#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vja h GLU 5 N 0.00 0.00 0.00 -1.46 4.81 -2.04 -3.01 114.58 112.89 2vja h GLU 5 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2vja h GLU 5 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 2vja h GLU 5 CO 0.00 0.25 -1.26 1.28 -0.73 0.00 0.00 179.01 178.55 2vja n LEU 6 N -3.46 0.70 -4.45 1.64 4.77 -1.26 -4.85 117.00 110.09 2vja n LEU 6 Ca -0.00 -0.33 -0.39 0.00 -0.03 0.00 0.00 56.01 55.26 2vja n LEU 6 Cb 0.43 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.39 2vja n LEU 6 CO 0.34 0.17 -0.18 -0.22 -1.33 0.00 0.00 177.39 176.17 2vja s LEU 7 N -3.46 4.31 -0.02 2.23 0.20 -1.14 -0.03 118.68 120.77 2vja s LEU 7 Ca 0.04 -0.58 0.05 0.00 0.69 0.00 0.00 54.13 54.33 2vja s LEU 7 Cb 0.15 -2.04 -0.01 0.00 -0.43 0.00 0.00 46.19 43.86 2vja s LEU 7 CO 0.87 -0.24 -0.19 -0.69 -0.29 0.00 0.00 176.35 175.82 2vja s VAL 8 N 1.63 1.49 -0.37 1.68 1.01 -0.70 -4.14 120.40 121.00 2vja s VAL 8 Ca 0.05 -0.79 -0.15 0.00 0.00 0.00 0.00 61.98 61.08 2vja s VAL 8 Cb -0.17 -1.25 -0.00 0.00 0.00 0.00 0.00 36.38 34.95 2vja s VAL 8 CO 0.07 0.42 0.36 0.20 0.00 0.00 0.00 175.10 176.16 2vja s ASN 9 N -0.30 6.16 0.42 3.32 -0.87 -1.26 -1.33 114.94 121.08 2vja s ASN 9 Ca 0.04 -0.42 0.08 0.00 -1.57 0.00 0.00 52.86 50.98 2vja s ASN 9 Cb -0.09 -2.19 0.01 0.00 -0.02 0.00 0.00 41.25 38.96 2vja s ASN 9 CO 0.00 -0.40 0.55 0.42 -2.57 0.00 0.00 177.10 175.10 2vja s THR 10 N 1.98 2.94 -0.56 1.60 -4.23 0.00 -4.97 115.64 112.40 2vja s THR 10 Ca 0.10 -1.05 0.16 0.00 -1.18 0.00 0.00 61.69 59.72 2vja s THR 10 Cb -0.17 -2.99 0.16 0.00 1.34 0.00 0.00 72.50 70.84 2vja s THR 10 CO 0.12 0.00 1.49 0.29 -0.54 0.00 0.00 174.62 175.97 2vja n LYS 11 N -1.81 0.10 -0.00 3.99 5.02 -1.26 -1.95 118.16 122.25 2vja n LYS 11 Ca 0.07 0.51 0.06 0.00 -2.02 0.00 0.00 58.31 56.94 2vja n LYS 11 Cb 0.59 -1.77 -0.08 0.00 -0.02 0.00 0.00 35.03 33.75 2vja n LYS 11 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2vja n SER 12 N -1.97 0.82 0.00 4.39 7.64 -1.26 -4.95 113.62 118.29 2vja n SER 12 Ca 0.00 -0.69 0.00 0.00 1.01 0.00 0.00 58.87 59.19 2vja n SER 12 Cb 0.09 1.10 0.00 0.00 -1.01 0.00 0.00 64.21 64.39 2vja n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vja n GLY 13 N 1.38 0.45 3.85 0.23 0.00 -0.82 -1.23 105.19 109.06 2vja n GLY 13 Ca 0.02 -1.62 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 2vja n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vja s LYS 14 N -1.56 3.98 0.00 1.61 1.02 -1.25 -0.82 119.74 122.72 2vja s LYS 14 Ca 0.00 0.60 0.02 0.00 0.02 0.00 0.00 55.97 56.61 2vja s LYS 14 Cb 0.00 -2.51 -0.01 0.00 -0.52 0.00 0.00 37.83 34.79 2vja s LYS 14 CO 0.00 0.21 -0.06 0.14 -0.92 0.00 0.00 175.35 174.72 2vja s VAL 15 N -1.91 0.48 -0.28 3.17 -7.23 -0.44 -0.50 120.40 113.68 2vja s VAL 15 Ca 0.52 -0.38 -0.03 0.00 -1.81 0.00 0.00 61.98 60.27 2vja s VAL 15 Cb -0.11 -0.43 0.03 0.00 0.56 0.00 0.00 36.38 36.43 2vja s VAL 15 CO 0.18 0.05 -0.00 -0.32 -0.31 0.00 0.00 175.10 174.70 2vja s MET 16 N -0.37 2.75 0.00 4.82 1.75 -0.34 -1.73 119.30 126.19 2vja s MET 16 Ca 0.00 -1.05 0.00 0.00 -1.25 0.00 0.00 55.69 53.39 2vja s MET 16 Cb -0.03 -3.16 0.00 0.00 2.84 0.00 0.00 34.83 34.48 2vja s MET 16 CO -0.00 -0.49 0.00 0.41 -0.65 0.00 0.00 175.02 174.28 2vja n GLY 17 N 4.71 -0.43 3.36 2.11 0.00 0.96 -1.55 105.19 114.34 2vja n GLY 17 Ca -0.15 -1.61 -0.12 0.00 0.00 0.00 0.00 46.02 44.14 2vja n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vja s THR 18 N 0.03 -0.01 -0.18 2.61 -1.32 0.14 -4.66 115.64 112.25 2vja s THR 18 Ca 0.00 0.02 -0.29 0.00 -1.21 0.00 0.00 61.69 60.21 2vja s THR 18 Cb 0.00 -0.67 -0.01 0.00 -1.51 0.00 0.00 72.50 70.31 2vja s THR 18 CO 0.00 0.01 1.22 -0.60 -2.21 0.00 0.00 174.62 173.04 2vja s ARG 19 N 0.64 4.23 0.04 7.08 3.52 -1.26 -1.19 118.95 132.01 2vja s ARG 19 Ca -0.03 1.59 0.07 0.00 -0.13 0.00 0.00 55.73 57.23 2vja s ARG 19 Cb -0.05 -3.75 -0.03 0.00 -1.56 0.00 0.00 34.95 29.56 2vja s ARG 19 CO -0.04 -0.71 -0.18 0.14 -0.81 0.00 0.00 175.30 173.70 2vja s VAL 20 N 3.48 2.76 0.49 7.11 -7.23 -0.10 -4.96 120.40 121.94 2vja s VAL 20 Ca 0.53 -1.19 -0.19 0.00 -1.81 0.00 0.00 61.98 59.31 2vja s VAL 20 Cb -0.20 -2.16 -0.09 0.00 0.56 0.00 0.00 36.38 34.49 2vja s VAL 20 CO 0.13 0.34 1.00 -2.16 -0.31 0.00 0.00 175.10 174.10 2vja s PRO 21 N -1.43 3.92 -0.30 4.82 0.04 -1.26 -1.18 135.00 139.62 2vja s PRO 21 Ca 0.14 1.15 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 2vja s PRO 21 Cb -0.10 -2.13 0.17 0.00 0.04 0.00 0.00 34.50 32.48 2vja s PRO 21 CO 0.05 -0.30 0.90 0.54 0.04 0.00 0.00 177.00 178.23 2vja s VAL 22 N -2.28 -0.60 -1.15 -0.36 0.11 0.27 -4.87 120.40 111.52 2vja s VAL 22 Ca 0.63 0.00 -0.25 0.00 -2.93 0.00 0.00 61.98 59.42 2vja s VAL 22 Cb -0.12 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.74 2vja s VAL 22 CO 0.23 0.00 0.76 0.18 -3.33 0.00 0.00 175.10 172.94 2vja n LEU 23 N 5.21 -2.00 -3.85 2.54 4.77 -1.26 -1.78 117.00 120.64 2vja n LEU 23 Ca -0.08 -1.11 -0.27 0.00 -0.03 0.00 0.00 56.01 54.53 2vja n LEU 23 Cb 0.52 -2.13 0.02 0.00 -2.33 0.00 0.00 43.42 39.50 2vja n LEU 23 CO -0.05 0.58 0.03 -1.54 -1.33 0.00 0.00 177.39 175.08 2vja n SER 24 N -2.49 -3.27 -0.31 -1.43 3.41 -1.26 -4.92 113.62 103.35 2vja n SER 24 Ca -0.10 -0.81 0.00 0.00 -0.26 0.00 0.00 58.87 57.70 2vja n SER 24 Cb 0.58 -3.88 0.00 0.00 -0.26 0.00 0.00 64.21 60.65 2vja n SER 24 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2vja n SER 25 N -2.92 0.00 -3.88 4.04 2.88 -0.73 -5.20 113.62 107.81 2vja n SER 25 Ca -0.10 -0.31 -0.10 0.00 -1.33 0.00 0.00 58.87 57.04 2vja n SER 25 Cb 0.59 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.99 2vja n SER 25 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2vja s HIS 26 N -4.08 0.21 0.20 0.66 0.09 -1.26 -0.57 115.29 110.54 2vja s HIS 26 Ca 0.00 -0.58 -0.18 0.00 -0.00 0.00 0.00 55.06 54.31 2vja s HIS 26 Cb 0.00 0.08 0.03 0.00 -0.00 0.00 0.00 32.58 32.69 2vja s HIS 26 CO 0.00 -0.76 0.53 0.96 -0.00 0.00 0.00 174.74 175.47 2vja s ILE 27 N -3.93 0.02 0.18 0.60 -4.36 -0.32 -4.36 121.20 109.04 2vja s ILE 27 Ca 0.14 -0.76 -0.25 0.00 -0.26 0.00 0.00 60.65 59.52 2vja s ILE 27 Cb 0.02 -1.57 -0.08 0.00 1.25 0.00 0.00 42.46 42.08 2vja s ILE 27 CO -0.02 -0.11 0.78 -0.44 0.24 0.00 0.00 174.94 175.39 2vja s SER 28 N -2.87 7.35 -0.07 4.36 0.01 0.08 -0.92 113.70 121.64 2vja s SER 28 Ca 0.09 1.63 0.01 0.00 1.31 0.00 0.00 55.95 58.98 2vja s SER 28 Cb -0.01 -2.49 0.02 0.00 0.21 0.00 0.00 66.02 63.75 2vja s SER 28 CO -0.03 0.18 -0.06 0.00 0.41 0.00 0.00 173.24 173.74 2vja s ALA 29 N -1.22 0.91 -0.34 1.44 0.00 -0.34 -1.09 121.76 121.14 2vja s ALA 29 Ca 0.37 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.12 2vja s ALA 29 Cb -0.22 -0.59 0.09 0.00 0.00 0.00 0.00 23.12 22.39 2vja s ALA 29 CO 0.25 -0.14 0.06 -0.06 0.00 0.00 0.00 175.76 175.88 2vja s PHE 30 N 1.18 3.58 -0.07 0.00 0.40 0.31 -0.69 117.98 122.70 2vja s PHE 30 Ca -0.06 -2.61 -0.04 0.00 -0.60 0.00 0.00 56.93 53.62 2vja s PHE 30 Cb -0.14 -2.74 -0.04 0.00 0.51 0.00 0.00 43.02 40.61 2vja s PHE 30 CO -0.02 -0.93 0.10 -0.51 0.70 0.00 0.00 175.22 174.57 2vja s LEU 31 N 1.04 4.10 -1.11 -0.37 1.43 0.02 -0.81 118.68 122.98 2vja s LEU 31 Ca 0.05 0.30 -0.02 0.00 -1.03 0.00 0.00 54.13 53.43 2vja s LEU 31 Cb -0.20 -2.16 0.00 0.00 0.03 0.00 0.00 46.19 43.86 2vja s LEU 31 CO -0.06 0.34 0.94 0.61 0.23 0.00 0.00 176.35 178.42 2vja n GLY 32 N 1.64 -0.30 3.65 -3.19 0.00 -1.19 -4.16 105.19 101.64 2vja n GLY 32 Ca -0.16 0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 2vja n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vja s ILE 33 N -3.31 4.91 0.10 -0.61 1.01 -0.24 -4.78 121.20 118.27 2vja s ILE 33 Ca 0.15 1.46 -0.31 0.00 0.00 0.00 0.00 60.65 61.94 2vja s ILE 33 Cb -0.06 -4.07 -0.08 0.00 0.01 0.00 0.00 42.46 38.26 2vja s ILE 33 CO 0.65 0.01 1.41 -2.16 0.00 0.00 0.00 174.94 174.85 2vja s PRO 34 N 2.38 4.31 0.00 2.79 0.04 -1.26 -0.68 135.00 142.57 2vja s PRO 34 Ca 0.34 2.08 0.06 0.00 0.04 0.00 0.00 61.00 63.51 2vja s PRO 34 Cb -0.16 -3.31 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 2vja s PRO 34 CO 0.10 -0.48 0.38 1.97 0.04 0.00 0.00 177.00 179.01 2vja n PHE 35 N 4.25 0.00 -4.07 0.56 1.16 -1.16 -4.89 117.46 113.32 2vja n PHE 35 Ca 0.12 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.60 2vja n PHE 35 Cb 0.42 0.00 -0.07 0.00 -1.61 0.00 0.00 39.48 38.22 2vja n PHE 35 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2vja s ALA 36 N -1.29 0.33 0.25 1.98 0.00 -1.25 -3.32 121.76 118.46 2vja s ALA 36 Ca 0.04 -1.18 -0.29 0.00 0.00 0.00 0.00 51.96 50.52 2vja s ALA 36 Cb 0.05 1.13 -0.09 0.00 0.00 0.00 0.00 23.12 24.21 2vja s ALA 36 CO 0.20 -0.71 0.93 -1.21 0.00 0.00 0.00 175.76 174.98 2vja s GLU 37 N -4.06 4.80 -0.27 0.00 0.41 0.12 -4.34 118.70 115.35 2vja s GLU 37 Ca 0.27 1.44 -0.35 0.00 -0.41 0.00 0.00 54.97 55.92 2vja s GLU 37 Cb 0.03 -3.20 -0.12 0.00 -1.78 0.00 0.00 34.13 29.07 2vja s GLU 37 CO 0.08 0.48 2.05 -2.30 -0.49 0.00 0.00 175.26 175.08 2vja n PRO 38 N 1.33 1.39 -1.14 0.39 -0.02 -1.26 -4.65 135.00 131.04 2vja n PRO 38 Ca -0.02 0.44 -0.34 0.00 -2.02 0.00 0.00 63.50 61.57 2vja n PRO 38 Cb 0.48 -2.49 -0.03 0.00 -0.02 0.00 0.00 33.50 31.44 2vja n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2vja n PRO 39 N 7.40 3.19 -3.49 0.52 -0.04 -1.26 -4.89 135.00 136.43 2vja n PRO 39 Ca 0.34 -1.98 -0.21 0.00 -0.04 0.00 0.00 63.50 61.61 2vja n PRO 39 Cb 0.24 -2.70 -0.01 0.00 -0.04 0.00 0.00 33.50 30.99 2vja n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2vja s VAL 40 N 2.58 2.42 0.00 0.52 -7.23 -1.26 -3.73 120.40 113.69 2vja s VAL 40 Ca 0.60 -1.28 0.00 0.00 -1.81 0.00 0.00 61.98 59.49 2vja s VAL 40 Cb 0.16 -2.70 0.00 0.00 0.56 0.00 0.00 36.38 34.40 2vja s VAL 40 CO -0.05 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.35 2vja n GLY 41 N -1.73 3.64 0.00 2.32 0.00 -1.26 -0.76 105.19 107.40 2vja n GLY 41 Ca 0.05 0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.25 2vja n GLY 41 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vja n ASN 42 N 5.89 0.00 -0.52 1.61 4.13 -1.26 -2.21 115.26 122.90 2vja n ASN 42 Ca 0.00 -0.48 0.13 0.00 1.68 0.00 0.00 54.58 55.90 2vja n ASN 42 Cb 0.00 -0.06 0.27 0.00 -1.54 0.00 0.00 39.78 38.44 2vja n ASN 42 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 2vja n MET 43 N -1.06 1.46 -1.97 3.52 2.81 0.06 -4.82 117.12 117.11 2vja n MET 43 Ca 0.14 -1.04 -0.41 0.00 -1.81 0.00 0.00 57.70 54.57 2vja n MET 43 Cb 0.09 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 31.10 2vja n MET 43 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2vja s ARG 44 N -2.26 4.24 0.00 0.03 3.52 -0.94 -1.92 118.95 121.62 2vja s ARG 44 Ca 0.27 2.36 0.00 0.00 -0.13 0.00 0.00 55.73 58.23 2vja s ARG 44 Cb 0.20 -3.08 0.00 0.00 -1.56 0.00 0.00 34.95 30.51 2vja s ARG 44 CO 0.44 -0.44 0.00 1.19 -0.81 0.00 0.00 175.30 175.68 2vja n PHE 45 N 2.01 0.00 -3.15 5.12 3.72 -1.26 -4.88 117.46 119.02 2vja n PHE 45 Ca 0.06 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.15 2vja n PHE 45 Cb 0.40 -0.12 -0.05 0.00 -0.94 0.00 0.00 39.48 38.78 2vja n PHE 45 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2vja s ARG 46 N 0.00 3.82 0.59 -1.08 3.52 -0.81 -4.12 118.95 120.87 2vja s ARG 46 Ca 0.00 0.40 -0.18 0.00 -0.13 0.00 0.00 55.73 55.82 2vja s ARG 46 Cb 0.00 -2.51 -0.07 0.00 -1.56 0.00 0.00 34.95 30.81 2vja s ARG 46 CO 0.00 0.15 0.69 0.54 -0.81 0.00 0.00 175.30 175.87 2vja n ARG 47 N -0.69 0.64 -2.33 5.12 1.74 -1.26 -4.92 116.66 114.96 2vja n ARG 47 Ca 0.02 0.25 -0.34 0.00 -0.77 0.00 0.00 57.85 57.00 2vja n ARG 47 Cb 0.53 -1.88 -0.01 0.00 -1.02 0.00 0.00 32.46 30.08 2vja n ARG 47 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2vja s PRO 48 N -2.37 3.51 -0.06 5.56 0.04 -1.26 -5.05 135.00 135.36 2vja s PRO 48 Ca 0.72 1.46 0.04 0.00 0.04 0.00 0.00 61.00 63.26 2vja s PRO 48 Cb -0.43 -2.04 -0.02 0.00 0.04 0.00 0.00 34.50 32.05 2vja s PRO 48 CO 0.51 -0.69 -0.17 -2.00 0.04 0.00 0.00 177.00 174.69 2vja s GLU 49 N -3.38 2.63 0.44 4.56 2.56 -1.26 -5.01 118.70 119.23 2vja s GLU 49 Ca 0.69 -0.75 -0.25 0.00 0.00 0.00 0.00 54.97 54.66 2vja s GLU 49 Cb -0.20 -2.35 -0.10 0.00 2.00 0.00 0.00 34.13 33.49 2vja s GLU 49 CO 0.26 0.50 1.18 -0.35 -0.56 0.00 0.00 175.26 176.29 2vja n PRO 50 N 2.64 1.68 -1.84 4.30 -0.04 -1.26 0.12 135.00 140.61 2vja n PRO 50 Ca -0.17 0.60 -0.42 0.00 -0.04 0.00 0.00 63.50 63.47 2vja n PRO 50 Cb 0.52 -2.28 -0.03 0.00 -0.04 0.00 0.00 33.50 31.68 2vja n PRO 50 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2vja s LYS 51 N -2.21 4.17 0.27 0.54 2.47 -1.21 -4.16 119.74 119.61 2vja s LYS 51 Ca 0.63 2.42 -0.29 0.00 -1.56 0.00 0.00 55.97 57.16 2vja s LYS 51 Cb -0.52 -3.91 -0.10 0.00 -1.46 0.00 0.00 37.83 31.85 2vja s LYS 51 CO 0.57 -0.86 1.29 0.15 0.16 0.00 0.00 175.35 176.66 2vja s LYS 52 N 3.69 4.40 0.54 4.03 1.02 -1.26 -4.94 119.74 127.22 2vja s LYS 52 Ca 0.79 2.11 -0.19 0.00 0.02 0.00 0.00 55.97 58.71 2vja s LYS 52 Cb -0.40 -3.13 -0.09 0.00 -0.52 0.00 0.00 37.83 33.69 2vja s LYS 52 CO 0.35 -0.17 0.59 -2.30 -0.92 0.00 0.00 175.35 172.90 2vja n PRO 53 N 1.59 0.60 -4.39 -1.68 -0.02 -1.26 -5.02 135.00 124.81 2vja n PRO 53 Ca 0.02 0.23 -0.20 0.00 -2.02 0.00 0.00 63.50 61.53 2vja n PRO 53 Cb 0.42 -1.72 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 2vja n PRO 53 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2vja s TRP 54 N -1.64 1.90 0.29 6.00 -2.14 -0.36 -5.03 118.94 117.96 2vja s TRP 54 Ca 0.68 -0.55 0.07 0.00 2.66 0.00 0.00 56.10 58.97 2vja s TRP 54 Cb -0.47 -0.92 -0.03 0.00 -3.10 0.00 0.00 33.47 28.95 2vja s TRP 54 CO 0.55 0.43 0.24 -1.54 -2.66 0.00 0.00 176.95 173.96 2vja s SER 55 N -3.39 5.41 0.04 -2.66 1.04 -1.26 -4.52 113.70 108.36 2vja s SER 55 Ca 0.26 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.32 2vja s SER 55 Cb -0.01 -1.20 0.00 0.00 0.10 0.00 0.00 66.02 64.92 2vja s SER 55 CO 0.10 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.74 2vja n GLY 56 N -1.27 -2.18 3.62 7.32 0.00 -1.26 -4.82 105.19 106.60 2vja n GLY 56 Ca -0.05 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.12 2vja n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vja s VAL 57 N -0.78 5.30 0.02 1.61 1.01 -1.26 -3.96 120.40 122.33 2vja s VAL 57 Ca 0.00 0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.95 2vja s VAL 57 Cb 0.00 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 2vja s VAL 57 CO 0.00 0.27 1.13 0.86 0.00 0.00 0.00 175.10 177.36 2vja s TRP 58 N 1.53 3.46 -0.54 5.22 -0.11 0.34 -4.87 118.94 123.97 2vja s TRP 58 Ca 0.09 1.41 -0.28 0.00 1.22 0.00 0.00 56.10 58.54 2vja s TRP 58 Cb -0.15 -3.33 0.01 0.00 -1.50 0.00 0.00 33.47 28.50 2vja s TRP 58 CO 0.08 -0.89 1.44 1.21 -4.62 0.00 0.00 176.95 174.17 2vja s ASN 59 N 1.12 6.12 -0.54 5.86 3.84 -1.26 -1.19 114.94 128.89 2vja s ASN 59 Ca 0.56 0.37 0.03 0.00 0.21 0.00 0.00 52.86 54.02 2vja s ASN 59 Cb -0.26 -2.54 0.41 0.00 -0.55 0.00 0.00 41.25 38.31 2vja s ASN 59 CO 0.27 -1.70 1.47 0.00 -2.79 0.00 0.00 177.10 174.35 2vja n ALA 60 N 9.62 5.58 0.66 1.71 0.00 -0.60 -4.67 120.51 132.82 2vja n ALA 60 Ca 0.13 -4.06 0.09 0.00 0.00 0.00 0.00 53.44 49.61 2vja n ALA 60 Cb 0.49 -1.01 -0.12 0.00 0.00 0.00 0.00 19.45 18.81 2vja n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2vja n SER 61 N -0.60 0.80 -4.08 0.00 3.41 -1.25 -0.80 113.62 111.10 2vja n SER 61 Ca 0.47 -0.70 -0.11 0.00 -0.26 0.00 0.00 58.87 58.26 2vja n SER 61 Cb 0.62 1.23 -0.11 0.00 -0.26 0.00 0.00 64.21 65.69 2vja n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2vja s THR 62 N -2.94 0.48 0.67 6.66 -4.23 -1.26 -4.82 115.64 110.19 2vja s THR 62 Ca 0.03 -1.35 -0.17 0.00 -1.18 0.00 0.00 61.69 59.03 2vja s THR 62 Cb 0.14 -0.93 -0.03 0.00 1.34 0.00 0.00 72.50 73.02 2vja s THR 62 CO 0.79 -0.59 0.83 -1.22 -0.54 0.00 0.00 174.62 173.89 2vja n TYR 63 N 0.95 0.27 -2.26 3.99 4.01 -1.26 -3.94 117.16 118.92 2vja n TYR 63 Ca -0.19 0.40 -0.19 0.00 -0.16 0.00 0.00 57.90 57.76 2vja n TYR 63 Cb 0.57 -2.05 0.11 0.00 -0.31 0.00 0.00 39.34 37.66 2vja n TYR 63 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2vja n PRO 64 N -1.17 -0.29 -1.82 -0.72 -0.04 -1.26 -4.85 135.00 124.85 2vja n PRO 64 Ca 0.13 -1.93 -0.32 0.00 -0.04 0.00 0.00 63.50 61.34 2vja n PRO 64 Cb 0.49 -0.69 0.03 0.00 -0.04 0.00 0.00 33.50 33.29 2vja n PRO 64 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2vja s ASN 65 N -4.33 5.69 0.13 3.54 0.01 -1.26 -4.87 114.94 113.84 2vja s ASN 65 Ca 0.53 1.66 -0.02 0.00 -0.71 0.00 0.00 52.86 54.32 2vja s ASN 65 Cb -0.02 -2.51 -0.05 0.00 0.41 0.00 0.00 41.25 39.08 2vja s ASN 65 CO 0.36 -1.23 0.32 0.20 -1.51 0.00 0.00 177.10 175.24 2vja s ASN 66 N -3.43 6.42 0.77 -1.22 0.02 -0.30 -4.74 114.94 112.46 2vja s ASN 66 Ca 0.60 0.44 -0.12 0.00 -1.02 0.00 0.00 52.86 52.75 2vja s ASN 66 Cb -0.14 -2.03 0.06 0.00 0.02 0.00 0.00 41.25 39.16 2vja s ASN 66 CO 0.47 0.07 1.14 0.00 0.02 0.00 0.00 177.10 178.80 2vja s GLN 68 N -4.43 4.27 0.20 0.00 -1.52 -1.24 -4.56 119.66 112.39 2vja s GLN 68 Ca 0.67 2.22 -0.20 0.00 -1.95 0.00 0.00 55.36 56.10 2vja s GLN 68 Cb -0.22 -3.19 0.04 0.00 -0.22 0.00 0.00 33.01 29.42 2vja s GLN 68 CO 0.51 -0.49 0.60 1.14 -0.25 0.00 0.00 175.29 176.79 2vja s GLN 69 N 0.81 1.44 0.39 2.91 -2.07 -1.26 -4.67 119.66 117.22 2vja s GLN 69 Ca 0.65 -0.76 -0.26 0.00 -1.82 0.00 0.00 55.36 53.17 2vja s GLN 69 Cb -0.40 0.57 -0.09 0.00 -1.09 0.00 0.00 33.01 31.99 2vja s GLN 69 CO 0.33 -0.63 1.29 -0.47 -1.32 0.00 0.00 175.29 174.49 2vja s TYR 70 N -3.84 2.88 -0.13 9.60 5.04 -1.25 -5.01 117.35 124.64 2vja s TYR 70 Ca 0.07 1.42 0.01 0.00 -2.44 0.00 0.00 57.07 56.13 2vja s TYR 70 Cb -0.02 -3.65 -0.00 0.00 0.35 0.00 0.00 41.96 38.63 2vja s TYR 70 CO -0.04 -1.99 -0.17 0.08 -1.34 0.00 0.00 175.55 172.08 2vja s VAL 71 N -1.25 2.58 -0.30 3.14 1.01 -1.26 -4.90 120.40 119.42 2vja s VAL 71 Ca 0.55 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 61.42 2vja s VAL 71 Cb -0.38 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 33.94 2vja s VAL 71 CO 0.49 0.53 1.47 -0.62 0.00 0.00 0.00 175.10 176.97 2vja s ASP 72 N 0.53 6.43 -0.21 3.32 2.15 -1.26 -4.87 116.67 122.77 2vja s ASP 72 Ca -0.11 1.26 0.13 0.00 0.43 0.00 0.00 52.55 54.26 2vja s ASP 72 Cb -0.16 -2.54 0.43 0.00 -0.30 0.00 0.00 42.92 40.35 2vja s ASP 72 CO 0.04 -1.27 1.30 -0.62 -0.17 0.00 0.00 175.17 174.45 2vja n GLU 73 N 7.70 1.78 -0.05 4.34 1.02 -1.26 -4.75 120.64 129.42 2vja n GLU 73 Ca 0.17 -3.01 -0.12 0.00 -0.02 0.00 0.00 57.16 54.18 2vja n GLU 73 Cb 0.46 -1.68 -0.06 0.00 -0.02 0.00 0.00 31.44 30.15 2vja n GLU 73 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2vja h GLN 74 N 0.86 0.27 -3.04 3.49 1.08 -2.00 -3.37 115.11 112.39 2vja h GLN 74 Ca 0.06 -0.08 -0.62 0.00 -1.45 0.00 0.00 58.65 56.57 2vja h GLN 74 Cb 1.25 -0.03 -0.41 0.00 -0.05 0.00 0.00 27.48 28.24 2vja h GLN 74 CO 0.14 0.46 -0.64 -0.06 -0.95 0.00 0.00 178.83 177.78 2vja s PHE 75 N -5.12 3.14 0.22 2.96 0.08 -1.26 -5.09 117.98 112.91 2vja s PHE 75 Ca -0.14 -3.15 -0.32 0.00 0.12 0.00 0.00 56.93 53.44 2vja s PHE 75 Cb 0.06 -2.47 -0.12 0.00 -0.57 0.00 0.00 43.02 39.91 2vja s PHE 75 CO 0.71 -0.62 1.62 -2.30 -0.10 0.00 0.00 175.22 174.54 2vja n PRO 76 N 2.33 2.54 0.00 0.24 -0.02 -1.26 -1.73 135.00 137.10 2vja n PRO 76 Ca 0.18 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 2vja n PRO 76 Cb 0.36 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.14 2vja n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vja n GLY 77 N 3.15 3.03 3.65 -1.23 0.00 -1.26 -4.98 105.19 107.55 2vja n GLY 77 Ca 0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.73 2vja n GLY 77 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2vja s PHE 78 N -1.39 2.69 0.45 1.61 5.36 -0.70 -4.90 117.98 121.09 2vja s PHE 78 Ca 0.00 0.88 0.34 0.00 -0.96 0.00 0.00 56.93 57.19 2vja s PHE 78 Cb 0.00 -3.71 1.76 0.00 -0.34 0.00 0.00 43.02 40.73 2vja s PHE 78 CO 0.00 -1.89 2.16 0.66 -1.46 0.00 0.00 175.22 174.69 2vja h SER 79 N 8.88 0.00 -0.04 6.13 4.64 -1.94 -2.01 113.55 129.21 2vja h SER 79 Ca -0.27 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.96 2vja h SER 79 Cb 1.11 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 2vja h SER 79 CO 1.00 0.05 -0.23 1.23 -0.87 0.00 0.00 176.83 178.01 2vja h GLY 80 N 0.74 0.49 0.11 -0.77 0.00 -1.93 -2.39 103.07 99.32 2vja h GLY 80 Ca -0.00 -0.38 -0.37 0.00 0.00 0.00 0.00 47.33 46.58 2vja h GLY 80 CO 0.01 0.35 -2.34 -1.14 0.00 0.00 0.00 176.54 173.41 2vja n SER 81 N -4.14 0.86 0.20 0.19 3.41 -1.11 -4.45 113.62 108.58 2vja n SER 81 Ca -0.00 -0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.67 2vja n SER 81 Cb 0.39 0.33 0.42 0.00 -0.26 0.00 0.00 64.21 65.09 2vja n SER 81 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2vja h GLU 82 N 0.00 0.00 0.00 4.33 5.08 -1.42 -2.96 114.58 119.62 2vja h GLU 82 Ca -0.53 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 2vja h GLU 82 Cb 2.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.35 2vja h GLU 82 CO -0.00 0.31 0.00 0.00 -1.00 0.00 0.00 179.01 178.32 2vja n MET 83 N -3.61 0.07 0.00 2.33 0.00 -0.90 -0.87 117.12 114.14 2vja n MET 83 Ca -0.01 0.55 0.08 0.00 0.00 0.00 0.00 57.70 58.32 2vja n MET 83 Cb 0.44 -1.73 -0.05 0.00 0.00 0.00 0.00 33.22 31.88 2vja n MET 83 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 2vja n TRP 84 N -1.88 0.00 -2.44 3.17 7.02 -1.12 -4.71 117.44 117.49 2vja n TRP 84 Ca -0.00 0.00 -0.32 0.00 -1.02 0.00 0.00 57.50 56.16 2vja n TRP 84 Cb 0.03 0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 28.89 2vja n TRP 84 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2vja s ASN 85 N -2.26 6.61 0.16 -0.99 0.01 -0.04 -4.69 114.94 113.73 2vja s ASN 85 Ca 0.10 1.52 -0.34 0.00 -0.71 0.00 0.00 52.86 53.43 2vja s ASN 85 Cb 0.13 -2.49 -0.14 0.00 0.41 0.00 0.00 41.25 39.16 2vja s ASN 85 CO 0.55 -0.57 1.51 -2.65 -1.51 0.00 0.00 177.10 174.43 2vja n PRO 86 N -1.57 1.94 -0.89 -0.60 -0.02 -1.26 -4.86 135.00 127.74 2vja n PRO 86 Ca 0.06 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2vja n PRO 86 Cb 0.54 -2.43 0.32 0.00 -0.02 0.00 0.00 33.50 31.91 2vja n PRO 86 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2vja n ASN 87 N 3.10 4.82 -3.78 2.55 6.94 -1.26 -4.96 115.26 122.67 2vja n ASN 87 Ca 0.17 -3.15 -0.04 0.00 -0.02 0.00 0.00 54.58 51.54 2vja n ASN 87 Cb 0.27 -0.69 -0.01 0.00 -2.36 0.00 0.00 39.78 36.98 2vja n ASN 87 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2vja s ARG 88 N -2.93 1.35 0.11 -3.83 1.70 -1.26 -5.11 118.95 108.99 2vja s ARG 88 Ca 0.53 -0.75 -0.35 0.00 -0.47 0.00 0.00 55.73 54.69 2vja s ARG 88 Cb 0.42 0.46 -0.17 0.00 -0.57 0.00 0.00 34.95 35.08 2vja s ARG 88 CO 0.13 -0.62 1.02 -1.91 -1.08 0.00 0.00 175.30 172.84 2vja n GLU 89 N -0.47 0.54 -3.44 3.89 4.07 -1.26 -4.43 120.64 119.54 2vja n GLU 89 Ca -0.05 0.19 -0.35 0.00 -0.06 0.00 0.00 57.16 56.88 2vja n GLU 89 Cb 0.60 -1.60 -0.06 0.00 -0.06 0.00 0.00 31.44 30.32 2vja n GLU 89 CO 0.00 0.00 0.00 -1.64 -0.06 0.00 0.00 177.13 175.43 2vja s MET 90 N -0.31 3.91 -0.12 5.31 -1.94 -1.26 -1.15 119.30 123.74 2vja s MET 90 Ca 0.78 0.39 -0.30 0.00 -1.71 0.00 0.00 55.69 54.85 2vja s MET 90 Cb -1.02 -2.98 0.10 0.00 2.01 0.00 0.00 34.83 32.94 2vja s MET 90 CO 0.54 0.52 0.85 0.45 -0.01 0.00 0.00 175.02 177.38 2vja s SER 91 N -1.67 -0.51 0.55 3.03 0.15 0.01 -4.89 113.70 110.37 2vja s SER 91 Ca 0.35 0.60 0.34 0.00 0.70 0.00 0.00 55.95 57.93 2vja s SER 91 Cb -0.15 0.47 1.39 0.00 -1.71 0.00 0.00 66.02 66.02 2vja s SER 91 CO 0.18 -0.44 2.00 -0.33 1.20 0.00 0.00 173.24 175.85 2vja h GLU 92 N 2.91 0.00 -4.84 5.44 5.08 -1.94 -3.28 114.58 117.94 2vja h GLU 92 Ca -0.23 0.00 -0.72 0.00 -1.00 0.00 0.00 59.36 57.41 2vja h GLU 92 Cb 1.15 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.23 2vja h GLU 92 CO 0.33 0.02 1.19 0.34 -1.00 0.00 0.00 179.01 179.88 2vja s ASP 93 N -5.71 6.93 -0.00 1.42 2.15 -1.26 -4.30 116.67 115.90 2vja s ASP 93 Ca 0.01 -2.69 0.00 0.00 0.43 0.00 0.00 52.55 50.30 2vja s ASP 93 Cb 0.09 -2.40 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 2vja s ASP 93 CO 0.54 -0.85 0.65 0.00 -0.17 0.00 0.00 175.17 175.35 2vja s LEU 95 N -0.30 4.05 0.21 0.00 1.43 -1.26 -4.73 118.68 118.09 2vja s LEU 95 Ca 0.00 -2.15 0.02 0.00 -1.03 0.00 0.00 54.13 50.97 2vja s LEU 95 Cb 0.00 -2.53 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 2vja s LEU 95 CO 0.00 -1.21 0.04 -0.31 0.23 0.00 0.00 176.35 175.11 2vja s TYR 96 N 3.90 1.37 0.05 0.29 1.51 -1.26 -2.98 117.35 120.23 2vja s TYR 96 Ca 0.47 -1.09 0.01 0.00 -1.01 0.00 0.00 57.07 55.45 2vja s TYR 96 Cb 0.01 -0.79 -0.03 0.00 -0.11 0.00 0.00 41.96 41.03 2vja s TYR 96 CO -0.01 -0.26 -0.05 -0.48 -1.11 0.00 0.00 175.55 173.64 2vja s LEU 97 N -3.24 2.39 0.04 -1.29 0.05 0.14 -2.99 118.68 113.78 2vja s LEU 97 Ca 0.30 -0.79 0.09 0.00 0.05 0.00 0.00 54.13 53.78 2vja s LEU 97 Cb 0.07 0.03 -0.03 0.00 -2.05 0.00 0.00 46.19 44.21 2vja s LEU 97 CO 0.08 -0.41 -0.25 0.20 -0.55 0.00 0.00 176.35 175.42 2vja s ASN 98 N -2.34 2.99 0.00 1.48 0.01 0.62 -1.08 114.94 116.62 2vja s ASN 98 Ca -0.01 -0.56 0.04 0.00 -0.71 0.00 0.00 52.86 51.62 2vja s ASN 98 Cb -0.01 -0.27 -0.01 0.00 0.41 0.00 0.00 41.25 41.37 2vja s ASN 98 CO -0.04 0.24 -0.11 -0.63 -1.51 0.00 0.00 177.10 175.04 2vja s ILE 99 N -0.78 0.90 -0.15 0.60 1.01 0.01 -0.84 121.20 121.95 2vja s ILE 99 Ca 0.11 -0.58 0.00 0.00 0.00 0.00 0.00 60.65 60.18 2vja s ILE 99 Cb -0.10 -0.77 0.02 0.00 0.01 0.00 0.00 42.46 41.62 2vja s ILE 99 CO 0.02 0.18 -0.15 0.26 0.00 0.00 0.00 174.94 175.25 2vja s TRP 100 N -0.40 2.23 -0.09 3.97 0.51 -0.09 -0.53 118.94 124.54 2vja s TRP 100 Ca 0.03 -1.25 0.04 0.00 -2.12 0.00 0.00 56.10 52.80 2vja s TRP 100 Cb -0.05 -1.63 -0.01 0.00 -0.81 0.00 0.00 33.47 30.98 2vja s TRP 100 CO -0.00 -0.68 -0.22 0.08 -0.51 0.00 0.00 176.95 175.63 2vja s VAL 101 N 1.43 2.31 0.60 4.03 1.01 -0.25 -1.80 120.40 127.74 2vja s VAL 101 Ca 0.04 -0.95 -0.18 0.00 0.00 0.00 0.00 61.98 60.90 2vja s VAL 101 Cb -0.13 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2vja s VAL 101 CO -0.10 0.56 1.15 -2.16 0.00 0.00 0.00 175.10 174.54 2vja s PRO 102 N 0.10 3.04 -0.15 2.72 0.04 -1.26 -0.74 135.00 138.74 2vja s PRO 102 Ca -0.10 1.61 -0.01 0.00 0.04 0.00 0.00 61.00 62.53 2vja s PRO 102 Cb -0.16 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.41 2vja s PRO 102 CO 0.06 -1.10 -0.11 0.45 0.04 0.00 0.00 177.00 176.34 2vja s SER 103 N -1.98 4.06 0.51 6.66 0.15 -1.26 -2.64 113.70 119.21 2vja s SER 103 Ca 0.72 -0.35 -0.20 0.00 0.70 0.00 0.00 55.95 56.82 2vja s SER 103 Cb -0.25 -1.64 -0.07 0.00 -1.71 0.00 0.00 66.02 62.36 2vja s SER 103 CO 0.33 0.12 1.12 -2.16 1.20 0.00 0.00 173.24 173.85 2vja s PRO 104 N 0.65 3.53 -0.23 5.44 0.04 -1.26 -4.93 135.00 138.25 2vja s PRO 104 Ca -0.06 1.59 -0.37 0.00 0.04 0.00 0.00 61.00 62.20 2vja s PRO 104 Cb -0.15 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 32.15 2vja s PRO 104 CO 0.02 -0.70 1.88 -2.13 0.04 0.00 0.00 177.00 176.12 2vja n ARG 105 N -1.06 1.52 -0.92 4.56 0.63 -1.08 -4.96 116.66 115.35 2vja n ARG 105 Ca 0.10 0.54 -0.22 0.00 -0.92 0.00 0.00 57.85 57.35 2vja n ARG 105 Cb 0.51 -2.37 0.18 0.00 0.45 0.00 0.00 32.46 31.23 2vja n ARG 105 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 2vja n PRO 106 N 6.39 -2.23 -4.45 -0.14 -0.04 -1.26 -5.02 135.00 128.24 2vja n PRO 106 Ca 0.28 -1.35 -0.31 0.00 -0.04 0.00 0.00 63.50 62.08 2vja n PRO 106 Cb 0.21 -1.17 -0.17 0.00 -0.04 0.00 0.00 33.50 32.33 2vja n PRO 106 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2vja s LYS 107 N -4.92 2.62 -1.47 0.54 1.02 -1.26 -4.47 119.74 111.81 2vja s LYS 107 Ca 0.54 -0.70 -0.06 0.00 0.02 0.00 0.00 55.97 55.76 2vja s LYS 107 Cb -0.04 -2.20 0.01 0.00 -0.52 0.00 0.00 37.83 35.07 2vja s LYS 107 CO 0.40 -0.08 0.19 0.45 -0.92 0.00 0.00 175.35 175.39 2vja n SER 108 N 4.26 -0.15 -4.91 2.83 2.88 -0.93 -4.94 113.62 112.67 2vja n SER 108 Ca -0.19 -1.23 -0.23 0.00 -1.33 0.00 0.00 58.87 55.88 2vja n SER 108 Cb 0.51 -1.88 0.06 0.00 -0.75 0.00 0.00 64.21 62.15 2vja n SER 108 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2vja s THR 109 N -4.17 2.44 0.32 2.46 -1.32 -0.29 -4.41 115.64 110.67 2vja s THR 109 Ca 0.08 -0.49 -0.29 0.00 -1.21 0.00 0.00 61.69 59.79 2vja s THR 109 Cb -0.04 -2.95 -0.10 0.00 -1.51 0.00 0.00 72.50 67.89 2vja s THR 109 CO 0.97 0.00 1.31 -0.89 -2.21 0.00 0.00 174.62 173.80 2vja s THR 110 N -3.01 2.77 0.06 5.08 2.01 -1.26 0.04 115.64 121.32 2vja s THR 110 Ca 0.60 0.76 0.07 0.00 0.31 0.00 0.00 61.69 63.43 2vja s THR 110 Cb -0.10 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 2vja s THR 110 CO 0.42 0.17 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.67 2vja s VAL 111 N -1.00 2.93 -0.08 3.82 1.01 -1.01 -1.44 120.40 124.63 2vja s VAL 111 Ca 0.50 -1.21 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2vja s VAL 111 Cb -0.39 -2.27 0.02 0.00 0.00 0.00 0.00 36.38 33.74 2vja s VAL 111 CO 0.51 0.28 -0.08 -0.04 0.00 0.00 0.00 175.10 175.77 2vja s MET 112 N -1.62 1.42 -0.26 2.72 -1.94 -0.43 -1.15 119.30 118.03 2vja s MET 112 Ca 0.16 -0.27 -0.06 0.00 -1.71 0.00 0.00 55.69 53.81 2vja s MET 112 Cb -0.11 -1.35 -0.01 0.00 2.01 0.00 0.00 34.83 35.38 2vja s MET 112 CO 0.07 -0.13 0.05 0.08 -0.01 0.00 0.00 175.02 175.08 2vja s VAL 113 N 1.19 3.93 -0.04 -6.03 1.01 0.29 -0.34 120.40 120.42 2vja s VAL 113 Ca -0.05 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 2vja s VAL 113 Cb -0.14 -2.92 -0.05 0.00 0.00 0.00 0.00 36.38 33.27 2vja s VAL 113 CO -0.02 0.24 0.63 0.86 0.00 0.00 0.00 175.10 176.81 2vja s TRP 114 N 1.53 3.62 -0.33 5.22 -0.11 0.24 -0.21 118.94 128.91 2vja s TRP 114 Ca 0.04 1.20 0.03 0.00 1.22 0.00 0.00 56.10 58.59 2vja s TRP 114 Cb -0.16 -2.69 0.10 0.00 -1.50 0.00 0.00 33.47 29.22 2vja s TRP 114 CO 0.01 0.22 0.04 0.42 -4.62 0.00 0.00 176.95 173.03 2vja s ILE 115 N 0.30 2.10 0.70 5.86 1.01 0.52 -2.61 121.20 129.08 2vja s ILE 115 Ca 0.33 -2.17 -0.16 0.00 0.00 0.00 0.00 60.65 58.65 2vja s ILE 115 Cb -0.18 -2.53 -0.00 0.00 0.01 0.00 0.00 42.46 39.76 2vja s ILE 115 CO 0.17 -0.55 1.03 0.00 0.00 0.00 0.00 174.94 175.59 2vja n TYR 116 N 4.34 0.91 -2.12 3.97 0.18 -1.26 -3.56 117.16 119.61 2vja n TYR 116 Ca 0.02 0.40 0.00 0.00 1.88 0.00 0.00 57.90 60.20 2vja n TYR 116 Cb 0.42 -2.12 0.00 0.00 -0.38 0.00 0.00 39.34 37.26 2vja n TYR 116 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2vja n GLY 117 N 1.07 1.90 0.00 -7.48 0.00 -1.18 -3.62 105.19 95.89 2vja n GLY 117 Ca 0.14 -2.05 0.00 0.00 0.00 0.00 0.00 46.02 44.11 2vja n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vja n GLY 118 N 5.00 0.91 2.44 -0.02 0.00 -1.26 -4.22 105.19 108.04 2vja n GLY 118 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 2vja n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vja n GLY 119 N 0.00 1.32 3.60 -0.02 0.00 -1.26 -1.86 105.19 106.97 2vja n GLY 119 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2vja n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vja n PHE 120 N -2.58 0.00 0.46 1.61 3.72 -1.26 -4.75 117.46 114.66 2vja n PHE 120 Ca -0.20 0.00 0.05 0.00 -0.05 0.00 0.00 57.45 57.26 2vja n PHE 120 Cb 0.63 -0.80 0.02 0.00 -0.94 0.00 0.00 39.48 38.39 2vja n PHE 120 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2vja n TYR 121 N -2.00 0.00 -3.81 1.38 0.18 -0.78 -0.07 117.16 112.07 2vja n TYR 121 Ca 0.00 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 59.72 2vja n TYR 121 Cb 0.00 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 38.98 2vja n TYR 121 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 2vja n SER 122 N 0.23 -1.97 0.00 9.48 3.41 -0.78 -3.90 113.62 120.09 2vja n SER 122 Ca 0.05 -2.25 0.00 0.00 -0.26 0.00 0.00 58.87 56.42 2vja n SER 122 Cb 0.25 3.26 0.00 0.00 -0.26 0.00 0.00 64.21 67.46 2vja n SER 122 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vja n GLY 123 N -0.59 3.44 3.05 5.00 0.00 -1.26 -4.12 105.19 110.72 2vja n GLY 123 Ca -0.06 -1.71 -0.10 0.00 0.00 0.00 0.00 46.02 44.15 2vja n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vja s SER 124 N 0.00 0.17 0.00 1.61 0.01 -1.26 -4.68 113.70 109.55 2vja s SER 124 Ca 0.00 -0.43 0.27 0.00 1.31 0.00 0.00 55.95 57.10 2vja s SER 124 Cb 0.00 0.16 0.88 0.00 0.21 0.00 0.00 66.02 67.27 2vja s SER 124 CO 0.00 -0.37 1.67 -1.54 0.41 0.00 0.00 173.24 173.40 2vja n SER 125 N 1.34 0.33 -0.77 2.44 3.41 -1.26 -4.00 113.62 115.11 2vja n SER 125 Ca -0.22 -0.04 0.12 0.00 -0.26 0.00 0.00 58.87 58.47 2vja n SER 125 Cb 0.56 -0.07 0.31 0.00 -0.26 0.00 0.00 64.21 64.75 2vja n SER 125 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2vja n THR 126 N -1.40 0.15 -1.71 6.66 -2.24 -1.26 -4.87 114.28 109.60 2vja n THR 126 Ca 0.07 -0.44 -0.38 0.00 -2.27 0.00 0.00 64.05 61.04 2vja n THR 126 Cb 0.33 0.85 0.05 0.00 -2.10 0.00 0.00 70.33 69.46 2vja n THR 126 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2vja n LEU 127 N 0.80 5.38 -0.24 3.22 4.77 -1.26 -4.91 117.00 124.77 2vja n LEU 127 Ca 0.17 0.89 -0.01 0.00 -0.03 0.00 0.00 56.01 57.04 2vja n LEU 127 Cb 0.47 -1.53 0.11 0.00 -2.33 0.00 0.00 43.42 40.14 2vja n LEU 127 CO 0.15 -0.97 1.09 0.44 -1.33 0.00 0.00 177.39 176.77 2vja h ASP 128 N 0.92 0.55 0.11 -1.43 3.32 -1.94 -1.05 116.42 116.90 2vja h ASP 128 Ca -0.50 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.58 2vja h ASP 128 Cb 1.33 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2vja h ASP 128 CO 0.54 0.34 0.00 1.33 -1.72 0.00 0.00 179.24 179.74 2vja n VAL 129 N -4.79 0.40 -0.17 -1.35 0.24 -1.26 -1.54 118.33 109.86 2vja n VAL 129 Ca 0.09 0.10 0.05 0.00 -2.04 0.00 0.00 64.34 62.54 2vja n VAL 129 Cb 0.20 -0.92 0.14 0.00 -1.47 0.00 0.00 33.84 31.79 2vja n VAL 129 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2vja n TYR 130 N -1.15 0.42 -1.60 6.34 4.01 -0.40 -4.67 117.16 120.11 2vja n TYR 130 Ca 0.07 -0.50 -0.44 0.00 -0.16 0.00 0.00 57.90 56.86 2vja n TYR 130 Cb 0.06 -0.03 -0.04 0.00 -0.31 0.00 0.00 39.34 39.03 2vja n TYR 130 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2vja n ASN 131 N 0.42 3.35 -0.16 7.72 2.85 -0.59 -4.86 115.26 123.99 2vja n ASN 131 Ca 0.11 0.43 0.15 0.00 -0.11 0.00 0.00 54.58 55.15 2vja n ASN 131 Cb 0.41 -1.51 0.77 0.00 1.24 0.00 0.00 39.78 40.69 2vja n ASN 131 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2vja n GLY 132 N 5.50 -0.66 0.33 8.20 0.00 -1.26 -4.28 105.19 113.02 2vja n GLY 132 Ca 0.29 -0.27 -0.05 0.00 0.00 0.00 0.00 46.02 45.98 2vja n GLY 132 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2vja h LYS 133 N 0.76 1.10 -0.00 1.61 2.10 -1.92 -1.73 116.57 118.48 2vja h LYS 133 Ca 0.00 -0.22 -0.00 0.00 -2.00 0.00 0.00 60.65 58.43 2vja h LYS 133 Cb 0.16 -0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2vja h LYS 133 CO 0.00 0.93 0.00 1.88 -2.00 0.00 0.00 179.45 180.26 2vja h TYR 134 N 1.06 0.00 -0.54 0.07 -1.99 -1.82 -1.46 116.97 112.29 2vja h TYR 134 Ca 0.23 -0.00 -0.12 0.00 2.00 0.00 0.00 58.73 60.85 2vja h TYR 134 Cb 0.28 -0.00 -0.02 0.00 2.00 0.00 0.00 36.73 38.99 2vja h TYR 134 CO 0.02 0.18 -0.11 1.25 -0.00 0.00 0.00 178.16 179.50 2vja h LEU 135 N -0.18 1.03 -0.43 3.88 5.85 -1.71 -0.53 115.31 123.22 2vja h LEU 135 Ca 0.00 -0.35 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 2vja h LEU 135 Cb 0.18 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 2vja h LEU 135 CO -0.00 1.15 0.09 0.00 -0.34 0.00 0.00 178.44 179.34 2vja h ALA 136 N 0.92 0.57 0.43 1.25 0.00 -1.30 -2.16 119.26 118.97 2vja h ALA 136 Ca 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2vja h ALA 136 Cb 0.69 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.32 2vja h ALA 136 CO 0.05 0.26 -0.21 -0.92 0.00 0.00 0.00 179.25 178.44 2vja h TYR 137 N 0.56 -0.54 -0.78 0.00 5.03 -1.22 0.14 116.97 120.17 2vja h TYR 137 Ca 0.13 -0.01 0.12 0.00 2.58 0.00 0.00 58.73 61.55 2vja h TYR 137 Cb 0.34 0.18 -0.08 0.00 1.55 0.00 0.00 36.73 38.71 2vja h TYR 137 CO 0.02 -0.28 0.39 1.15 -1.32 0.00 0.00 178.16 178.13 2vja h THR 138 N -1.11 0.80 -0.15 1.81 2.02 -1.18 -2.60 112.91 112.51 2vja h THR 138 Ca -0.06 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.91 2vja h THR 138 Cb 0.50 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 2vja h THR 138 CO 0.10 0.11 0.00 -0.62 0.37 0.00 0.00 175.52 175.48 2vja n GLU 139 N -4.86 2.06 -3.62 6.66 -0.58 -0.81 -5.01 120.64 114.47 2vja n GLU 139 Ca 0.14 -1.89 -0.29 0.00 -0.42 0.00 0.00 57.16 54.70 2vja n GLU 139 Cb 0.34 -1.42 0.04 0.00 -0.57 0.00 0.00 31.44 29.83 2vja n GLU 139 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2vja n GLU 140 N 1.22 -1.32 -4.28 3.49 1.02 0.41 -5.02 120.64 116.16 2vja n GLU 140 Ca 0.14 0.55 -0.16 0.00 -0.02 0.00 0.00 57.16 57.67 2vja n GLU 140 Cb 0.53 -4.28 -0.10 0.00 -0.02 0.00 0.00 31.44 27.58 2vja n GLU 140 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2vja s VAL 141 N -3.42 1.26 -0.29 2.62 -7.23 -0.79 -4.74 120.40 107.82 2vja s VAL 141 Ca 0.44 -2.09 -0.19 0.00 -1.81 0.00 0.00 61.98 58.33 2vja s VAL 141 Cb -0.15 -1.97 -0.02 0.00 0.56 0.00 0.00 36.38 34.80 2vja s VAL 141 CO 0.85 -0.65 0.58 -0.69 -0.31 0.00 0.00 175.10 174.88 2vja s VAL 142 N -3.27 4.99 -0.23 1.32 1.01 -0.52 -4.51 120.40 119.18 2vja s VAL 142 Ca 0.20 0.85 -0.08 0.00 0.00 0.00 0.00 61.98 62.94 2vja s VAL 142 Cb 0.02 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2vja s VAL 142 CO 0.03 -0.06 0.09 -0.22 0.00 0.00 0.00 175.10 174.95 2vja s LEU 143 N 2.48 3.71 -0.09 3.92 2.96 -0.74 -1.31 118.68 129.60 2vja s LEU 143 Ca 0.23 -0.06 0.03 0.00 -0.22 0.00 0.00 54.13 54.11 2vja s LEU 143 Cb -0.15 -1.98 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 2vja s LEU 143 CO 0.11 0.04 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.32 2vja s VAL 144 N 1.20 2.79 -0.15 1.68 1.01 0.54 -0.91 120.40 126.55 2vja s VAL 144 Ca 0.05 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.26 2vja s VAL 144 Cb -0.14 -2.11 0.02 0.00 0.00 0.00 0.00 36.38 34.14 2vja s VAL 144 CO 0.04 0.56 -0.19 -0.94 0.00 0.00 0.00 175.10 174.57 2vja s SER 145 N -0.08 2.93 0.55 3.32 1.04 -0.02 0.80 113.70 122.24 2vja s SER 145 Ca -0.03 -0.57 0.08 0.00 0.48 0.00 0.00 55.95 55.91 2vja s SER 145 Cb -0.14 -1.35 0.08 0.00 0.10 0.00 0.00 66.02 64.71 2vja s SER 145 CO 0.04 0.02 0.66 0.00 0.98 0.00 0.00 173.24 174.93 2vja n LEU 146 N 4.42 0.00 -4.17 2.42 -0.00 -1.07 -0.28 117.00 118.32 2vja n LEU 146 Ca -0.20 -2.51 -0.11 0.00 -0.00 0.00 0.00 56.01 53.20 2vja n LEU 146 Cb 0.51 -0.30 -0.10 0.00 -0.00 0.00 0.00 43.42 43.53 2vja n LEU 146 CO 0.25 -0.67 -0.29 -0.94 -0.00 0.00 0.00 177.39 175.75 2vja s SER 147 N -4.35 0.41 -0.11 1.45 1.04 -1.16 -4.57 113.70 106.41 2vja s SER 147 Ca 0.50 -1.24 -0.30 0.00 0.48 0.00 0.00 55.95 55.39 2vja s SER 147 Cb -0.04 0.28 0.09 0.00 0.10 0.00 0.00 66.02 66.46 2vja s SER 147 CO 0.32 -0.73 0.80 -0.72 0.98 0.00 0.00 173.24 173.89 2vja s TYR 148 N -4.01 -0.57 0.30 5.02 1.13 -1.26 -4.46 117.35 113.50 2vja s TYR 148 Ca 0.27 1.03 -0.30 0.00 -1.41 0.00 0.00 57.07 56.66 2vja s TYR 148 Cb 0.07 0.41 -0.11 0.00 -1.10 0.00 0.00 41.96 41.23 2vja s TYR 148 CO 0.04 -0.49 1.57 1.03 -2.51 0.00 0.00 175.55 175.19 2vja s ARG 149 N -0.98 4.13 0.41 -3.49 0.52 -1.26 -4.92 118.95 113.36 2vja s ARG 149 Ca -0.07 2.56 0.07 0.00 -0.52 0.00 0.00 55.73 57.77 2vja s ARG 149 Cb -0.01 -3.02 -0.07 0.00 0.52 0.00 0.00 34.95 32.37 2vja s ARG 149 CO 0.06 -0.60 0.04 0.14 0.02 0.00 0.00 175.30 174.95 2vja s VAL 150 N -0.19 2.02 0.00 3.52 -7.23 -1.26 -4.18 120.40 113.07 2vja s VAL 150 Ca 0.61 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.83 2vja s VAL 150 Cb -0.47 -2.97 0.00 0.00 0.56 0.00 0.00 36.38 33.50 2vja s VAL 150 CO 0.50 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.90 2vja n GLY 151 N -1.02 -0.09 0.37 2.32 0.00 0.90 -2.87 105.19 104.79 2vja n GLY 151 Ca -0.05 -1.01 0.11 0.00 0.00 0.00 0.00 46.02 45.07 2vja n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vja h ALA 152 N -0.68 1.78 -0.91 4.61 0.00 -1.90 0.21 119.26 122.37 2vja h ALA 152 Ca 0.00 0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.06 2vja h ALA 152 Cb 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.57 2vja h ALA 152 CO 0.00 -0.00 0.58 0.74 0.00 0.00 0.00 179.25 180.57 2vja h PHE 153 N 0.74 0.89 0.00 0.00 0.04 -1.94 -1.04 116.94 115.64 2vja h PHE 153 Ca 0.44 0.03 0.00 0.00 2.80 0.00 0.00 57.97 61.23 2vja h PHE 153 Cb 0.63 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 38.50 2vja h PHE 153 CO -0.00 0.34 -1.32 0.41 -0.60 0.00 0.00 178.31 177.14 2vja n GLY 154 N -1.41 -0.68 0.00 -1.45 0.00 -0.27 -4.01 105.19 97.37 2vja n GLY 154 Ca 0.17 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2vja n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vja n PHE 155 N -1.77 0.00 -1.68 1.61 3.72 0.58 -0.86 117.46 119.06 2vja n PHE 155 Ca -0.00 -0.10 -0.46 0.00 -0.05 0.00 0.00 57.45 56.84 2vja n PHE 155 Cb 0.36 -0.01 -0.04 0.00 -0.94 0.00 0.00 39.48 38.85 2vja n PHE 155 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2vja n LEU 156 N -0.10 3.63 -4.16 4.37 7.94 -0.42 -4.48 117.00 123.79 2vja n LEU 156 Ca 0.00 0.98 -0.33 0.00 -1.11 0.00 0.00 56.01 55.55 2vja n LEU 156 Cb 0.43 -1.44 -0.16 0.00 0.53 0.00 0.00 43.42 42.78 2vja n LEU 156 CO 0.00 -0.00 -0.51 0.00 -1.11 0.00 0.00 177.39 175.77 2vja s ALA 157 N 3.35 2.40 -0.52 1.96 0.00 -1.26 -3.38 121.76 124.30 2vja s ALA 157 Ca 0.88 -1.20 0.07 0.00 0.00 0.00 0.00 51.96 51.71 2vja s ALA 157 Cb -0.60 -1.25 0.24 0.00 0.00 0.00 0.00 23.12 21.51 2vja s ALA 157 CO 0.45 -0.33 0.62 1.28 0.00 0.00 0.00 175.76 177.78 2vja n LEU 158 N 4.58 1.98 -4.53 0.00 4.77 -0.33 -2.83 117.00 120.65 2vja n LEU 158 Ca -0.20 -5.06 -0.52 0.00 -0.03 0.00 0.00 56.01 50.19 2vja n LEU 158 Cb 0.50 -0.04 -0.05 0.00 -2.33 0.00 0.00 43.42 41.50 2vja n LEU 158 CO 0.27 2.05 0.60 1.57 -1.33 0.00 0.00 177.39 180.54 2vja n HIS 159 N 1.21 0.89 0.00 -1.77 -0.00 -1.26 -1.56 115.22 112.73 2vja n HIS 159 Ca 0.26 0.82 0.00 0.00 -0.00 0.00 0.00 57.72 58.80 2vja n HIS 159 Cb 0.46 -2.19 0.00 0.00 -0.00 0.00 0.00 29.99 28.27 2vja n HIS 159 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2vja n GLY 160 N 1.94 3.10 3.85 1.57 0.00 -1.26 -5.06 105.19 109.32 2vja n GLY 160 Ca 0.17 -1.02 -0.32 0.00 0.00 0.00 0.00 46.02 44.86 2vja n GLY 160 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vja s SER 161 N 0.00 6.64 0.00 1.61 0.15 -0.60 -4.96 113.70 116.54 2vja s SER 161 Ca 0.00 1.51 0.12 0.00 0.70 0.00 0.00 55.95 58.28 2vja s SER 161 Cb 0.00 -2.48 0.05 0.00 -1.71 0.00 0.00 66.02 61.88 2vja s SER 161 CO 0.00 -0.53 0.80 0.00 1.20 0.00 0.00 173.24 174.71 2vja n GLN 162 N -1.42 1.34 0.02 5.44 1.13 -1.26 -3.47 117.38 119.16 2vja n GLN 162 Ca 0.06 -0.97 -0.03 0.00 -1.94 0.00 0.00 57.00 54.12 2vja n GLN 162 Cb 0.54 -1.19 -0.10 0.00 0.11 0.00 0.00 30.24 29.60 2vja n GLN 162 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2vja h GLU 163 N 1.92 0.00 -1.01 -1.09 4.39 -1.93 -3.41 114.58 113.45 2vja h GLU 163 Ca 0.00 0.00 -0.38 0.00 0.34 0.00 0.00 59.36 59.32 2vja h GLU 163 Cb 0.47 0.00 -0.27 0.00 -0.10 0.00 0.00 28.75 28.85 2vja h GLU 163 CO 0.00 0.43 -0.81 0.00 -1.16 0.00 0.00 179.01 177.47 2vja n ALA 164 N -2.43 0.56 0.43 3.43 0.00 -1.26 -2.83 120.51 118.41 2vja n ALA 164 Ca -0.10 -2.42 0.13 0.00 0.00 0.00 0.00 53.44 51.04 2vja n ALA 164 Cb 0.91 -1.06 0.49 0.00 0.00 0.00 0.00 19.45 19.79 2vja n ALA 164 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2vja h PRO 165 N 3.63 0.00 0.00 0.00 0.13 -1.73 -0.87 132.00 133.16 2vja h PRO 165 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2vja h PRO 165 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2vja h PRO 165 CO 0.37 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.55 2vja n GLY 166 N 0.29 0.05 2.77 1.56 0.00 -1.22 -4.41 105.19 104.22 2vja n GLY 166 Ca 0.03 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.37 2vja n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vja n ASN 167 N -0.86 -3.95 0.08 1.61 3.02 -1.26 -4.88 115.26 109.02 2vja n ASN 167 Ca 0.00 0.00 0.18 0.00 -0.03 0.00 0.00 54.58 54.73 2vja n ASN 167 Cb 0.00 -2.14 0.72 0.00 -0.61 0.00 0.00 39.78 37.75 2vja n ASN 167 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2vja h VAL 168 N 0.00 0.67 -0.57 2.41 -1.51 -1.84 -0.20 116.25 115.20 2vja h VAL 168 Ca 0.00 0.00 -0.03 0.00 -1.23 0.00 0.00 66.70 65.44 2vja h VAL 168 Cb 0.49 0.78 -0.03 0.00 -2.13 0.00 0.00 31.29 30.40 2vja h VAL 168 CO 0.00 0.00 0.23 1.23 -1.23 0.00 0.00 177.57 177.80 2vja h GLY 169 N 0.00 0.92 1.37 5.19 0.00 -1.22 0.11 103.07 109.44 2vja h GLY 169 Ca 0.18 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.91 2vja h GLY 169 CO -0.00 0.47 -0.19 1.41 0.00 0.00 0.00 176.54 178.23 2vja h LEU 170 N 0.79 0.74 -1.17 3.11 3.38 -1.33 -2.31 115.31 118.51 2vja h LEU 170 Ca 0.19 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2vja h LEU 170 Cb 0.20 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2vja h LEU 170 CO -0.02 0.93 0.00 -0.07 0.09 0.00 0.00 178.44 179.38 2vja h LEU 171 N 0.65 0.54 -0.40 1.67 3.38 -0.78 -0.85 115.31 119.52 2vja h LEU 171 Ca 0.10 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 2vja h LEU 171 Cb 0.68 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2vja h LEU 171 CO 0.05 0.61 0.18 0.44 0.09 0.00 0.00 178.44 179.81 2vja h ASP 172 N 0.55 0.53 -0.80 -0.43 3.32 -0.28 -0.47 116.42 118.84 2vja h ASP 172 Ca 0.12 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 57.06 2vja h ASP 172 Cb 0.35 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.71 2vja h ASP 172 CO 0.01 0.53 0.50 1.56 -1.72 0.00 0.00 179.24 180.12 2vja h GLN 173 N 0.50 0.93 -0.49 3.56 4.20 -0.85 -1.66 115.11 121.30 2vja h GLN 173 Ca 0.13 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.78 2vja h GLN 173 Cb 0.15 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 2vja h GLN 173 CO -0.01 0.62 0.27 -0.09 -0.67 0.00 0.00 178.83 178.94 2vja h ARG 174 N 0.96 0.68 -0.22 1.46 2.43 -0.64 -1.44 114.38 117.61 2vja h ARG 174 Ca 0.33 -0.08 -0.03 0.00 -0.81 0.00 0.00 59.98 59.39 2vja h ARG 174 Cb 0.06 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2vja h ARG 174 CO -0.13 0.53 -0.00 1.98 -1.51 0.00 0.00 179.97 180.84 2vja h MET 175 N 0.64 0.32 -0.40 0.20 4.05 -0.52 0.27 114.93 119.50 2vja h MET 175 Ca 0.17 -0.05 -0.16 0.00 -0.28 0.00 0.00 59.70 59.38 2vja h MET 175 Cb 0.05 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 2vja h MET 175 CO -0.03 0.35 -0.37 0.00 0.23 0.00 0.00 176.91 177.10 2vja h ALA 176 N 1.69 0.58 -0.54 0.39 0.00 -0.74 -0.57 119.26 120.08 2vja h ALA 176 Ca 0.07 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 2vja h ALA 176 Cb 0.22 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2vja h ALA 176 CO 0.00 0.68 -0.12 -0.07 0.00 0.00 0.00 179.25 179.74 2vja h LEU 177 N 0.78 1.05 -1.21 0.00 3.38 -0.37 -1.18 115.31 117.76 2vja h LEU 177 Ca 0.07 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 2vja h LEU 177 Cb 0.96 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 2vja h LEU 177 CO 0.09 1.16 0.42 -0.61 0.09 0.00 0.00 178.44 179.60 2vja h GLN 178 N 0.92 0.96 -0.48 1.13 5.75 -0.32 0.67 115.11 123.74 2vja h GLN 178 Ca 0.14 -0.08 -0.10 0.00 -0.15 0.00 0.00 58.65 58.46 2vja h GLN 178 Cb 0.70 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.03 2vja h GLN 178 CO 0.05 0.68 -0.09 2.35 -2.65 0.00 0.00 178.83 179.17 2vja h TRP 179 N 0.97 0.94 -0.48 3.99 7.01 -0.58 -1.97 115.95 125.83 2vja h TRP 179 Ca 0.25 -0.17 -0.13 0.00 2.11 0.00 0.00 58.89 60.96 2vja h TRP 179 Cb -0.03 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.77 2vja h TRP 179 CO 0.00 0.90 -0.19 0.28 -2.79 0.00 0.00 178.44 176.64 2vja h VAL 180 N 0.78 1.27 -0.33 2.65 2.07 -0.10 0.05 116.25 122.64 2vja h VAL 180 Ca 0.13 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.29 2vja h VAL 180 Cb 0.59 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.44 2vja h VAL 180 CO 0.04 0.47 0.18 -0.74 0.02 0.00 0.00 177.57 177.53 2vja h HIS 181 N 0.85 0.43 0.00 1.57 -0.00 -0.59 0.32 115.15 117.73 2vja h HIS 181 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.49 2vja h HIS 181 Cb 0.76 -0.14 0.00 0.00 -0.00 0.00 0.00 27.41 28.03 2vja h HIS 181 CO 0.05 0.30 -1.47 -0.25 -0.00 0.00 0.00 177.93 176.57 2vja n ASP 182 N -4.45 0.44 0.00 3.26 8.00 -0.77 -4.68 116.55 118.35 2vja n ASP 182 Ca 0.02 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.62 2vja n ASP 182 Cb 0.10 1.21 0.00 0.00 -0.02 0.00 0.00 41.12 42.40 2vja n ASP 182 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2vja n ASN 183 N -2.39 0.53 -0.05 -2.24 3.02 -0.02 -4.80 115.26 109.31 2vja n ASN 183 Ca -0.02 -0.25 0.03 0.00 -0.03 0.00 0.00 54.58 54.31 2vja n ASN 183 Cb 0.54 0.62 0.38 0.00 -0.61 0.00 0.00 39.78 40.71 2vja n ASN 183 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2vja h ILE 184 N 0.00 1.13 -0.43 2.41 6.09 -1.09 -1.17 117.51 124.45 2vja h ILE 184 Ca 0.00 -0.27 0.12 0.00 -1.37 0.00 0.00 64.86 63.34 2vja h ILE 184 Cb 0.00 0.45 -0.02 0.00 0.47 0.00 0.00 36.82 37.72 2vja h ILE 184 CO 0.00 0.13 0.32 0.06 -3.07 0.00 0.00 178.15 175.59 2vja h GLN 185 N 0.65 0.00 0.00 2.19 3.07 -1.75 0.35 115.11 119.61 2vja h GLN 185 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.91 2vja h GLN 185 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.52 2vja h GLN 185 CO -0.03 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.08 2vja n PHE 186 N -4.31 0.23 -0.07 0.06 3.72 -0.44 -2.31 117.46 114.33 2vja n PHE 186 Ca 0.07 0.08 0.06 0.00 -0.05 0.00 0.00 57.45 57.61 2vja n PHE 186 Cb 0.52 -0.63 0.14 0.00 -0.94 0.00 0.00 39.48 38.57 2vja n PHE 186 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2vja n PHE 187 N -1.70 0.41 -0.29 1.38 3.01 0.11 -4.90 117.46 115.48 2vja n PHE 187 Ca 0.05 -0.42 0.00 0.00 1.01 0.00 0.00 57.45 58.09 2vja n PHE 187 Cb 0.26 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 2vja n PHE 187 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vja n GLY 188 N 0.60 0.71 3.85 1.37 0.00 -0.98 -4.77 105.19 105.97 2vja n GLY 188 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 2vja n GLY 188 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vja s GLY 189 N -1.52 2.31 -0.64 -0.02 0.00 -0.29 -1.13 107.32 106.03 2vja s GLY 189 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 44.72 44.65 2vja s GLY 189 CO 0.00 0.27 0.58 -0.35 0.00 0.00 0.00 173.10 173.60 2vja s ASP 190 N -2.32 6.29 0.65 1.64 2.15 0.11 -2.93 116.67 122.26 2vja s ASP 190 Ca 0.55 -2.19 0.22 0.00 0.43 0.00 0.00 52.55 51.56 2vja s ASP 190 Cb -0.10 -2.17 1.21 0.00 -0.30 0.00 0.00 42.92 41.56 2vja s ASP 190 CO 0.18 -0.71 1.68 1.55 -0.17 0.00 0.00 175.17 177.70 2vja h PRO 191 N 8.33 0.00 -0.01 4.34 0.13 -1.88 0.28 132.00 143.19 2vja h PRO 191 Ca -0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.01 2vja h PRO 191 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2vja h PRO 191 CO 0.90 0.00 -0.23 1.63 -0.23 0.00 0.00 178.00 180.07 2vja n LYS 192 N -2.75 1.22 -3.02 0.86 5.02 -1.26 -4.32 118.16 113.91 2vja n LYS 192 Ca -0.01 -0.83 -0.23 0.00 -2.02 0.00 0.00 58.31 55.22 2vja n LYS 192 Cb 0.52 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 34.01 2vja n LYS 192 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2vja n THR 193 N -0.16 1.74 -3.88 -0.18 -1.04 0.98 -4.68 114.28 107.05 2vja n THR 193 Ca 0.13 -5.13 -0.35 0.00 -2.04 0.00 0.00 64.05 56.66 2vja n THR 193 Cb 0.40 -0.91 -0.10 0.00 -1.82 0.00 0.00 70.33 67.91 2vja n THR 193 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2vja s VAL 194 N -3.67 4.95 -0.15 12.58 1.01 -1.25 -2.40 120.40 131.46 2vja s VAL 194 Ca 0.45 0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.44 2vja s VAL 194 Cb 0.31 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 2vja s VAL 194 CO -0.11 0.43 -0.10 -0.89 0.00 0.00 0.00 175.10 174.42 2vja s THR 195 N 0.59 3.23 -0.12 3.92 2.01 -0.30 0.49 115.64 125.45 2vja s THR 195 Ca 0.05 -0.59 -0.05 0.00 0.31 0.00 0.00 61.69 61.41 2vja s THR 195 Cb -0.13 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.96 2vja s THR 195 CO 0.01 0.50 0.08 0.27 -0.69 0.00 0.00 174.62 174.79 2vja s ILE 196 N 0.59 4.99 -0.02 1.82 -4.36 -0.98 0.10 121.20 123.34 2vja s ILE 196 Ca -0.06 0.02 -0.09 0.00 -0.26 0.00 0.00 60.65 60.26 2vja s ILE 196 Cb -0.15 -3.17 0.01 0.00 1.25 0.00 0.00 42.46 40.40 2vja s ILE 196 CO 0.03 0.59 0.19 0.72 0.24 0.00 0.00 174.94 176.70 2vja s PHE 197 N -0.73 -0.07 0.20 1.37 -0.71 0.71 -1.27 117.98 117.47 2vja s PHE 197 Ca 0.12 0.13 -0.23 0.00 -1.04 0.00 0.00 56.93 55.92 2vja s PHE 197 Cb -0.12 0.01 0.05 0.00 -1.21 0.00 0.00 43.02 41.76 2vja s PHE 197 CO 0.03 -0.26 0.67 0.20 -1.34 0.00 0.00 175.22 174.51 2vja s GLY 198 N -0.96 -0.41 0.09 1.99 0.00 -1.14 -0.35 107.32 106.54 2vja s GLY 198 Ca -0.10 0.20 0.09 0.00 0.00 0.00 0.00 44.72 44.91 2vja s GLY 198 CO 0.02 0.07 -0.22 1.85 0.00 0.00 0.00 173.10 174.81 2vja s GLU 199 N -3.78 1.73 5.26 2.90 -6.30 -1.23 -1.28 118.70 116.00 2vja s GLU 199 Ca 0.05 -1.18 0.00 0.00 -2.50 0.00 0.00 54.97 51.35 2vja s GLU 199 Cb -0.03 -2.04 0.00 0.00 0.00 0.00 0.00 34.13 32.06 2vja s GLU 199 CO -0.05 0.49 0.00 0.45 0.02 0.00 0.00 175.26 176.17 2vja n SER 200 N 1.17 0.00 0.30 -1.70 2.88 0.12 0.83 113.62 117.23 2vja n SER 200 Ca -0.17 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.54 2vja n SER 200 Cb 0.53 0.00 0.91 0.00 -0.75 0.00 0.00 64.21 64.90 2vja n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2vja h ALA 201 N -0.72 1.25 -0.14 -1.46 0.00 -1.87 -0.05 119.26 116.28 2vja h ALA 201 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 2vja h ALA 201 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2vja h ALA 201 CO 0.00 0.05 -0.58 0.78 0.00 0.00 0.00 179.25 179.51 2vja h GLY 202 N 0.49 0.48 1.30 0.00 0.00 0.37 -0.81 103.07 104.90 2vja h GLY 202 Ca -0.00 -0.57 -0.21 0.00 0.00 0.00 0.00 47.33 46.55 2vja h GLY 202 CO 0.01 0.51 -0.73 -1.33 0.00 0.00 0.00 176.54 175.00 2vja h GLY 203 N 1.20 0.76 1.20 4.60 0.00 -0.86 -2.02 103.07 107.95 2vja h GLY 203 Ca 0.00 -1.05 -0.05 0.00 0.00 0.00 0.00 47.33 46.23 2vja h GLY 203 CO 0.10 0.93 0.19 0.00 0.00 0.00 0.00 176.54 177.77 2vja h ALA 204 N 0.69 1.11 0.07 3.60 0.00 -1.14 -1.15 119.26 122.43 2vja h ALA 204 Ca -0.04 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2vja h ALA 204 Cb 1.34 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2vja h ALA 204 CO 0.15 0.61 -0.03 0.77 0.00 0.00 0.00 179.25 180.74 2vja h SER 205 N 0.97 -0.08 -0.59 0.00 0.02 -0.99 0.11 113.55 112.98 2vja h SER 205 Ca 0.21 -0.09 0.11 0.00 -0.84 0.00 0.00 61.79 61.18 2vja h SER 205 Cb 0.29 0.02 -0.09 0.00 0.14 0.00 0.00 62.40 62.76 2vja h SER 205 CO -0.01 0.04 0.11 0.58 -1.14 0.00 0.00 176.83 176.41 2vja h VAL 206 N -0.19 0.63 -0.87 2.27 2.07 -1.16 0.66 116.25 119.67 2vja h VAL 206 Ca -0.01 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.42 2vja h VAL 206 Cb 0.16 0.37 -0.04 0.00 -1.52 0.00 0.00 31.29 30.26 2vja h VAL 206 CO 0.02 0.04 0.51 1.23 0.02 0.00 0.00 177.57 179.39 2vja h GLY 207 N 0.24 1.26 2.00 2.17 0.00 -0.76 -2.19 103.07 105.78 2vja h GLY 207 Ca 0.31 -0.54 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 2vja h GLY 207 CO -0.41 0.52 -0.33 -0.33 0.00 0.00 0.00 176.54 175.99 2vja h MET 208 N 1.19 0.00 0.00 4.80 2.86 0.13 -2.17 114.93 121.75 2vja h MET 208 Ca 0.31 -0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.82 2vja h MET 208 Cb -0.03 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 2vja h MET 208 CO -0.06 0.34 -0.62 0.45 1.06 0.00 0.00 176.91 178.08 2vja h HIS 209 N 0.00 0.00 -0.03 -0.22 3.86 -0.54 0.87 115.15 119.09 2vja h HIS 209 Ca -0.00 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.12 2vja h HIS 209 Cb 0.59 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.05 2vja h HIS 209 CO 0.00 0.62 -0.40 0.82 0.86 0.00 0.00 177.93 179.83 2vja h ILE 210 N 0.00 1.30 0.07 2.45 2.04 -0.81 -3.23 117.51 119.32 2vja h ILE 210 Ca -0.01 -1.41 -0.17 0.00 1.00 0.00 0.00 64.86 64.27 2vja h ILE 210 Cb 1.21 1.72 -0.00 0.00 -0.74 0.00 0.00 36.82 39.00 2vja h ILE 210 CO 0.08 0.41 -0.85 -0.07 0.00 0.00 0.00 178.15 177.72 2vja h LEU 211 N 0.06 0.23 -9.43 1.44 3.38 -0.98 0.96 115.31 110.97 2vja h LEU 211 Ca 0.00 -0.86 -0.54 0.00 0.09 0.00 0.00 57.88 56.58 2vja h LEU 211 Cb 0.73 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 41.42 2vja h LEU 211 CO 0.05 1.37 0.94 -0.55 0.09 0.00 0.00 178.44 180.34 2vja s SER 212 N -6.76 6.69 0.22 -0.43 0.15 0.25 -4.65 113.70 109.17 2vja s SER 212 Ca -0.20 2.36 -0.07 0.00 0.70 0.00 0.00 55.95 58.74 2vja s SER 212 Cb 0.02 -2.56 0.30 0.00 -1.71 0.00 0.00 66.02 62.07 2vja s SER 212 CO 0.73 -0.83 1.81 -0.65 1.20 0.00 0.00 173.24 175.50 2vja h PRO 213 N 8.10 0.70 0.00 5.44 0.11 -1.86 -2.02 132.00 142.47 2vja h PRO 213 Ca -0.41 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2vja h PRO 213 Cb 1.19 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2vja h PRO 213 CO 0.92 0.46 0.00 0.41 -0.21 0.00 0.00 178.00 179.58 2vja n GLY 214 N -1.30 -0.76 0.03 -0.55 0.00 -1.26 -2.97 105.19 98.39 2vja n GLY 214 Ca 0.10 -0.03 -0.00 0.00 0.00 0.00 0.00 46.02 46.09 2vja n GLY 214 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vja n SER 215 N -1.48 2.35 -0.33 1.61 7.64 -0.79 -4.75 113.62 117.87 2vja n SER 215 Ca 0.02 0.00 0.19 0.00 1.01 0.00 0.00 58.87 60.09 2vja n SER 215 Cb 0.09 1.10 0.40 0.00 -1.01 0.00 0.00 64.21 64.78 2vja n SER 215 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2vja h ARG 216 N 0.00 0.43 -0.05 1.43 3.08 -1.37 -1.22 114.38 116.68 2vja h ARG 216 Ca -0.17 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.86 2vja h ARG 216 Cb 1.17 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.12 2vja h ARG 216 CO 0.01 0.28 0.00 -0.25 -1.07 0.00 0.00 179.97 178.94 2vja n ASP 217 N -4.99 0.57 -1.13 7.04 8.00 -1.26 -3.78 116.55 120.99 2vja n ASP 217 Ca 0.27 -1.46 0.11 0.00 0.71 0.00 0.00 54.79 54.43 2vja n ASP 217 Cb 0.81 -0.03 0.27 0.00 -0.02 0.00 0.00 41.12 42.15 2vja n ASP 217 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2vja n LEU 218 N -0.43 3.33 -3.46 0.64 4.77 -0.46 -4.96 117.00 116.43 2vja n LEU 218 Ca 0.16 -1.56 -0.12 0.00 -0.03 0.00 0.00 56.01 54.46 2vja n LEU 218 Cb 0.16 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 2vja n LEU 218 CO 0.12 0.78 0.38 0.72 -1.33 0.00 0.00 177.39 178.06 2vja s PHE 219 N -1.33 -0.51 -0.20 -1.77 -0.71 -1.25 -4.86 117.98 107.35 2vja s PHE 219 Ca 0.41 0.37 -0.17 0.00 -1.04 0.00 0.00 56.93 56.50 2vja s PHE 219 Cb 0.22 0.51 -0.13 0.00 -1.21 0.00 0.00 43.02 42.41 2vja s PHE 219 CO 0.30 -0.80 -0.02 -2.13 -1.34 0.00 0.00 175.22 171.23 2vja n ARG 220 N -0.21 0.54 -4.30 1.99 3.00 0.18 -4.92 116.66 112.93 2vja n ARG 220 Ca -0.17 0.49 -0.16 0.00 -0.00 0.00 0.00 57.85 58.01 2vja n ARG 220 Cb 0.64 -1.67 -0.10 0.00 0.00 0.00 0.00 32.46 31.33 2vja n ARG 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2vja s ARG 221 N -2.39 1.37 0.03 -0.14 0.52 -1.04 -4.67 118.95 112.62 2vja s ARG 221 Ca -0.27 -1.73 0.01 0.00 -0.52 0.00 0.00 55.73 53.22 2vja s ARG 221 Cb 0.06 -0.19 -0.02 0.00 0.52 0.00 0.00 34.95 35.32 2vja s ARG 221 CO 0.47 -0.30 -0.05 0.00 0.02 0.00 0.00 175.30 175.44 2vja s ALA 222 N -3.81 0.32 -0.08 2.13 0.00 -1.17 -2.33 121.76 116.82 2vja s ALA 222 Ca 0.37 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.65 2vja s ALA 222 Cb 0.08 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.33 2vja s ALA 222 CO 0.13 -0.12 -0.10 0.42 0.00 0.00 0.00 175.76 176.10 2vja s ILE 223 N -1.56 1.04 -0.21 0.00 1.01 -0.40 -2.40 121.20 118.68 2vja s ILE 223 Ca -0.12 -0.37 -0.01 0.00 0.00 0.00 0.00 60.65 60.15 2vja s ILE 223 Cb -0.09 -1.00 0.02 0.00 0.01 0.00 0.00 42.46 41.40 2vja s ILE 223 CO -0.01 0.35 -0.12 -0.76 0.00 0.00 0.00 174.94 174.40 2vja s LEU 224 N 1.10 2.64 -0.32 2.97 1.02 -0.68 -2.89 118.68 122.52 2vja s LEU 224 Ca -0.06 -0.66 -0.06 0.00 0.02 0.00 0.00 54.13 53.36 2vja s LEU 224 Cb -0.14 -1.60 0.03 0.00 0.02 0.00 0.00 46.19 44.50 2vja s LEU 224 CO -0.01 -0.04 0.09 -1.10 0.02 0.00 0.00 176.35 175.30 2vja s GLN 225 N 1.34 2.78 -1.40 1.70 -0.21 -0.40 -2.40 119.66 121.07 2vja s GLN 225 Ca 0.03 -1.07 -0.04 0.00 0.02 0.00 0.00 55.36 54.30 2vja s GLN 225 Cb -0.14 -3.42 0.03 0.00 1.00 0.00 0.00 33.01 30.48 2vja s GLN 225 CO -0.08 -0.58 0.74 0.43 -2.12 0.00 0.00 175.29 173.67 2vja n SER 226 N 4.83 -2.10 -3.65 5.90 7.64 -0.41 -0.70 113.62 125.13 2vja n SER 226 Ca -0.13 -0.84 -0.02 0.00 1.01 0.00 0.00 58.87 58.88 2vja n SER 226 Cb 0.46 -3.81 -0.06 0.00 -1.01 0.00 0.00 64.21 59.79 2vja n SER 226 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2vja s GLY 227 N -4.04 0.29 0.06 0.23 0.00 -1.26 -3.01 107.32 99.59 2vja s GLY 227 Ca 0.21 3.35 -0.08 0.00 0.00 0.00 0.00 44.72 48.20 2vja s GLY 227 CO 0.83 1.68 0.15 -1.35 0.00 0.00 0.00 173.10 174.42 2vja s SER 228 N -0.31 0.13 0.44 1.64 1.04 -1.26 -3.93 113.70 111.46 2vja s SER 228 Ca 0.08 -0.55 0.17 0.00 0.48 0.00 0.00 55.95 56.14 2vja s SER 228 Cb -0.04 0.28 1.11 0.00 0.10 0.00 0.00 66.02 67.48 2vja s SER 228 CO -0.14 -0.60 1.93 1.55 0.98 0.00 0.00 173.24 176.96 2vja h PRO 229 N 3.26 0.34 -0.07 4.02 0.13 -1.80 -2.54 132.00 135.34 2vja h PRO 229 Ca -0.33 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2vja h PRO 229 Cb 1.19 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2vja h PRO 229 CO 0.53 0.22 0.00 0.27 -0.23 0.00 0.00 178.00 178.79 2vja n ASN 230 N -4.46 0.84 -4.64 1.44 6.94 -1.26 -4.74 115.26 109.38 2vja n ASN 230 Ca 0.14 -1.52 -0.40 0.00 -0.02 0.00 0.00 54.58 52.78 2vja n ASN 230 Cb 0.55 -0.04 0.02 0.00 -2.36 0.00 0.00 39.78 37.95 2vja n ASN 230 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2vja h PRO 232 N 1.38 0.00 0.00 0.00 0.13 -1.84 -2.33 132.00 129.34 2vja h PRO 232 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2vja h PRO 232 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2vja h PRO 232 CO 0.56 0.02 -0.98 -2.67 -0.23 0.00 0.00 178.00 174.70 2vja n TRP 233 N -3.28 0.02 0.88 1.56 4.27 -1.26 -4.49 117.44 115.14 2vja n TRP 233 Ca -0.02 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.72 2vja n TRP 233 Cb 0.15 -0.09 0.55 0.00 -1.36 0.00 0.00 31.31 30.56 2vja n TRP 233 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2vja n ALA 234 N -1.56 2.24 -3.54 -1.67 0.00 -0.88 -4.64 120.51 110.46 2vja n ALA 234 Ca 0.04 -0.08 -0.10 0.00 0.00 0.00 0.00 53.44 53.30 2vja n ALA 234 Cb 0.35 -1.44 -0.02 0.00 0.00 0.00 0.00 19.45 18.34 2vja n ALA 234 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2vja s SER 235 N -3.24 -0.43 0.09 0.00 1.04 -1.26 -3.88 113.70 106.02 2vja s SER 235 Ca 0.13 -0.13 -0.02 0.00 0.48 0.00 0.00 55.95 56.40 2vja s SER 235 Cb 0.17 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.81 2vja s SER 235 CO 0.51 -0.93 0.04 0.68 0.98 0.00 0.00 173.24 174.52 2vja s VAL 236 N -3.57 0.16 0.73 5.02 -7.23 -0.57 -4.98 120.40 109.95 2vja s VAL 236 Ca 0.05 -1.76 -0.11 0.00 -1.81 0.00 0.00 61.98 58.35 2vja s VAL 236 Cb -0.02 -1.71 0.03 0.00 0.56 0.00 0.00 36.38 35.24 2vja s VAL 236 CO -0.08 -0.73 1.07 -0.94 -0.31 0.00 0.00 175.10 174.11 2vja s SER 237 N -2.96 5.11 0.39 4.85 1.04 -1.26 -2.02 113.70 118.85 2vja s SER 237 Ca 0.14 1.50 0.07 0.00 0.48 0.00 0.00 55.95 58.13 2vja s SER 237 Cb 0.07 -2.33 0.81 0.00 0.10 0.00 0.00 66.02 64.67 2vja s SER 237 CO -0.05 -1.60 2.02 -0.37 0.98 0.00 0.00 173.24 174.22 2vja h VAL 238 N -0.83 1.08 -0.34 5.02 -1.51 -1.95 -0.01 116.25 117.71 2vja h VAL 238 Ca -0.45 -0.22 -0.02 0.00 -1.23 0.00 0.00 66.70 64.78 2vja h VAL 238 Cb 1.23 0.39 -0.02 0.00 -2.13 0.00 0.00 31.29 30.76 2vja h VAL 238 CO 0.58 0.12 0.14 0.00 -1.23 0.00 0.00 177.57 177.17 2vja h ALA 239 N 1.69 0.44 -0.20 5.19 0.00 -1.95 -0.86 119.26 123.57 2vja h ALA 239 Ca 0.21 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.84 2vja h ALA 239 Cb 0.05 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 2vja h ALA 239 CO -0.05 0.04 -0.51 1.49 0.00 0.00 0.00 179.25 180.22 2vja h GLU 240 N 0.41 0.54 -0.58 0.00 4.57 -1.76 -1.76 114.58 116.01 2vja h GLU 240 Ca 0.11 -0.32 -0.04 0.00 -1.18 0.00 0.00 59.36 57.93 2vja h GLU 240 Cb 0.18 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2vja h GLU 240 CO -0.01 0.92 0.21 0.78 -1.18 0.00 0.00 179.01 179.73 2vja h GLY 241 N 1.08 0.94 1.06 1.92 0.00 -0.84 -1.64 103.07 105.59 2vja h GLY 241 Ca 0.02 -0.53 -0.10 0.00 0.00 0.00 0.00 47.33 46.71 2vja h GLY 241 CO 0.10 0.50 -0.06 -0.09 0.00 0.00 0.00 176.54 176.98 2vja h ARG 242 N 0.80 0.97 -0.34 4.80 2.43 -1.00 -1.18 114.38 120.86 2vja h ARG 242 Ca 0.19 -0.34 0.01 0.00 -0.81 0.00 0.00 59.98 59.03 2vja h ARG 242 Cb 0.24 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2vja h ARG 242 CO -0.01 1.01 0.20 -0.09 -1.51 0.00 0.00 179.97 179.57 2vja h ARG 243 N 0.84 0.39 -0.60 0.20 2.43 -1.06 0.11 114.38 116.69 2vja h ARG 243 Ca 0.14 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.20 2vja h ARG 243 Cb 0.62 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.05 2vja h ARG 243 CO 0.04 0.26 0.05 0.00 -1.51 0.00 0.00 179.97 178.81 2vja h ARG 244 N 0.40 1.01 0.07 0.20 3.08 -1.21 0.27 114.38 118.20 2vja h ARG 244 Ca 0.13 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 2vja h ARG 244 Cb -0.00 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 29.94 2vja h ARG 244 CO -0.06 0.96 -0.03 0.00 -1.07 0.00 0.00 179.97 179.76 2vja h ALA 245 N 1.11 -0.09 -0.84 0.04 0.00 -0.64 0.16 119.26 119.01 2vja h ALA 245 Ca 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2vja h ALA 245 Cb 0.48 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 2vja h ALA 245 CO 0.02 -0.54 0.43 0.28 0.00 0.00 0.00 179.25 179.43 2vja h VAL 246 N -0.11 1.25 0.00 0.00 2.07 -0.60 -1.64 116.25 117.22 2vja h VAL 246 Ca -0.01 -0.67 -0.06 0.00 0.82 0.00 0.00 66.70 66.78 2vja h VAL 246 Cb 0.09 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.00 2vja h VAL 246 CO 0.02 0.30 -0.26 -0.08 0.02 0.00 0.00 177.57 177.56 2vja h GLU 247 N 1.18 0.00 -0.34 1.57 4.57 -0.49 -0.99 114.58 120.08 2vja h GLU 247 Ca 0.29 0.00 -0.11 0.00 -1.18 0.00 0.00 59.36 58.37 2vja h GLU 247 Cb 0.08 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 2vja h GLU 247 CO -0.04 0.26 -0.20 1.25 -1.18 0.00 0.00 179.01 179.11 2vja h LEU 248 N 0.00 0.77 -0.11 1.64 5.85 0.25 -2.03 115.31 121.69 2vja h LEU 248 Ca -0.00 -0.42 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 2vja h LEU 248 Cb 0.60 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 2vja h LEU 248 CO 0.03 1.02 0.06 1.23 -0.34 0.00 0.00 178.44 180.44 2vja h GLY 249 N 0.52 0.16 0.04 3.75 0.00 -0.87 -2.89 103.07 103.78 2vja h GLY 249 Ca 0.07 -0.07 0.08 0.00 0.00 0.00 0.00 47.33 47.41 2vja h GLY 249 CO 0.06 0.07 -0.18 -0.09 0.00 0.00 0.00 176.54 176.39 2vja h ARG 250 N 0.08 -0.10 -0.63 4.80 2.43 -1.12 0.14 114.38 119.98 2vja h ARG 250 Ca 0.04 0.01 0.18 0.00 -0.81 0.00 0.00 59.98 59.40 2vja h ARG 250 Cb 0.08 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2vja h ARG 250 CO -0.01 -0.07 0.50 -0.91 -1.51 0.00 0.00 179.97 177.98 2vja h ASN 251 N -0.11 0.00 -0.41 -3.80 2.35 -1.18 0.12 115.58 112.55 2vja h ASN 251 Ca 0.20 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.87 2vja h ASN 251 Cb 0.41 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.73 2vja h ASN 251 CO -0.47 0.00 0.05 0.18 -1.65 0.00 0.00 177.43 175.54 2vja n LEU 252 N -4.12 4.60 -3.78 1.61 4.77 0.40 -4.97 117.00 115.50 2vja n LEU 252 Ca 0.12 -3.18 -0.28 0.00 -0.03 0.00 0.00 56.01 52.64 2vja n LEU 252 Cb 0.74 -0.62 0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2vja n LEU 252 CO 0.35 0.79 -0.13 0.59 -1.33 0.00 0.00 177.39 177.66 2vja n ASN 253 N -0.43 -3.09 -4.94 -1.43 3.02 0.41 -4.98 115.26 103.81 2vja n ASN 253 Ca 0.28 -0.99 -0.25 0.00 -0.03 0.00 0.00 54.58 53.59 2vja n ASN 253 Cb 1.06 -3.33 -0.02 0.00 -0.61 0.00 0.00 39.78 36.87 2vja n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vja s ASN 255 N -3.62 6.87 -0.06 0.00 3.84 -1.26 -4.71 114.94 116.00 2vja s ASN 255 Ca 0.37 1.97 0.17 0.00 0.21 0.00 0.00 52.86 55.58 2vja s ASN 255 Cb -0.10 -2.55 0.56 0.00 -0.55 0.00 0.00 41.25 38.62 2vja s ASN 255 CO 0.31 -0.76 1.48 0.18 -2.79 0.00 0.00 177.10 175.52 2vja n LEU 256 N 6.09 3.95 -0.10 3.21 4.77 -1.26 -3.20 117.00 130.46 2vja n LEU 256 Ca 0.14 -2.28 0.03 0.00 -0.03 0.00 0.00 56.01 53.87 2vja n LEU 256 Cb 0.44 -0.45 0.36 0.00 -2.33 0.00 0.00 43.42 41.43 2vja n LEU 256 CO 0.58 0.82 1.20 0.78 -1.33 0.00 0.00 177.39 179.44 2vja h ASN 257 N 3.28 0.63 -5.08 -1.43 2.35 -1.96 -3.46 115.58 109.92 2vja h ASN 257 Ca 0.00 -0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2vja h ASN 257 Cb 1.14 -0.15 -0.08 0.00 0.05 0.00 0.00 38.32 39.27 2vja h ASN 257 CO 0.11 0.45 0.09 -0.94 -1.65 0.00 0.00 177.43 175.49 2vja s SER 258 N -6.48 -0.25 0.11 5.81 1.04 -1.26 -5.05 113.70 107.61 2vja s SER 258 Ca -0.09 -0.57 -0.24 0.00 0.48 0.00 0.00 55.95 55.52 2vja s SER 258 Cb 0.18 0.64 -0.09 0.00 0.10 0.00 0.00 66.02 66.84 2vja s SER 258 CO 0.76 -1.17 1.69 0.44 0.98 0.00 0.00 173.24 175.93 2vja h ASP 259 N 2.12 -0.36 -0.75 7.02 3.32 -1.94 0.60 116.42 126.43 2vja h ASP 259 Ca -0.25 0.05 0.06 0.00 0.02 0.00 0.00 57.03 56.91 2vja h ASP 259 Cb 1.26 0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.90 2vja h ASP 259 CO 0.32 -0.18 0.44 -0.33 -1.72 0.00 0.00 179.24 177.77 2vja h GLU 260 N -0.23 0.78 -0.51 3.56 4.39 -1.98 0.37 114.58 120.97 2vja h GLU 260 Ca 0.03 -0.05 -0.12 0.00 0.34 0.00 0.00 59.36 59.57 2vja h GLU 260 Cb 0.27 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 2vja h GLU 260 CO -0.10 0.52 -0.14 0.93 -1.16 0.00 0.00 179.01 179.06 2vja h GLU 261 N 0.81 1.00 -0.06 2.33 5.08 -1.81 0.33 114.58 122.26 2vja h GLU 261 Ca 0.33 -0.39 -0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2vja h GLU 261 Cb 0.18 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2vja h GLU 261 CO -0.18 1.07 0.02 1.25 -1.00 0.00 0.00 179.01 180.17 2vja h LEU 262 N 0.86 0.09 -0.43 1.33 5.85 -0.17 -2.43 115.31 120.41 2vja h LEU 262 Ca 0.13 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 2vja h LEU 262 Cb 0.71 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.70 2vja h LEU 262 CO 0.05 0.25 0.18 0.40 -0.34 0.00 0.00 178.44 178.98 2vja h ILE 263 N -0.08 1.20 -0.84 4.05 2.04 -0.20 -1.69 117.51 121.98 2vja h ILE 263 Ca 0.02 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.30 2vja h ILE 263 Cb 0.19 0.79 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 2vja h ILE 263 CO -0.00 0.22 0.56 0.45 0.00 0.00 0.00 178.15 179.38 2vja h HIS 264 N 0.55 1.04 -0.04 1.37 3.86 -0.91 0.48 115.15 121.49 2vja h HIS 264 Ca 0.14 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.38 2vja h HIS 264 Cb 0.18 -0.35 -0.00 0.00 1.06 0.00 0.00 27.41 28.30 2vja h HIS 264 CO -0.00 0.63 0.01 0.00 0.86 0.00 0.00 177.93 179.43 2vja h LEU 266 N -0.16 0.00 -0.12 0.00 3.38 -0.78 -1.79 115.31 115.84 2vja h LEU 266 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2vja h LEU 266 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2vja h LEU 266 CO 0.00 0.15 0.00 0.54 0.09 0.00 0.00 178.44 179.22 2vja n ARG 267 N -4.17 0.13 0.08 1.13 1.74 0.11 -3.04 116.66 112.63 2vja n ARG 267 Ca -0.02 0.19 0.11 0.00 -0.77 0.00 0.00 57.85 57.36 2vja n ARG 267 Cb 0.23 -1.67 -0.00 0.00 -1.02 0.00 0.00 32.46 29.99 2vja n ARG 267 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2vja n GLU 268 N -1.89 0.55 -2.43 5.56 -0.58 -0.68 -4.92 120.64 116.25 2vja n GLU 268 Ca 0.05 0.07 -0.34 0.00 -0.42 0.00 0.00 57.16 56.52 2vja n GLU 268 Cb 0.33 -1.75 -0.02 0.00 -0.57 0.00 0.00 31.44 29.42 2vja n GLU 268 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2vja s LYS 269 N -3.35 3.68 0.49 3.49 -0.14 -1.17 -5.02 119.74 117.72 2vja s LYS 269 Ca -0.00 1.34 -0.19 0.00 -1.36 0.00 0.00 55.97 55.76 2vja s LYS 269 Cb 0.11 -2.08 -0.08 0.00 -1.68 0.00 0.00 37.83 34.10 2vja s LYS 269 CO 0.80 -0.53 1.00 0.15 -0.76 0.00 0.00 175.35 176.02 2vja s LYS 270 N -3.41 3.88 0.23 1.68 1.02 -1.26 -4.95 119.74 116.93 2vja s LYS 270 Ca 0.67 1.17 -0.14 0.00 0.02 0.00 0.00 55.97 57.69 2vja s LYS 270 Cb -0.17 -2.12 0.28 0.00 -0.52 0.00 0.00 37.83 35.30 2vja s LYS 270 CO 0.24 -0.34 1.59 -1.35 -0.92 0.00 0.00 175.35 174.57 2vja h PRO 271 N 1.33 -0.04 0.00 -1.68 0.11 -1.96 -0.59 132.00 129.17 2vja h PRO 271 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 2vja h PRO 271 Cb 1.20 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2vja h PRO 271 CO 0.60 -0.03 -0.05 0.37 -0.21 0.00 0.00 178.00 178.68 2vja h GLN 272 N -0.04 0.00 -0.21 1.05 5.75 -1.99 -1.88 115.11 117.80 2vja h GLN 272 Ca 0.35 0.00 -0.15 0.00 -0.15 0.00 0.00 58.65 58.69 2vja h GLN 272 Cb 0.58 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.12 2vja h GLN 272 CO -0.82 0.05 -0.50 0.93 -2.65 0.00 0.00 178.83 175.85 2vja h GLU 273 N 0.00 0.56 0.10 1.69 5.08 -1.47 0.12 114.58 120.66 2vja h GLU 273 Ca -0.00 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.03 2vja h GLU 273 Cb 0.19 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2vja h GLU 273 CO 0.01 0.93 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.83 2vja h LEU 274 N 0.44 -0.12 -1.06 1.33 4.07 -1.32 -3.23 115.31 115.43 2vja h LEU 274 Ca 0.02 -0.37 0.06 0.00 0.08 0.00 0.00 57.88 57.67 2vja h LEU 274 Cb 1.03 0.03 -0.06 0.00 1.08 0.00 0.00 40.66 42.74 2vja h LEU 274 CO 0.09 0.33 0.63 0.40 -1.08 0.00 0.00 178.44 178.81 2vja h ILE 275 N -0.59 1.10 -0.14 1.22 2.04 -1.40 -1.68 117.51 118.07 2vja h ILE 275 Ca -0.01 -0.39 0.04 0.00 1.00 0.00 0.00 64.86 65.49 2vja h ILE 275 Cb 0.48 -0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.40 2vja h ILE 275 CO 0.02 0.21 0.12 0.44 0.00 0.00 0.00 178.15 178.95 2vja h ASP 276 N 1.15 0.00 -0.09 1.72 3.32 -0.98 -2.51 116.42 119.03 2vja h ASP 276 Ca 0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.46 2vja h ASP 276 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2vja h ASP 276 CO -0.15 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.70 2vja n VAL 277 N -4.10 0.32 -0.27 -1.35 0.24 -0.85 -4.76 118.33 107.57 2vja n VAL 277 Ca 0.00 -0.66 0.02 0.00 -2.04 0.00 0.00 64.34 61.66 2vja n VAL 277 Cb 0.24 0.95 0.09 0.00 -1.47 0.00 0.00 33.84 33.66 2vja n VAL 277 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2vja h GLU 278 N 1.53 0.00 0.00 7.34 4.81 -0.86 -0.96 114.58 126.44 2vja h GLU 278 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2vja h GLU 278 Cb 0.44 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.82 2vja h GLU 278 CO 0.00 0.00 0.00 -1.49 -0.73 0.00 0.00 179.01 176.79 2vja h TRP 279 N 0.00 0.00 0.00 0.92 4.06 -1.86 -3.16 115.95 115.92 2vja h TRP 279 Ca 0.37 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.32 2vja h TRP 279 Cb 0.57 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.73 2vja h TRP 279 CO -0.60 0.00 0.00 0.09 -3.56 0.00 0.00 178.44 174.37 2vja n ASN 280 N -2.95 0.42 0.01 -3.49 3.02 -0.37 -2.70 115.26 109.20 2vja n ASN 280 Ca 0.01 0.63 0.13 0.00 -0.03 0.00 0.00 54.58 55.32 2vja n ASN 280 Cb 0.31 -0.71 0.34 0.00 -0.61 0.00 0.00 39.78 39.11 2vja n ASN 280 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 2vja n VAL 281 N -1.99 0.05 -1.80 2.41 0.24 -1.19 -4.89 118.33 111.16 2vja n VAL 281 Ca 0.01 -0.03 -0.41 0.00 -2.04 0.00 0.00 64.34 61.87 2vja n VAL 281 Cb 0.14 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 2vja n VAL 281 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2vja s LEU 282 N -3.16 4.29 0.45 1.34 1.43 -1.10 -4.81 118.68 117.12 2vja s LEU 282 Ca 0.11 3.04 0.25 0.00 -1.03 0.00 0.00 54.13 56.50 2vja s LEU 282 Cb 0.17 -3.71 0.84 0.00 0.03 0.00 0.00 46.19 43.53 2vja s LEU 282 CO 0.65 -0.92 1.79 1.55 0.23 0.00 0.00 176.35 179.65 2vja h PRO 283 N 2.90 0.00 -4.58 1.29 0.13 -1.92 -3.46 132.00 126.36 2vja h PRO 283 Ca -0.51 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.39 2vja h PRO 283 Cb 1.24 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 2vja h PRO 283 CO 0.64 0.18 -0.64 -0.06 -0.23 0.00 0.00 178.00 177.89 2vja s PHE 284 N -3.51 1.08 0.07 1.56 0.08 -1.26 -5.11 117.98 110.88 2vja s PHE 284 Ca 0.02 -1.26 -0.30 0.00 0.12 0.00 0.00 56.93 55.51 2vja s PHE 284 Cb 0.09 -0.58 -0.05 0.00 -0.57 0.00 0.00 43.02 41.91 2vja s PHE 284 CO 0.63 -0.51 0.98 -0.51 -0.10 0.00 0.00 175.22 175.72 2vja s ASP 285 N -3.13 7.42 0.14 1.36 1.01 -1.26 -4.98 116.67 117.23 2vja s ASP 285 Ca 0.31 1.76 -0.17 0.00 0.71 0.00 0.00 52.55 55.16 2vja s ASP 285 Cb 0.07 -2.58 0.06 0.00 1.01 0.00 0.00 42.92 41.48 2vja s ASP 285 CO 0.07 -0.17 0.80 -1.54 0.21 0.00 0.00 175.17 174.54 2vja n SER 286 N 3.27 -1.34 -4.13 0.27 3.41 -1.26 -4.73 113.62 109.12 2vja n SER 286 Ca 0.04 -1.70 -0.13 0.00 -0.26 0.00 0.00 58.87 56.82 2vja n SER 286 Cb 0.50 2.17 -0.11 0.00 -0.26 0.00 0.00 64.21 66.51 2vja n SER 286 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 2vja s ILE 287 N -2.17 0.74 -1.29 -1.33 -4.36 -0.82 -4.82 121.20 107.16 2vja s ILE 287 Ca 0.18 -1.43 -0.08 0.00 -0.26 0.00 0.00 60.65 59.06 2vja s ILE 287 Cb -0.02 -1.08 0.01 0.00 1.25 0.00 0.00 42.46 42.62 2vja s ILE 287 CO 0.04 -0.51 1.12 0.33 0.24 0.00 0.00 174.94 176.16 2vja n PHE 288 N 0.89 -2.71 -3.97 1.37 -0.00 -1.26 -4.81 117.46 106.97 2vja n PHE 288 Ca -0.19 0.97 -0.17 0.00 -0.00 0.00 0.00 57.45 58.06 2vja n PHE 288 Cb 0.57 -4.87 -0.16 0.00 -0.00 0.00 0.00 39.48 35.02 2vja n PHE 288 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2vja s ARG 289 N -6.18 0.35 0.01 -4.13 1.81 -1.26 -4.63 118.95 104.92 2vja s ARG 289 Ca 0.52 0.03 0.07 0.00 -1.72 0.00 0.00 55.73 54.63 2vja s ARG 289 Cb -0.23 -0.48 -0.02 0.00 -0.45 0.00 0.00 34.95 33.77 2vja s ARG 289 CO 0.70 -0.10 -0.20 -0.06 -0.68 0.00 0.00 175.30 174.96 2vja s PHE 290 N 0.86 1.75 0.02 -0.53 0.08 -1.26 -5.07 117.98 113.84 2vja s PHE 290 Ca -0.09 -0.35 -0.11 0.00 0.12 0.00 0.00 56.93 56.50 2vja s PHE 290 Cb -0.12 -1.08 -0.06 0.00 -0.57 0.00 0.00 43.02 41.19 2vja s PHE 290 CO -0.01 0.03 1.17 0.77 -0.10 0.00 0.00 175.22 177.08 2vja h SER 291 N 5.27 -0.41 -3.32 1.36 0.02 -1.91 -3.40 113.55 111.16 2vja h SER 291 Ca -0.40 0.03 -0.73 0.00 -0.84 0.00 0.00 61.79 59.85 2vja h SER 291 Cb 1.15 0.13 -0.27 0.00 0.14 0.00 0.00 62.40 63.56 2vja h SER 291 CO 0.46 -0.22 -0.38 -0.36 -1.14 0.00 0.00 176.83 175.19 2vja s PHE 292 N -3.88 3.33 0.36 3.45 0.08 -1.26 -5.00 117.98 115.05 2vja s PHE 292 Ca -0.06 -1.46 0.04 0.00 0.12 0.00 0.00 56.93 55.57 2vja s PHE 292 Cb 0.01 -3.29 -0.05 0.00 -0.57 0.00 0.00 43.02 39.12 2vja s PHE 292 CO 0.18 -0.91 0.07 0.14 -0.10 0.00 0.00 175.22 174.60 2vja s VAL 293 N 1.48 1.12 0.57 -0.44 -7.23 -1.26 -4.40 120.40 110.23 2vja s VAL 293 Ca 0.04 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.03 2vja s VAL 293 Cb -0.25 -2.68 -0.08 0.00 0.56 0.00 0.00 36.38 33.93 2vja s VAL 293 CO 0.02 0.00 0.59 -2.65 -0.31 0.00 0.00 175.10 172.75 2vja n PRO 294 N -0.79 0.57 -5.29 4.82 -0.02 -1.25 -4.69 135.00 128.35 2vja n PRO 294 Ca -0.04 0.22 -0.31 0.00 -2.02 0.00 0.00 63.50 61.35 2vja n PRO 294 Cb 0.66 -1.76 -0.16 0.00 -0.02 0.00 0.00 33.50 32.22 2vja n PRO 294 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2vja s VAL 295 N -1.68 2.05 -1.03 -1.45 -7.23 -1.26 -1.51 120.40 108.28 2vja s VAL 295 Ca 0.70 -1.09 -0.23 0.00 -1.81 0.00 0.00 61.98 59.54 2vja s VAL 295 Cb -0.44 -1.71 0.03 0.00 0.56 0.00 0.00 36.38 34.82 2vja s VAL 295 CO 0.53 0.58 1.57 -0.63 -0.31 0.00 0.00 175.10 176.84 2vja s ILE 296 N -0.45 3.85 -2.74 -0.62 -1.09 -0.85 -4.78 121.20 114.51 2vja s ILE 296 Ca 0.05 -0.81 0.25 0.00 -2.23 0.00 0.00 60.65 57.92 2vja s ILE 296 Cb -0.11 -4.89 0.34 0.00 -1.58 0.00 0.00 42.46 36.22 2vja s ILE 296 CO 0.01 -1.77 1.43 -0.90 -1.23 0.00 0.00 174.94 172.48 2vja n ASP 297 N 9.79 2.55 0.00 3.58 5.75 -1.26 -4.23 116.55 132.73 2vja n ASP 297 Ca 0.36 -1.84 0.00 0.00 -0.01 0.00 0.00 54.79 53.30 2vja n ASP 297 Cb 0.50 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.55 2vja n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vja n GLY 298 N 1.31 0.60 0.90 6.12 0.00 -0.66 -4.79 105.19 108.67 2vja n GLY 298 Ca 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.18 2vja n GLY 298 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vja n GLU 299 N -1.94 0.02 -0.08 1.61 2.13 -1.26 -4.39 120.64 116.73 2vja n GLU 299 Ca 0.00 0.01 -0.06 0.00 0.66 0.00 0.00 57.16 57.77 2vja n GLU 299 Cb 0.04 -0.21 0.13 0.00 0.27 0.00 0.00 31.44 31.67 2vja n GLU 299 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 2vja h PHE 300 N -0.03 0.81 -3.65 4.31 3.04 -1.91 -3.36 116.94 116.15 2vja h PHE 300 Ca 0.00 -0.16 -0.68 0.00 3.98 0.00 0.00 57.97 61.11 2vja h PHE 300 Cb 0.03 -0.20 -0.36 0.00 2.56 0.00 0.00 35.95 37.98 2vja h PHE 300 CO -0.01 0.84 -0.66 -0.06 -2.02 0.00 0.00 178.31 176.40 2vja s PHE 301 N -4.71 3.52 0.20 0.41 0.08 -1.26 -4.37 117.98 111.85 2vja s PHE 301 Ca -0.09 -2.42 -0.22 0.00 0.12 0.00 0.00 56.93 54.32 2vja s PHE 301 Cb 0.14 -2.74 0.13 0.00 -0.57 0.00 0.00 43.02 39.98 2vja s PHE 301 CO 0.82 -0.91 1.56 -1.35 -0.10 0.00 0.00 175.22 175.24 2vja h PRO 302 N 7.89 -0.10 0.00 0.24 0.11 -1.77 -1.75 132.00 136.63 2vja h PRO 302 Ca -0.13 0.01 -0.20 0.00 0.11 0.00 0.00 66.00 65.79 2vja h PRO 302 Cb 1.04 0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.12 2vja h PRO 302 CO 0.59 -0.06 -0.19 0.25 -0.21 0.00 0.00 178.00 178.37 2vja n THR 303 N -5.42 0.00 -1.60 -1.15 -2.24 -1.26 -4.30 114.28 98.30 2vja n THR 303 Ca 0.06 -0.97 -0.39 0.00 -2.27 0.00 0.00 64.05 60.48 2vja n THR 303 Cb 0.36 0.45 0.04 0.00 -2.10 0.00 0.00 70.33 69.08 2vja n THR 303 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2vja n SER 304 N -2.33 0.73 -0.18 3.42 3.41 -1.26 -4.78 113.62 112.63 2vja n SER 304 Ca 0.02 0.86 -0.02 0.00 -0.26 0.00 0.00 58.87 59.47 2vja n SER 304 Cb 0.24 -1.36 0.08 0.00 -0.26 0.00 0.00 64.21 62.91 2vja n SER 304 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2vja h LEU 305 N 0.76 0.28 -0.01 1.04 3.38 -1.98 -1.96 115.31 116.82 2vja h LEU 305 Ca -0.47 0.05 0.01 0.00 0.09 0.00 0.00 57.88 57.56 2vja h LEU 305 Cb 1.36 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 2vja h LEU 305 CO 0.52 0.18 -0.02 -0.08 0.09 0.00 0.00 178.44 179.14 2vja h GLU 306 N 0.44 -0.02 -0.39 1.13 4.57 -1.99 -1.30 114.58 117.01 2vja h GLU 306 Ca 0.26 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.43 2vja h GLU 306 Cb 0.26 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 2vja h GLU 306 CO -0.23 -0.02 0.21 0.66 -1.18 0.00 0.00 179.01 178.45 2vja h SER 307 N -0.02 0.47 -0.20 1.04 4.64 -1.86 -0.67 113.55 116.95 2vja h SER 307 Ca 0.01 -0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 61.18 2vja h SER 307 Cb 0.04 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 2vja h SER 307 CO -0.03 0.39 -0.28 0.24 -0.87 0.00 0.00 176.83 176.29 2vja h MET 308 N 0.54 0.68 -0.08 4.77 2.86 -0.97 -2.00 114.93 120.74 2vja h MET 308 Ca 0.14 -0.29 -0.13 0.00 -2.06 0.00 0.00 59.70 57.36 2vja h MET 308 Cb 0.03 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.65 2vja h MET 308 CO -0.02 0.89 -0.53 -0.07 1.06 0.00 0.00 176.91 178.24 2vja h LEU 309 N 0.59 0.23 0.06 1.22 3.38 -0.04 -0.54 115.31 120.20 2vja h LEU 309 Ca 0.07 -0.12 -0.28 0.00 0.09 0.00 0.00 57.88 57.65 2vja h LEU 309 Cb 0.78 -0.07 0.02 0.00 0.09 0.00 0.00 40.66 41.48 2vja h LEU 309 CO 0.06 0.72 -1.19 0.78 0.09 0.00 0.00 178.44 178.91 2vja h ASN 310 N 0.17 0.71 1.14 -0.43 2.35 -1.01 -3.22 115.58 115.29 2vja h ASN 310 Ca 0.00 -0.66 0.00 0.00 -0.55 0.00 0.00 56.30 55.09 2vja h ASN 310 Cb 0.98 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2vja h ASN 310 CO 0.08 1.48 0.00 -1.54 -1.65 0.00 0.00 177.43 175.80 2vja n SER 311 N -3.73 0.43 -0.07 5.81 3.41 -0.77 -4.90 113.62 113.80 2vja n SER 311 Ca -0.11 0.55 -0.01 0.00 -0.26 0.00 0.00 58.87 59.04 2vja n SER 311 Cb 0.96 -0.66 -0.00 0.00 -0.26 0.00 0.00 64.21 64.25 2vja n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vja n GLY 312 N 1.13 0.45 3.56 5.00 0.00 -0.90 -4.96 105.19 109.47 2vja n GLY 312 Ca 0.06 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.61 2vja n GLY 312 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vja s ASN 313 N -2.98 6.74 -0.02 1.61 2.47 -0.26 -4.85 114.94 117.66 2vja s ASN 313 Ca 0.00 -2.16 -0.30 0.00 0.42 0.00 0.00 52.86 50.82 2vja s ASN 313 Cb 0.00 -2.55 0.12 0.00 -1.45 0.00 0.00 41.25 37.37 2vja s ASN 313 CO 0.00 -1.23 1.24 0.72 -3.72 0.00 0.00 177.10 174.11 2vja s PHE 314 N 4.14 -0.06 0.22 0.43 -0.12 -1.26 -4.74 117.98 116.59 2vja s PHE 314 Ca 0.49 -0.06 -0.31 0.00 -0.05 0.00 0.00 56.93 57.01 2vja s PHE 314 Cb 0.02 0.55 -0.11 0.00 -0.63 0.00 0.00 43.02 42.85 2vja s PHE 314 CO 0.01 -0.33 1.60 0.21 -0.05 0.00 0.00 175.22 176.66 2vja s LYS 315 N -2.52 4.17 -0.36 1.99 2.20 0.33 -4.97 119.74 120.58 2vja s LYS 315 Ca 0.13 2.48 -0.08 0.00 -0.36 0.00 0.00 55.97 58.14 2vja s LYS 315 Cb 0.04 -3.09 0.04 0.00 -1.51 0.00 0.00 37.83 33.31 2vja s LYS 315 CO -0.03 -0.63 0.16 0.15 -0.36 0.00 0.00 175.35 174.64 2vja s LYS 316 N 0.50 2.66 0.00 4.03 1.02 -1.26 -4.94 119.74 121.75 2vja s LYS 316 Ca 0.68 -1.20 0.00 0.00 0.02 0.00 0.00 55.97 55.47 2vja s LYS 316 Cb -0.46 -3.59 0.00 0.00 -0.52 0.00 0.00 37.83 33.26 2vja s LYS 316 CO 0.38 -0.72 0.00 -2.37 -0.92 0.00 0.00 175.35 171.71 2vja n THR 317 N 4.88 0.00 -4.15 2.17 5.66 -1.26 -4.75 114.28 116.82 2vja n THR 317 Ca -0.12 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.53 2vja n THR 317 Cb 0.45 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.14 2vja n THR 317 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2vja s GLN 318 N 1.85 3.28 0.09 1.09 1.11 -1.26 -0.32 119.66 125.50 2vja s GLN 318 Ca 0.00 -0.30 0.05 0.00 0.01 0.00 0.00 55.36 55.12 2vja s GLN 318 Cb 0.00 -2.99 -0.03 0.00 -1.01 0.00 0.00 33.01 28.98 2vja s GLN 318 CO 0.00 0.67 -0.14 0.96 0.01 0.00 0.00 175.29 176.79 2vja s ILE 319 N -0.76 1.18 -0.10 1.08 -4.36 -0.16 -3.02 121.20 115.06 2vja s ILE 319 Ca 0.12 -1.51 -0.02 0.00 -0.26 0.00 0.00 60.65 58.99 2vja s ILE 319 Cb -0.12 -1.29 0.04 0.00 1.25 0.00 0.00 42.46 42.34 2vja s ILE 319 CO 0.03 -0.34 0.02 -0.22 0.24 0.00 0.00 174.94 174.67 2vja s LEU 320 N -2.10 0.60 0.09 0.37 0.20 -1.01 -1.71 118.68 115.11 2vja s LEU 320 Ca 0.03 -0.22 -0.05 0.00 0.69 0.00 0.00 54.13 54.58 2vja s LEU 320 Cb -0.07 -0.41 -0.02 0.00 -0.43 0.00 0.00 46.19 45.26 2vja s LEU 320 CO 0.02 -0.23 0.10 -1.48 -0.29 0.00 0.00 176.35 174.47 2vja s LEU 321 N 2.00 1.83 0.00 -0.68 2.34 -0.28 -1.69 118.68 122.20 2vja s LEU 321 Ca 0.04 -0.90 -0.16 0.00 0.06 0.00 0.00 54.13 53.17 2vja s LEU 321 Cb -0.13 0.62 0.06 0.00 -0.56 0.00 0.00 46.19 46.17 2vja s LEU 321 CO -0.06 -0.70 0.76 0.61 -1.06 0.00 0.00 176.35 175.90 2vja n GLY 322 N -0.02 0.81 3.23 -3.48 0.00 -1.01 -1.45 105.19 103.28 2vja n GLY 322 Ca -0.12 -1.10 -0.15 0.00 0.00 0.00 0.00 46.02 44.65 2vja n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vja s VAL 323 N -2.20 0.02 0.24 1.61 -7.23 -1.03 -1.29 120.40 110.52 2vja s VAL 323 Ca 0.17 -2.00 0.07 0.00 -1.81 0.00 0.00 61.98 58.41 2vja s VAL 323 Cb -0.02 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.38 2vja s VAL 323 CO 0.04 0.00 0.13 0.20 -0.31 0.00 0.00 175.10 175.17 2vja s ASN 324 N -3.24 5.27 0.22 4.85 0.01 -1.26 -0.47 114.94 120.32 2vja s ASN 324 Ca 0.39 -0.33 -0.08 0.00 -0.71 0.00 0.00 52.86 52.14 2vja s ASN 324 Cb 0.05 -1.27 0.27 0.00 0.41 0.00 0.00 41.25 40.72 2vja s ASN 324 CO 0.18 -0.01 1.84 0.50 -1.51 0.00 0.00 177.10 178.10 2vja h LYS 325 N 1.75 0.85 -2.19 -0.60 3.64 -1.34 -3.33 116.57 115.34 2vja h LYS 325 Ca -0.47 -0.05 -0.60 0.00 -1.27 0.00 0.00 60.65 58.26 2vja h LYS 325 Cb 1.23 -0.19 -0.42 0.00 -0.41 0.00 0.00 32.23 32.44 2vja h LYS 325 CO 0.61 0.56 -0.62 -0.25 -2.27 0.00 0.00 179.45 177.48 2vja n ASP 326 N -4.67 3.69 0.24 4.20 8.00 -0.66 -4.92 116.55 122.42 2vja n ASP 326 Ca 0.10 -3.44 0.07 0.00 0.71 0.00 0.00 54.79 52.23 2vja n ASP 326 Cb 0.15 -0.66 0.56 0.00 -0.02 0.00 0.00 41.12 41.16 2vja n ASP 326 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2vja h GLU 327 N 4.03 0.00 0.00 -1.24 4.39 -1.75 -3.29 114.58 116.72 2vja h GLU 327 Ca 0.19 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.81 2vja h GLU 327 Cb 0.65 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.29 2vja h GLU 327 CO 0.82 0.15 -0.74 0.78 -1.16 0.00 0.00 179.01 178.86 2vja h GLY 328 N 0.51 0.00 0.10 -3.84 0.00 -1.85 -3.40 103.07 94.58 2vja h GLY 328 Ca -0.00 0.00 0.15 0.00 0.00 0.00 0.00 47.33 47.48 2vja h GLY 328 CO 0.02 0.00 0.31 1.48 0.00 0.00 0.00 176.54 178.35 2vja h SER 329 N 0.00 0.28 -0.32 0.19 4.64 -1.80 -2.46 113.55 114.07 2vja h SER 329 Ca -0.04 0.12 0.06 0.00 -0.47 0.00 0.00 61.79 61.45 2vja h SER 329 Cb 1.28 0.10 -0.05 0.00 -0.31 0.00 0.00 62.40 63.42 2vja h SER 329 CO 0.03 0.09 0.00 0.15 -0.87 0.00 0.00 176.83 176.24 2vja h PHE 330 N 0.44 -0.01 0.00 4.77 3.04 -1.83 -1.96 116.94 121.39 2vja h PHE 330 Ca 0.43 0.02 -0.06 0.00 3.98 0.00 0.00 57.97 62.34 2vja h PHE 330 Cb 0.68 0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.23 2vja h PHE 330 CO -0.17 -0.05 -0.31 0.74 -2.02 0.00 0.00 178.31 176.50 2vja h PHE 331 N 0.10 0.00 -0.22 0.41 -1.00 -1.75 -3.09 116.94 111.39 2vja h PHE 331 Ca 0.16 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.82 2vja h PHE 331 Cb 0.21 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.77 2vja h PHE 331 CO -0.23 0.31 -0.33 -0.07 -1.61 0.00 0.00 178.31 176.38 2vja h LEU 332 N 0.00 0.66 -1.32 1.54 3.38 -1.05 -2.27 115.31 116.25 2vja h LEU 332 Ca -0.00 -0.52 0.11 0.00 0.09 0.00 0.00 57.88 57.56 2vja h LEU 332 Cb 0.93 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 2vja h LEU 332 CO 0.04 1.05 0.54 0.25 0.09 0.00 0.00 178.44 180.42 2vja h LEU 333 N 0.29 0.67 0.01 1.67 5.85 -1.29 -0.16 115.31 122.34 2vja h LEU 333 Ca 0.02 0.03 -0.26 0.00 0.84 0.00 0.00 57.88 58.51 2vja h LEU 333 Cb 0.91 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 2vja h LEU 333 CO 0.08 0.38 -1.40 1.88 -0.34 0.00 0.00 178.44 179.03 2vja h TYR 334 N 0.73 0.03 0.00 1.25 -1.99 -1.48 -3.42 116.97 112.08 2vja h TYR 334 Ca 0.40 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 61.11 2vja h TYR 334 Cb 0.54 -0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.27 2vja h TYR 334 CO -0.00 1.03 0.00 0.41 -0.00 0.00 0.00 178.16 179.60 2vja n GLY 335 N 1.48 -0.10 3.45 3.88 0.00 -0.86 -5.06 105.19 107.98 2vja n GLY 335 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 2vja n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vja s ALA 336 N -0.24 2.65 0.44 4.61 0.00 -0.09 -4.92 121.76 124.22 2vja s ALA 336 Ca 0.00 -0.96 -0.25 0.00 0.00 0.00 0.00 51.96 50.75 2vja s ALA 336 Cb 0.00 -1.02 -0.08 0.00 0.00 0.00 0.00 23.12 22.03 2vja s ALA 336 CO 0.00 0.49 1.28 -1.25 0.00 0.00 0.00 175.76 176.29 2vja s PRO 337 N -0.50 3.76 0.00 0.00 0.04 -1.26 -3.32 135.00 133.72 2vja s PRO 337 Ca 0.07 2.09 0.00 0.00 0.04 0.00 0.00 61.00 63.20 2vja s PRO 337 Cb -0.12 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.84 2vja s PRO 337 CO 0.02 -0.64 0.00 0.41 0.04 0.00 0.00 177.00 176.83 2vja n GLY 338 N 0.63 3.02 3.83 0.56 0.00 -1.26 -4.89 105.19 107.08 2vja n GLY 338 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2vja n GLY 338 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vja s PHE 339 N -2.64 3.71 -0.01 1.61 0.08 -1.21 -4.59 117.98 114.93 2vja s PHE 339 Ca 0.00 1.10 -0.15 0.00 0.12 0.00 0.00 56.93 58.00 2vja s PHE 339 Cb 0.00 -2.38 0.02 0.00 -0.57 0.00 0.00 43.02 40.09 2vja s PHE 339 CO 0.00 0.55 0.32 0.45 -0.10 0.00 0.00 175.22 176.44 2vja s SER 340 N -1.32 -0.20 0.41 1.36 0.15 -1.26 -4.93 113.70 107.90 2vja s SER 340 Ca 0.30 0.06 0.22 0.00 0.70 0.00 0.00 55.95 57.24 2vja s SER 340 Cb -0.17 0.33 0.46 0.00 -1.71 0.00 0.00 66.02 64.92 2vja s SER 340 CO 0.17 -0.48 1.64 0.50 1.20 0.00 0.00 173.24 176.27 2vja h LYS 341 N 3.74 0.00 -0.54 5.44 3.64 -1.98 -3.29 116.57 123.57 2vja h LYS 341 Ca -0.30 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 58.90 2vja h LYS 341 Cb 1.18 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.89 2vja h LYS 341 CO 0.41 0.16 0.15 -0.25 -2.27 0.00 0.00 179.45 177.65 2vja n ASP 342 N -3.17 3.83 -3.76 4.20 8.00 -1.26 -4.39 116.55 120.00 2vja n ASP 342 Ca 0.03 -3.37 -0.10 0.00 0.71 0.00 0.00 54.79 52.06 2vja n ASP 342 Cb 0.55 -0.67 -0.05 0.00 -0.02 0.00 0.00 41.12 40.93 2vja n ASP 342 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2vja s SER 343 N -1.72 -0.19 0.63 -2.24 1.04 -1.24 -5.02 113.70 104.97 2vja s SER 343 Ca 0.49 -0.52 0.40 0.00 0.48 0.00 0.00 55.95 56.80 2vja s SER 343 Cb 0.41 0.52 2.10 0.00 0.10 0.00 0.00 66.02 69.15 2vja s SER 343 CO 0.08 -0.97 2.26 -0.33 0.98 0.00 0.00 173.24 175.27 2vja h GLU 344 N 2.32 0.00 -5.44 4.02 5.08 -1.94 -3.44 114.58 115.18 2vja h GLU 344 Ca -0.31 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 57.80 2vja h GLU 344 Cb 1.25 0.00 0.20 0.00 0.50 0.00 0.00 28.75 30.70 2vja h GLU 344 CO 0.42 0.01 -0.85 0.43 -1.00 0.00 0.00 179.01 178.02 2vja n SER 345 N -3.18 -6.47 -4.71 1.42 7.64 -1.26 -4.82 113.62 102.24 2vja n SER 345 Ca -0.02 -0.70 -0.42 0.00 1.01 0.00 0.00 58.87 58.74 2vja n SER 345 Cb 0.13 -5.19 -0.03 0.00 -1.01 0.00 0.00 64.21 58.12 2vja n SER 345 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2vja s LYS 346 N -4.42 4.42 -0.26 1.43 1.02 -1.26 -4.73 119.74 115.94 2vja s LYS 346 Ca 0.44 1.72 -0.13 0.00 0.02 0.00 0.00 55.97 58.02 2vja s LYS 346 Cb -0.06 -3.42 -0.04 0.00 -0.52 0.00 0.00 37.83 33.79 2vja s LYS 346 CO 0.74 -0.29 0.27 0.42 -0.92 0.00 0.00 175.35 175.56 2vja s ILE 347 N 1.39 5.26 1.26 2.17 -1.09 -0.74 -4.95 121.20 124.50 2vja s ILE 347 Ca 0.57 0.38 -0.18 0.00 -2.23 0.00 0.00 60.65 59.19 2vja s ILE 347 Cb -0.27 -3.61 0.31 0.00 -1.58 0.00 0.00 42.46 37.31 2vja s ILE 347 CO 0.27 0.23 1.01 -0.94 -1.23 0.00 0.00 174.94 174.29 2vja s SER 348 N 1.51 0.28 0.11 3.58 1.04 -1.26 -4.35 113.70 114.61 2vja s SER 348 Ca 0.11 1.02 -0.13 0.00 0.48 0.00 0.00 55.95 57.43 2vja s SER 348 Cb -0.15 -1.52 -0.09 0.00 0.10 0.00 0.00 66.02 64.35 2vja s SER 348 CO 0.09 -4.56 1.40 -0.09 0.98 0.00 0.00 173.24 171.05 2vja h ARG 349 N -2.87 0.80 -0.35 4.02 9.65 -1.93 -2.19 114.38 121.50 2vja h ARG 349 Ca -0.51 -0.49 -0.01 0.00 -1.10 0.00 0.00 59.98 57.87 2vja h ARG 349 Cb 1.33 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.94 2vja h ARG 349 CO 0.39 1.12 0.19 1.49 2.80 0.00 0.00 179.97 185.97 2vja h GLU 350 N 0.57 0.50 0.00 0.20 4.81 -1.99 -1.96 114.58 116.70 2vja h GLU 350 Ca 0.02 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.14 2vja h GLU 350 Cb 1.06 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 2vja h GLU 350 CO 0.10 0.42 -0.26 -0.44 -0.73 0.00 0.00 179.01 178.10 2vja h ASP 351 N 0.44 0.00 -0.02 1.04 3.32 -1.90 -1.60 116.42 117.71 2vja h ASP 351 Ca 0.12 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 2vja h ASP 351 Cb 0.07 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.62 2vja h ASP 351 CO -0.02 0.26 0.01 0.15 -1.72 0.00 0.00 179.24 177.92 2vja h PHE 352 N 0.00 0.03 -0.30 4.55 3.57 -0.89 0.13 116.94 124.04 2vja h PHE 352 Ca -0.00 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.56 2vja h PHE 352 Cb 0.48 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.15 2vja h PHE 352 CO 0.00 0.23 -0.11 1.98 -2.23 0.00 0.00 178.31 178.19 2vja h MET 353 N -0.18 -0.04 -0.88 1.11 4.05 -0.88 -0.80 114.93 117.31 2vja h MET 353 Ca 0.01 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.45 2vja h MET 353 Cb 0.22 0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 30.98 2vja h MET 353 CO -0.00 -0.03 0.57 0.77 0.23 0.00 0.00 176.91 178.46 2vja h SER 354 N -0.04 0.97 0.13 1.39 0.02 -1.11 -2.89 113.55 112.01 2vja h SER 354 Ca 0.15 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2vja h SER 354 Cb 0.27 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 2vja h SER 354 CO -0.34 0.68 -0.24 1.23 -1.14 0.00 0.00 176.83 177.02 2vja h GLY 355 N 1.14 -0.44 0.83 -3.77 0.00 0.66 -1.93 103.07 99.55 2vja h GLY 355 Ca 0.34 0.28 0.06 0.00 0.00 0.00 0.00 47.33 48.01 2vja h GLY 355 CO -0.10 -0.21 0.62 -0.39 0.00 0.00 0.00 176.54 176.46 2vja h VAL 356 N -0.44 1.10 -0.76 4.60 -1.51 -1.19 0.42 116.25 118.47 2vja h VAL 356 Ca 0.03 -0.39 0.01 0.00 -1.23 0.00 0.00 66.70 65.12 2vja h VAL 356 Cb 0.46 -0.13 -0.04 0.00 -2.13 0.00 0.00 31.29 29.45 2vja h VAL 356 CO -0.13 0.21 0.50 0.50 -1.23 0.00 0.00 177.57 177.42 2vja h LYS 357 N 1.14 0.99 0.00 5.19 1.63 -1.28 0.26 116.57 124.49 2vja h LYS 357 Ca 0.40 -0.06 -0.07 0.00 -0.85 0.00 0.00 60.65 60.08 2vja h LYS 357 Cb 0.14 -0.22 -0.01 0.00 -0.60 0.00 0.00 32.23 31.53 2vja h LYS 357 CO -0.15 0.66 -0.32 -0.07 -3.45 0.00 0.00 179.45 176.11 2vja h LEU 358 N 1.02 0.00 0.00 5.20 4.07 -0.40 -2.77 115.31 122.43 2vja h LEU 358 Ca 0.28 0.00 -0.23 0.00 0.08 0.00 0.00 57.88 58.01 2vja h LEU 358 Cb -0.11 0.00 -0.04 0.00 1.08 0.00 0.00 40.66 41.60 2vja h LEU 358 CO -0.07 0.32 -1.21 0.28 -1.08 0.00 0.00 178.44 176.68 2vja h SER 359 N 0.00 0.00 -2.12 -0.43 0.02 0.24 -2.18 113.55 109.08 2vja h SER 359 Ca -0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 2vja h SER 359 Cb 0.73 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.87 2vja h SER 359 CO 0.04 0.97 -0.92 0.52 -1.14 0.00 0.00 176.83 176.30 2vja n VAL 360 N -3.23 1.12 0.00 2.27 0.31 -0.04 -4.92 118.33 113.84 2vja n VAL 360 Ca -0.06 -4.88 0.21 0.00 -0.01 0.00 0.00 64.34 59.61 2vja n VAL 360 Cb 0.96 -1.23 0.72 0.00 -0.91 0.00 0.00 33.84 33.38 2vja n VAL 360 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2vja h PRO 361 N 3.38 0.00 0.00 5.55 0.13 -1.68 -1.69 132.00 137.69 2vja h PRO 361 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2vja h PRO 361 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 2vja h PRO 361 CO 0.64 0.00 -0.19 1.12 -0.23 0.00 0.00 178.00 179.34 2vja h HIS 362 N 0.00 0.00 -3.99 1.56 2.07 -1.92 -3.47 115.15 109.40 2vja h HIS 362 Ca 0.26 0.00 -0.48 0.00 -2.85 0.00 0.00 60.37 57.30 2vja h HIS 362 Cb 1.10 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.10 2vja h HIS 362 CO 0.00 0.00 0.40 0.00 -3.07 0.00 0.00 177.93 175.26 2vja s ALA 363 N -3.14 3.03 0.91 6.11 0.00 -0.64 -5.07 121.76 122.97 2vja s ALA 363 Ca 0.09 0.67 -0.02 0.00 0.00 0.00 0.00 51.96 52.70 2vja s ALA 363 Cb 0.12 -3.26 0.02 0.00 0.00 0.00 0.00 23.12 20.00 2vja s ALA 363 CO 0.64 -0.23 0.15 0.27 0.00 0.00 0.00 175.76 176.59 2vja n ASN 364 N -0.29 0.03 0.05 0.00 0.23 -1.26 -4.80 115.26 109.21 2vja n ASN 364 Ca 0.06 -1.07 -0.04 0.00 -0.53 0.00 0.00 54.58 53.01 2vja n ASN 364 Cb 0.50 -0.11 0.19 0.00 -2.08 0.00 0.00 39.78 38.28 2vja n ASN 364 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2vja h ASP 365 N -0.18 0.40 -0.39 0.53 3.32 -1.97 -1.94 116.42 116.19 2vja h ASP 365 Ca -0.05 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.75 2vja h ASP 365 Cb 0.14 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 2vja h ASP 365 CO 0.04 0.74 -0.11 0.25 -1.72 0.00 0.00 179.24 178.43 2vja h LEU 366 N 0.33 0.78 -0.76 1.55 5.85 -1.97 -1.39 115.31 119.71 2vja h LEU 366 Ca 0.04 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 2vja h LEU 366 Cb 0.80 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 2vja h LEU 366 CO 0.06 0.97 0.41 1.23 -0.34 0.00 0.00 178.44 180.78 2vja h GLY 367 N 0.58 1.13 0.98 3.75 0.00 -1.88 -0.51 103.07 107.12 2vja h GLY 367 Ca 0.10 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 2vja h GLY 367 CO 0.04 0.49 0.22 1.41 0.00 0.00 0.00 176.54 178.71 2vja h LEU 368 N 1.04 0.71 -1.10 3.11 3.38 -1.17 -0.19 115.31 121.10 2vja h LEU 368 Ca 0.27 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.08 2vja h LEU 368 Cb 0.04 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 40.56 2vja h LEU 368 CO -0.04 0.67 0.56 0.44 0.09 0.00 0.00 178.44 180.16 2vja h ASP 369 N 0.70 1.03 -0.22 -0.43 3.32 -0.84 0.67 116.42 120.64 2vja h ASP 369 Ca 0.18 -0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 2vja h ASP 369 Cb 0.17 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 2vja h ASP 369 CO -0.02 0.76 0.11 0.00 -1.72 0.00 0.00 179.24 178.37 2vja h ALA 370 N 1.42 0.29 -0.68 3.45 0.00 -0.36 0.11 119.26 123.49 2vja h ALA 370 Ca 0.32 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 55.07 2vja h ALA 370 Cb -0.11 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2vja h ALA 370 CO -0.07 -0.15 0.14 0.28 0.00 0.00 0.00 179.25 179.45 2vja h VAL 371 N 0.23 1.26 0.11 0.00 2.07 -0.59 -1.24 116.25 118.09 2vja h VAL 371 Ca 0.08 -1.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 2vja h VAL 371 Cb 0.12 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 2vja h VAL 371 CO -0.01 0.38 -0.05 0.74 0.02 0.00 0.00 177.57 178.65 2vja h THR 372 N 1.04 0.94 -0.86 2.57 2.02 -0.61 -2.27 112.91 115.74 2vja h THR 372 Ca 0.21 -0.18 -0.01 0.00 0.77 0.00 0.00 66.41 67.20 2vja h THR 372 Cb 0.41 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.83 2vja h THR 372 CO 0.01 0.04 0.50 0.25 0.37 0.00 0.00 175.52 176.69 2vja h LEU 373 N -0.23 1.04 -1.84 2.58 5.85 -0.70 -1.13 115.31 120.87 2vja h LEU 373 Ca -0.02 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 2vja h LEU 373 Cb 0.19 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.95 2vja h LEU 373 CO 0.03 0.81 -0.14 -0.61 -0.34 0.00 0.00 178.44 178.19 2vja h GLN 374 N 1.19 0.00 -0.13 1.25 5.75 -1.02 -3.12 115.11 119.03 2vja h GLN 374 Ca 0.31 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.81 2vja h GLN 374 Cb -0.02 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.53 2vja h GLN 374 CO -0.05 0.14 0.00 0.66 -2.65 0.00 0.00 178.83 176.92 2vja n TYR 375 N -3.98 0.31 -4.44 3.99 4.01 -0.84 -5.00 117.16 111.21 2vja n TYR 375 Ca -0.02 -0.72 -0.33 0.00 -0.16 0.00 0.00 57.90 56.67 2vja n TYR 375 Cb 0.23 -0.13 -0.15 0.00 -0.31 0.00 0.00 39.34 38.97 2vja n TYR 375 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2vja s THR 376 N -1.92 2.59 -0.56 -0.72 2.01 -0.49 -4.83 115.64 111.72 2vja s THR 376 Ca 0.23 -0.79 -0.24 0.00 0.31 0.00 0.00 61.69 61.20 2vja s THR 376 Cb 0.18 -2.09 0.04 0.00 0.01 0.00 0.00 72.50 70.64 2vja s THR 376 CO 0.06 0.51 0.93 -0.62 -0.69 0.00 0.00 174.62 174.82 2vja s ASP 377 N 0.93 6.32 0.00 3.53 2.15 -1.26 -4.90 116.67 123.43 2vja s ASP 377 Ca -0.03 -0.43 0.14 0.00 0.43 0.00 0.00 52.55 52.66 2vja s ASP 377 Cb -0.15 -2.43 0.85 0.00 -0.30 0.00 0.00 42.92 40.89 2vja s ASP 377 CO -0.02 -1.23 1.33 0.79 -0.17 0.00 0.00 175.17 175.86 2vja n TRP 378 N 7.43 0.00 1.23 -5.34 7.02 -1.26 -1.78 117.44 124.73 2vja n TRP 378 Ca 0.01 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.62 2vja n TRP 378 Cb 0.47 0.00 0.29 0.00 -2.42 0.00 0.00 31.31 29.65 2vja n TRP 378 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2vja n MET 379 N -0.83 1.63 -2.54 -0.99 2.81 -1.26 -4.48 117.12 111.46 2vja n MET 379 Ca 0.11 -1.16 -0.04 0.00 -1.81 0.00 0.00 57.70 54.79 2vja n MET 379 Cb 0.05 -1.48 0.07 0.00 -0.71 0.00 0.00 33.22 31.15 2vja n MET 379 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2vja n ASP 380 N 0.33 -1.36 0.27 7.83 2.03 -0.81 -5.02 116.55 119.82 2vja n ASP 380 Ca 0.15 -1.99 0.17 0.00 0.52 0.00 0.00 54.79 53.64 2vja n ASP 380 Cb 0.44 0.83 0.93 0.00 -0.72 0.00 0.00 41.12 42.60 2vja n ASP 380 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 2vja h ASP 381 N 1.31 0.00 -0.36 1.67 2.03 -1.57 -2.42 116.42 117.07 2vja h ASP 381 Ca -0.37 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 2vja h ASP 381 Cb 1.25 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.75 2vja h ASP 381 CO -0.13 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.67 2vja n ASN 382 N -3.63 3.84 -4.60 4.15 3.02 -1.26 -4.82 115.26 111.96 2vja n ASN 382 Ca -0.01 -2.54 -0.42 0.00 -0.03 0.00 0.00 54.58 51.57 2vja n ASN 382 Cb 0.20 -0.60 -0.04 0.00 -0.61 0.00 0.00 39.78 38.73 2vja n ASN 382 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2vja s ASN 383 N -0.51 6.66 0.28 6.41 3.04 -0.91 -4.94 114.94 124.98 2vja s ASN 383 Ca 0.33 0.56 -0.02 0.00 0.04 0.00 0.00 52.86 53.78 2vja s ASN 383 Cb 0.25 -2.45 0.40 0.00 -1.54 0.00 0.00 41.25 37.91 2vja s ASN 383 CO 0.10 -0.82 1.85 1.23 -3.04 0.00 0.00 177.10 176.42 2vja h GLY 384 N 9.97 0.94 1.21 1.21 0.00 -1.89 -1.89 103.07 112.62 2vja h GLY 384 Ca -0.23 -0.51 -0.15 0.00 0.00 0.00 0.00 47.33 46.44 2vja h GLY 384 CO 0.96 0.48 -0.35 -2.22 0.00 0.00 0.00 176.54 175.41 2vja h ILE 385 N 0.86 1.28 0.00 2.60 2.04 -1.90 -1.73 117.51 120.65 2vja h ILE 385 Ca 0.20 -1.52 -0.09 0.00 1.00 0.00 0.00 64.86 64.44 2vja h ILE 385 Cb 0.23 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2vja h ILE 385 CO -0.01 0.51 -0.43 0.11 0.00 0.00 0.00 178.15 178.33 2vja h LYS 386 N 0.72 0.00 0.01 2.37 1.57 -1.90 -1.25 116.57 118.09 2vja h LYS 386 Ca 0.07 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.64 2vja h LYS 386 Cb 0.93 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 2vja h LYS 386 CO 0.09 0.43 -0.92 -0.91 -0.57 0.00 0.00 179.45 177.56 2vja h ASN 387 N 0.00 0.32 0.20 0.86 2.35 -1.20 -0.98 115.58 117.13 2vja h ASN 387 Ca -0.00 -0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 2vja h ASN 387 Cb 0.76 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 39.04 2vja h ASN 387 CO 0.06 1.08 -0.10 -0.09 -1.65 0.00 0.00 177.43 176.73 2vja h ARG 388 N 0.13 -0.26 -0.25 0.81 2.43 -1.08 -1.82 114.38 114.33 2vja h ARG 388 Ca -0.06 0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 2vja h ARG 388 Cb 1.57 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 31.16 2vja h ARG 388 CO 0.15 0.08 -0.00 -0.44 -1.51 0.00 0.00 179.97 178.25 2vja h ASP 389 N -0.65 0.34 -0.13 -3.80 3.32 -1.30 -0.40 116.42 113.80 2vja h ASP 389 Ca -0.03 -0.05 -0.02 0.00 0.02 0.00 0.00 57.03 56.95 2vja h ASP 389 Cb 0.46 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.92 2vja h ASP 389 CO 0.05 0.40 0.01 1.23 -1.72 0.00 0.00 179.24 179.21 2vja h GLY 390 N 0.68 0.24 1.46 2.75 0.00 -1.10 -0.83 103.07 106.27 2vja h GLY 390 Ca 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2vja h GLY 390 CO 0.01 0.16 0.28 -2.00 0.00 0.00 0.00 176.54 174.98 2vja h LEU 391 N -0.03 0.63 -0.70 3.11 5.85 -0.99 0.59 115.31 123.77 2vja h LEU 391 Ca 0.04 -0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 2vja h LEU 391 Cb 0.33 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 2vja h LEU 391 CO 0.00 0.51 0.18 -0.78 -0.34 0.00 0.00 178.44 178.02 2vja h ASP 392 N 0.72 1.05 0.01 1.25 3.58 -0.68 -2.12 116.42 120.22 2vja h ASP 392 Ca 0.18 -0.23 -0.23 0.00 0.42 0.00 0.00 57.03 57.18 2vja h ASP 392 Cb 0.02 -0.28 0.01 0.00 1.72 0.00 0.00 39.33 40.81 2vja h ASP 392 CO -0.03 1.01 -0.84 0.44 -2.88 0.00 0.00 179.24 176.93 2vja h ASP 393 N 1.05 0.81 0.32 2.28 3.32 -0.27 -2.80 116.42 121.14 2vja h ASP 393 Ca 0.22 -0.56 0.00 0.00 0.02 0.00 0.00 57.03 56.71 2vja h ASP 393 Cb 0.35 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.64 2vja h ASP 393 CO -0.00 1.35 -0.37 0.40 -1.72 0.00 0.00 179.24 178.91 2vja h ILE 394 N 0.43 0.25 -0.74 0.35 2.04 -0.67 0.56 117.51 119.73 2vja h ILE 394 Ca -0.07 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.85 2vja h ILE 394 Cb 1.47 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 37.74 2vja h ILE 394 CO 0.16 0.00 0.44 0.58 0.00 0.00 0.00 178.15 179.34 2vja h VAL 395 N -0.73 1.02 -0.10 1.67 2.07 -1.48 -1.14 116.25 117.57 2vja h VAL 395 Ca -0.02 -0.28 -0.23 0.00 0.82 0.00 0.00 66.70 67.00 2vja h VAL 395 Cb 0.67 0.13 0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2vja h VAL 395 CO -0.09 0.15 -0.82 1.23 0.02 0.00 0.00 177.57 178.06 2vja h GLY 396 N 0.82 0.81 0.91 2.17 0.00 -1.20 -2.18 103.07 104.40 2vja h GLY 396 Ca 0.32 -1.22 -0.06 0.00 0.00 0.00 0.00 47.33 46.36 2vja h GLY 396 CO -0.16 1.09 -0.04 -0.55 0.00 0.00 0.00 176.54 176.88 2vja h ASP 397 N 0.44 0.61 -0.24 0.19 3.32 0.28 -0.97 116.42 120.05 2vja h ASP 397 Ca -0.07 -0.34 -0.18 0.00 0.02 0.00 0.00 57.03 56.46 2vja h ASP 397 Cb 1.46 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2vja h ASP 397 CO 0.17 0.81 -0.57 -0.74 -1.72 0.00 0.00 179.24 177.18 2vja h HIS 398 N 0.41 1.03 0.00 4.55 2.76 -1.29 -0.46 115.15 122.16 2vja h HIS 398 Ca 0.09 -0.39 -0.18 0.00 -2.20 0.00 0.00 60.37 57.69 2vja h HIS 398 Cb 0.51 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.26 2vja h HIS 398 CO 0.04 1.21 -1.41 -0.91 -1.30 0.00 0.00 177.93 175.57 2vja h ASN 399 N 0.56 0.00 0.00 3.26 2.35 -1.45 -3.41 115.58 116.89 2vja h ASN 399 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2vja h ASN 399 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2vja h ASN 399 CO 0.12 0.62 0.00 0.52 -1.65 0.00 0.00 177.43 177.04 2vja n VAL 400 N -2.92 0.16 0.15 2.81 0.31 -0.54 -4.62 118.33 113.68 2vja n VAL 400 Ca -0.10 0.05 -0.14 0.00 -0.01 0.00 0.00 64.34 64.14 2vja n VAL 400 Cb 0.86 -0.78 -0.07 0.00 -0.91 0.00 0.00 33.84 32.93 2vja n VAL 400 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2vja h ILE 401 N 0.00 0.22 -0.50 2.52 2.04 -1.35 -1.55 117.51 118.90 2vja h ILE 401 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 2vja h ILE 401 Cb 0.00 0.22 -0.02 0.00 -0.74 0.00 0.00 36.82 36.29 2vja h ILE 401 CO 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 178.15 178.08 2vja h PRO 403 N 0.81 0.38 -0.25 0.00 0.11 -1.70 -0.99 132.00 130.36 2vja h PRO 403 Ca 0.14 -0.11 -0.15 0.00 0.11 0.00 0.00 66.00 65.99 2vja h PRO 403 Cb 0.59 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 2vja h PRO 403 CO 0.04 0.54 -0.45 1.25 -0.21 0.00 0.00 178.00 179.16 2vja h LEU 404 N 0.35 0.71 -0.79 2.35 6.46 -0.86 -1.98 115.31 121.54 2vja h LEU 404 Ca 0.06 -0.34 -0.12 0.00 -0.12 0.00 0.00 57.88 57.36 2vja h LEU 404 Cb 0.49 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.21 2vja h LEU 404 CO 0.03 1.06 -0.40 0.24 -0.62 0.00 0.00 178.44 178.75 2vja h MET 405 N 0.52 0.43 -0.64 1.25 2.86 -0.60 0.81 114.93 119.57 2vja h MET 405 Ca 0.03 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.42 2vja h MET 405 Cb 0.99 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.63 2vja h MET 405 CO 0.09 0.76 0.22 1.25 1.06 0.00 0.00 176.91 180.30 2vja h HIS 406 N 0.36 1.01 -0.19 -0.22 -0.00 -1.05 -1.45 115.15 113.60 2vja h HIS 406 Ca 0.03 -0.09 -0.03 0.00 -0.00 0.00 0.00 60.37 60.28 2vja h HIS 406 Cb 0.86 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.96 2vja h HIS 406 CO 0.03 0.81 0.01 0.35 -0.00 0.00 0.00 177.93 179.13 2vja h PHE 407 N 0.91 0.36 -0.92 5.26 3.57 -0.91 -2.11 116.94 123.10 2vja h PHE 407 Ca 0.21 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 2vja h PHE 407 Cb 0.26 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 2vja h PHE 407 CO 0.02 0.51 0.53 -0.24 -2.23 0.00 0.00 178.31 176.90 2vja h VAL 408 N 0.10 1.26 -0.27 1.41 3.04 -0.68 0.13 116.25 121.25 2vja h VAL 408 Ca 0.06 -0.61 -0.16 0.00 -1.01 0.00 0.00 66.70 64.97 2vja h VAL 408 Cb 0.36 -0.01 -0.01 0.00 -2.01 0.00 0.00 31.29 29.62 2vja h VAL 408 CO 0.01 0.28 -0.49 0.78 -1.01 0.00 0.00 177.57 177.14 2vja h ASN 409 N 1.28 0.79 -0.31 3.17 2.35 -1.24 -1.88 115.58 119.74 2vja h ASN 409 Ca 0.33 -0.40 -0.14 0.00 -0.55 0.00 0.00 56.30 55.54 2vja h ASN 409 Cb -0.01 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.13 2vja h ASN 409 CO -0.06 1.15 -0.35 0.11 -1.65 0.00 0.00 177.43 176.63 2vja h LYS 410 N 0.57 0.79 -0.19 0.81 1.79 -1.00 -3.28 116.57 116.07 2vja h LYS 410 Ca 0.03 -0.43 -0.02 0.00 -2.18 0.00 0.00 60.65 58.05 2vja h LYS 410 Cb 1.05 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.72 2vja h LYS 410 CO 0.10 1.06 0.04 -0.92 -1.08 0.00 0.00 179.45 178.65 2vja h TYR 411 N 0.56 0.32 -0.58 -1.35 3.20 -0.74 -3.12 116.97 115.26 2vja h TYR 411 Ca 0.05 -0.04 0.17 0.00 3.14 0.00 0.00 58.73 62.04 2vja h TYR 411 Cb 0.93 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.09 2vja h TYR 411 CO 0.07 0.44 0.54 1.15 -1.64 0.00 0.00 178.16 178.72 2vja h THR 412 N 0.10 0.42 0.00 1.81 2.02 -1.40 0.41 112.91 116.28 2vja h THR 412 Ca 0.06 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.18 2vja h THR 412 Cb 0.29 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.28 2vja h THR 412 CO 0.00 0.00 -0.27 0.11 0.37 0.00 0.00 175.52 175.73 2vja h LYS 413 N 0.00 0.00 0.00 6.66 1.57 -1.62 -3.30 116.57 119.88 2vja h LYS 413 Ca 0.28 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 2vja h LYS 413 Cb 1.35 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.65 2vja h LYS 413 CO -0.00 0.27 -1.20 1.19 -0.57 0.00 0.00 179.45 179.14 2vja n PHE 414 N -4.08 0.00 -0.36 -1.35 3.72 -0.20 -5.07 117.46 110.13 2vja n PHE 414 Ca -0.02 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.11 2vja n PHE 414 Cb 0.33 -0.12 0.25 0.00 -0.94 0.00 0.00 39.48 39.00 2vja n PHE 414 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vja n GLY 415 N 2.45 -3.25 0.13 1.37 0.00 0.13 -4.82 105.19 101.19 2vja n GLY 415 Ca -0.02 -1.36 0.10 0.00 0.00 0.00 0.00 46.02 44.73 2vja n GLY 415 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2vja n ASN 416 N -4.27 2.31 0.00 1.61 4.05 0.56 -4.87 115.26 114.65 2vja n ASN 416 Ca 0.10 -3.17 0.00 0.00 0.45 0.00 0.00 54.58 51.96 2vja n ASN 416 Cb 0.52 -0.44 0.00 0.00 1.23 0.00 0.00 39.78 41.09 2vja n ASN 416 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2vja n GLY 417 N -1.40 2.49 3.36 8.20 0.00 -1.22 -4.65 105.19 111.97 2vja n GLY 417 Ca 0.16 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.91 2vja n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vja s THR 418 N 0.00 2.79 -0.15 2.61 2.01 -1.26 -0.99 115.64 120.65 2vja s THR 418 Ca 0.00 -0.78 -0.00 0.00 0.31 0.00 0.00 61.69 61.22 2vja s THR 418 Cb 0.00 -2.12 0.03 0.00 0.01 0.00 0.00 72.50 70.42 2vja s THR 418 CO 0.00 0.55 -0.09 -0.31 -0.69 0.00 0.00 174.62 174.08 2vja s TYR 419 N 0.02 1.84 -0.07 4.92 1.51 -0.70 0.51 117.35 125.38 2vja s TYR 419 Ca -0.06 -1.08 0.01 0.00 -1.01 0.00 0.00 57.07 54.94 2vja s TYR 419 Cb -0.15 -1.40 -0.03 0.00 -0.11 0.00 0.00 41.96 40.28 2vja s TYR 419 CO 0.05 -0.61 -0.08 -1.17 -1.11 0.00 0.00 175.55 172.62 2vja s LEU 420 N 1.59 3.11 0.13 -1.29 2.96 -1.26 -1.12 118.68 122.81 2vja s LEU 420 Ca 0.03 -0.05 0.05 0.00 -0.22 0.00 0.00 54.13 53.93 2vja s LEU 420 Cb -0.14 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.83 2vja s LEU 420 CO -0.09 0.35 -0.11 -0.72 -1.32 0.00 0.00 176.35 174.46 2vja s TYR 421 N -0.71 1.24 -0.30 5.38 -0.85 -0.53 -2.47 117.35 119.11 2vja s TYR 421 Ca 0.11 -0.70 -0.01 0.00 -0.52 0.00 0.00 57.07 55.95 2vja s TYR 421 Cb -0.11 -0.64 0.10 0.00 0.38 0.00 0.00 41.96 41.68 2vja s TYR 421 CO 0.01 0.07 0.09 0.12 -1.52 0.00 0.00 175.55 174.33 2vja s PHE 422 N -2.94 1.80 -0.42 -3.49 5.36 -0.36 -2.47 117.98 115.46 2vja s PHE 422 Ca 0.13 -1.76 -0.27 0.00 -0.96 0.00 0.00 56.93 54.07 2vja s PHE 422 Cb 0.00 -1.74 0.02 0.00 -0.34 0.00 0.00 43.02 40.97 2vja s PHE 422 CO 0.01 -0.86 1.02 0.12 -1.46 0.00 0.00 175.22 174.05 2vja s PHE 423 N 1.59 2.97 -0.28 10.12 5.36 0.38 -1.04 117.98 137.07 2vja s PHE 423 Ca 0.09 0.75 0.17 0.00 -0.96 0.00 0.00 56.93 56.98 2vja s PHE 423 Cb -0.17 -3.99 0.49 0.00 -0.34 0.00 0.00 43.02 39.01 2vja s PHE 423 CO -0.23 -1.02 1.13 0.27 -1.46 0.00 0.00 175.22 173.91 2vja n ASN 424 N 7.23 2.69 -4.61 6.13 6.94 -1.17 -1.27 115.26 131.19 2vja n ASN 424 Ca 0.09 -2.63 -0.35 0.00 -0.02 0.00 0.00 54.58 51.67 2vja n ASN 424 Cb 0.48 -0.44 -0.10 0.00 -2.36 0.00 0.00 39.78 37.36 2vja n ASN 424 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2vja s HIS 425 N -3.70 3.22 -0.46 -2.53 2.46 -1.26 -4.93 115.29 108.09 2vja s HIS 425 Ca 0.35 0.01 -0.22 0.00 0.47 0.00 0.00 55.06 55.67 2vja s HIS 425 Cb 0.36 -2.10 0.03 0.00 -0.13 0.00 0.00 32.58 30.74 2vja s HIS 425 CO -0.01 0.09 0.73 0.50 -2.47 0.00 0.00 174.74 173.58 2vja s ARG 426 N 0.54 3.32 0.30 2.88 6.06 -1.26 -4.82 118.95 125.97 2vja s ARG 426 Ca 0.03 -0.30 -0.28 0.00 -2.50 0.00 0.00 55.73 52.67 2vja s ARG 426 Cb -0.13 -3.97 -0.13 0.00 0.06 0.00 0.00 34.95 30.77 2vja s ARG 426 CO 0.01 -1.13 1.12 0.00 -2.50 0.00 0.00 175.30 172.80 2vja n ALA 427 N 6.58 0.30 0.15 6.12 0.00 -1.26 -4.89 120.51 127.51 2vja n ALA 427 Ca -0.00 0.38 -0.00 0.00 0.00 0.00 0.00 53.44 53.82 2vja n ALA 427 Cb 0.48 -2.10 0.21 0.00 0.00 0.00 0.00 19.45 18.03 2vja n ALA 427 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2vja h SER 428 N 2.29 0.00 -0.61 0.00 4.64 -1.95 -3.18 113.55 114.74 2vja h SER 428 Ca -0.42 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.80 2vja h SER 428 Cb 1.32 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.35 2vja h SER 428 CO 0.62 0.57 0.12 -0.46 -0.87 0.00 0.00 176.83 176.81 2vja n ASN 429 N -3.84 5.04 -4.76 4.97 0.23 -1.26 -5.00 115.26 110.64 2vja n ASN 429 Ca -0.01 -3.10 -0.41 0.00 -0.53 0.00 0.00 54.58 50.52 2vja n ASN 429 Cb 0.58 -0.70 -0.01 0.00 -2.08 0.00 0.00 39.78 37.57 2vja n ASN 429 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2vja s LEU 430 N -2.90 4.35 0.00 -4.53 1.98 -1.20 -4.92 118.68 111.45 2vja s LEU 430 Ca 0.53 2.92 0.24 0.00 -2.89 0.00 0.00 54.13 54.93 2vja s LEU 430 Cb 0.42 -3.65 0.25 0.00 0.66 0.00 0.00 46.19 43.88 2vja s LEU 430 CO 0.14 -0.83 1.24 1.33 -1.89 0.00 0.00 176.35 176.33 2vja n VAL 431 N 1.49 0.00 -2.65 1.68 0.24 -1.26 -4.92 118.33 112.91 2vja n VAL 431 Ca 0.05 -0.04 -0.28 0.00 -2.04 0.00 0.00 64.34 62.03 2vja n VAL 431 Cb 0.39 0.59 -0.01 0.00 -1.47 0.00 0.00 33.84 33.35 2vja n VAL 431 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2vja s TRP 432 N -2.90 3.55 0.82 6.34 0.52 -1.26 -4.96 118.94 121.05 2vja s TRP 432 Ca 0.12 0.88 -0.11 0.00 0.02 0.00 0.00 56.10 57.01 2vja s TRP 432 Cb 0.17 -2.35 0.09 0.00 -1.15 0.00 0.00 33.47 30.24 2vja s TRP 432 CO 0.72 -0.26 1.14 -1.25 0.02 0.00 0.00 176.95 177.32 2vja s PRO 433 N -4.57 1.70 0.33 4.98 0.04 -1.26 -4.94 135.00 131.28 2vja s PRO 433 Ca 0.48 1.45 0.01 0.00 0.04 0.00 0.00 61.00 62.99 2vja s PRO 433 Cb -0.10 -1.81 0.56 0.00 0.04 0.00 0.00 34.50 33.18 2vja s PRO 433 CO 0.42 -2.11 1.95 0.93 0.04 0.00 0.00 177.00 178.24 2vja h GLU 434 N -1.26 0.83 -0.13 4.56 5.08 -1.94 -2.84 114.58 118.88 2vja h GLU 434 Ca -0.44 -0.09 0.04 0.00 -1.00 0.00 0.00 59.36 57.87 2vja h GLU 434 Cb 1.26 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 2vja h GLU 434 CO 0.47 0.62 0.20 0.11 -1.00 0.00 0.00 179.01 179.40 2vja h TRP 435 N 0.83 0.00 0.00 4.33 5.08 -1.90 0.32 115.95 124.62 2vja h TRP 435 Ca 0.21 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.18 2vja h TRP 435 Cb 0.04 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.20 2vja h TRP 435 CO 0.01 0.00 0.00 0.52 -1.28 0.00 0.00 178.44 177.69 2vja h MET 436 N 0.00 0.00 0.00 0.12 2.86 -1.87 -3.49 114.93 112.55 2vja h MET 436 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2vja h MET 436 Cb 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2vja h MET 436 CO -0.00 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.38 2vja n GLY 437 N 0.60 2.79 3.48 8.32 0.00 0.10 -4.10 105.19 116.37 2vja n GLY 437 Ca 0.03 -0.39 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 2vja n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vja s VAL 438 N 0.00 4.41 0.51 1.61 1.01 -1.26 -4.92 120.40 121.75 2vja s VAL 438 Ca 0.00 -1.04 -0.21 0.00 0.00 0.00 0.00 61.98 60.73 2vja s VAL 438 Cb 0.00 -4.83 -0.06 0.00 0.00 0.00 0.00 36.38 31.49 2vja s VAL 438 CO 0.00 -1.61 1.18 -0.63 0.00 0.00 0.00 175.10 174.03 2vja s ILE 439 N 3.65 2.97 0.02 2.22 1.01 -1.26 -1.66 121.20 128.16 2vja s ILE 439 Ca 0.34 0.67 -0.33 0.00 0.00 0.00 0.00 60.65 61.33 2vja s ILE 439 Cb -0.06 -3.31 -0.12 0.00 0.01 0.00 0.00 42.46 38.98 2vja s ILE 439 CO -0.04 -0.06 1.82 1.57 0.00 0.00 0.00 174.94 178.22 2vja n HIS 440 N -0.93 2.39 -0.04 3.97 -0.00 -1.24 -1.42 115.22 117.94 2vja n HIS 440 Ca 0.10 -0.01 0.00 0.00 -0.00 0.00 0.00 57.72 57.81 2vja n HIS 440 Cb 0.49 -2.66 0.00 0.00 -0.00 0.00 0.00 29.99 27.81 2vja n HIS 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2vja n GLY 441 N 4.16 0.75 1.01 1.57 0.00 -1.26 -4.95 105.19 106.47 2vja n GLY 441 Ca 0.20 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.27 2vja n GLY 441 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2vja n TYR 442 N -2.00 0.84 0.04 1.61 4.02 -0.51 -3.07 117.16 118.09 2vja n TYR 442 Ca 0.00 -0.33 0.11 0.00 -0.01 0.00 0.00 57.90 57.67 2vja n TYR 442 Cb 0.00 -0.16 -0.10 0.00 -0.02 0.00 0.00 39.34 39.05 2vja n TYR 442 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2vja n GLU 443 N 0.52 0.63 -0.06 -0.72 0.00 -1.26 -4.30 120.64 115.45 2vja n GLU 443 Ca 0.14 -0.07 -0.07 0.00 0.00 0.00 0.00 57.16 57.16 2vja n GLU 443 Cb 0.56 -1.64 -0.02 0.00 0.00 0.00 0.00 31.44 30.34 2vja n GLU 443 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2vja h ILE 444 N 0.00 0.74 -0.36 3.84 2.04 -1.95 0.12 117.51 121.94 2vja h ILE 444 Ca 0.00 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 2vja h ILE 444 Cb 1.00 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 2vja h ILE 444 CO 0.00 0.00 0.32 1.05 0.00 0.00 0.00 178.15 179.52 2vja h GLU 445 N -0.00 0.00 0.10 2.37 4.11 -1.78 0.25 114.58 119.62 2vja h GLU 445 Ca 0.12 0.00 -0.28 0.00 0.07 0.00 0.00 59.36 59.28 2vja h GLU 445 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2vja h GLU 445 CO -0.26 0.00 -1.31 0.74 0.07 0.00 0.00 179.01 178.24 2vja h PHE 446 N 0.00 0.39 -0.05 2.06 -1.00 -1.08 -2.01 116.94 115.25 2vja h PHE 446 Ca 0.17 -0.28 -0.09 0.00 2.81 0.00 0.00 57.97 60.58 2vja h PHE 446 Cb 0.81 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 40.34 2vja h PHE 446 CO 0.00 1.26 -0.37 0.28 -1.61 0.00 0.00 178.31 177.87 2vja h VAL 447 N 0.06 1.28 -0.57 -0.55 2.07 0.55 -2.97 116.25 116.12 2vja h VAL 447 Ca -0.16 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.02 2vja h VAL 447 Cb 1.96 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 33.39 2vja h VAL 447 CO 0.17 0.39 0.00 0.49 0.02 0.00 0.00 177.57 178.65 2vja n PHE 448 N -4.08 0.96 -1.11 1.57 3.01 -0.21 -4.68 117.46 112.92 2vja n PHE 448 Ca -0.02 -0.43 -0.04 0.00 1.01 0.00 0.00 57.45 57.97 2vja n PHE 448 Cb 0.43 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 39.80 2vja n PHE 448 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vja n GLY 449 N 1.27 0.55 0.41 1.37 0.00 -1.12 -4.18 105.19 103.49 2vja n GLY 449 Ca 0.20 -0.13 0.21 0.00 0.00 0.00 0.00 46.02 46.29 2vja n GLY 449 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vja h LEU 450 N 0.00 0.30 -2.59 0.99 -0.00 -1.65 0.73 115.31 113.10 2vja h LEU 450 Ca -0.08 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 57.83 2vja h LEU 450 Cb 0.66 -0.03 -0.00 0.00 -0.00 0.00 0.00 40.66 41.29 2vja h LEU 450 CO 0.11 0.12 -0.00 -0.65 -0.00 0.00 0.00 178.44 178.03 2vja h PRO 451 N 0.30 0.00 0.00 1.13 0.11 -1.91 -2.50 132.00 129.13 2vja h PRO 451 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 2vja h PRO 451 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2vja h PRO 451 CO -0.13 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.94 2vja n LEU 452 N -3.09 0.00 -4.47 2.35 4.77 0.25 -4.60 117.00 112.21 2vja n LEU 452 Ca -0.02 0.44 -0.41 0.00 -0.03 0.00 0.00 56.01 55.99 2vja n LEU 452 Cb 0.13 -0.44 -0.11 0.00 -2.33 0.00 0.00 43.42 40.68 2vja n LEU 452 CO 0.22 -0.20 -0.13 0.54 -1.33 0.00 0.00 177.39 176.49 2vja s VAL 453 N -2.88 5.03 0.20 4.08 0.11 -0.95 -4.99 120.40 121.01 2vja s VAL 453 Ca 0.10 -0.47 -0.21 0.00 -2.93 0.00 0.00 61.98 58.47 2vja s VAL 453 Cb 0.11 -3.67 0.15 0.00 -1.53 0.00 0.00 36.38 31.43 2vja s VAL 453 CO 0.28 -0.11 1.56 0.11 -3.33 0.00 0.00 175.10 173.61 2vja h LYS 454 N 8.49 -0.05 0.00 1.54 1.79 -1.89 -0.53 116.57 125.93 2vja h LYS 454 Ca -0.29 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.18 2vja h LYS 454 Cb 1.14 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.80 2vja h LYS 454 CO 0.66 -0.03 0.24 0.39 -1.08 0.00 0.00 179.45 179.63 2vja n GLU 455 N -5.42 0.09 0.00 3.15 4.71 -1.26 -0.11 120.64 121.80 2vja n GLU 455 Ca 0.07 0.55 0.14 0.00 -0.01 0.00 0.00 57.16 57.90 2vja n GLU 455 Cb 0.36 -2.02 0.52 0.00 -1.01 0.00 0.00 31.44 29.29 2vja n GLU 455 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2vja n LEU 456 N -1.99 0.57 -3.64 -4.62 4.77 -0.21 -4.97 117.00 106.90 2vja n LEU 456 Ca -0.01 -0.02 -0.21 0.00 -0.03 0.00 0.00 56.01 55.74 2vja n LEU 456 Cb 0.26 -0.20 0.04 0.00 -2.33 0.00 0.00 43.42 41.19 2vja n LEU 456 CO 0.06 0.11 -0.04 0.59 -1.33 0.00 0.00 177.39 176.77 2vja n ASN 457 N -0.98 -1.83 -4.95 -1.43 3.02 0.85 -4.99 115.26 104.95 2vja n ASN 457 Ca 0.12 -0.81 -0.24 0.00 -0.03 0.00 0.00 54.58 53.63 2vja n ASN 457 Cb 0.30 -4.19 -0.02 0.00 -0.61 0.00 0.00 39.78 35.26 2vja n ASN 457 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2vja s TYR 458 N -3.61 3.48 0.71 3.10 1.51 -1.26 -4.71 117.35 116.56 2vja s TYR 458 Ca 0.06 0.25 -0.11 0.00 -1.01 0.00 0.00 57.07 56.26 2vja s TYR 458 Cb -0.01 -1.80 0.01 0.00 -0.11 0.00 0.00 41.96 40.05 2vja s TYR 458 CO 0.80 0.27 1.06 0.95 -1.11 0.00 0.00 175.55 177.53 2vja s THR 459 N -2.11 3.91 0.40 -0.71 -4.23 -1.26 -4.88 115.64 106.76 2vja s THR 459 Ca 0.38 0.62 0.09 0.00 -1.18 0.00 0.00 61.69 61.60 2vja s THR 459 Cb -0.10 -3.38 0.20 0.00 1.34 0.00 0.00 72.50 70.56 2vja s THR 459 CO 0.32 -0.81 1.97 0.00 -0.54 0.00 0.00 174.62 175.56 2vja h ALA 460 N -0.75 1.59 -0.11 3.99 0.00 -1.98 -1.41 119.26 120.58 2vja h ALA 460 Ca -0.44 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.22 2vja h ALA 460 Cb 1.22 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2vja h ALA 460 CO 0.58 0.31 -0.41 0.93 0.00 0.00 0.00 179.25 180.66 2vja h GLU 461 N 0.33 0.25 -0.01 0.00 3.07 -1.98 -2.12 114.58 114.12 2vja h GLU 461 Ca 0.08 -0.12 -0.17 0.00 -0.50 0.00 0.00 59.36 58.65 2vja h GLU 461 Cb 0.22 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.11 2vja h GLU 461 CO 0.00 0.62 -0.78 0.93 -1.40 0.00 0.00 179.01 178.39 2vja h GLU 462 N 0.21 0.12 -0.38 2.33 5.08 -1.66 -1.50 114.58 118.79 2vja h GLU 462 Ca 0.02 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 2vja h GLU 462 Cb 0.81 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2vja h GLU 462 CO 0.06 0.84 -0.03 1.49 -1.00 0.00 0.00 179.01 180.37 2vja h GLU 463 N 0.07 0.69 -0.65 2.33 4.81 -1.03 -0.73 114.58 120.07 2vja h GLU 463 Ca -0.02 -0.23 -0.04 0.00 -0.13 0.00 0.00 59.36 58.93 2vja h GLU 463 Cb 1.37 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.66 2vja h GLU 463 CO 0.11 0.81 0.25 0.00 -0.73 0.00 0.00 179.01 179.45 2vja h ALA 464 N 0.86 0.85 -0.53 2.92 0.00 -1.32 -0.82 119.26 121.22 2vja h ALA 464 Ca 0.10 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2vja h ALA 464 Cb 0.51 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 2vja h ALA 464 CO 0.02 0.48 0.31 1.25 0.00 0.00 0.00 179.25 181.31 2vja h LEU 465 N 0.92 0.50 -0.82 0.00 5.85 -0.96 -1.32 115.31 119.48 2vja h LEU 465 Ca 0.22 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.91 2vja h LEU 465 Cb 0.22 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2vja h LEU 465 CO -0.02 0.35 0.36 -1.28 -0.34 0.00 0.00 178.44 177.52 2vja h SER 466 N 0.62 1.11 -0.56 1.25 0.87 -0.72 -1.26 113.55 114.86 2vja h SER 466 Ca 0.22 -0.15 -0.09 0.00 -1.23 0.00 0.00 61.79 60.53 2vja h SER 466 Cb 0.04 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 61.69 2vja h SER 466 CO -0.10 0.95 -0.00 0.03 -0.53 0.00 0.00 176.83 177.18 2vja h ARG 467 N 1.18 1.01 0.00 2.24 3.08 -0.55 -0.00 114.38 121.34 2vja h ARG 467 Ca 0.28 -0.31 -0.11 0.00 0.07 0.00 0.00 59.98 59.91 2vja h ARG 467 Cb 0.17 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 2vja h ARG 467 CO -0.03 0.99 -0.51 0.07 -1.07 0.00 0.00 179.97 179.42 2vja h ARG 468 N 0.93 0.00 -0.09 0.04 0.11 -1.01 -1.91 114.38 112.45 2vja h ARG 468 Ca 0.17 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.16 2vja h ARG 468 Cb 0.54 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.62 2vja h ARG 468 CO 0.03 0.51 -0.29 0.82 0.10 0.00 0.00 179.97 181.15 2vja h ILE 469 N 0.00 1.41 -0.73 0.08 2.04 -0.90 -0.62 117.51 118.79 2vja h ILE 469 Ca -0.01 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.20 2vja h ILE 469 Cb 1.11 2.23 -0.04 0.00 -0.74 0.00 0.00 36.82 39.39 2vja h ILE 469 CO 0.07 0.47 0.41 0.24 0.00 0.00 0.00 178.15 179.35 2vja h MET 470 N -0.12 1.01 -0.16 2.37 2.86 -0.95 -0.61 114.93 119.32 2vja h MET 470 Ca -0.01 -0.10 -0.16 0.00 -2.06 0.00 0.00 59.70 57.37 2vja h MET 470 Cb 0.91 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.36 2vja h MET 470 CO 0.06 0.73 -0.56 1.25 1.06 0.00 0.00 176.91 179.45 2vja h HIS 471 N 1.02 0.60 -0.15 -0.22 -0.00 -1.30 0.77 115.15 115.87 2vja h HIS 471 Ca 0.26 -0.21 -0.01 0.00 -0.00 0.00 0.00 60.37 60.40 2vja h HIS 471 Cb 0.00 -0.11 -0.01 0.00 -0.00 0.00 0.00 27.41 27.29 2vja h HIS 471 CO 0.01 0.93 0.04 1.88 -0.00 0.00 0.00 177.93 180.78 2vja h TYR 472 N 0.37 0.24 0.33 5.26 0.05 -0.50 -0.25 116.97 122.47 2vja h TYR 472 Ca 0.01 -0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.74 2vja h TYR 472 Cb 1.09 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.76 2vja h TYR 472 CO 0.04 0.37 -0.16 -1.49 -1.05 0.00 0.00 178.16 175.87 2vja h TRP 473 N 0.05 -0.41 -0.35 4.88 -0.00 -0.99 -0.99 115.95 118.14 2vja h TRP 473 Ca 0.05 -0.01 -0.01 0.00 -0.00 0.00 0.00 58.89 58.91 2vja h TRP 473 Cb 0.24 0.14 -0.02 0.00 -0.00 0.00 0.00 29.16 29.52 2vja h TRP 473 CO 0.00 -0.25 0.16 0.00 -0.00 0.00 0.00 178.44 178.35 2vja h ALA 474 N 0.23 0.45 -0.73 1.49 0.00 -0.86 -0.11 119.26 119.73 2vja h ALA 474 Ca -0.05 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 2vja h ALA 474 Cb 0.34 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2vja h ALA 474 CO 0.07 0.02 0.32 1.15 0.00 0.00 0.00 179.25 180.81 2vja h THR 475 N 0.43 1.25 -0.35 0.00 2.02 -1.03 -1.40 112.91 113.82 2vja h THR 475 Ca 0.12 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.55 2vja h THR 475 Cb 0.13 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 2vja h THR 475 CO -0.01 0.30 0.18 0.15 0.37 0.00 0.00 175.52 176.50 2vja h PHE 476 N 1.04 0.50 -0.89 3.16 3.57 -0.96 -1.32 116.94 122.05 2vja h PHE 476 Ca 0.25 -0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.78 2vja h PHE 476 Cb 0.17 -0.16 -0.06 0.00 2.79 0.00 0.00 35.95 38.70 2vja h PHE 476 CO 0.01 0.43 0.58 0.00 -2.23 0.00 0.00 178.31 177.10 2vja h ALA 477 N 1.03 1.50 -0.00 2.41 0.00 -0.51 0.61 119.26 124.30 2vja h ALA 477 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2vja h ALA 477 Cb 0.11 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2vja h ALA 477 CO -0.02 0.38 -0.43 0.36 0.00 0.00 0.00 179.25 179.54 2vja n LYS 478 N -4.48 0.09 0.00 0.00 2.85 -0.57 -4.56 118.16 111.49 2vja n LYS 478 Ca 0.13 -0.05 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2vja n LYS 478 Cb 0.17 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.05 2vja n LYS 478 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2vja n THR 479 N -1.41 0.00 -0.51 0.58 -2.24 -0.52 -5.01 114.28 105.17 2vja n THR 479 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2vja n THR 479 Cb 0.34 0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 2vja n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vja n GLY 480 N 0.00 0.75 2.96 3.38 0.00 0.21 -5.03 105.19 107.46 2vja n GLY 480 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 2vja n GLY 480 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vja s ASN 481 N -2.04 0.40 0.00 1.61 3.84 -1.25 -4.94 114.94 112.56 2vja s ASN 481 Ca 0.00 0.50 0.13 0.00 0.21 0.00 0.00 52.86 53.70 2vja s ASN 481 Cb 0.00 0.53 0.61 0.00 -0.55 0.00 0.00 41.25 41.84 2vja s ASN 481 CO 0.00 -0.23 1.36 -0.81 -2.79 0.00 0.00 177.10 174.63 2vja n PRO 482 N 5.21 0.11 -3.77 0.43 -0.04 -1.26 -3.29 135.00 132.38 2vja n PRO 482 Ca -0.08 0.21 -0.37 0.00 -0.04 0.00 0.00 63.50 63.22 2vja n PRO 482 Cb 0.50 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 2vja n PRO 482 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2vja s ASN 483 N -2.75 6.46 -0.10 3.54 0.01 -1.26 -4.50 114.94 116.33 2vja s ASN 483 Ca 0.10 0.54 -0.20 0.00 -0.71 0.00 0.00 52.86 52.59 2vja s ASN 483 Cb 0.08 -2.11 -0.04 0.00 0.41 0.00 0.00 41.25 39.59 2vja s ASN 483 CO 0.21 0.35 0.57 -1.61 -1.51 0.00 0.00 177.10 175.11 2vja s GLU 484 N -0.82 4.37 0.00 -0.60 2.02 -1.26 -5.00 118.70 117.41 2vja s GLU 484 Ca 0.16 0.61 -0.05 0.00 0.02 0.00 0.00 54.97 55.71 2vja s GLU 484 Cb -0.13 -3.45 -0.06 0.00 0.10 0.00 0.00 34.13 30.59 2vja s GLU 484 CO 0.05 0.10 0.61 -2.30 0.02 0.00 0.00 175.26 173.74 2vja n PRO 485 N 3.80 0.00 -0.61 0.39 -0.02 -1.26 -5.14 135.00 132.16 2vja n PRO 485 Ca -0.05 -0.27 -0.24 0.00 -2.02 0.00 0.00 63.50 60.92 2vja n PRO 485 Cb 0.51 -1.47 -0.03 0.00 -0.02 0.00 0.00 33.50 32.49 2vja n PRO 485 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2vja n SER 490 N 4.39 0.33 -4.68 2.55 7.64 -1.26 -5.27 113.62 117.31 2vja n SER 490 Ca 0.08 0.43 -0.37 0.00 1.01 0.00 0.00 58.87 60.01 2vja n SER 490 Cb 0.14 -0.32 -0.08 0.00 -1.01 0.00 0.00 64.21 62.93 2vja n SER 490 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2vja s LYS 491 N 0.82 4.16 -0.44 1.43 1.02 -1.26 -5.03 119.74 120.44 2vja s LYS 491 Ca 0.37 -0.01 -0.28 0.00 0.02 0.00 0.00 55.97 56.06 2vja s LYS 491 Cb -0.52 -3.50 -0.01 0.00 -0.52 0.00 0.00 37.83 33.27 2vja s LYS 491 CO 0.27 0.08 1.72 -0.46 -0.92 0.00 0.00 175.35 176.05 2vja s TRP 492 N 0.97 1.90 0.78 3.18 -0.11 -1.26 -4.96 118.94 119.43 2vja s TRP 492 Ca 0.14 0.67 -0.12 0.00 1.22 0.00 0.00 56.10 58.01 2vja s TRP 492 Cb -0.14 -4.17 0.06 0.00 -1.50 0.00 0.00 33.47 27.73 2vja s TRP 492 CO 0.05 -2.53 1.13 -1.25 -4.62 0.00 0.00 176.95 169.73 2vja s PRO 493 N 5.93 2.05 0.15 5.86 0.04 -1.26 -4.90 135.00 142.87 2vja s PRO 493 Ca 0.71 1.41 -0.29 0.00 0.04 0.00 0.00 61.00 62.87 2vja s PRO 493 Cb -0.17 -1.86 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 2vja s PRO 493 CO 0.29 -1.83 0.91 -1.17 0.04 0.00 0.00 177.00 175.24 2vja s LEU 494 N -5.73 4.56 -0.16 -3.56 2.96 -1.26 -4.72 118.68 110.77 2vja s LEU 494 Ca 0.66 1.79 -0.29 0.00 -0.22 0.00 0.00 54.13 56.07 2vja s LEU 494 Cb -0.21 -3.52 -0.01 0.00 0.50 0.00 0.00 46.19 42.95 2vja s LEU 494 CO 0.52 0.05 1.09 0.12 -1.32 0.00 0.00 176.35 176.81 2vja s PHE 495 N -0.54 3.29 0.22 5.38 2.19 0.18 -4.45 117.98 124.24 2vja s PHE 495 Ca 0.43 1.39 0.11 0.00 0.33 0.00 0.00 56.93 59.19 2vja s PHE 495 Cb -0.24 -3.31 -0.05 0.00 -1.31 0.00 0.00 43.02 38.12 2vja s PHE 495 CO 0.29 -0.73 -0.23 0.95 1.83 0.00 0.00 175.22 177.34 2vja s THR 496 N 2.77 2.35 0.26 0.12 -4.23 -1.26 -4.31 115.64 111.34 2vja s THR 496 Ca 0.49 -2.14 -0.03 0.00 -1.18 0.00 0.00 61.69 58.84 2vja s THR 496 Cb -0.18 -2.16 0.24 0.00 1.34 0.00 0.00 72.50 71.74 2vja s THR 496 CO 0.13 -0.21 1.82 0.74 -0.54 0.00 0.00 174.62 176.56 2vja h THR 497 N 2.94 0.93 0.00 3.99 2.02 -1.95 0.18 112.91 121.02 2vja h THR 497 Ca -0.44 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.43 2vja h THR 497 Cb 1.22 -0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.60 2vja h THR 497 CO 0.52 0.16 0.00 1.17 0.37 0.00 0.00 175.52 177.74 2vja n LYS 498 N -4.69 0.00 0.19 6.66 3.00 -1.26 -4.30 118.16 117.77 2vja n LYS 498 Ca 0.15 0.40 0.14 0.00 -0.00 0.00 0.00 58.31 58.99 2vja n LYS 498 Cb 0.29 -1.14 0.42 0.00 0.00 0.00 0.00 35.03 34.60 2vja n LYS 498 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.40 178.33 2vja h GLU 499 N 0.00 0.00 -6.97 1.64 5.08 -1.97 -3.48 114.58 108.88 2vja h GLU 499 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 2vja h GLU 499 Cb 0.00 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.14 2vja h GLU 499 CO 0.00 0.00 -0.92 1.04 -1.00 0.00 0.00 179.01 178.13 2vja n GLN 500 N -2.76 -0.61 -2.55 2.33 6.02 0.65 -4.50 117.38 115.96 2vja n GLN 500 Ca 0.03 0.05 -0.31 0.00 -0.01 0.00 0.00 57.00 56.76 2vja n GLN 500 Cb 0.40 -2.77 -0.03 0.00 1.02 0.00 0.00 30.24 28.86 2vja n GLN 500 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2vja s LYS 501 N -7.20 3.83 0.17 -1.09 1.02 -1.26 -2.18 119.74 113.02 2vja s LYS 501 Ca 0.22 0.70 -0.18 0.00 0.02 0.00 0.00 55.97 56.74 2vja s LYS 501 Cb -0.13 -2.25 0.04 0.00 -0.52 0.00 0.00 37.83 34.98 2vja s LYS 501 CO 0.92 -0.20 0.50 -0.59 -0.92 0.00 0.00 175.35 175.06 2vja s PHE 502 N -2.58 -0.23 0.24 3.18 -0.12 -0.86 -4.20 117.98 113.41 2vja s PHE 502 Ca 0.55 -0.08 0.12 0.00 -0.05 0.00 0.00 56.93 57.46 2vja s PHE 502 Cb -0.10 0.38 -0.05 0.00 -0.63 0.00 0.00 43.02 42.62 2vja s PHE 502 CO 0.34 -0.84 -0.21 0.96 -0.05 0.00 0.00 175.22 175.43 2vja s ILE 503 N -3.83 2.49 0.36 -4.49 -4.36 -1.03 -0.95 121.20 109.38 2vja s ILE 503 Ca 0.06 -2.20 -0.12 0.00 -0.26 0.00 0.00 60.65 58.13 2vja s ILE 503 Cb -0.00 -2.26 -0.07 0.00 1.25 0.00 0.00 42.46 41.38 2vja s ILE 503 CO -0.08 -0.27 0.73 -1.81 0.24 0.00 0.00 174.94 173.76 2vja s ASP 504 N -3.13 6.61 -0.40 4.36 1.01 -1.03 -1.22 116.67 122.88 2vja s ASP 504 Ca 0.26 1.15 0.02 0.00 0.71 0.00 0.00 52.55 54.69 2vja s ASP 504 Cb -0.06 -2.32 0.12 0.00 1.01 0.00 0.00 42.92 41.66 2vja s ASP 504 CO 0.13 -0.30 0.16 -0.22 0.21 0.00 0.00 175.17 175.16 2vja s LEU 505 N -3.45 3.33 0.00 1.23 2.96 -0.21 -4.59 118.68 117.96 2vja s LEU 505 Ca 0.52 -2.33 0.00 0.00 -0.22 0.00 0.00 54.13 52.10 2vja s LEU 505 Cb -0.10 -1.23 0.00 0.00 0.50 0.00 0.00 46.19 45.35 2vja s LEU 505 CO 0.25 -0.33 0.00 -0.46 -1.32 0.00 0.00 176.35 174.50 2vja n ASN 506 N 3.97 0.00 -0.08 3.68 0.23 -1.26 -3.07 115.26 118.73 2vja n ASN 506 Ca 0.04 -0.57 0.15 0.00 -0.53 0.00 0.00 54.58 53.67 2vja n ASN 506 Cb 0.38 0.00 0.70 0.00 -2.08 0.00 0.00 39.78 38.78 2vja n ASN 506 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2vja n THR 507 N 0.00 0.00 -3.30 5.53 -2.24 -1.26 -4.86 114.28 108.16 2vja n THR 507 Ca 0.00 -0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.51 2vja n THR 507 Cb 0.00 -0.24 -0.00 0.00 -2.10 0.00 0.00 70.33 67.99 2vja n THR 507 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2vja s GLU 508 N -2.40 3.27 0.32 -0.78 2.02 -1.26 -5.04 118.70 114.84 2vja s GLU 508 Ca 0.32 -0.53 -0.28 0.00 0.02 0.00 0.00 54.97 54.50 2vja s GLU 508 Cb 0.20 -2.67 -0.13 0.00 0.10 0.00 0.00 34.13 31.64 2vja s GLU 508 CO 0.45 0.01 1.25 -2.30 0.02 0.00 0.00 175.26 174.68 2vja n PRO 509 N -1.84 1.97 -1.48 0.39 -0.02 -1.26 -4.85 135.00 127.91 2vja n PRO 509 Ca -0.02 0.69 -0.45 0.00 -2.02 0.00 0.00 63.50 61.70 2vja n PRO 509 Cb 0.57 -2.24 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 2vja n PRO 509 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2vja n MET 510 N 0.69 0.65 -4.14 -0.52 0.00 -1.26 -5.00 117.12 107.53 2vja n MET 510 Ca 0.06 0.23 -0.18 0.00 -0.00 0.00 0.00 57.70 57.81 2vja n MET 510 Cb 0.35 -1.43 -0.16 0.00 0.00 0.00 0.00 33.22 31.98 2vja n MET 510 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2vja s LYS 511 N -1.33 0.60 -0.12 2.12 -0.14 -1.26 -5.04 119.74 114.57 2vja s LYS 511 Ca 0.61 -0.12 -0.08 0.00 -1.36 0.00 0.00 55.97 55.03 2vja s LYS 511 Cb -0.77 -0.63 -0.04 0.00 -1.68 0.00 0.00 37.83 34.71 2vja s LYS 511 CO 0.58 -0.01 0.16 0.08 -0.76 0.00 0.00 175.35 175.40 2vja s VAL 512 N 0.51 5.47 0.35 3.17 1.01 -1.26 -2.46 120.40 127.19 2vja s VAL 512 Ca -0.06 0.25 0.04 0.00 0.00 0.00 0.00 61.98 62.21 2vja s VAL 512 Cb -0.10 -3.43 -0.02 0.00 0.00 0.00 0.00 36.38 32.84 2vja s VAL 512 CO -0.00 0.59 0.15 1.41 0.00 0.00 0.00 175.10 177.25 2vja n HIS 513 N 2.18 -0.01 -3.90 5.22 8.25 -0.13 -4.99 115.22 121.85 2vja n HIS 513 Ca -0.19 -2.35 -0.11 0.00 -0.26 0.00 0.00 57.72 54.81 2vja n HIS 513 Cb 0.54 0.04 -0.10 0.00 1.12 0.00 0.00 29.99 31.59 2vja n HIS 513 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2vja s GLN 514 N -3.35 0.41 -0.96 -0.41 -0.21 -1.26 -2.04 119.66 111.84 2vja s GLN 514 Ca 0.21 -0.40 -0.08 0.00 0.02 0.00 0.00 55.36 55.11 2vja s GLN 514 Cb 0.01 0.17 -0.02 0.00 1.00 0.00 0.00 33.01 34.16 2vja s GLN 514 CO 0.15 -0.09 0.78 0.54 -2.12 0.00 0.00 175.29 174.55 2vja n ARG 515 N 1.63 -1.56 -1.68 2.91 1.74 -0.93 -4.84 116.66 113.93 2vja n ARG 515 Ca -0.22 0.91 -0.53 0.00 -0.77 0.00 0.00 57.85 57.24 2vja n ARG 515 Cb 0.56 -4.87 -0.06 0.00 -1.02 0.00 0.00 32.46 27.07 2vja n ARG 515 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2vja n LEU 516 N -3.03 2.88 -4.27 0.55 7.94 -1.26 -2.16 117.00 117.65 2vja n LEU 516 Ca -0.08 0.97 -0.34 0.00 -1.11 0.00 0.00 56.01 55.45 2vja n LEU 516 Cb 0.58 -1.26 -0.09 0.00 0.53 0.00 0.00 43.42 43.19 2vja n LEU 516 CO 0.60 -0.27 -0.33 0.54 -1.11 0.00 0.00 177.39 176.83 2vja n ARG 517 N 6.25 -0.86 -0.30 1.96 1.74 -1.26 -4.84 116.66 119.35 2vja n ARG 517 Ca 0.26 0.10 -0.04 0.00 -0.77 0.00 0.00 57.85 57.40 2vja n ARG 517 Cb 0.22 -3.79 0.10 0.00 -1.02 0.00 0.00 32.46 27.96 2vja n ARG 517 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 2vja h VAL 518 N -1.29 1.25 0.56 1.55 3.04 -1.80 -1.77 116.25 117.79 2vja h VAL 518 Ca -0.60 -0.69 -0.02 0.00 -1.01 0.00 0.00 66.70 64.39 2vja h VAL 518 Cb 1.31 0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 30.73 2vja h VAL 518 CO 0.74 0.30 -0.42 -0.61 -1.01 0.00 0.00 177.57 176.57 2vja h GLN 519 N 1.19 -0.92 -0.69 4.17 5.75 -1.88 0.09 115.11 122.83 2vja h GLN 519 Ca 0.29 0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.81 2vja h GLN 519 Cb 0.09 0.21 -0.03 0.00 1.07 0.00 0.00 27.48 28.82 2vja h GLN 519 CO -0.04 -0.61 0.25 0.52 -2.65 0.00 0.00 178.83 176.30 2vja h MET 520 N -0.95 1.03 0.00 1.69 2.86 -1.95 -2.75 114.93 114.85 2vja h MET 520 Ca -0.06 -0.19 -0.03 0.00 -2.06 0.00 0.00 59.70 57.36 2vja h MET 520 Cb 0.80 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 32.29 2vja h MET 520 CO 0.01 0.86 -0.15 0.00 1.06 0.00 0.00 176.91 178.69 2vja h VAL 522 N 0.00 1.27 0.02 0.00 2.07 -0.68 0.99 116.25 119.93 2vja h VAL 522 Ca -0.00 -1.31 -0.00 0.00 0.82 0.00 0.00 66.70 66.21 2vja h VAL 522 Cb 0.67 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.68 2vja h VAL 522 CO 0.02 0.43 -0.01 0.15 0.02 0.00 0.00 177.57 178.18 2vja h PHE 523 N 0.60 -0.03 -0.00 1.57 3.57 -1.16 -1.40 116.94 120.09 2vja h PHE 523 Ca 0.09 -0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.43 2vja h PHE 523 Cb 0.71 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.44 2vja h PHE 523 CO 0.03 0.25 -0.74 -1.49 -2.23 0.00 0.00 178.31 174.13 2vja h TRP 524 N -0.30 0.06 0.00 0.41 4.06 -1.19 0.46 115.95 119.44 2vja h TRP 524 Ca -0.00 -0.03 -0.18 0.00 2.06 0.00 0.00 58.89 60.73 2vja h TRP 524 Cb 0.29 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 28.41 2vja h TRP 524 CO 0.02 0.77 -1.63 0.09 -3.56 0.00 0.00 178.44 174.13 2vja n ASN 525 N -3.68 0.64 0.02 -3.49 3.02 0.33 -4.42 115.26 107.70 2vja n ASN 525 Ca -0.01 0.28 -0.01 0.00 -0.03 0.00 0.00 54.58 54.81 2vja n ASN 525 Cb 0.72 0.47 -0.00 0.00 -0.61 0.00 0.00 39.78 40.36 2vja n ASN 525 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vja n GLN 526 N -2.81 0.03 0.25 3.52 6.02 -0.56 -4.74 117.38 119.10 2vja n GLN 526 Ca -0.13 0.01 -0.15 0.00 -0.01 0.00 0.00 57.00 56.73 2vja n GLN 526 Cb 0.86 -0.55 -0.08 0.00 1.02 0.00 0.00 30.24 31.50 2vja n GLN 526 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2vja h PHE 527 N -0.05 -0.59 -0.06 1.08 3.57 -1.42 -2.77 116.94 116.70 2vja h PHE 527 Ca -0.01 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.49 2vja h PHE 527 Cb 0.41 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.32 2vja h PHE 527 CO -0.02 -0.27 -0.07 1.25 -2.23 0.00 0.00 178.31 176.97 2vja h LEU 528 N -0.86 -0.21 -0.48 0.59 5.85 -1.17 0.10 115.31 119.14 2vja h LEU 528 Ca -0.06 0.04 0.09 0.00 0.84 0.00 0.00 57.88 58.79 2vja h LEU 528 Cb 0.58 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.63 2vja h LEU 528 CO 0.11 -0.10 -0.04 -0.65 -0.34 0.00 0.00 178.44 177.42 2vja h PRO 529 N -0.09 0.07 -0.94 5.25 0.11 -1.77 0.23 132.00 134.85 2vja h PRO 529 Ca 0.05 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.16 2vja h PRO 529 Cb 0.16 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 31.21 2vja h PRO 529 CO -0.12 0.04 0.62 -0.22 -0.21 0.00 0.00 178.00 178.11 2vja h LYS 530 N 0.07 1.24 -0.55 1.05 3.64 -1.15 -0.66 116.57 120.21 2vja h LYS 530 Ca 0.24 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.44 2vja h LYS 530 Cb 0.36 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2vja h LYS 530 CO -0.43 0.83 -0.05 1.25 -2.27 0.00 0.00 179.45 178.77 2vja h LEU 531 N 1.28 1.00 -0.85 5.20 6.46 0.92 -1.69 115.31 127.63 2vja h LEU 531 Ca 0.34 -0.33 -0.12 0.00 -0.12 0.00 0.00 57.88 57.65 2vja h LEU 531 Cb -0.14 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.51 2vja h LEU 531 CO -0.07 1.09 -0.55 -0.07 -0.62 0.00 0.00 178.44 178.22 2vja h LEU 532 N 0.89 0.07 -0.57 2.25 3.38 -0.20 -1.39 115.31 119.75 2vja h LEU 532 Ca 0.15 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 2vja h LEU 532 Cb 0.61 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2vja h LEU 532 CO 0.04 0.61 -0.71 -1.13 0.09 0.00 0.00 178.44 177.33 2vja h ASN 533 N 0.05 0.00 1.25 -0.43 -1.24 -0.96 -3.19 115.58 111.05 2vja h ASN 533 Ca -0.00 0.00 -0.11 0.00 0.71 0.00 0.00 56.30 56.90 2vja h ASN 533 Cb 0.99 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 40.03 2vja h ASN 533 CO 0.08 0.71 -0.79 0.00 -1.29 0.00 0.00 177.43 176.14 2vja h ALA 534 N 1.29 0.67 0.00 1.57 0.00 -1.09 -3.51 119.26 118.19 2vja h ALA 534 Ca -0.01 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.40 2vja h ALA 534 Cb 1.27 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.10 2vja h ALA 534 CO 0.09 0.62 0.00 0.25 0.00 0.00 0.00 179.25 180.21