -1.72 0.00 0.00 179.24 176.91 2g3m h ASP 423 N 0.09 0.00 -0.56 6.45 3.58 -1.63 -2.20 116.42 122.16 2g3m h ASP 423 Ca 0.02 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.52 2g3m h ASP 423 Cb 0.43 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.43 2g3m h ASP 423 CO 0.03 0.12 0.27 -0.07 -2.88 0.00 0.00 179.24 176.71 2g3m h LEU 424 N 0.00 0.36 -0.35 2.28 3.38 -1.46 0.21 115.31 119.73 2g3m h LEU 424 Ca -0.00 0.04 -0.13 0.00 0.09 0.00 0.00 57.88 57.88 2g3m h LEU 424 Cb 0.23 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2g3m h LEU 424 CO 0.02 0.24 -0.30 0.11 0.09 0.00 0.00 178.44 178.59 2g3m h LYS 425 N 0.50 0.82 -0.31 1.13 1.57 -1.55 -2.96 116.57 115.77 2g3m h LYS 425 Ca 0.26 -0.42 0.01 0.00 -1.87 0.00 0.00 60.65 58.63 2g3m h LYS 425 Cb 0.20 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2g3m h LYS 425 CO -0.20 1.05 0.20 1.25 -0.57 0.00 0.00 179.45 181.18 2g3m h LEU 426 N 0.61 0.33 -1.27 2.94 6.46 -0.83 -2.17 115.31 121.38 2g3m h LEU 426 Ca 0.06 -0.00 0.03 0.00 -0.12 0.00 0.00 57.88 57.85 2g3m h LEU 426 Cb 0.88 -0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 40.69 2g3m h LEU 426 CO 0.08 0.24 0.51 1.56 -0.62 0.00 0.00 178.44 180.21 2g3m h GLN 427 N 0.40 0.93 -0.40 1.25 1.08 -0.63 -0.33 115.11 117.42 2g3m h GLN 427 Ca 0.12 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 2g3m h GLN 427 Cb -0.03 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.17 2g3m h GLN 427 CO -0.04 0.62 0.19 1.25 -0.95 0.00 0.00 178.83 179.90 2g3m h LEU 428 N 0.96 0.53 -0.64 1.46 5.85 -1.26 -0.22 115.31 121.99 2g3m h LEU 428 Ca 0.31 -0.13 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2g3m h LEU 428 Cb 0.03 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.89 2g3m h LEU 428 CO -0.09 0.52 0.25 1.56 -0.34 0.00 0.00 178.44 180.34 2g3m h GLN 429 N 0.51 0.96 0.42 1.25 4.20 -0.72 -1.41 115.11 120.33 2g3m h GLN 429 Ca 0.14 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 2g3m h GLN 429 Cb 0.13 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2g3m h GLN 429 CO -0.02 0.81 -0.20 -0.07 -0.67 0.00 0.00 178.83 178.68 2g3m h LEU 430 N 0.90 -0.48 -1.15 1.46 4.07 -0.71 0.82 115.31 120.22 2g3m h LEU 430 Ca 0.21 -0.04 -0.08 0.00 0.08 0.00 0.00 57.88 58.06 2g3m h LEU 430 Cb 0.22 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.07 2g3m h LEU 430 CO -0.02 -0.27 -0.23 -0.37 -1.08 0.00 0.00 178.44 176.48 2g3m h VAL 431 N -0.67 1.24 -0.01 1.22 -1.51 -1.04 -1.80 116.25 113.68 2g3m h VAL 431 Ca -0.06 -1.11 -0.18 0.00 -1.23 0.00 0.00 66.70 64.12 2g3m h VAL 431 Cb 0.49 1.36 -0.02 0.00 -2.13 0.00 0.00 31.29 30.99 2g3m h VAL 431 CO 0.10 0.34 -0.80 -0.07 -1.23 0.00 0.00 177.57 175.91 2g3m h LEU 432 N 0.29 0.17 -0.51 4.19 3.38 -1.22 -1.05 115.31 120.56 2g3m h LEU 432 Ca 0.05 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 2g3m h LEU 432 Cb 0.57 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 2g3m h LEU 432 CO 0.04 0.90 0.15 1.23 0.09 0.00 0.00 178.44 180.85 2g3m h GLY 433 N 1.94 0.86 0.80 0.83 0.00 -0.38 0.32 103.07 107.45 2g3m h GLY 433 Ca -0.03 -0.52 -0.03 0.00 0.00 0.00 0.00 47.33 46.75 2g3m h GLY 433 CO 0.12 0.49 -0.01 1.41 0.00 0.00 0.00 176.54 178.54 2g3m h LEU 434 N 0.70 0.33 -0.35 3.11 4.07 -1.29 -2.88 115.31 119.01 2g3m h LEU 434 Ca 0.16 -0.33 0.04 0.00 0.08 0.00 0.00 57.88 57.83 2g3m h LEU 434 Cb 0.29 -0.09 -0.04 0.00 1.08 0.00 0.00 40.66 41.91 2g3m h LEU 434 CO -0.00 0.58 0.14 -1.28 -1.08 0.00 0.00 178.44 176.79 2g3m h SER 435 N 0.07 0.17 0.47 -0.43 0.87 -0.98 -0.67 113.55 113.05 2g3m h SER 435 Ca 0.05 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2g3m h SER 435 Cb 0.42 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 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 0.43 -0.97 2.23 0.13 0.08 -2.89 119.36 113.38 2g3m n ILE 436 Ca 0.01 0.11 0.08 0.00 -1.10 0.00 0.00 62.75 61.84 2g3m n ILE 436 Cb 0.11 -0.76 0.32 0.00 -0.84 0.00 0.00 39.64 38.47 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 -1.34 4.59 0.00 9.51 7.64 -0.33 -4.82 113.62 128.87 2g3m n SER 437 Ca 0.08 -3.00 0.00 0.00 1.01 0.00 0.00 58.87 56.97 2g3m n SER 437 Cb 0.19 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.78 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 -0.09 0.66 3.13 0.23 0.00 -1.14 -4.90 105.19 103.08 2g3m n GLY 438 Ca 0.24 0.00 -0.37 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 -2.54 3.76 0.11 1.61 1.01 -0.79 -4.67 120.40 118.89 2g3m s VAL 439 Ca 0.00 -2.54 -0.14 0.00 0.00 0.00 0.00 61.98 59.31 2g3m s VAL 439 Cb 0.00 -3.48 -0.07 0.00 0.00 0.00 0.00 36.38 32.83 2g3m s VAL 439 CO 0.00 -0.82 1.44 1.55 0.00 0.00 0.00 175.10 177.27 2g3m h PRO 440 N 7.53 0.76 -5.23 2.72 0.13 -1.82 -3.15 132.00 132.95 2g3m h PRO 440 Ca -0.06 -0.39 -0.67 0.00 -0.87 0.00 0.00 66.00 64.01 2g3m h PRO 440 Cb 1.00 0.01 -0.16 0.00 0.13 0.00 0.00 31.00 31.98 2g3m h PRO 440 CO 0.73 1.01 0.85 -0.06 -0.23 0.00 0.00 178.00 180.30 2g3m s PHE 441 N -4.40 2.97 0.18 1.56 0.08 -1.26 -4.53 117.98 112.57 2g3m s PHE 441 Ca -0.12 -1.16 0.02 0.00 0.12 0.00 0.00 56.93 55.78 2g3m s PHE 441 Cb 0.09 -4.33 -0.05 0.00 -0.57 0.00 0.00 43.02 38.17 2g3m s PHE 441 CO 0.84 -1.57 0.02 0.14 -0.10 0.00 0.00 175.22 174.55 2g3m s VAL 442 N 3.21 0.65 0.05 -0.44 -7.23 -1.26 -1.09 120.40 114.29 2g3m s VAL 442 Ca 0.32 -1.98 -0.26 0.00 -1.81 0.00 0.00 61.98 58.24 2g3m s VAL 442 Cb -0.07 -2.19 0.09 0.00 0.56 0.00 0.00 36.38 34.77 2g3m s VAL 442 CO -0.06 -0.40 1.21 -0.83 -0.31 0.00 0.00 175.10 174.71 2g3m s GLY 443 N -3.19 -0.04 0.27 2.32 0.00 -1.06 -1.46 107.32 104.17 2g3m s GLY 443 Ca 0.26 -0.11 0.02 0.00 0.00 0.00 0.00 44.72 44.90 2g3m s GLY 443 CO 0.05 4.74 0.07 0.00 0.00 0.00 0.00 173.10 177.96 2g3m s ASP 445 N -3.35 6.64 -0.09 0.00 1.01 -1.26 -4.39 116.67 115.23 2g3m s ASP 445 Ca 0.36 1.12 -0.29 0.00 0.71 0.00 0.00 52.55 54.45 2g3m s ASP 445 Cb 0.08 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.41 2g3m s ASP 445 CO 0.13 -1.12 1.70 -0.63 0.21 0.00 0.00 175.17 175.46 2g3m s ILE 446 N 4.48 3.53 0.00 0.77 1.01 0.68 -1.44 121.20 130.22 2g3m s ILE 446 Ca 0.56 0.62 0.00 0.00 0.00 0.00 0.00 60.65 61.84 2g3m s ILE 446 Cb -0.16 -3.44 0.00 0.00 0.01 0.00 0.00 42.46 38.87 2g3m s ILE 446 CO 0.24 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.69 2g3m n GLY 447 N 4.36 0.22 0.07 6.18 0.00 -1.26 -3.74 105.19 111.01 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 -3.12 0.10 -0.02 0.00 -0.52 -4.58 105.19 95.06 2g3m n GLY 448 Ca 0.00 -1.11 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 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 0.08 -0.11 -1.91 1.61 3.57 -1.29 -3.41 116.94 115.46 2g3m h PHE 449 Ca 0.00 -0.00 -0.65 0.00 3.53 0.00 0.00 57.97 60.85 2g3m h PHE 449 Cb 0.00 0.04 0.08 0.00 2.79 0.00 0.00 35.95 38.86 2g3m h PHE 449 CO 0.00 0.42 0.22 1.04 -2.23 0.00 0.00 178.31 177.76 2g3m n GLN 450 N -4.85 1.09 0.00 1.11 1.13 -0.85 -0.24 117.38 114.78 2g3m n GLN 450 Ca -0.08 0.39 0.00 0.00 -1.94 0.00 0.00 57.00 55.37 2g3m n GLN 450 Cb 0.29 -1.86 0.00 0.00 0.11 0.00 0.00 30.24 28.78 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 1.93 0.77 2.75 1.08 0.00 -1.26 -4.69 105.19 105.77 2g3m n GLY 451 Ca 0.15 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 1.53 0.00 1.61 1.74 -1.25 -4.67 116.66 115.62 2g3m n ARG 452 Ca 0.00 -2.42 0.13 0.00 -0.77 0.00 0.00 57.85 54.79 2g3m n ARG 452 Cb 0.00 -0.63 0.40 0.00 -1.02 0.00 0.00 32.46 31.21 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 -1.01 1.38 -3.67 0.55 6.94 -1.26 -4.90 115.26 113.29 2g3m n ASN 453 Ca -0.04 -1.23 -0.11 0.00 -0.02 0.00 0.00 54.58 53.17 2g3m n ASN 453 Cb 0.84 0.09 -0.06 0.00 -2.36 0.00 0.00 39.78 38.29 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 -2.27 -0.20 0.32 -2.53 -0.71 -1.26 -5.08 117.98 106.25 2g3m s PHE 454 Ca 0.30 -0.01 0.02 0.00 -1.04 0.00 0.00 56.93 56.20 2g3m s PHE 454 Cb 0.20 0.21 0.55 0.00 -1.21 0.00 0.00 43.02 42.77 2g3m s PHE 454 CO 0.44 -0.62 1.90 0.00 -1.34 0.00 0.00 175.22 175.59 2g3m h ALA 455 N 2.71 1.38 0.00 1.99 0.00 -2.00 -3.33 119.26 120.00 2g3m h ALA 455 Ca -0.33 -0.15 -0.15 0.00 0.00 0.00 0.00 54.91 54.27 2g3m h ALA 455 Cb 1.23 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 2g3m h ALA 455 CO 0.46 0.46 -0.27 0.39 0.00 0.00 0.00 179.25 180.29 2g3m n GLU 456 N -4.33 1.72 -4.38 0.00 4.71 -1.26 -4.78 120.64 112.31 2g3m n GLU 456 Ca 0.04 -0.81 -0.30 0.00 -0.01 0.00 0.00 57.16 56.08 2g3m n GLU 456 Cb 0.18 -1.86 -0.17 0.00 -1.01 0.00 0.00 31.44 28.58 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 1.09 1.64 -0.46 -3.67 1.01 -1.25 -4.89 121.20 114.66 2g3m s ILE 457 Ca 0.54 -0.71 -0.13 0.00 0.00 0.00 0.00 60.65 60.35 2g3m s ILE 457 Cb 0.26 -1.49 0.08 0.00 0.01 0.00 0.00 42.46 41.32 2g3m s ILE 457 CO 0.00 0.47 0.36 -0.62 0.00 0.00 0.00 174.94 175.15 2g3m s ASP 458 N 1.08 5.97 -0.27 3.58 -1.08 -0.42 -4.94 116.67 120.60 2g3m s ASP 458 Ca -0.04 -1.47 0.12 0.00 -0.52 0.00 0.00 52.55 50.65 2g3m s ASP 458 Cb -0.14 -2.12 0.80 0.00 -1.46 0.00 0.00 42.92 40.00 2g3m s ASP 458 CO -0.04 -0.64 1.78 0.59 0.52 0.00 0.00 175.17 177.37 2g3m n ASN 459 N 5.10 5.45 -4.75 -0.34 3.02 -1.26 -4.41 115.26 118.07 2g3m n ASN 459 Ca -0.12 -3.04 -0.38 0.00 -0.03 0.00 0.00 54.58 51.02 2g3m n ASN 459 Cb 0.43 -0.71 0.04 0.00 -0.61 0.00 0.00 39.78 38.92 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 -0.85 5.29 0.29 6.41 1.04 -1.26 -4.91 113.70 119.71 2g3m s SER 460 Ca 0.55 2.67 0.08 0.00 0.48 0.00 0.00 55.95 59.72 2g3m s SER 460 Cb 0.43 -2.63 0.44 0.00 0.10 0.00 0.00 66.02 64.35 2g3m s SER 460 CO 0.15 -1.55 1.68 0.24 0.98 0.00 0.00 173.24 174.74 2g3m h MET 461 N 1.38 0.17 -0.05 4.02 0.00 -1.99 -2.48 114.93 115.97 2g3m h MET 461 Ca -0.51 -0.09 -0.11 0.00 0.00 0.00 0.00 59.70 58.99 2g3m h MET 461 Cb 1.30 0.00 -0.01 0.00 0.00 0.00 0.00 31.60 32.89 2g3m h MET 461 CO 0.57 0.61 -0.49 0.38 0.00 0.00 0.00 176.91 177.98 2g3m h ASP 462 N 0.14 0.14 -0.36 1.22 2.03 -2.00 -1.56 116.42 116.04 2g3m h ASP 462 Ca 0.01 -0.06 -0.11 0.00 -0.73 0.00 0.00 57.03 56.14 2g3m h ASP 462 Cb 0.89 -0.04 -0.01 0.00 -0.83 0.00 0.00 39.33 39.35 2g3m h ASP 462 CO 0.07 0.61 -0.19 0.25 -1.03 0.00 0.00 179.24 178.95 2g3m h LEU 463 N 0.10 0.78 -0.70 0.15 6.46 -1.91 -1.97 115.31 118.23 2g3m h LEU 463 Ca 0.00 -0.41 0.05 0.00 -0.12 0.00 0.00 57.88 57.40 2g3m h LEU 463 Cb 0.91 -0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.57 2g3m h LEU 463 CO 0.07 1.02 0.41 0.25 -0.62 0.00 0.00 178.44 179.57 2g3m h LEU 464 N 0.54 0.62 -0.83 2.25 5.85 -1.12 -1.09 115.31 121.54 2g3m h LEU 464 Ca 0.08 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2g3m h LEU 464 Cb 0.74 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.62 2g3m h LEU 464 CO 0.06 0.41 0.44 0.58 -0.34 0.00 0.00 178.44 179.58 2g3m h VAL 465 N 0.76 1.25 0.00 1.05 2.07 -1.09 -1.71 116.25 118.58 2g3m h VAL 465 Ca 0.31 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 2g3m h VAL 465 Cb 0.15 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 2g3m h VAL 465 CO -0.17 0.29 -0.16 0.11 0.02 0.00 0.00 177.57 177.66 2g3m h LYS 466 N 1.17 0.00 -0.10 1.57 1.79 -0.47 -0.69 116.57 119.83 2g3m h LYS 466 Ca 0.29 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.72 2g3m h LYS 466 Cb 0.06 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.71 2g3m h LYS 466 CO -0.04 0.16 -0.08 1.88 -1.08 0.00 0.00 179.45 180.28 2g3m h TYR 467 N 0.00 0.28 -0.98 -1.35 0.05 -0.34 0.29 116.97 114.92 2g3m h TYR 467 Ca -0.00 -0.08 0.04 0.00 0.05 0.00 0.00 58.73 58.74 2g3m h TYR 467 Cb 0.39 -0.06 -0.06 0.00 1.01 0.00 0.00 36.73 38.01 2g3m h TYR 467 CO 0.00 0.64 0.64 1.88 -1.05 0.00 0.00 178.16 180.27 2g3m h TYR 468 N -0.15 1.20 -0.31 4.88 0.05 -0.91 -1.83 116.97 119.90 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 -0.40 -0.00 0.00 1.01 0.00 0.00 36.73 37.92 2g3m h TYR 468 CO 0.08 0.67 -0.52 0.00 -1.05 0.00 0.00 178.16 177.34 2g3m h ALA 469 N 1.41 0.48 -0.34 3.88 0.00 -1.02 -2.91 119.26 120.76 2g3m h ALA 469 Ca 0.40 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2g3m h ALA 469 Cb 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2g3m h ALA 469 CO -0.13 0.68 0.19 1.25 0.00 0.00 0.00 179.25 181.24 2g3m h LEU 470 N 0.70 0.31 -0.47 0.00 5.85 0.13 -2.60 115.31 119.22 2g3m h LEU 470 Ca 0.02 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2g3m h LEU 470 Cb 1.13 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.10 2g3m h LEU 470 CO 0.12 0.23 0.00 0.00 -0.34 0.00 0.00 178.44 178.44 2g3m n ALA 471 N -2.23 2.53 -0.31 1.25 0.00 -0.74 -4.48 120.51 116.53 2g3m n ALA 471 Ca -0.00 -0.26 0.17 0.00 0.00 0.00 0.00 53.44 53.35 2g3m n ALA 471 Cb 0.06 -1.12 0.33 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 -0.23 -0.01 -0.68 0.00 7.94 -0.98 -0.57 117.00 122.47 2g3m n LEU 472 Ca 0.10 1.55 0.06 0.00 -1.11 0.00 0.00 56.01 56.61 2g3m n LEU 472 Cb 0.15 -0.61 0.17 0.00 0.53 0.00 0.00 43.42 43.65 2g3m n LEU 472 CO 0.08 -1.61 0.64 0.49 -1.11 0.00 0.00 177.39 175.88 2g3m n PHE 473 N -5.28 0.53 -2.19 1.96 3.72 -1.26 -4.77 117.46 110.16 2g3m n PHE 473 Ca 0.25 -0.54 -0.38 0.00 -0.05 0.00 0.00 57.45 56.72 2g3m n PHE 473 Cb 0.82 -0.06 -0.01 0.00 -0.94 0.00 0.00 39.48 39.29 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 -1.21 2.89 0.15 1.38 0.08 0.26 -4.82 117.98 116.71 2g3m s PHE 474 Ca 0.26 1.50 -0.16 0.00 0.12 0.00 0.00 56.93 58.65 2g3m s PHE 474 Cb 0.15 -3.48 0.01 0.00 -0.57 0.00 0.00 43.02 39.13 2g3m s PHE 474 CO 0.15 -1.67 1.81 -1.35 -0.10 0.00 0.00 175.22 174.06 2g3m h PRO 475 N 2.36 0.53 -5.04 0.24 0.11 -1.83 -3.39 132.00 124.98 2g3m h PRO 475 Ca -0.49 -0.04 -0.63 0.00 0.11 0.00 0.00 66.00 64.95 2g3m h PRO 475 Cb 1.25 -0.12 -0.16 0.00 0.11 0.00 0.00 31.00 32.08 2g3m h PRO 475 CO 0.61 0.36 -0.36 0.12 -0.21 0.00 0.00 178.00 178.52 2g3m s PHE 476 N -6.13 3.23 -0.59 0.65 5.36 -0.53 -4.53 117.98 115.45 2g3m s PHE 476 Ca -0.13 0.27 0.03 0.00 -0.96 0.00 0.00 56.93 56.14 2g3m s PHE 476 Cb 0.11 -2.49 0.15 0.00 -0.34 0.00 0.00 43.02 40.44 2g3m s PHE 476 CO 0.72 -0.21 0.36 -0.47 -1.46 0.00 0.00 175.22 174.16 2g3m s TYR 477 N 1.93 3.33 -0.01 10.12 5.04 -1.26 -4.33 117.35 132.17 2g3m s TYR 477 Ca 0.11 -3.16 0.04 0.00 -2.44 0.00 0.00 57.07 51.62 2g3m s TYR 477 Cb -0.16 -2.86 -0.01 0.00 0.35 0.00 0.00 41.96 39.29 2g3m s TYR 477 CO 0.10 -0.71 -0.12 0.50 -1.34 0.00 0.00 175.55 173.99 2g3m s ARG 478 N -0.59 0.97 -0.23 4.97 3.52 -1.26 -1.41 118.95 124.93 2g3m s ARG 478 Ca 0.19 -0.42 -0.10 0.00 -0.13 0.00 0.00 55.73 55.27 2g3m s ARG 478 Cb -0.20 -0.94 -0.05 0.00 -1.56 0.00 0.00 34.95 32.21 2g3m s ARG 478 CO -0.05 0.25 0.14 0.45 -0.81 0.00 0.00 175.30 175.29 2g3m s SER 479 N -0.26 6.04 -0.02 -2.12 0.15 -0.53 -0.23 113.70 116.74 2g3m s SER 479 Ca 0.04 0.11 -0.04 0.00 0.70 0.00 0.00 55.95 56.77 2g3m s SER 479 Cb -0.05 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.18 2g3m s SER 479 CO -0.00 0.09 0.08 -2.28 1.20 0.00 0.00 173.24 172.33 2g3m s HIS 480 N 0.92 -0.01 -0.02 3.44 5.04 -1.25 -0.19 115.29 123.22 2g3m s HIS 480 Ca 0.07 0.04 -0.08 0.00 -1.54 0.00 0.00 55.06 53.55 2g3m s HIS 480 Cb -0.13 -0.02 0.01 0.00 0.04 0.00 0.00 32.58 32.48 2g3m s HIS 480 CO 0.03 -0.12 0.17 0.21 -2.34 0.00 0.00 174.74 172.68 2g3m s LYS 481 N -0.52 0.44 0.82 2.88 2.47 -1.25 -4.05 119.74 120.54 2g3m s LYS 481 Ca -0.06 -0.23 -0.11 0.00 -1.56 0.00 0.00 55.97 54.02 2g3m s LYS 481 Cb -0.04 0.19 0.08 0.00 -1.46 0.00 0.00 37.83 36.61 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 -1.04 1.99 0.23 3.13 0.00 0.67 -1.10 121.76 125.64 2g3m s ALA 482 Ca -0.11 0.19 -0.06 0.00 0.00 0.00 0.00 51.96 51.98 2g3m s ALA 482 Cb -0.06 -3.26 0.40 0.00 0.00 0.00 0.00 23.12 20.20 2g3m s ALA 482 CO 0.02 -2.01 1.73 1.15 0.00 0.00 0.00 175.76 176.65 2g3m h THR 483 N -1.30 0.67 -0.34 0.00 2.02 -1.66 -1.83 112.91 110.47 2g3m h THR 483 Ca -0.45 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 66.59 2g3m h THR 483 Cb 1.25 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2g3m h THR 483 CO 0.52 0.08 0.00 -0.90 0.37 0.00 0.00 175.52 175.58 2g3m n ASP 484 N -5.02 2.10 -4.89 4.18 5.75 -1.26 -4.91 116.55 112.51 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 0.38 -0.29 -0.00 0.00 -1.03 0.00 0.00 41.12 40.17 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 1.65 0.87 6.12 0.00 -0.69 -3.79 107.32 110.58 2g3m s GLY 485 Ca 0.24 -0.27 -0.11 0.00 0.00 0.00 0.00 44.72 44.58 2g3m s GLY 485 CO 0.14 -0.06 1.10 -0.26 0.00 0.00 0.00 173.10 174.03 2g3m s ILE 486 N -2.85 2.74 -0.08 0.90 -4.36 -1.26 -4.92 121.20 111.37 2g3m s ILE 486 Ca 0.51 0.24 -0.30 0.00 -0.26 0.00 0.00 60.65 60.85 2g3m s ILE 486 Cb -0.11 -2.56 -0.04 0.00 1.25 0.00 0.00 42.46 41.00 2g3m s ILE 486 CO 0.46 -0.31 1.46 -1.81 0.24 0.00 0.00 174.94 174.98 2g3m s ASP 487 N -3.14 6.80 0.00 4.36 1.01 -1.26 -4.90 116.67 119.55 2g3m s ASP 487 Ca 0.64 2.03 0.18 0.00 0.71 0.00 0.00 52.55 56.11 2g3m s ASP 487 Cb -0.19 -2.54 0.32 0.00 1.01 0.00 0.00 42.92 41.51 2g3m s ASP 487 CO 0.57 -0.82 1.24 0.35 0.21 0.00 0.00 175.17 176.73 2g3m n THR 488 N 5.24 0.47 -1.89 -1.27 -2.24 -1.26 -4.93 114.28 108.40 2g3m n THR 488 Ca 0.15 -0.73 -0.41 0.00 -2.27 0.00 0.00 64.05 60.79 2g3m n THR 488 Cb 0.44 0.97 -0.01 0.00 -2.10 0.00 0.00 70.33 69.62 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 -1.29 4.19 0.48 -0.78 8.01 -1.26 -4.87 118.70 123.17 2g3m s GLU 489 Ca 0.29 2.46 0.25 0.00 0.01 0.00 0.00 54.97 57.98 2g3m s GLU 489 Cb 0.18 -3.03 1.29 0.00 -4.31 0.00 0.00 34.13 28.25 2g3m s GLU 489 CO 0.25 -0.49 1.87 -1.35 0.01 0.00 0.00 175.26 175.54 2g3m h PRO 490 N 4.15 0.19 0.00 0.39 0.11 -1.97 -1.05 132.00 133.82 2g3m h PRO 490 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2g3m h PRO 490 Cb 1.23 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2g3m h PRO 490 CO 0.73 0.13 0.00 1.33 -0.21 0.00 0.00 178.00 179.97 2g3m n VAL 491 N -4.40 1.17 0.51 3.15 0.24 -1.26 -1.56 118.33 116.19 2g3m n VAL 491 Ca 0.19 0.40 0.11 0.00 -2.04 0.00 0.00 64.34 63.01 2g3m n VAL 491 Cb 0.85 -1.32 0.17 0.00 -1.47 0.00 0.00 33.84 32.07 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 -1.88 0.32 -3.30 6.34 3.72 -0.40 -4.96 117.46 117.31 2g3m n PHE 492 Ca 0.01 -0.17 -0.31 0.00 -0.05 0.00 0.00 57.45 56.93 2g3m n PHE 492 Cb 0.12 -0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.61 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 -1.60 4.09 0.66 4.37 1.43 -0.60 -5.05 118.68 121.97 2g3m s LEU 493 Ca 0.34 0.95 -0.17 0.00 -1.03 0.00 0.00 54.13 54.21 2g3m s LEU 493 Cb 0.21 -3.74 -0.00 0.00 0.03 0.00 0.00 46.19 42.68 2g3m s LEU 493 CO 0.30 -0.15 1.25 -2.84 0.23 0.00 0.00 176.35 175.13 2g3m s PRO 494 N -3.11 2.53 0.30 1.29 0.02 -1.26 -4.50 135.00 130.26 2g3m s PRO 494 Ca 0.48 1.92 0.02 0.00 0.02 0.00 0.00 61.00 63.44 2g3m s PRO 494 Cb -0.11 -1.86 0.75 0.00 0.02 0.00 0.00 34.50 33.30 2g3m s PRO 494 CO 0.24 -1.57 1.60 -0.44 -0.33 0.00 0.00 177.00 176.50 2g3m h ASP 495 N 0.38 -0.25 -0.40 2.53 3.32 -1.97 -0.13 116.42 119.92 2g3m h ASP 495 Ca -0.50 0.24 0.08 0.00 0.02 0.00 0.00 57.03 56.88 2g3m h ASP 495 Cb 1.32 0.38 -0.08 0.00 0.22 0.00 0.00 39.33 41.17 2g3m h ASP 495 CO 0.53 -0.28 -0.12 0.22 -1.72 0.00 0.00 179.24 177.87 2g3m h TYR 496 N 0.08 -0.26 0.09 4.55 3.20 -2.01 -1.04 116.97 121.59 2g3m h TYR 496 Ca 0.58 0.04 -0.25 0.00 3.14 0.00 0.00 58.73 62.24 2g3m h TYR 496 Cb 1.22 0.18 -0.01 0.00 1.54 0.00 0.00 36.73 39.66 2g3m h TYR 496 CO -0.38 -0.19 -1.17 1.88 -1.64 0.00 0.00 178.16 176.66 2g3m h TYR 497 N -0.02 0.34 -0.80 -3.82 0.05 -1.58 -3.25 116.97 107.90 2g3m h TYR 497 Ca 0.19 -0.25 0.02 0.00 0.05 0.00 0.00 58.73 58.74 2g3m h TYR 497 Cb 0.32 -0.01 -0.04 0.00 1.01 0.00 0.00 36.73 38.00 2g3m h TYR 497 CO -0.37 1.20 0.52 -0.22 -1.05 0.00 0.00 178.16 178.24 2g3m h LYS 498 N 0.05 1.02 -0.78 4.88 3.64 -0.74 -2.19 116.57 122.45 2g3m h LYS 498 Ca -0.10 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 2g3m h LYS 498 Cb 1.91 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 33.47 2g3m h LYS 498 CO 0.18 0.67 0.30 0.93 -2.27 0.00 0.00 179.45 179.27 2g3m h GLU 499 N 1.05 1.17 -0.54 1.90 4.39 -1.28 -0.95 114.58 120.31 2g3m h GLU 499 Ca 0.30 -0.21 -0.04 0.00 0.34 0.00 0.00 59.36 59.75 2g3m h GLU 499 Cb -0.07 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.36 2g3m h GLU 499 CO -0.08 0.95 0.20 0.87 -1.16 0.00 0.00 179.01 179.79 2g3m h LYS 500 N 1.14 0.82 -0.34 2.33 1.57 -1.47 -0.79 116.57 119.83 2g3m h LYS 500 Ca 0.26 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.82 2g3m h LYS 500 Cb 0.22 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2g3m h LYS 500 CO -0.02 0.73 -0.03 0.28 -0.57 0.00 0.00 179.45 179.84 2g3m h VAL 501 N 0.74 1.27 -0.44 0.50 2.07 -1.19 -2.23 116.25 116.97 2g3m h VAL 501 Ca 0.18 -1.03 0.07 0.00 0.82 0.00 0.00 66.70 66.74 2g3m h VAL 501 Cb 0.23 1.25 -0.06 0.00 -1.52 0.00 0.00 31.29 31.18 2g3m h VAL 501 CO -0.01 0.34 0.06 0.50 0.02 0.00 0.00 177.57 178.48 2g3m h LYS 502 N 0.43 0.18 -0.62 1.57 3.64 -0.91 -0.13 116.57 120.72 2g3m h LYS 502 Ca 0.09 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.39 2g3m h LYS 502 Cb 0.50 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 2g3m h LYS 502 CO 0.02 0.12 0.11 0.93 -2.27 0.00 0.00 179.45 178.37 2g3m h GLU 503 N 0.19 1.00 -0.37 1.90 5.08 -1.04 -0.87 114.58 120.47 2g3m h GLU 503 Ca 0.22 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 2g3m h GLU 503 Cb 0.28 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 2g3m h GLU 503 CO -0.30 0.91 0.09 0.82 -1.00 0.00 0.00 179.01 179.53 2g3m h ILE 504 N 0.94 1.23 -0.63 3.13 2.04 -0.75 0.16 117.51 123.63 2g3m h ILE 504 Ca 0.19 -0.77 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 2g3m h ILE 504 Cb 0.39 1.02 -0.03 0.00 -0.74 0.00 0.00 36.82 37.47 2g3m h ILE 504 CO 0.01 0.26 0.16 0.58 0.00 0.00 0.00 178.15 179.16 2g3m h VAL 505 N 0.45 1.25 -0.57 1.67 2.07 -0.86 -1.07 116.25 119.19 2g3m h VAL 505 Ca 0.12 -0.90 -0.04 0.00 0.82 0.00 0.00 66.70 66.70 2g3m h VAL 505 Cb 0.31 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 2g3m h VAL 505 CO 0.00 0.34 0.20 -0.33 0.02 0.00 0.00 177.57 177.81 2g3m h GLU 506 N 0.91 0.84 -0.38 1.57 5.08 -0.92 -1.79 114.58 119.90 2g3m h GLU 506 Ca 0.20 -0.14 -0.09 0.00 -1.00 0.00 0.00 59.36 58.33 2g3m h GLU 506 Cb 0.34 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 2g3m h GLU 506 CO -0.00 0.71 -0.14 1.25 -1.00 0.00 0.00 179.01 179.82 2g3m h LEU 507 N 0.82 0.68 -0.39 1.33 5.85 -0.37 -1.16 115.31 122.08 2g3m h LEU 507 Ca 0.19 -0.21 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2g3m h LEU 507 Cb 0.20 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2g3m h LEU 507 CO -0.01 0.84 0.14 -0.09 -0.34 0.00 0.00 178.44 178.98 2g3m h ARG 508 N 0.62 0.60 0.00 1.25 2.43 -0.46 -2.05 114.38 116.77 2g3m h ARG 508 Ca 0.10 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 2g3m h ARG 508 Cb 0.60 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 2g3m h ARG 508 CO 0.04 0.58 -0.24 1.88 -1.51 0.00 0.00 179.97 180.73 2g3m h TYR 509 N 0.49 0.00 -0.40 2.20 0.05 -1.08 0.92 116.97 119.15 2g3m h TYR 509 Ca 0.13 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.83 2g3m h TYR 509 Cb 0.22 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.94 2g3m h TYR 509 CO 0.00 0.24 -0.09 -0.22 -1.05 0.00 0.00 178.16 177.05 2g3m h LYS 510 N 0.00 0.70 -0.02 4.88 3.64 -0.64 -2.76 116.57 122.37 2g3m h LYS 510 Ca -0.00 -0.21 0.00 0.00 -1.27 0.00 0.00 60.65 59.17 2g3m h LYS 510 Cb 0.42 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 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 -4.19 0.00 -0.29 1.91 3.72 -0.64 -0.36 117.46 117.62 2g3m n PHE 511 Ca 0.01 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.49 2g3m n PHE 511 Cb 0.34 -0.03 0.23 0.00 -0.94 0.00 0.00 39.48 39.07 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 2.49 0.45 -1.24 4.37 5.85 -0.55 -1.01 115.31 125.66 2g3m h LEU 512 Ca 0.00 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.89 2g3m h LEU 512 Cb 0.61 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.63 2g3m h LEU 512 CO 0.00 0.17 0.55 -0.65 -0.34 0.00 0.00 178.44 178.16 2g3m h PRO 513 N 0.55 0.88 -0.07 5.25 0.11 -1.78 0.28 132.00 137.23 2g3m h PRO 513 Ca 0.46 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.50 2g3m h PRO 513 Cb 0.70 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 31.61 2g3m h PRO 513 CO -0.39 0.58 -0.05 -0.92 -0.21 0.00 0.00 178.00 177.01 2g3m h TYR 514 N 0.90 0.18 -0.36 0.65 3.20 -1.00 -1.63 116.97 118.91 2g3m h TYR 514 Ca 0.37 -0.05 0.04 0.00 3.14 0.00 0.00 58.73 62.23 2g3m h TYR 514 Cb 0.26 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 2g3m h TYR 514 CO -0.00 0.57 0.11 0.82 -1.64 0.00 0.00 178.16 178.03 2g3m h ILE 515 N -0.27 0.88 -0.15 1.81 2.04 -0.65 -1.10 117.51 120.08 2g3m h ILE 515 Ca 0.01 -0.09 -0.06 0.00 1.00 0.00 0.00 64.86 65.72 2g3m h ILE 515 Cb 0.54 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2g3m h ILE 515 CO 0.01 0.05 -0.20 0.22 0.00 0.00 0.00 178.15 178.23 2g3m h TYR 516 N 0.26 0.27 -0.60 1.37 3.20 -0.48 -0.69 116.97 120.29 2g3m h TYR 516 Ca 0.17 -0.04 -0.08 0.00 3.14 0.00 0.00 58.73 61.92 2g3m h TYR 516 Cb 0.15 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.33 2g3m h TYR 516 CO -0.15 0.44 0.06 0.77 -1.64 0.00 0.00 178.16 177.64 2g3m h SER 517 N 0.23 0.97 0.36 -2.11 0.02 -0.45 -0.88 113.55 111.69 2g3m h SER 517 Ca 0.04 -0.24 -0.09 0.00 -0.84 0.00 0.00 61.79 60.67 2g3m h SER 517 Cb 0.49 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2g3m h SER 517 CO 0.03 0.98 -0.40 -0.07 -1.14 0.00 0.00 176.83 176.24 2g3m h LEU 518 N 0.94 0.05 -0.63 5.07 3.38 -0.43 -1.24 115.31 122.45 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 41.17 2g3m h LEU 518 CO 0.02 0.44 0.08 0.00 0.09 0.00 0.00 178.44 179.07 2g3m h ALA 519 N 1.56 0.84 -0.41 1.53 0.00 -0.27 0.72 119.26 123.23 2g3m h ALA 519 Ca 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 2g3m h ALA 519 Cb 0.72 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2g3m h ALA 519 CO 0.05 0.62 0.20 1.25 0.00 0.00 0.00 179.25 181.37 2g3m h LEU 520 N 0.97 0.54 -0.89 0.00 5.85 -0.59 -0.89 115.31 120.30 2g3m h LEU 520 Ca 0.19 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.85 2g3m h LEU 520 Cb 0.47 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 2g3m h LEU 520 CO 0.02 0.51 0.55 -0.08 -0.34 0.00 0.00 178.44 179.10 2g3m h GLU 521 N 0.53 0.97 -0.53 1.25 4.81 -0.83 -1.10 114.58 119.68 2g3m h GLU 521 Ca 0.14 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2g3m h GLU 521 Cb 0.12 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.25 2g3m h GLU 521 CO -0.02 0.64 0.19 0.00 -0.73 0.00 0.00 179.01 179.09 2g3m h ALA 522 N 1.42 0.70 0.00 2.92 0.00 -0.22 0.17 119.26 124.25 2g3m h ALA 522 Ca 0.39 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2g3m h ALA 522 Cb 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2g3m h ALA 522 CO -0.18 0.34 0.00 0.66 0.00 0.00 0.00 179.25 180.07 2g3m h SER 523 N 0.73 0.00 0.01 0.00 4.64 -0.45 0.24 113.55 118.72 2g3m h SER 523 Ca 0.17 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 61.09 2g3m h SER 523 Cb 0.25 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.28 2g3m h SER 523 CO -0.01 0.00 -2.28 -0.62 -0.87 0.00 0.00 176.83 173.05 2g3m n GLU 524 N -2.89 0.62 -0.00 4.77 1.02 -0.48 -4.45 120.64 119.23 2g3m n GLU 524 Ca 0.02 0.28 0.07 0.00 -0.02 0.00 0.00 57.16 57.51 2g3m n GLU 524 Cb 0.34 -1.56 -0.10 0.00 -0.02 0.00 0.00 31.44 30.11 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 -3.92 1.55 -1.15 3.49 4.01 0.58 -5.00 118.16 117.72 2g3m n LYS 525 Ca -0.47 -0.05 0.00 0.00 -0.51 0.00 0.00 58.31 57.28 2g3m n LYS 525 Cb 0.90 -1.25 0.00 0.00 -0.51 0.00 0.00 35.03 34.17 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 1.46 0.45 3.76 0.72 0.00 0.07 -4.44 105.19 107.21 2g3m n GLY 526 Ca 0.01 -0.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.68 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 3.72 0.62 1.61 3.76 -1.26 -4.58 115.29 117.16 2g3m s HIS 527 Ca 0.00 1.35 -0.16 0.00 -0.15 0.00 0.00 55.06 56.10 2g3m s HIS 527 Cb 0.00 -2.72 -0.02 0.00 1.11 0.00 0.00 32.58 30.95 2g3m s HIS 527 CO 0.00 0.32 1.11 -1.25 -0.85 0.00 0.00 174.74 174.07 2g3m s PRO 528 N -0.18 3.02 -0.05 8.40 0.04 -1.26 -3.84 135.00 141.13 2g3m s PRO 528 Ca 0.35 1.41 -0.08 0.00 0.04 0.00 0.00 61.00 62.72 2g3m s PRO 528 Cb -0.20 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 2g3m s PRO 528 CO 0.20 -1.08 0.37 0.28 0.04 0.00 0.00 177.00 176.81 2g3m h VAL 529 N 0.38 0.00 -3.12 -0.36 2.07 -1.85 -3.44 116.25 109.93 2g3m h VAL 529 Ca -0.48 -0.63 -0.59 0.00 0.82 0.00 0.00 66.70 65.82 2g3m h VAL 529 Cb 1.25 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.97 2g3m h VAL 529 CO 0.55 0.00 -0.20 0.27 0.02 0.00 0.00 177.57 178.22 2g3m s ILE 530 N -2.48 5.02 0.01 4.57 -4.36 -1.26 -0.57 121.20 122.13 2g3m s ILE 530 Ca -0.04 0.67 0.00 0.00 -0.26 0.00 0.00 60.65 61.02 2g3m s ILE 530 Cb 0.00 -3.69 -0.01 0.00 1.25 0.00 0.00 42.46 40.01 2g3m s ILE 530 CO 0.13 0.38 -0.02 -0.13 0.24 0.00 0.00 174.94 175.54 2g3m s ARG 531 N -1.63 0.17 0.64 0.37 0.52 0.14 -4.80 118.95 114.36 2g3m s ARG 531 Ca 0.31 -0.29 -0.15 0.00 -0.52 0.00 0.00 55.73 55.07 2g3m s ARG 531 Cb -0.15 0.02 -0.01 0.00 0.52 0.00 0.00 34.95 35.33 2g3m s ARG 531 CO 0.17 -0.02 1.10 -1.25 0.02 0.00 0.00 175.30 175.32 2g3m s PRO 532 N -0.68 2.97 0.38 3.54 0.04 -1.26 0.54 135.00 140.53 2g3m s PRO 532 Ca -0.07 1.35 0.10 0.00 0.04 0.00 0.00 61.00 62.42 2g3m s PRO 532 Cb -0.05 -1.98 0.88 0.00 0.04 0.00 0.00 34.50 33.39 2g3m s PRO 532 CO -0.00 -1.11 1.90 -0.07 0.04 0.00 0.00 177.00 177.75 2g3m h LEU 533 N 0.20 0.57 -0.08 -3.56 3.38 -1.83 -0.99 115.31 112.99 2g3m h LEU 533 Ca -0.47 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.53 2g3m h LEU 533 Cb 1.24 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2g3m h LEU 533 CO 0.55 0.31 0.00 2.22 0.09 0.00 0.00 178.44 181.61 2g3m n PHE 534 N -4.52 0.06 -0.11 1.13 1.16 -1.26 -1.84 117.46 112.08 2g3m n PHE 534 Ca 0.15 0.03 -0.13 0.00 -1.87 0.00 0.00 57.45 55.63 2g3m n PHE 534 Cb 0.44 -0.55 -0.03 0.00 -1.61 0.00 0.00 39.48 37.74 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 0.97 0.00 2.97 5.03 -1.53 -0.96 116.97 123.46 2g3m h TYR 535 Ca 0.00 -0.29 -0.01 0.00 2.58 0.00 0.00 58.73 61.01 2g3m h TYR 535 Cb 0.14 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.21 2g3m h TYR 535 CO 0.00 1.07 -0.96 0.93 -1.32 0.00 0.00 178.16 177.88 2g3m h GLU 536 N 0.60 0.00 -1.86 1.82 4.39 -1.56 -3.40 114.58 114.57 2g3m h GLU 536 Ca 0.06 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.27 2g3m h GLU 536 Cb 0.89 0.00 -0.41 0.00 -0.10 0.00 0.00 28.75 29.14 2g3m h GLU 536 CO 0.08 0.03 -1.06 1.19 -1.16 0.00 0.00 179.01 178.08 2g3m n PHE 537 N -2.73 1.30 0.28 4.33 3.01 -0.77 -4.93 117.46 117.95 2g3m n PHE 537 Ca -0.00 -3.64 0.16 0.00 1.01 0.00 0.00 57.45 54.97 2g3m n PHE 537 Cb 0.57 -0.41 0.81 0.00 -0.01 0.00 0.00 39.48 40.44 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 2.97 0.00 -0.00 -1.08 3.07 -1.38 -2.50 115.11 116.19 2g3m h GLN 538 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.82 2g3m h GLN 538 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.47 2g3m h GLN 538 CO 0.58 0.00 -0.15 -0.40 0.09 0.00 0.00 178.83 178.95 2g3m n ASP 539 N -2.67 0.19 -4.34 0.06 5.75 -1.26 -4.67 116.55 109.61 2g3m n ASP 539 Ca -0.01 0.13 -0.43 0.00 -0.01 0.00 0.00 54.79 54.47 2g3m n ASP 539 Cb 0.12 -0.23 -0.09 0.00 -1.03 0.00 0.00 41.12 39.89 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 -2.91 5.93 0.49 -1.12 2.15 -0.94 -4.89 116.67 115.37 2g3m s ASP 540 Ca 0.16 -1.38 0.23 0.00 0.43 0.00 0.00 52.55 51.99 2g3m s ASP 540 Cb 0.19 -2.10 1.28 0.00 -0.30 0.00 0.00 42.92 41.99 2g3m s ASP 540 CO 0.57 -0.59 1.93 0.44 -0.17 0.00 0.00 175.17 177.35 2g3m h ASP 541 N 8.60 0.16 -0.76 -0.34 3.32 -1.86 -1.02 116.42 124.52 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 0.82 0.08 0.50 0.44 -1.72 0.00 0.00 179.24 179.36 2g3m h ASP 542 N 0.17 0.61 0.07 6.45 5.19 -1.95 -2.27 116.42 124.69 2g3m h ASP 542 Ca 0.36 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.78 2g3m h ASP 542 Cb 1.15 -0.11 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 2g3m h ASP 542 CO -0.06 0.36 -0.02 0.24 -3.12 0.00 0.00 179.24 176.65 2g3m h MET 543 N 0.68 0.00 0.00 3.56 2.86 -1.49 -2.16 114.93 118.37 2g3m h MET 543 Ca 0.35 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.99 2g3m h MET 543 Cb 0.46 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.12 2g3m h MET 543 CO -0.13 0.02 0.00 0.66 1.06 0.00 0.00 176.91 178.52 2g3m n TYR 544 N -3.61 0.00 0.49 -0.22 4.02 -0.85 -2.92 117.16 114.07 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 0.10 -0.14 -0.01 0.00 -0.02 0.00 0.00 39.34 39.27 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 -1.14 2.27 -3.07 -0.72 5.12 -0.81 -4.43 116.66 113.87 2g3m n ARG 545 Ca 0.17 -0.53 -0.42 0.00 -1.93 0.00 0.00 57.85 55.14 2g3m n ARG 545 Cb 0.16 -1.09 -0.06 0.00 -1.16 0.00 0.00 32.46 30.30 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 -1.53 4.82 0.00 0.55 1.09 -1.15 -4.87 121.20 120.11 2g3m s ILE 546 Ca 0.08 0.49 0.00 0.00 -1.10 0.00 0.00 60.65 60.12 2g3m s ILE 546 Cb 0.09 -4.16 0.00 0.00 -1.06 0.00 0.00 42.46 37.33 2g3m s ILE 546 CO 0.30 -0.45 0.24 -0.62 -0.10 0.00 0.00 174.94 174.31 2g3m n GLU 547 N 6.23 1.83 -0.89 2.79 1.02 -1.26 -4.63 120.64 125.73 2g3m n GLU 547 Ca -0.00 -0.24 0.05 0.00 -0.02 0.00 0.00 57.16 56.95 2g3m n GLU 547 Cb 0.48 -0.69 0.38 0.00 -0.02 0.00 0.00 31.44 31.59 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 -0.33 5.42 -3.98 1.62 5.68 -1.26 -4.72 116.55 118.98 2g3m n ASP 548 Ca 0.00 -3.01 -0.09 0.00 -0.50 0.00 0.00 54.79 51.19 2g3m n ASP 548 Cb 0.03 -0.69 -0.11 0.00 -1.14 0.00 0.00 41.12 39.21 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 -2.83 0.32 0.00 0.11 2.02 -1.26 -3.88 118.70 113.19 2g3m s GLU 549 Ca 0.54 -0.61 -0.16 0.00 0.02 0.00 0.00 54.97 54.75 2g3m s GLU 549 Cb 0.42 0.07 0.03 0.00 0.10 0.00 0.00 34.13 34.75 2g3m s GLU 549 CO 0.15 -0.04 0.35 1.52 0.02 0.00 0.00 175.26 177.26 2g3m s TYR 550 N -1.42 -0.22 0.02 1.61 -0.85 -0.54 -4.51 117.35 111.45 2g3m s TYR 550 Ca -0.15 0.28 -0.18 0.00 -0.52 0.00 0.00 57.07 56.50 2g3m s TYR 550 Cb -0.10 0.14 -0.06 0.00 0.38 0.00 0.00 41.96 42.32 2g3m s TYR 550 CO -0.01 -0.45 0.51 -1.64 -1.52 0.00 0.00 175.55 172.43 2g3m s MET 551 N -1.69 4.13 -0.40 -3.49 -1.94 0.19 -1.08 119.30 115.02 2g3m s MET 551 Ca -0.11 0.60 -0.07 0.00 -1.71 0.00 0.00 55.69 54.40 2g3m s MET 551 Cb -0.03 -3.26 0.08 0.00 2.01 0.00 0.00 34.83 33.63 2g3m s MET 551 CO 0.03 0.59 0.22 0.08 -0.01 0.00 0.00 175.02 175.92 2g3m s VAL 552 N -0.84 3.84 0.00 -6.03 1.01 0.33 0.29 120.40 119.00 2g3m s VAL 552 Ca 0.27 -1.57 0.00 0.00 0.00 0.00 0.00 61.98 60.68 2g3m s VAL 552 Cb -0.18 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.80 2g3m s VAL 552 CO 0.16 -0.51 0.00 0.61 0.00 0.00 0.00 175.10 175.36 2g3m n GLY 553 N 4.80 -0.39 0.03 4.51 0.00 0.27 -2.45 105.19 111.96 2g3m n GLY 553 Ca -0.08 -1.07 0.11 0.00 0.00 0.00 0.00 46.02 44.98 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 0.23 -0.09 1.61 4.81 -1.26 -4.56 118.16 118.89 2g3m n LYS 554 Ca 0.00 0.01 -0.10 0.00 -0.87 0.00 0.00 58.31 57.35 2g3m n LYS 554 Cb 0.00 -1.59 -0.13 0.00 0.02 0.00 0.00 35.03 33.33 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 -1.89 0.00 -4.09 5.64 4.01 -1.25 -4.92 117.16 114.66 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 0.42 -0.86 -0.10 0.00 -0.31 0.00 0.00 39.34 38.49 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 -5.48 3.74 -0.13 7.72 0.20 -1.03 -1.76 118.68 121.94 2g3m s LEU 556 Ca -0.13 0.08 -0.02 0.00 0.69 0.00 0.00 54.13 54.75 2g3m s LEU 556 Cb 0.06 -1.93 -0.02 0.00 -0.43 0.00 0.00 46.19 43.86 2g3m s LEU 556 CO 0.68 0.20 -0.07 -0.22 -0.29 0.00 0.00 176.35 176.65 2g3m s LEU 557 N 0.19 3.08 -0.10 -0.68 0.20 -0.15 0.12 118.68 121.34 2g3m s LEU 557 Ca 0.03 -0.17 0.02 0.00 0.69 0.00 0.00 54.13 54.70 2g3m s LEU 557 Cb -0.12 -1.72 0.01 0.00 -0.43 0.00 0.00 46.19 43.93 2g3m s LEU 557 CO 0.01 0.20 -0.14 -0.47 -0.29 0.00 0.00 176.35 175.66 2g3m s TYR 558 N 0.16 1.83 -0.75 5.38 5.04 -0.24 -1.15 117.35 127.61 2g3m s TYR 558 Ca -0.03 -0.83 0.02 0.00 -2.44 0.00 0.00 57.07 53.79 2g3m s TYR 558 Cb -0.14 -1.34 0.18 0.00 0.35 0.00 0.00 41.96 41.02 2g3m s TYR 558 CO 0.03 -0.44 0.57 0.00 -1.34 0.00 0.00 175.55 174.38 2g3m s ALA 559 N 0.97 3.93 0.51 3.97 0.00 -0.53 -1.46 121.76 129.14 2g3m s ALA 559 Ca -0.08 -3.79 -0.23 0.00 0.00 0.00 0.00 51.96 47.86 2g3m s ALA 559 Cb -0.15 -2.40 -0.06 0.00 0.00 0.00 0.00 23.12 20.51 2g3m s ALA 559 CO -0.01 -2.11 1.39 -1.25 0.00 0.00 0.00 175.76 173.79 2g3m s PRO 560 N -1.31 3.34 -0.46 0.00 0.04 -1.25 -4.20 135.00 131.16 2g3m s PRO 560 Ca 0.25 2.33 -0.28 0.00 0.04 0.00 0.00 61.00 63.33 2g3m s PRO 560 Cb -0.07 -2.41 0.03 0.00 0.04 0.00 0.00 34.50 32.08 2g3m s PRO 560 CO -0.14 -1.06 1.10 0.42 0.04 0.00 0.00 177.00 177.36 2g3m s ILE 561 N -1.25 4.28 -0.37 0.56 1.01 -1.26 -4.88 121.20 119.28 2g3m s ILE 561 Ca 0.68 1.22 0.06 0.00 0.00 0.00 0.00 60.65 62.60 2g3m s ILE 561 Cb -0.42 -4.56 0.53 0.00 0.01 0.00 0.00 42.46 38.02 2g3m s ILE 561 CO 0.52 -0.92 1.60 1.33 0.00 0.00 0.00 174.94 177.46 2g3m n VAL 562 N 6.67 2.83 -4.09 2.92 0.24 -1.26 -4.92 118.33 120.71 2g3m n VAL 562 Ca 0.11 -2.80 -0.11 0.00 -2.04 0.00 0.00 64.34 59.50 2g3m n VAL 562 Cb 0.49 -0.55 -0.07 0.00 -1.47 0.00 0.00 33.84 32.23 2g3m n VAL 562 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2g3m s SER 563 N -2.33 0.22 0.00 -1.34 1.04 -1.26 -4.92 113.70 105.10 2g3m s SER 563 Ca 0.51 -1.21 0.25 0.00 0.48 0.00 0.00 55.95 55.97 2g3m s SER 563 Cb 0.44 0.52 1.24 0.00 0.10 0.00 0.00 66.02 68.32 2g3m s SER 563 CO 0.02 -1.06 1.82 0.29 0.98 0.00 0.00 173.24 175.30 2g3m n LYS 564 N -0.38 0.34 -0.66 4.02 4.01 -1.26 -4.88 118.16 119.35 2g3m n LYS 564 Ca 0.00 0.05 -0.29 0.00 -0.51 0.00 0.00 58.31 57.57 2g3m n LYS 564 Cb 0.63 -1.50 0.23 0.00 -0.51 0.00 0.00 35.03 33.88 2g3m n LYS 564 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 2g3m s GLU 565 N -2.59 -0.52 0.10 1.97 2.02 -1.26 -4.95 118.70 113.47 2g3m s GLU 565 Ca 0.23 0.87 0.23 0.00 0.02 0.00 0.00 54.97 56.31 2g3m s GLU 565 Cb 0.17 -1.60 -0.00 0.00 0.10 0.00 0.00 34.13 32.80 2g3m s GLU 565 CO 0.38 -3.47 0.98 -1.91 0.02 0.00 0.00 175.26 171.26 2g3m n GLU 566 N -4.74 0.47 -4.05 1.61 2.13 -1.26 -4.96 120.64 109.84 2g3m n GLU 566 Ca 0.04 0.02 -0.11 0.00 0.66 0.00 0.00 57.16 57.77 2g3m n GLU 566 Cb 0.54 -1.68 -0.06 0.00 0.27 0.00 0.00 31.44 30.52 2g3m n GLU 566 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2g3m s SER 567 N -4.60 0.23 0.24 4.31 1.04 -1.26 -4.75 113.70 108.92 2g3m s SER 567 Ca 0.01 -1.17 -0.10 0.00 0.48 0.00 0.00 55.95 55.17 2g3m s SER 567 Cb 0.12 0.58 -0.01 0.00 0.10 0.00 0.00 66.02 66.81 2g3m s SER 567 CO 0.81 -1.15 0.41 0.00 0.98 0.00 0.00 173.24 174.28 2g3m s ARG 568 N -3.73 1.50 0.11 4.02 1.70 -1.26 -4.95 118.95 116.34 2g3m s ARG 568 Ca 0.27 -1.36 -0.19 0.00 -0.47 0.00 0.00 55.73 53.98 2g3m s ARG 568 Cb 0.01 0.43 -0.07 0.00 -0.57 0.00 0.00 34.95 34.74 2g3m s ARG 568 CO 0.13 -0.60 0.60 -0.51 -1.08 0.00 0.00 175.30 173.84 2g3m s LEU 569 N -3.06 4.49 -0.10 -1.89 1.43 -1.26 -0.54 118.68 117.75 2g3m s LEU 569 Ca 0.26 1.29 0.03 0.00 -1.03 0.00 0.00 54.13 54.68 2g3m s LEU 569 Cb 0.01 -3.05 0.01 0.00 0.03 0.00 0.00 46.19 43.19 2g3m s LEU 569 CO 0.10 0.22 -0.18 -0.69 0.23 0.00 0.00 176.35 176.04 2g3m s VAL 570 N -1.20 1.64 -0.20 -1.59 1.01 0.31 -4.90 120.40 115.48 2g3m s VAL 570 Ca 0.32 -0.76 -0.16 0.00 0.00 0.00 0.00 61.98 61.38 2g3m s VAL 570 Cb -0.19 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.69 2g3m s VAL 570 CO 0.20 0.47 0.41 -0.89 0.00 0.00 0.00 175.10 175.28 2g3m s THR 571 N 0.67 5.19 -0.15 3.92 2.01 -1.26 -0.91 115.64 125.12 2g3m s THR 571 Ca -0.13 0.73 -0.04 0.00 0.31 0.00 0.00 61.69 62.56 2g3m s THR 571 Cb -0.16 -3.74 -0.03 0.00 0.01 0.00 0.00 72.50 68.58 2g3m s THR 571 CO 0.03 0.25 -0.02 -0.76 -0.69 0.00 0.00 174.62 173.43 2g3m s LEU 572 N 1.28 3.35 1.09 4.42 1.43 -0.07 -5.00 118.68 125.18 2g3m s LEU 572 Ca 0.20 -0.07 -0.16 0.00 -1.03 0.00 0.00 54.13 53.06 2g3m s LEU 572 Cb -0.15 -1.80 0.24 0.00 0.03 0.00 0.00 46.19 44.50 2g3m s LEU 572 CO 0.08 0.20 1.12 -2.84 0.23 0.00 0.00 176.35 175.14 2g3m s PRO 573 N 0.19 -0.35 0.51 1.29 0.02 -1.26 -0.27 135.00 135.12 2g3m s PRO 573 Ca -0.01 0.14 -0.21 0.00 0.02 0.00 0.00 61.00 60.94 2g3m s PRO 573 Cb -0.14 -1.68 -0.08 0.00 0.02 0.00 0.00 34.50 32.62 2g3m s PRO 573 CO 0.02 -3.17 0.89 -2.13 -0.33 0.00 0.00 177.00 172.28 2g3m n ARG 574 N -4.42 1.02 0.00 5.54 0.63 -1.26 -1.33 116.66 116.83 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 -2.01 0.00 0.00 0.45 0.00 0.00 32.46 31.49 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 1.35 1.10 3.84 5.14 0.00 -1.26 -4.76 105.19 110.59 2g3m n GLY 575 Ca 0.11 -2.11 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 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 -1.49 3.93 -0.06 1.61 1.02 -1.26 0.37 119.74 123.85 2g3m s LYS 576 Ca 0.00 0.42 0.04 0.00 0.02 0.00 0.00 55.97 56.44 2g3m s LYS 576 Cb 0.00 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.20 2g3m s LYS 576 CO 0.00 0.62 -0.16 -1.58 -0.92 0.00 0.00 175.35 173.30 2g3m s TRP 577 N -1.23 1.74 -0.27 3.18 0.52 0.52 -1.61 118.94 121.79 2g3m s TRP 577 Ca 0.29 -0.59 -0.13 0.00 0.02 0.00 0.00 56.10 55.69 2g3m s TRP 577 Cb -0.16 -1.20 -0.04 0.00 -1.15 0.00 0.00 33.47 30.91 2g3m s TRP 577 CO 0.16 -0.24 0.28 -0.47 0.02 0.00 0.00 176.95 176.70 2g3m s TYR 578 N 0.30 3.24 -0.67 -1.98 5.04 0.17 -0.17 117.35 123.29 2g3m s TYR 578 Ca -0.10 0.28 -0.27 0.00 -2.44 0.00 0.00 57.07 54.54 2g3m s TYR 578 Cb -0.14 -2.47 0.00 0.00 0.35 0.00 0.00 41.96 39.70 2g3m s TYR 578 CO 0.04 -0.18 1.61 1.21 -1.34 0.00 0.00 175.55 176.88 2g3m s ASN 579 N 1.66 5.66 0.36 4.32 3.84 0.99 -0.51 114.94 131.26 2g3m s ASN 579 Ca 0.11 -0.02 0.18 0.00 0.21 0.00 0.00 52.86 53.34 2g3m s ASN 579 Cb -0.16 -2.54 1.24 0.00 -0.55 0.00 0.00 41.25 39.24 2g3m s ASN 579 CO 0.10 -2.14 1.59 0.22 -2.79 0.00 0.00 177.10 174.08 2g3m h TYR 580 N 12.78 0.74 0.12 0.43 3.20 -1.78 0.40 116.97 132.86 2g3m h TYR 580 Ca -0.27 0.04 -0.30 0.00 3.14 0.00 0.00 58.73 61.34 2g3m h TYR 580 Cb 1.11 -0.15 -0.00 0.00 1.54 0.00 0.00 36.73 39.22 2g3m h TYR 580 CO 1.08 -0.43 -1.49 -1.49 -1.64 0.00 0.00 178.16 174.19 2g3m h TRP 581 N 0.04 0.48 -0.02 -3.82 4.06 -1.89 -3.39 115.95 111.41 2g3m h TRP 581 Ca 0.80 -0.35 0.00 0.00 2.06 0.00 0.00 58.89 61.41 2g3m h TRP 581 Cb 2.05 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 30.19 2g3m h TRP 581 CO -0.07 1.38 0.00 0.27 -3.56 0.00 0.00 178.44 176.46 2g3m n ASN 582 N -3.47 1.41 0.00 -3.49 0.23 -0.94 -5.01 115.26 103.99 2g3m n ASN 582 Ca -0.15 -1.28 0.00 0.00 -0.53 0.00 0.00 54.58 52.62 2g3m n ASN 582 Cb 1.04 -0.01 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 0.08 2.02 3.75 4.83 0.00 0.14 -4.51 105.19 111.49 2g3m n GLY 583 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.05 4.15 -0.32 1.61 2.12 -1.26 -4.50 118.70 120.46 2g3m s GLU 584 Ca 0.00 2.52 -0.09 0.00 0.36 0.00 0.00 54.97 57.76 2g3m s GLU 584 Cb 0.00 -3.04 0.01 0.00 0.26 0.00 0.00 34.13 31.36 2g3m s GLU 584 CO 0.00 -0.59 0.14 0.42 -0.54 0.00 0.00 175.26 174.69 2g3m s ILE 585 N 0.02 4.31 0.04 -3.70 1.01 -1.26 -0.01 121.20 121.62 2g3m s ILE 585 Ca 0.63 -0.67 0.03 0.00 0.00 0.00 0.00 60.65 60.64 2g3m s ILE 585 Cb -0.47 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 2g3m s ILE 585 CO 0.47 -0.01 0.01 -0.63 0.00 0.00 0.00 174.94 174.77 2g3m s ILE 586 N 1.54 4.18 -0.08 2.92 1.01 0.77 -4.89 121.20 126.65 2g3m s ILE 586 Ca 0.03 -0.76 -0.29 0.00 0.00 0.00 0.00 60.65 59.63 2g3m s ILE 586 Cb -0.18 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 2g3m s ILE 586 CO 0.05 0.25 0.98 0.20 0.00 0.00 0.00 174.94 176.42 2g3m s ASN 587 N -1.95 7.25 0.92 3.58 0.01 -1.26 -0.36 114.94 123.13 2g3m s ASN 587 Ca 0.23 1.53 -0.11 0.00 -0.71 0.00 0.00 52.86 53.80 2g3m s ASN 587 Cb -0.12 -2.55 0.12 0.00 0.41 0.00 0.00 41.25 39.12 2g3m s ASN 587 CO 0.15 -0.39 1.01 0.61 -1.51 0.00 0.00 177.10 176.97 2g3m n GLY 588 N 3.07 -0.66 2.01 0.66 0.00 1.17 -4.27 105.19 107.17 2g3m n GLY 588 Ca 0.08 -0.70 -0.04 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.69 -0.66 -3.84 1.61 3.00 0.62 -4.42 118.16 110.79 2g3m n LYS 589 Ca 0.11 0.26 -0.07 0.00 -0.00 0.00 0.00 58.31 58.61 2g3m n LYS 589 Cb 0.52 -2.77 -0.02 0.00 0.00 0.00 0.00 35.03 32.76 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 -3.10 -0.27 -0.14 3.14 1.04 -1.10 -4.99 113.70 108.27 2g3m s SER 590 Ca 0.13 -0.58 0.02 0.00 0.48 0.00 0.00 55.95 56.00 2g3m s SER 590 Cb -0.02 0.72 0.01 0.00 0.10 0.00 0.00 66.02 66.84 2g3m s SER 590 CO 0.22 -1.33 -0.20 -0.69 0.98 0.00 0.00 173.24 172.21 2g3m s VAL 591 N -3.91 1.97 0.28 5.02 1.01 -1.26 -0.89 120.40 122.62 2g3m s VAL 591 Ca 0.11 -0.92 0.06 0.00 0.00 0.00 0.00 61.98 61.23 2g3m s VAL 591 Cb -0.06 -1.75 -0.06 0.00 0.00 0.00 0.00 36.38 34.51 2g3m s VAL 591 CO 0.06 0.53 -0.03 0.68 0.00 0.00 0.00 175.10 176.34 2g3m s VAL 592 N 0.95 1.50 -0.07 2.92 -7.23 -0.09 -4.91 120.40 113.47 2g3m s VAL 592 Ca -0.04 -2.09 -0.14 0.00 -1.81 0.00 0.00 61.98 57.90 2g3m s VAL 592 Cb -0.15 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.23 2g3m s VAL 592 CO -0.04 -0.25 0.36 -0.75 -0.31 0.00 0.00 175.10 174.11 2g3m s LYS 593 N -3.77 4.03 0.77 4.82 2.20 -1.26 0.11 119.74 126.64 2g3m s LYS 593 Ca 0.31 0.28 -0.13 0.00 -0.36 0.00 0.00 55.97 56.07 2g3m s LYS 593 Cb 0.05 -3.31 0.06 0.00 -1.51 0.00 0.00 37.83 33.13 2g3m s LYS 593 CO 0.12 0.49 1.15 -1.54 -0.36 0.00 0.00 175.35 175.22 2g3m s SER 594 N -0.38 4.08 0.00 1.43 1.04 0.30 -4.91 113.70 115.25 2g3m s SER 594 Ca 0.21 2.15 0.02 0.00 0.48 0.00 0.00 55.95 58.81 2g3m s SER 594 Cb -0.15 -2.56 -0.02 0.00 0.10 0.00 0.00 66.02 63.39 2g3m s SER 594 CO 0.09 -2.33 0.16 0.35 0.98 0.00 0.00 173.24 172.49 2g3m n THR 595 N -3.22 0.00 -4.16 2.02 -2.24 -1.26 -4.67 114.28 100.74 2g3m n THR 595 Ca 0.12 -0.46 -0.10 0.00 -2.27 0.00 0.00 64.05 61.33 2g3m n THR 595 Cb 0.52 1.01 -0.10 0.00 -2.10 0.00 0.00 70.33 69.65 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 -1.04 0.85 0.60 4.78 2.46 -1.26 -5.03 115.29 116.65 2g3m s HIS 596 Ca 0.01 -0.98 0.42 0.00 0.47 0.00 0.00 55.06 54.98 2g3m s HIS 596 Cb 0.02 -0.51 2.25 0.00 -0.13 0.00 0.00 32.58 34.20 2g3m s HIS 596 CO 0.07 -0.22 2.32 1.49 -2.47 0.00 0.00 174.74 175.93 2g3m h GLU 597 N 2.97 0.00 -2.88 2.88 4.81 -1.97 -3.26 114.58 117.13 2g3m h GLU 597 Ca -0.35 0.00 -0.61 0.00 -0.13 0.00 0.00 59.36 58.27 2g3m h GLU 597 Cb 1.17 0.00 -0.41 0.00 0.63 0.00 0.00 28.75 30.14 2g3m h GLU 597 CO 0.64 0.00 -0.70 -0.51 -0.73 0.00 0.00 179.01 177.72 2g3m s LEU 598 N -6.34 3.77 -0.85 1.64 1.43 -1.26 -4.60 118.68 112.47 2g3m s LEU 598 Ca -0.04 -3.58 -0.20 0.00 -1.03 0.00 0.00 54.13 49.27 2g3m s LEU 598 Cb 0.13 -1.27 -0.20 0.00 0.03 0.00 0.00 46.19 44.88 2g3m s LEU 598 CO 0.44 -0.12 2.29 -2.65 0.23 0.00 0.00 176.35 176.55 2g3m n PRO 599 N 2.29 0.36 -4.68 1.29 -0.02 -1.23 -4.92 135.00 128.08 2g3m n PRO 599 Ca 0.22 -0.63 -0.33 0.00 -2.02 0.00 0.00 63.50 60.74 2g3m n PRO 599 Cb 0.39 -2.86 -0.12 0.00 -0.02 0.00 0.00 33.50 30.88 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 10.32 3.45 0.01 4.25 1.01 -1.26 -1.45 121.20 137.54 2g3m s ILE 600 Ca 1.02 -0.55 0.01 0.00 0.00 0.00 0.00 60.65 61.13 2g3m s ILE 600 Cb -0.34 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 39.70 2g3m s ILE 600 CO 0.23 0.56 -0.04 -0.31 0.00 0.00 0.00 174.94 175.38 2g3m s TYR 601 N -0.34 0.39 -0.10 3.97 1.51 -0.30 -2.27 117.35 120.20 2g3m s TYR 601 Ca 0.04 -0.21 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 2g3m s TYR 601 Cb -0.12 -0.25 -0.02 0.00 -0.11 0.00 0.00 41.96 41.45 2g3m s TYR 601 CO 0.02 -0.04 -0.09 -0.51 -1.11 0.00 0.00 175.55 173.82 2g3m s LEU 602 N -0.56 2.98 0.22 -1.29 1.43 0.33 -0.98 118.68 120.81 2g3m s LEU 602 Ca -0.03 -0.16 -0.13 0.00 -1.03 0.00 0.00 54.13 52.78 2g3m s LEU 602 Cb -0.04 -1.66 -0.08 0.00 0.03 0.00 0.00 46.19 44.44 2g3m s LEU 602 CO -0.00 0.27 0.60 0.00 0.23 0.00 0.00 176.35 177.45 2g3m s ARG 603 N -0.25 3.93 -0.06 1.70 1.70 -0.73 0.46 118.95 125.70 2g3m s ARG 603 Ca 0.03 0.46 -0.35 0.00 -0.47 0.00 0.00 55.73 55.40 2g3m s ARG 603 Cb -0.13 -2.71 -0.13 0.00 -0.57 0.00 0.00 34.95 31.41 2g3m s ARG 603 CO 0.03 0.34 1.77 -1.91 -1.08 0.00 0.00 175.30 174.44 2g3m n GLU 604 N 0.17 1.95 -0.01 3.89 2.13 -0.63 -3.10 120.64 125.04 2g3m n GLU 604 Ca -0.01 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.52 2g3m n GLU 604 Cb 0.52 -2.50 0.00 0.00 0.27 0.00 0.00 31.44 29.73 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 4.06 0.90 3.01 8.31 0.00 0.21 -4.89 105.19 116.79 2g3m n GLY 605 Ca 0.22 -0.82 -0.10 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 -2.01 0.15 -0.08 1.61 0.01 0.23 -4.78 113.70 108.83 2g3m s SER 606 Ca 0.00 -0.35 -0.03 0.00 1.31 0.00 0.00 55.95 56.88 2g3m s SER 606 Cb 0.00 0.13 0.04 0.00 0.21 0.00 0.00 66.02 66.40 2g3m s SER 606 CO 0.00 -0.29 0.06 -0.63 0.41 0.00 0.00 173.24 172.80 2g3m s ILE 607 N -1.27 -0.04 -0.15 1.44 1.01 -1.26 -0.46 121.20 120.48 2g3m s ILE 607 Ca -0.14 0.20 0.01 0.00 0.00 0.00 0.00 60.65 60.73 2g3m s ILE 607 Cb -0.08 -0.33 0.02 0.00 0.01 0.00 0.00 42.46 42.07 2g3m s ILE 607 CO -0.00 0.04 -0.17 -0.63 0.00 0.00 0.00 174.94 174.18 2g3m s ILE 608 N 2.13 1.75 -0.06 2.92 1.09 0.14 -4.98 121.20 124.20 2g3m s ILE 608 Ca 0.04 -0.76 -0.26 0.00 -1.10 0.00 0.00 60.65 58.56 2g3m s ILE 608 Cb -0.13 -1.60 -0.03 0.00 -1.06 0.00 0.00 42.46 39.63 2g3m s ILE 608 CO -0.05 0.49 0.84 -2.84 -0.10 0.00 0.00 174.94 173.28 2g3m s PRO 609 N 1.24 4.46 0.38 2.79 0.02 -1.26 -1.65 135.00 140.98 2g3m s PRO 609 Ca 0.01 1.13 0.08 0.00 0.02 0.00 0.00 61.00 62.24 2g3m s PRO 609 Cb -0.14 -3.48 -0.05 0.00 0.02 0.00 0.00 34.50 30.85 2g3m s PRO 609 CO -0.08 -0.06 0.11 -0.51 -0.33 0.00 0.00 177.00 176.13 2g3m s LEU 610 N 1.14 3.07 0.56 -5.54 1.43 -0.46 -2.70 118.68 116.18 2g3m s LEU 610 Ca 0.44 -1.05 -0.19 0.00 -1.03 0.00 0.00 54.13 52.30 2g3m s LEU 610 Cb -0.19 -1.40 -0.07 0.00 0.03 0.00 0.00 46.19 44.57 2g3m s LEU 610 CO 0.21 -0.42 0.87 1.21 0.23 0.00 0.00 176.35 178.45 2g3m n GLU 611 N -1.12 0.89 -2.39 1.70 2.13 0.52 -2.29 120.64 120.08 2g3m n GLU 611 Ca -0.03 0.34 -0.12 0.00 0.66 0.00 0.00 57.16 58.01 2g3m n GLU 611 Cb 0.64 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 30.32 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 1.39 -0.08 2.43 8.31 0.00 -1.26 -2.89 105.19 113.08 2g3m n GLY 612 Ca 0.12 -0.35 -0.19 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.40 -5.37 -4.83 1.61 8.00 -1.14 -4.49 116.55 109.93 2g3m n ASP 613 Ca -0.11 0.16 -0.31 0.00 0.71 0.00 0.00 54.79 55.24 2g3m n ASP 613 Cb 0.59 -4.57 0.06 0.00 -0.02 0.00 0.00 41.12 37.18 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 -4.62 2.77 -0.12 -1.24 2.02 -0.97 -2.22 118.70 114.32 2g3m s GLU 614 Ca 0.00 0.79 -0.10 0.00 0.02 0.00 0.00 54.97 55.67 2g3m s GLU 614 Cb 0.00 -1.98 0.03 0.00 0.10 0.00 0.00 34.13 32.28 2g3m s GLU 614 CO 0.00 -1.18 0.32 -1.17 0.02 0.00 0.00 175.26 173.25 2g3m s LEU 615 N -5.55 0.69 -0.11 1.80 2.96 -0.50 -1.35 118.68 116.62 2g3m s LEU 615 Ca 0.58 0.65 0.02 0.00 -0.22 0.00 0.00 54.13 55.16 2g3m s LEU 615 Cb -0.13 1.08 0.01 0.00 0.50 0.00 0.00 46.19 47.65 2g3m s LEU 615 CO 0.54 -0.12 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.67 2g3m s ILE 616 N 0.35 1.54 -0.06 6.68 1.01 -0.66 0.20 121.20 130.26 2g3m s ILE 616 Ca -0.01 -0.67 0.04 0.00 0.00 0.00 0.00 60.65 60.01 2g3m s ILE 616 Cb -0.03 -1.41 0.00 0.00 0.01 0.00 0.00 42.46 41.03 2g3m s ILE 616 CO -0.01 0.45 -0.17 -0.69 0.00 0.00 0.00 174.94 174.51 2g3m s VAL 617 N 0.99 1.49 -0.23 2.92 1.01 0.18 -0.68 120.40 126.08 2g3m s VAL 617 Ca -0.06 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 2g3m s VAL 617 Cb -0.15 -1.30 0.11 0.00 0.00 0.00 0.00 36.38 35.04 2g3m s VAL 617 CO -0.02 0.43 0.25 -0.47 0.00 0.00 0.00 175.10 175.29 2g3m s TYR 618 N 0.23 -0.35 0.00 5.22 5.04 0.40 -1.78 117.35 126.11 2g3m s TYR 618 Ca -0.09 0.17 0.00 0.00 -2.44 0.00 0.00 57.07 54.71 2g3m s TYR 618 Cb -0.14 -0.36 0.00 0.00 0.35 0.00 0.00 41.96 41.81 2g3m s TYR 618 CO 0.04 -0.68 0.00 0.41 -1.34 0.00 0.00 175.55 173.97 2g3m n GLY 619 N 5.32 -2.05 3.70 8.97 0.00 -1.26 0.76 105.19 120.64 2g3m n GLY 619 Ca -0.05 -1.49 -0.35 0.00 0.00 0.00 0.00 46.02 44.13 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 3.73 -0.01 1.61 2.02 -1.26 -4.58 118.70 120.20 2g3m s GLU 620 Ca 0.00 -0.30 -0.30 0.00 0.02 0.00 0.00 54.97 54.39 2g3m s GLU 620 Cb 0.00 -3.16 0.12 0.00 0.10 0.00 0.00 34.13 31.19 2g3m s GLU 620 CO 0.00 0.45 1.28 -0.08 0.02 0.00 0.00 175.26 176.93 2g3m s THR 621 N -0.13 0.00 -0.08 3.63 -1.32 -1.12 -4.49 115.64 112.13 2g3m s THR 621 Ca 0.08 -0.23 0.03 0.00 -1.21 0.00 0.00 61.69 60.35 2g3m s THR 621 Cb -0.12 -2.06 0.01 0.00 -1.51 0.00 0.00 72.50 68.82 2g3m s THR 621 CO 0.01 0.00 -0.16 -0.55 -2.21 0.00 0.00 174.62 171.71 2g3m s SER 622 N -3.03 2.21 0.04 8.08 0.15 -1.26 -1.12 113.70 118.77 2g3m s SER 622 Ca 0.15 -0.38 0.04 0.00 0.70 0.00 0.00 55.95 56.46 2g3m s SER 622 Cb 0.04 -1.01 -0.02 0.00 -1.71 0.00 0.00 66.02 63.32 2g3m s SER 622 CO -0.04 0.07 -0.12 0.12 1.20 0.00 0.00 173.24 174.47 2g3m s PHE 623 N 0.59 1.06 -0.27 3.44 5.36 0.40 -4.99 117.98 123.58 2g3m s PHE 623 Ca -0.15 -0.39 -0.02 0.00 -0.96 0.00 0.00 56.93 55.41 2g3m s PHE 623 Cb -0.16 -0.62 0.03 0.00 -0.34 0.00 0.00 43.02 41.92 2g3m s PHE 623 CO 0.05 0.02 -0.03 0.21 -1.46 0.00 0.00 175.22 174.00 2g3m s LYS 624 N -1.29 2.74 0.68 10.12 2.20 -1.26 -0.07 119.74 132.86 2g3m s LYS 624 Ca -0.01 -1.05 -0.12 0.00 -0.36 0.00 0.00 55.97 54.42 2g3m s LYS 624 Cb -0.08 -3.07 0.00 0.00 -1.51 0.00 0.00 37.83 33.18 2g3m s LYS 624 CO 0.01 -0.46 1.07 0.50 -0.36 0.00 0.00 175.35 176.11 2g3m s ARG 625 N 1.32 2.92 0.63 4.03 3.52 0.32 -4.83 118.95 126.84 2g3m s ARG 625 Ca -0.01 1.09 0.31 0.00 -0.13 0.00 0.00 55.73 56.98 2g3m s ARG 625 Cb -0.18 -1.98 1.69 0.00 -1.56 0.00 0.00 34.95 32.92 2g3m s ARG 625 CO -0.03 -1.12 2.02 0.10 -0.81 0.00 0.00 175.30 175.45 2g3m h TYR 626 N -0.43 0.00 -0.43 5.12 -0.00 -1.83 0.08 116.97 119.47 2g3m h TYR 626 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.28 2g3m h TYR 626 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.95 2g3m h TYR 626 CO 0.60 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 178.36 2g3m n ASP 627 N -3.37 3.89 0.00 0.10 5.75 -1.26 -4.90 116.55 116.75 2g3m n ASP 627 Ca 0.01 -2.47 0.00 0.00 -0.01 0.00 0.00 54.79 52.32 2g3m n ASP 627 Cb 0.39 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 39.93 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 0.60 -0.42 -4.69 -1.12 6.94 0.01 -5.01 115.26 111.57 2g3m n ASN 628 Ca 0.19 0.00 -0.42 0.00 -0.02 0.00 0.00 54.58 54.32 2g3m n ASN 628 Cb 0.78 -0.28 -0.03 0.00 -2.36 0.00 0.00 39.78 37.89 2g3m n ASN 628 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2g3m s ALA 629 N -3.51 3.47 -0.18 -2.53 0.00 -1.25 -4.79 121.76 112.97 2g3m s ALA 629 Ca 0.00 0.52 -0.10 0.00 0.00 0.00 0.00 51.96 52.37 2g3m s ALA 629 Cb 0.00 -3.49 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 2g3m s ALA 629 CO 0.00 -0.72 0.16 -1.21 0.00 0.00 0.00 175.76 173.99 2g3m s GLU 630 N 2.18 4.12 -0.17 0.00 2.02 -1.26 -0.52 118.70 125.07 2g3m s GLU 630 Ca 0.53 -0.16 0.00 0.00 0.02 0.00 0.00 54.97 55.36 2g3m s GLU 630 Cb -0.22 -3.40 0.01 0.00 0.10 0.00 0.00 34.13 30.62 2g3m s GLU 630 CO 0.20 0.34 -0.16 0.42 0.02 0.00 0.00 175.26 176.08 2g3m s ILE 631 N 0.22 2.49 -0.17 -1.63 1.01 0.89 -1.45 121.20 122.57 2g3m s ILE 631 Ca 0.10 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.95 2g3m s ILE 631 Cb -0.11 -2.06 0.02 0.00 0.01 0.00 0.00 42.46 40.32 2g3m s ILE 631 CO -0.00 0.51 -0.19 -0.89 0.00 0.00 0.00 174.94 174.37 2g3m s THR 632 N 1.06 1.95 -0.02 2.92 2.01 -0.81 -0.45 115.64 122.29 2g3m s THR 632 Ca -0.01 -0.87 -0.01 0.00 0.31 0.00 0.00 61.69 61.11 2g3m s THR 632 Cb -0.14 -1.77 -0.04 0.00 0.01 0.00 0.00 72.50 70.55 2g3m s THR 632 CO -0.05 0.52 0.06 -0.94 -0.69 0.00 0.00 174.62 173.52 2g3m s SER 633 N 1.33 5.55 0.00 3.53 1.04 -0.28 -0.91 113.70 123.97 2g3m s SER 633 Ca 0.05 0.13 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2g3m s SER 633 Cb -0.13 -1.58 0.00 0.00 0.10 0.00 0.00 66.02 64.41 2g3m s SER 633 CO -0.12 0.30 0.00 -1.54 0.98 0.00 0.00 173.24 172.85 2g3m n SER 634 N 1.40 0.74 -0.41 7.02 3.41 0.37 -2.78 113.62 123.37 2g3m n SER 634 Ca -0.14 -0.58 -0.10 0.00 -0.26 0.00 0.00 58.87 57.78 2g3m n SER 634 Cb 0.53 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.39 2g3m n SER 634 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2g3m h SER 635 N 0.00 -2.12 -0.24 4.04 4.64 -1.99 -3.28 113.55 114.60 2g3m h SER 635 Ca 0.00 0.33 -0.21 0.00 -0.47 0.00 0.00 61.79 61.44 2g3m h SER 635 Cb 0.00 0.94 -0.38 0.00 -0.31 0.00 0.00 62.40 62.66 2g3m h SER 635 CO 0.00 -0.24 -1.02 0.59 -0.87 0.00 0.00 176.83 175.29 2g3m n ASN 636 N -5.27 1.13 -3.73 4.97 3.02 -1.26 -5.02 115.26 109.11 2g3m n ASN 636 Ca 0.02 -2.02 -0.13 0.00 -0.03 0.00 0.00 54.58 52.43 2g3m n ASN 636 Cb 0.27 -0.33 -0.10 0.00 -0.61 0.00 0.00 39.78 39.00 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 -2.16 0.44 -0.26 3.52 2.12 -1.24 -1.10 118.70 120.03 2g3m s GLU 637 Ca 0.28 0.59 0.02 0.00 0.36 0.00 0.00 54.97 56.21 2g3m s GLU 637 Cb 0.34 0.17 0.05 0.00 0.26 0.00 0.00 34.13 34.95 2g3m s GLU 637 CO -0.09 -0.08 -0.10 0.42 -0.54 0.00 0.00 175.26 174.87 2g3m s ILE 638 N 0.45 2.33 0.13 -3.70 1.01 0.14 -0.48 121.20 121.08 2g3m s ILE 638 Ca -0.02 -1.47 -0.01 0.00 0.00 0.00 0.00 60.65 59.14 2g3m s ILE 638 Cb -0.04 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 2g3m s ILE 638 CO -0.02 0.04 0.31 -0.54 0.00 0.00 0.00 174.94 174.73 2g3m s LYS 639 N 1.16 3.52 -0.05 2.79 1.02 -0.09 -1.23 119.74 126.86 2g3m s LYS 639 Ca -0.06 -0.32 0.04 0.00 0.02 0.00 0.00 55.97 55.65 2g3m s LYS 639 Cb -0.19 -2.93 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 2g3m s LYS 639 CO -0.05 0.51 -0.16 -0.06 -0.92 0.00 0.00 175.35 174.66 2g3m s PHE 640 N -1.66 1.67 0.22 3.18 0.40 0.16 -1.93 117.98 120.01 2g3m s PHE 640 Ca 0.38 -0.51 0.36 0.00 -0.60 0.00 0.00 56.93 56.55 2g3m s PHE 640 Cb -0.12 -1.14 1.71 0.00 0.51 0.00 0.00 43.02 43.98 2g3m s PHE 640 CO 0.27 -0.19 2.07 0.66 0.70 0.00 0.00 175.22 178.73 2g3m h SER 641 N 6.41 0.00 -5.03 1.36 4.64 -1.56 -3.44 113.55 115.92 2g3m h SER 641 Ca -0.32 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.03 2g3m h SER 641 Cb 1.18 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.19 2g3m h SER 641 CO 0.48 0.00 0.17 0.00 -0.87 0.00 0.00 176.83 176.60 2g3m s ARG 642 N -3.80 1.57 0.04 4.77 1.70 -1.26 -4.97 118.95 117.00 2g3m s ARG 642 Ca -0.01 -0.85 -0.30 0.00 -0.47 0.00 0.00 55.73 54.10 2g3m s ARG 642 Cb 0.10 0.58 -0.07 0.00 -0.57 0.00 0.00 34.95 34.99 2g3m s ARG 642 CO 0.45 -0.70 1.56 -2.00 -1.08 0.00 0.00 175.30 173.54 2g3m s GLU 643 N -3.87 4.23 0.03 3.89 2.12 -1.25 -4.80 118.70 119.04 2g3m s GLU 643 Ca 0.09 2.20 0.01 0.00 0.36 0.00 0.00 54.97 57.63 2g3m s GLU 643 Cb -0.03 -3.60 -0.02 0.00 0.26 0.00 0.00 34.13 30.73 2g3m s GLU 643 CO 0.00 -0.68 -0.05 0.96 -0.54 0.00 0.00 175.26 174.95 2g3m s ILE 644 N 2.59 0.29 0.30 -3.70 -4.36 -1.13 -4.95 121.20 110.25 2g3m s ILE 644 Ca 0.70 -0.95 -0.27 0.00 -0.26 0.00 0.00 60.65 59.87 2g3m s ILE 644 Cb -0.37 -0.40 -0.10 0.00 1.25 0.00 0.00 42.46 42.85 2g3m s ILE 644 CO 0.30 -0.43 0.96 -0.47 0.24 0.00 0.00 174.94 175.55 2g3m s TYR 645 N -1.37 3.73 -0.05 1.37 6.14 -1.26 -1.61 117.35 124.30 2g3m s TYR 645 Ca -0.13 1.80 0.00 0.00 0.64 0.00 0.00 57.07 59.39 2g3m s TYR 645 Cb -0.10 -2.99 0.02 0.00 0.42 0.00 0.00 41.96 39.32 2g3m s TYR 645 CO -0.00 0.15 -0.02 0.08 0.64 0.00 0.00 175.55 176.39 2g3m s VAL 646 N -1.46 0.40 0.00 3.14 1.01 -0.76 -4.95 120.40 117.78 2g3m s VAL 646 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.46 2g3m s VAL 646 Cb -0.22 -0.48 0.00 0.00 0.00 0.00 0.00 36.38 35.68 2g3m s VAL 646 CO 0.28 0.22 0.00 -1.54 0.00 0.00 0.00 175.10 174.05 2g3m n SER 647 N 4.39 0.00 -4.86 3.32 3.41 -0.94 -1.29 113.62 117.64 2g3m n SER 647 Ca -0.20 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.06 2g3m n SER 647 Cb 0.50 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.40 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 0.17 3.79 -0.10 4.33 2.20 -1.26 -1.19 119.74 127.68 2g3m s LYS 648 Ca 0.00 0.22 0.02 0.00 -0.36 0.00 0.00 55.97 55.85 2g3m s LYS 648 Cb 0.00 -2.98 0.02 0.00 -1.51 0.00 0.00 37.83 33.35 2g3m s LYS 648 CO 0.00 0.54 -0.14 -1.17 -0.36 0.00 0.00 175.35 174.22 2g3m s LEU 649 N -1.93 1.66 -0.13 5.43 2.96 -0.57 -1.41 118.68 124.69 2g3m s LEU 649 Ca 0.34 -0.40 -0.01 0.00 -0.22 0.00 0.00 54.13 53.84 2g3m s LEU 649 Cb -0.14 -1.04 -0.02 0.00 0.50 0.00 0.00 46.19 45.50 2g3m s LEU 649 CO 0.18 0.00 -0.11 -0.89 -1.32 0.00 0.00 176.35 174.21 2g3m s THR 650 N 1.03 3.20 -0.19 3.68 2.01 0.13 -1.01 115.64 124.49 2g3m s THR 650 Ca -0.06 -0.61 0.01 0.00 0.31 0.00 0.00 61.69 61.34 2g3m s THR 650 Cb -0.15 -2.35 0.04 0.00 0.01 0.00 0.00 72.50 70.05 2g3m s THR 650 CO -0.02 0.52 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.67 2g3m s ILE 651 N 0.33 1.77 -0.11 1.82 1.01 0.15 -0.65 121.20 125.51 2g3m s ILE 651 Ca -0.09 -0.98 -0.18 0.00 0.00 0.00 0.00 60.65 59.39 2g3m s ILE 651 Cb -0.16 -1.75 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 2g3m s ILE 651 CO 0.05 0.29 0.48 0.28 0.00 0.00 0.00 174.94 176.04 2g3m s THR 652 N 1.36 5.18 -0.27 2.92 -1.32 -0.74 -0.57 115.64 122.21 2g3m s THR 652 Ca 0.01 0.96 -0.22 0.00 -1.21 0.00 0.00 61.69 61.22 2g3m s THR 652 Cb -0.15 -3.82 0.07 0.00 -1.51 0.00 0.00 72.50 67.09 2g3m s THR 652 CO -0.09 0.33 0.71 -0.55 -2.21 0.00 0.00 174.62 172.81 2g3m s SER 653 N 0.57 -0.82 0.39 8.08 0.15 0.64 -4.43 113.70 118.29 2g3m s SER 653 Ca 0.26 1.47 0.21 0.00 0.70 0.00 0.00 55.95 58.59 2g3m s SER 653 Cb -0.15 1.43 0.49 0.00 -1.71 0.00 0.00 66.02 66.08 2g3m s SER 653 CO 0.10 -0.25 1.64 -0.33 1.20 0.00 0.00 173.24 175.61 2g3m h GLU 654 N 5.73 0.00 -5.71 5.44 5.08 -1.97 -3.40 114.58 119.75 2g3m h GLU 654 Ca -0.29 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.46 2g3m h GLU 654 Cb 1.19 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.36 2g3m h GLU 654 CO 0.09 0.24 -0.29 0.15 -1.00 0.00 0.00 179.01 178.20 2g3m s LYS 655 N -3.28 4.02 0.40 2.33 1.02 -1.26 -5.00 119.74 117.98 2g3m s LYS 655 Ca 0.04 0.20 -0.26 0.00 0.02 0.00 0.00 55.97 55.97 2g3m s LYS 655 Cb 0.08 -3.32 -0.10 0.00 -0.52 0.00 0.00 37.83 33.96 2g3m s LYS 655 CO 0.68 0.47 1.25 -0.35 -0.92 0.00 0.00 175.35 176.48 2g3m n PRO 656 N 2.74 1.92 -4.60 -1.68 -0.04 -1.26 -5.01 135.00 127.06 2g3m n PRO 656 Ca -0.13 0.68 -0.33 0.00 -0.04 0.00 0.00 63.50 63.68 2g3m n PRO 656 Cb 0.52 -2.34 -0.16 0.00 -0.04 0.00 0.00 33.50 31.48 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 -1.18 2.16 -0.20 0.52 1.01 -1.26 -4.97 120.40 116.48 2g3m s VAL 657 Ca 0.60 -0.94 0.14 0.00 0.00 0.00 0.00 61.98 61.78 2g3m s VAL 657 Cb -0.52 -1.88 -0.23 0.00 0.00 0.00 0.00 36.38 33.75 2g3m s VAL 657 CO 0.59 0.54 0.04 -1.20 0.00 0.00 0.00 175.10 175.07 2g3m n SER 658 N 4.11 0.48 -3.66 3.32 7.64 0.51 -4.88 113.62 121.15 2g3m n SER 658 Ca -0.20 -0.01 -0.05 0.00 1.01 0.00 0.00 58.87 59.63 2g3m n SER 658 Cb 0.51 0.63 -0.01 0.00 -1.01 0.00 0.00 64.21 64.33 2g3m n SER 658 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 2g3m s LYS 659 N -2.50 0.98 0.09 1.43 -2.85 0.50 -3.39 119.74 114.00 2g3m s LYS 659 Ca -0.15 -0.49 0.05 0.00 -1.00 0.00 0.00 55.97 54.38 2g3m s LYS 659 Cb 0.07 0.37 -0.03 0.00 -2.06 0.00 0.00 37.83 36.17 2g3m s LYS 659 CO 0.78 -0.44 -0.14 0.96 0.10 0.00 0.00 175.35 176.61 2g3m s ILE 660 N -3.13 1.17 -0.12 3.79 -4.36 -0.78 -0.44 121.20 117.34 2g3m s ILE 660 Ca 0.10 -1.48 0.02 0.00 -0.26 0.00 0.00 60.65 59.03 2g3m s ILE 660 Cb -0.01 -1.26 0.01 0.00 1.25 0.00 0.00 42.46 42.45 2g3m s ILE 660 CO -0.02 -0.33 -0.18 -0.63 0.24 0.00 0.00 174.94 174.02 2g3m s ILE 661 N -1.70 1.72 -0.22 8.37 1.01 0.17 0.05 121.20 130.61 2g3m s ILE 661 Ca 0.03 -0.78 -0.20 0.00 0.00 0.00 0.00 60.65 59.70 2g3m s ILE 661 Cb -0.07 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.83 2g3m s ILE 661 CO 0.02 0.48 0.60 -0.69 0.00 0.00 0.00 174.94 175.35 2g3m s VAL 662 N 0.85 5.03 -1.56 2.92 1.01 -0.10 -1.14 120.40 127.42 2g3m s VAL 662 Ca -0.08 1.10 -0.04 0.00 0.00 0.00 0.00 61.98 62.96 2g3m s VAL 662 Cb -0.15 -3.91 0.04 0.00 0.00 0.00 0.00 36.38 32.35 2g3m s VAL 662 CO -0.00 0.10 0.21 0.47 0.00 0.00 0.00 175.10 175.88 2g3m n ASP 663 N 5.18 0.10 -0.82 3.32 8.00 -0.16 -1.17 116.55 131.00 2g3m n ASP 663 Ca -0.02 -1.19 -0.09 0.00 0.71 0.00 0.00 54.79 54.19 2g3m n ASP 663 Cb 0.50 -2.01 -0.04 0.00 -0.02 0.00 0.00 41.12 39.54 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 -2.85 -4.71 0.00 -2.24 8.00 -1.26 -4.78 116.55 108.70 2g3m n ASP 664 Ca -0.25 0.23 0.00 0.00 0.71 0.00 0.00 54.79 55.48 2g3m n ASP 664 Cb 0.66 -3.58 0.00 0.00 -0.02 0.00 0.00 41.12 38.18 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 -0.65 0.00 -4.67 -2.24 3.41 -0.31 -5.05 113.62 104.10 2g3m n SER 665 Ca -0.09 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.09 2g3m n SER 665 Cb 0.50 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 2g3m n SER 665 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2g3m s LYS 666 N 0.00 4.16 -0.12 4.33 2.20 -1.21 -4.76 119.74 124.35 2g3m s LYS 666 Ca 0.00 2.46 -0.15 0.00 -0.36 0.00 0.00 55.97 57.92 2g3m s LYS 666 Cb 0.00 -3.95 -0.05 0.00 -1.51 0.00 0.00 37.83 32.33 2g3m s LYS 666 CO 0.00 -0.88 0.36 -1.21 -0.36 0.00 0.00 175.35 173.26 2g3m s GLU 667 N 3.81 4.18 -0.07 4.03 2.02 -1.26 -0.92 118.70 130.49 2g3m s GLU 667 Ca 0.81 0.25 0.04 0.00 0.02 0.00 0.00 54.97 56.09 2g3m s GLU 667 Cb -0.40 -3.38 -0.02 0.00 0.10 0.00 0.00 34.13 30.43 2g3m s GLU 667 CO 0.36 0.32 -0.18 0.42 0.02 0.00 0.00 175.26 176.21 2g3m s ILE 668 N 0.16 2.68 0.28 -1.63 1.01 0.11 -4.99 121.20 118.82 2g3m s ILE 668 Ca 0.20 -0.84 -0.29 0.00 0.00 0.00 0.00 60.65 59.72 2g3m s ILE 668 Cb -0.14 -2.04 -0.10 0.00 0.01 0.00 0.00 42.46 40.19 2g3m s ILE 668 CO 0.07 0.57 1.19 -1.58 0.00 0.00 0.00 174.94 175.19 2g3m s GLN 669 N -0.27 4.51 -0.06 2.79 0.74 -1.26 -1.86 119.66 124.26 2g3m s GLN 669 Ca 0.01 1.97 0.01 0.00 0.05 0.00 0.00 55.36 57.40 2g3m s GLN 669 Cb -0.13 -3.16 -0.03 0.00 1.10 0.00 0.00 33.01 30.80 2g3m s GLN 669 CO 0.03 0.02 -0.08 0.08 -0.55 0.00 0.00 175.29 174.79 2g3m s VAL 670 N -0.95 3.61 -0.09 1.34 1.01 -1.22 -4.55 120.40 119.55 2g3m s VAL 670 Ca 0.48 -0.55 0.04 0.00 0.00 0.00 0.00 61.98 61.95 2g3m s VAL 670 Cb -0.35 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.55 2g3m s VAL 670 CO 0.44 0.57 -0.22 -0.70 0.00 0.00 0.00 175.10 175.20 2g3m s GLU 671 N -0.87 2.95 -0.55 2.72 2.12 0.60 -4.89 118.70 120.78 2g3m s GLU 671 Ca 0.13 -0.85 -0.23 0.00 0.36 0.00 0.00 54.97 54.38 2g3m s GLU 671 Cb -0.11 -2.32 0.05 0.00 0.26 0.00 0.00 34.13 32.01 2g3m s GLU 671 CO 0.02 0.25 0.87 0.21 -0.54 0.00 0.00 175.26 176.07 2g3m s LYS 672 N 0.17 3.27 0.33 4.30 2.20 -1.26 0.43 119.74 129.18 2g3m s LYS 672 Ca -0.13 -0.45 0.21 0.00 -0.36 0.00 0.00 55.97 55.24 2g3m s LYS 672 Cb -0.16 -4.08 0.17 0.00 -1.51 0.00 0.00 37.83 32.26 2g3m s LYS 672 CO 0.07 -1.45 1.38 1.79 -0.36 0.00 0.00 175.35 176.78 2g3m h THR 673 N 5.98 0.16 -1.52 3.43 1.35 -1.85 -3.49 112.91 116.98 2g3m h THR 673 Ca -0.27 -1.25 0.32 0.00 -0.55 0.00 0.00 66.41 64.67 2g3m h THR 673 Cb 1.08 1.93 -0.11 0.00 -1.73 0.00 0.00 68.15 69.31 2g3m h THR 673 CO 1.07 0.09 0.82 0.00 -0.25 0.00 0.00 175.52 177.25 2g3m s MET 674 N -3.20 0.42 0.09 4.72 0.00 -1.24 -5.05 119.30 115.05 2g3m s MET 674 Ca 0.04 -0.24 -0.36 0.00 0.00 0.00 0.00 55.69 55.13 2g3m s MET 674 Cb 0.07 0.14 -0.18 0.00 0.00 0.00 0.00 34.83 34.86 2g3m s MET 674 CO 0.72 -0.19 1.14 0.00 0.00 0.00 0.00 175.02 176.69 2g3m n GLN 675 N -0.52 0.68 -0.80 3.16 10.64 -1.26 -0.37 117.38 128.91 2g3m n GLN 675 Ca -0.08 0.24 0.00 0.00 -1.83 0.00 0.00 57.00 55.34 2g3m n GLN 675 Cb 0.63 -1.75 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 2.01 -3.37 -4.30 2.61 3.02 -1.26 -4.51 115.26 109.46 2g3m n ASN 676 Ca 0.18 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.39 2g3m n ASN 676 Cb 0.17 -2.95 -0.15 0.00 -0.61 0.00 0.00 39.78 36.24 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 -1.08 2.99 -0.11 3.41 2.01 0.50 -0.26 115.64 123.10 2g3m s THR 677 Ca 0.00 -0.65 0.02 0.00 0.31 0.00 0.00 61.69 61.37 2g3m s THR 677 Cb 0.00 -2.30 0.01 0.00 0.01 0.00 0.00 72.50 70.22 2g3m s THR 677 CO 0.00 0.49 -0.15 -0.31 -0.69 0.00 0.00 174.62 173.95 2g3m s TYR 678 N 1.00 2.00 0.02 4.92 1.51 0.27 -2.35 117.35 124.72 2g3m s TYR 678 Ca -0.01 -0.95 0.04 0.00 -1.01 0.00 0.00 57.07 55.13 2g3m s TYR 678 Cb -0.15 -1.44 -0.04 0.00 -0.11 0.00 0.00 41.96 40.22 2g3m s TYR 678 CO -0.01 -0.49 -0.05 0.08 -1.11 0.00 0.00 175.55 173.96 2g3m s VAL 679 N 1.01 3.74 -0.06 0.71 1.01 0.17 0.30 120.40 127.28 2g3m s VAL 679 Ca -0.06 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.07 2g3m s VAL 679 Cb -0.15 -2.66 0.04 0.00 0.00 0.00 0.00 36.38 33.61 2g3m s VAL 679 CO -0.02 0.33 0.10 0.00 0.00 0.00 0.00 175.10 175.51 2g3m s ALA 680 N -1.07 0.07 -0.72 5.51 0.00 -0.18 -0.29 121.76 125.08 2g3m s ALA 680 Ca 0.19 0.33 -0.27 0.00 0.00 0.00 0.00 51.96 52.21 2g3m s ALA 680 Cb -0.11 -0.71 0.03 0.00 0.00 0.00 0.00 23.12 22.33 2g3m s ALA 680 CO 0.10 -0.54 1.26 0.15 0.00 0.00 0.00 175.76 176.73 2g3m s LYS 681 N 2.22 3.23 -0.21 0.00 -0.14 -1.26 -1.51 119.74 122.06 2g3m s LYS 681 Ca 0.04 -0.20 -0.17 0.00 -1.36 0.00 0.00 55.97 54.28 2g3m s LYS 681 Cb -0.12 -4.16 -0.19 0.00 -1.68 0.00 0.00 37.83 31.68 2g3m s LYS 681 CO -0.04 -2.08 0.10 -0.89 -0.76 0.00 0.00 175.35 171.68 2g3m n ILE 682 N 6.40 1.57 -4.27 2.17 5.41 -0.34 -4.97 119.36 125.33 2g3m n ILE 682 Ca 0.03 -0.20 -0.32 0.00 1.00 0.00 0.00 62.75 63.26 2g3m n ILE 682 Cb 0.49 -1.95 -0.08 0.00 -0.71 0.00 0.00 39.64 37.39 2g3m n ILE 682 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2g3m n ASN 683 N -4.23 0.40 -3.67 4.38 3.02 -0.41 -4.92 115.26 109.82 2g3m n ASN 683 Ca -0.37 -1.26 -0.07 0.00 -0.03 0.00 0.00 54.58 52.85 2g3m n ASN 683 Cb 0.78 -1.72 -0.02 0.00 -0.61 0.00 0.00 39.78 38.22 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 -7.32 1.27 0.33 3.52 -2.07 -0.68 -4.96 119.66 109.73 2g3m s GLN 684 Ca 0.04 -0.63 -0.27 0.00 -1.82 0.00 0.00 55.36 52.68 2g3m s GLN 684 Cb -0.02 0.48 -0.09 0.00 -1.09 0.00 0.00 33.01 32.28 2g3m s GLN 684 CO 0.99 -0.57 1.04 0.15 -1.32 0.00 0.00 175.29 175.57 2g3m s LYS 685 N -3.47 4.48 -0.25 9.60 1.02 -1.26 -1.83 119.74 128.03 2g3m s LYS 685 Ca 0.09 1.59 -0.01 0.00 0.02 0.00 0.00 55.97 57.65 2g3m s LYS 685 Cb -0.02 -2.90 0.03 0.00 -0.52 0.00 0.00 37.83 34.41 2g3m s LYS 685 CO -0.01 0.13 -0.07 0.42 -0.92 0.00 0.00 175.35 174.89 2g3m s ILE 686 N -1.42 2.82 0.27 2.17 1.01 -0.63 -4.95 121.20 120.47 2g3m s ILE 686 Ca 0.50 -1.04 -0.02 0.00 0.00 0.00 0.00 60.65 60.09 2g3m s ILE 686 Cb -0.26 -2.43 0.15 0.00 0.01 0.00 0.00 42.46 39.93 2g3m s ILE 686 CO 0.32 0.21 1.81 0.03 0.00 0.00 0.00 174.94 177.31 2g3m h ARG 687 N 8.00 0.86 0.00 2.79 3.08 -1.91 -3.00 114.38 124.21 2g3m h ARG 687 Ca -0.33 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2g3m h ARG 687 Cb 1.11 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.03 2g3m h ARG 687 CO 0.57 0.78 0.00 0.41 -1.07 0.00 0.00 179.97 180.66 2g3m n GLY 688 N -0.82 0.00 3.67 0.04 0.00 -1.26 -3.78 105.19 103.03 2g3m n GLY 688 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 1.57 -0.04 1.61 -2.85 -1.26 -0.67 119.74 117.57 2g3m s LYS 689 Ca 0.00 -0.78 0.00 0.00 -1.00 0.00 0.00 55.97 54.20 2g3m s LYS 689 Cb 0.00 0.60 0.03 0.00 -2.06 0.00 0.00 37.83 36.39 2g3m s LYS 689 CO 0.00 -0.70 -0.01 0.42 0.10 0.00 0.00 175.35 175.16 2g3m s ILE 690 N -3.85 0.25 -0.07 3.79 1.01 -0.37 -0.99 121.20 120.99 2g3m s ILE 690 Ca 0.07 0.06 -0.00 0.00 0.00 0.00 0.00 60.65 60.78 2g3m s ILE 690 Cb -0.04 -0.35 -0.03 0.00 0.01 0.00 0.00 42.46 42.05 2g3m s ILE 690 CO -0.01 0.17 -0.03 0.20 0.00 0.00 0.00 174.94 175.27 2g3m s ASN 691 N 1.14 4.96 0.03 3.58 -0.87 -0.29 -0.68 114.94 122.80 2g3m s ASN 691 Ca -0.08 0.05 0.01 0.00 -1.57 0.00 0.00 52.86 51.27 2g3m s ASN 691 Cb -0.14 -1.32 -0.04 0.00 -0.02 0.00 0.00 41.25 39.74 2g3m s ASN 691 CO -0.02 0.36 0.07 -0.76 -2.57 0.00 0.00 177.10 174.18 2g3m s LEU 692 N -0.95 3.82 0.00 0.60 1.02 -0.26 -0.65 118.68 122.26 2g3m s LEU 692 Ca 0.14 0.07 0.00 0.00 0.02 0.00 0.00 54.13 54.36 2g3m s LEU 692 Cb -0.11 -2.33 0.00 0.00 0.02 0.00 0.00 46.19 43.77 2g3m s LEU 692 CO 0.03 0.24 0.00 -0.62 0.02 0.00 0.00 176.35 176.02