#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vjb h GLU 5 N 0.00 0.94 0.00 -1.46 5.08 -2.03 -2.93 114.58 114.19 2vjb h GLU 5 Ca 0.00 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2vjb h GLU 5 Cb 0.00 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.05 2vjb h GLU 5 CO 0.00 0.67 0.00 1.28 -1.00 0.00 0.00 179.01 179.96 2vjb n LEU 6 N -4.54 0.08 -4.25 1.33 4.77 -1.26 -4.60 117.00 108.53 2vjb n LEU 6 Ca 0.06 0.52 -0.39 0.00 -0.03 0.00 0.00 56.01 56.17 2vjb n LEU 6 Cb 0.06 -0.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.54 2vjb n LEU 6 CO 0.37 -0.18 -0.18 -0.22 -1.33 0.00 0.00 177.39 175.85 2vjb s LEU 7 N -3.17 4.81 -0.04 2.23 2.96 -1.11 0.28 118.68 124.64 2vjb s LEU 7 Ca 0.09 -1.42 0.05 0.00 -0.22 0.00 0.00 54.13 52.64 2vjb s LEU 7 Cb 0.13 -1.92 -0.01 0.00 0.50 0.00 0.00 46.19 44.90 2vjb s LEU 7 CO 0.38 -0.45 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.07 2vjb s VAL 8 N 1.38 1.63 -0.26 1.68 1.01 -0.42 -4.85 120.40 120.56 2vjb s VAL 8 Ca 0.02 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 61.07 2vjb s VAL 8 Cb -0.22 -1.38 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 2vjb s VAL 8 CO 0.02 0.46 0.12 0.54 0.00 0.00 0.00 175.10 176.23 2vjb s ASN 9 N -0.16 5.46 0.55 3.32 2.20 -1.26 0.07 114.94 125.12 2vjb s ASN 9 Ca -0.00 -0.16 0.09 0.00 -0.94 0.00 0.00 52.86 51.84 2vjb s ASN 9 Cb -0.11 -2.00 0.07 0.00 -2.00 0.00 0.00 41.25 37.21 2vjb s ASN 9 CO 0.02 -0.05 0.67 0.42 -2.94 0.00 0.00 177.10 175.22 2vjb s THR 10 N 1.66 2.11 0.14 0.54 -4.23 -0.21 -4.95 115.64 110.71 2vjb s THR 10 Ca 0.06 -1.12 0.33 0.00 -1.18 0.00 0.00 61.69 59.78 2vjb s THR 10 Cb -0.16 -2.24 0.35 0.00 1.34 0.00 0.00 72.50 71.80 2vjb s THR 10 CO 0.06 0.00 2.01 0.11 -0.54 0.00 0.00 174.62 176.26 2vjb h LYS 11 N 0.37 0.00 0.00 3.99 6.56 -1.95 -2.44 116.57 123.10 2vjb h LYS 11 Ca -0.32 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.27 2vjb h LYS 11 Cb 1.29 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.95 2vjb h LYS 11 CO 0.45 0.00 -0.98 0.43 -2.06 0.00 0.00 179.45 177.30 2vjb n SER 12 N -2.76 0.89 0.00 0.86 7.64 -1.26 -4.87 113.62 114.12 2vjb n SER 12 Ca -0.01 -0.90 0.00 0.00 1.01 0.00 0.00 58.87 58.97 2vjb n SER 12 Cb 0.15 1.06 0.00 0.00 -1.01 0.00 0.00 64.21 64.40 2vjb n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vjb n GLY 13 N 1.45 1.80 3.82 0.23 0.00 -0.92 -1.13 105.19 110.44 2vjb n GLY 13 Ca 0.03 -1.75 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 2vjb n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vjb s LYS 14 N -1.55 3.81 -0.00 1.61 1.02 -1.25 -1.05 119.74 122.34 2vjb s LYS 14 Ca 0.00 1.14 0.01 0.00 0.02 0.00 0.00 55.97 57.13 2vjb s LYS 14 Cb 0.00 -2.11 -0.00 0.00 -0.52 0.00 0.00 37.83 35.20 2vjb s LYS 14 CO 0.00 -0.39 -0.03 0.08 -0.92 0.00 0.00 175.35 174.09 2vjb s VAL 15 N -2.36 0.24 -0.26 3.17 1.01 0.11 -1.36 120.40 120.96 2vjb s VAL 15 Ca 0.62 -0.12 -0.00 0.00 0.00 0.00 0.00 61.98 62.48 2vjb s VAL 15 Cb -0.13 -0.21 0.04 0.00 0.00 0.00 0.00 36.38 36.08 2vjb s VAL 15 CO 0.27 0.07 -0.07 -0.32 0.00 0.00 0.00 175.10 175.04 2vjb s MET 16 N -0.03 2.60 0.00 2.72 1.75 0.56 -1.30 119.30 125.60 2vjb s MET 16 Ca 0.01 -1.13 0.00 0.00 -1.25 0.00 0.00 55.69 53.32 2vjb s MET 16 Cb -0.02 -2.96 0.00 0.00 2.84 0.00 0.00 34.83 34.69 2vjb s MET 16 CO -0.00 -0.48 0.00 0.41 -0.65 0.00 0.00 175.02 174.30 2vjb n GLY 17 N 4.59 -0.15 3.08 2.11 0.00 0.14 -0.84 105.19 114.12 2vjb n GLY 17 Ca -0.16 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 2vjb n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vjb s THR 18 N 0.06 0.08 -0.26 2.61 -1.32 -0.03 -4.76 115.64 112.02 2vjb s THR 18 Ca 0.00 -0.70 -0.23 0.00 -1.21 0.00 0.00 61.69 59.55 2vjb s THR 18 Cb 0.00 -0.39 -0.01 0.00 -1.51 0.00 0.00 72.50 70.59 2vjb s THR 18 CO 0.00 -0.39 0.75 -0.60 -2.21 0.00 0.00 174.62 172.17 2vjb s ARG 19 N -1.33 4.10 -0.06 7.08 3.52 -1.26 -0.73 118.95 130.28 2vjb s ARG 19 Ca -0.14 0.72 0.03 0.00 -0.13 0.00 0.00 55.73 56.20 2vjb s ARG 19 Cb -0.08 -3.67 -0.03 0.00 -1.56 0.00 0.00 34.95 29.62 2vjb s ARG 19 CO 0.01 -0.52 -0.13 0.14 -0.81 0.00 0.00 175.30 173.99 2vjb s VAL 20 N 2.74 3.16 0.42 7.11 -7.23 0.08 -4.96 120.40 121.72 2vjb s VAL 20 Ca 0.31 -0.68 -0.24 0.00 -1.81 0.00 0.00 61.98 59.56 2vjb s VAL 20 Cb -0.15 -2.25 -0.08 0.00 0.56 0.00 0.00 36.38 34.46 2vjb s VAL 20 CO 0.09 0.59 1.14 -2.16 -0.31 0.00 0.00 175.10 174.45 2vjb s PRO 21 N -0.69 3.96 -0.29 4.82 0.04 -1.26 -1.51 135.00 140.06 2vjb s PRO 21 Ca 0.11 1.73 0.01 0.00 0.04 0.00 0.00 61.00 62.89 2vjb s PRO 21 Cb -0.11 -2.53 0.19 0.00 0.04 0.00 0.00 34.50 32.09 2vjb s PRO 21 CO 0.01 -0.37 0.56 0.54 0.04 0.00 0.00 177.00 177.78 2vjb s VAL 22 N -1.53 -0.94 -1.07 -0.36 0.11 0.81 -4.87 120.40 112.54 2vjb s VAL 22 Ca 0.60 -0.03 -0.15 0.00 -2.93 0.00 0.00 61.98 59.47 2vjb s VAL 22 Cb -0.28 -0.98 -0.02 0.00 -1.53 0.00 0.00 36.38 33.57 2vjb s VAL 22 CO 0.34 -0.03 0.80 0.18 -3.33 0.00 0.00 175.10 173.07 2vjb n LEU 23 N 5.42 -3.66 -0.01 2.54 4.77 -1.26 -1.68 117.00 123.12 2vjb n LEU 23 Ca 0.01 -0.88 -0.00 0.00 -0.03 0.00 0.00 56.01 55.11 2vjb n LEU 23 Cb 0.52 -2.59 -0.00 0.00 -2.33 0.00 0.00 43.42 39.02 2vjb n LEU 23 CO -0.00 0.27 -0.00 -1.20 -1.33 0.00 0.00 177.39 175.13 2vjb n SER 24 N -2.71 -5.22 -0.42 -1.43 7.64 -1.26 -4.91 113.62 105.32 2vjb n SER 24 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.79 2vjb n SER 24 Cb 0.59 -2.73 0.00 0.00 -1.01 0.00 0.00 64.21 61.07 2vjb n SER 24 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2vjb n SER 25 N -0.74 0.23 -3.93 6.43 2.88 -0.68 -5.19 113.62 112.63 2vjb n SER 25 Ca -0.00 -0.37 -0.09 0.00 -1.33 0.00 0.00 58.87 57.08 2vjb n SER 25 Cb 0.37 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.75 2vjb n SER 25 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2vjb s HIS 26 N -1.19 0.24 0.13 0.66 3.76 -1.26 -0.14 115.29 117.50 2vjb s HIS 26 Ca 0.00 -0.66 -0.10 0.00 -0.15 0.00 0.00 55.06 54.15 2vjb s HIS 26 Cb 0.00 -0.15 -0.00 0.00 1.11 0.00 0.00 32.58 33.54 2vjb s HIS 26 CO 0.00 -0.46 0.26 0.96 -0.85 0.00 0.00 174.74 174.65 2vjb s ILE 27 N -3.55 0.10 0.10 0.60 -4.36 -0.57 -4.43 121.20 109.09 2vjb s ILE 27 Ca 0.03 -1.21 -0.14 0.00 -0.26 0.00 0.00 60.65 59.07 2vjb s ILE 27 Cb 0.04 -1.56 -0.06 0.00 1.25 0.00 0.00 42.46 42.12 2vjb s ILE 27 CO -0.09 -0.44 0.50 -0.44 0.24 0.00 0.00 174.94 174.71 2vjb s SER 28 N -2.91 6.81 -0.03 4.36 0.01 -0.39 -0.74 113.70 120.82 2vjb s SER 28 Ca 0.11 1.02 0.01 0.00 1.31 0.00 0.00 55.95 58.40 2vjb s SER 28 Cb 0.04 -2.27 0.02 0.00 0.21 0.00 0.00 66.02 64.02 2vjb s SER 28 CO -0.06 0.17 -0.02 0.00 0.41 0.00 0.00 173.24 173.74 2vjb s ALA 29 N -1.36 0.44 -0.33 1.44 0.00 0.10 -0.78 121.76 121.26 2vjb s ALA 29 Ca 0.34 0.01 0.01 0.00 0.00 0.00 0.00 51.96 52.32 2vjb s ALA 29 Cb -0.16 -0.29 0.09 0.00 0.00 0.00 0.00 23.12 22.76 2vjb s ALA 29 CO 0.18 -0.01 0.05 -0.06 0.00 0.00 0.00 175.76 175.92 2vjb s PHE 30 N 0.69 3.53 -0.10 0.00 0.40 0.11 -0.85 117.98 121.77 2vjb s PHE 30 Ca -0.08 -2.51 -0.02 0.00 -0.60 0.00 0.00 56.93 53.71 2vjb s PHE 30 Cb -0.11 -2.66 -0.03 0.00 0.51 0.00 0.00 43.02 40.73 2vjb s PHE 30 CO -0.01 -0.91 0.00 -0.51 0.70 0.00 0.00 175.22 174.49 2vjb s LEU 31 N 1.07 3.58 -0.68 -0.37 1.43 -0.08 0.28 118.68 123.90 2vjb s LEU 31 Ca 0.03 0.12 -0.03 0.00 -1.03 0.00 0.00 54.13 53.23 2vjb s LEU 31 Cb -0.20 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.19 2vjb s LEU 31 CO -0.05 0.35 0.36 0.61 0.23 0.00 0.00 176.35 177.85 2vjb n GLY 32 N 2.34 0.18 3.71 -3.19 0.00 -1.16 -4.01 105.19 103.05 2vjb n GLY 32 Ca -0.18 -0.33 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 2vjb n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vjb s ILE 33 N -2.92 4.91 0.17 -0.61 1.01 -0.51 -4.78 121.20 118.47 2vjb s ILE 33 Ca 0.18 1.89 -0.30 0.00 0.00 0.00 0.00 60.65 62.42 2vjb s ILE 33 Cb -0.08 -4.24 -0.07 0.00 0.01 0.00 0.00 42.46 38.07 2vjb s ILE 33 CO 0.22 0.17 1.02 -2.16 0.00 0.00 0.00 174.94 174.19 2vjb s PRO 34 N 1.05 4.68 0.00 2.79 0.04 -1.26 -0.40 135.00 141.90 2vjb s PRO 34 Ca 0.48 1.59 0.00 0.00 0.04 0.00 0.00 61.00 63.11 2vjb s PRO 34 Cb -0.20 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.04 2vjb s PRO 34 CO 0.24 0.22 0.33 1.97 0.04 0.00 0.00 177.00 179.80 2vjb n PHE 35 N 2.26 0.00 -3.91 0.56 1.16 -1.11 -4.89 117.46 111.54 2vjb n PHE 35 Ca 0.01 0.00 -0.09 0.00 -1.87 0.00 0.00 57.45 55.50 2vjb n PHE 35 Cb 0.47 0.00 -0.05 0.00 -1.61 0.00 0.00 39.48 38.29 2vjb n PHE 35 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2vjb s ALA 36 N -0.28 -0.40 0.37 1.98 0.00 -1.25 -3.29 121.76 118.89 2vjb s ALA 36 Ca 0.00 -0.67 -0.25 0.00 0.00 0.00 0.00 51.96 51.04 2vjb s ALA 36 Cb 0.00 0.94 -0.09 0.00 0.00 0.00 0.00 23.12 23.97 2vjb s ALA 36 CO 0.00 -0.78 1.01 -1.21 0.00 0.00 0.00 175.76 174.77 2vjb s GLU 37 N -3.96 4.32 -0.13 0.00 0.41 0.77 -4.39 118.70 115.72 2vjb s GLU 37 Ca 0.17 1.42 -0.32 0.00 -0.41 0.00 0.00 54.97 55.83 2vjb s GLU 37 Cb 0.00 -2.61 -0.09 0.00 -1.78 0.00 0.00 34.13 29.65 2vjb s GLU 37 CO 0.03 0.02 2.05 -2.30 -0.49 0.00 0.00 175.26 174.57 2vjb n PRO 38 N 0.11 2.14 -0.90 0.39 -0.02 -1.26 -4.70 135.00 130.76 2vjb n PRO 38 Ca 0.04 0.71 -0.20 0.00 -2.02 0.00 0.00 63.50 62.03 2vjb n PRO 38 Cb 0.50 -2.89 -0.08 0.00 -0.02 0.00 0.00 33.50 31.02 2vjb n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2vjb n PRO 39 N 7.71 2.23 -3.75 0.52 -0.04 -1.26 -4.87 135.00 135.54 2vjb n PRO 39 Ca 0.27 -1.31 -0.20 0.00 -0.04 0.00 0.00 63.50 62.21 2vjb n PRO 39 Cb 0.36 -2.27 -0.02 0.00 -0.04 0.00 0.00 33.50 31.53 2vjb n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2vjb s VAL 40 N 2.16 4.06 0.00 0.52 -7.23 -1.26 -3.35 120.40 115.30 2vjb s VAL 40 Ca 0.53 -1.19 0.00 0.00 -1.81 0.00 0.00 61.98 59.51 2vjb s VAL 40 Cb 0.19 -3.38 0.00 0.00 0.56 0.00 0.00 36.38 33.75 2vjb s VAL 40 CO -0.02 -0.21 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 2vjb n GLY 41 N -1.45 3.67 0.00 2.32 0.00 -1.26 -1.42 105.19 107.05 2vjb n GLY 41 Ca -0.03 0.17 0.14 0.00 0.00 0.00 0.00 46.02 46.30 2vjb n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2vjb n ASN 42 N 9.60 0.00 0.04 1.61 0.23 -1.26 -2.83 115.26 122.65 2vjb n ASN 42 Ca 0.00 -0.84 0.11 0.00 -0.53 0.00 0.00 54.58 53.33 2vjb n ASN 42 Cb 0.00 -0.01 0.04 0.00 -2.08 0.00 0.00 39.78 37.73 2vjb n ASN 42 CO 0.00 0.00 0.00 0.23 -0.93 0.00 0.00 177.26 176.56 2vjb n MET 43 N -1.01 0.31 -1.76 -3.83 2.81 -0.50 -4.84 117.12 108.30 2vjb n MET 43 Ca 0.20 0.01 -0.42 0.00 -1.81 0.00 0.00 57.70 55.69 2vjb n MET 43 Cb 0.10 -1.62 -0.02 0.00 -0.71 0.00 0.00 33.22 30.97 2vjb n MET 43 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 2vjb s ARG 44 N -3.21 4.12 0.00 0.03 3.52 -1.13 -1.20 118.95 121.08 2vjb s ARG 44 Ca 0.04 2.59 0.00 0.00 -0.13 0.00 0.00 55.73 58.22 2vjb s ARG 44 Cb 0.14 -3.04 0.00 0.00 -1.56 0.00 0.00 34.95 30.49 2vjb s ARG 44 CO 0.79 -0.67 0.00 1.19 -0.81 0.00 0.00 175.30 175.80 2vjb n PHE 45 N 2.76 0.00 -2.78 5.12 3.72 -1.26 -4.90 117.46 120.14 2vjb n PHE 45 Ca 0.11 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.20 2vjb n PHE 45 Cb 0.37 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.87 2vjb n PHE 45 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2vjb s ARG 46 N -0.05 3.82 0.62 -1.08 3.52 -0.34 -4.08 118.95 121.35 2vjb s ARG 46 Ca 0.00 0.57 -0.18 0.00 -0.13 0.00 0.00 55.73 55.99 2vjb s ARG 46 Cb 0.00 -2.34 -0.04 0.00 -1.56 0.00 0.00 34.95 31.01 2vjb s ARG 46 CO 0.00 -0.07 1.04 0.54 -0.81 0.00 0.00 175.30 175.99 2vjb n ARG 47 N -1.32 0.91 -1.49 5.12 1.74 -1.26 -4.94 116.66 115.43 2vjb n ARG 47 Ca 0.03 0.36 -0.32 0.00 -0.77 0.00 0.00 57.85 57.15 2vjb n ARG 47 Cb 0.54 -2.25 0.07 0.00 -1.02 0.00 0.00 32.46 29.80 2vjb n ARG 47 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2vjb s PRO 48 N -2.93 2.56 -0.02 5.56 0.04 -1.26 -5.06 135.00 133.88 2vjb s PRO 48 Ca 0.78 1.21 0.05 0.00 0.04 0.00 0.00 61.00 63.08 2vjb s PRO 48 Cb -0.40 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.20 2vjb s PRO 48 CO 0.45 -1.42 -0.17 -2.00 0.04 0.00 0.00 177.00 173.91 2vjb s GLU 49 N -4.63 1.48 0.30 4.56 2.56 -1.26 -5.03 118.70 116.67 2vjb s GLU 49 Ca 0.63 -0.59 -0.29 0.00 0.00 0.00 0.00 54.97 54.72 2vjb s GLU 49 Cb -0.18 -1.37 -0.13 0.00 2.00 0.00 0.00 34.13 34.45 2vjb s GLU 49 CO 0.51 0.31 1.23 -2.30 -0.56 0.00 0.00 175.26 174.45 2vjb n PRO 50 N 2.85 1.87 -1.95 4.30 -0.02 -1.26 -0.16 135.00 140.62 2vjb n PRO 50 Ca -0.16 0.66 -0.42 0.00 -2.02 0.00 0.00 63.50 61.56 2vjb n PRO 50 Cb 0.54 -2.19 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 2vjb n PRO 50 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2vjb s LYS 51 N -1.46 4.21 0.32 -0.52 2.47 -1.21 -4.20 119.74 119.35 2vjb s LYS 51 Ca 0.59 2.32 -0.24 0.00 -1.56 0.00 0.00 55.97 57.08 2vjb s LYS 51 Cb -0.63 -3.48 -0.10 0.00 -1.46 0.00 0.00 37.83 32.17 2vjb s LYS 51 CO 0.59 -0.69 0.91 -1.59 0.16 0.00 0.00 175.35 174.73 2vjb s LYS 52 N 2.21 4.48 0.28 4.03 -2.85 -1.26 -4.90 119.74 121.73 2vjb s LYS 52 Ca 0.72 1.22 -0.26 0.00 -1.00 0.00 0.00 55.97 56.65 2vjb s LYS 52 Cb -0.40 -2.74 -0.15 0.00 -2.06 0.00 0.00 37.83 32.47 2vjb s LYS 52 CO 0.32 0.26 0.57 -2.30 0.10 0.00 0.00 175.35 174.30 2vjb n PRO 53 N 0.44 0.38 -4.51 1.78 -0.02 -1.26 -5.01 135.00 126.80 2vjb n PRO 53 Ca 0.02 0.13 -0.25 0.00 -2.02 0.00 0.00 63.50 61.38 2vjb n PRO 53 Cb 0.51 -1.26 -0.10 0.00 -0.02 0.00 0.00 33.50 32.63 2vjb n PRO 53 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2vjb s TRP 54 N -1.18 2.36 0.28 6.00 -2.14 -0.28 -5.02 118.94 118.96 2vjb s TRP 54 Ca 0.62 -0.42 0.06 0.00 2.66 0.00 0.00 56.10 59.02 2vjb s TRP 54 Cb -0.79 -1.22 -0.02 0.00 -3.10 0.00 0.00 33.47 28.34 2vjb s TRP 54 CO 0.58 0.64 0.39 -1.12 -2.66 0.00 0.00 176.95 174.78 2vjb s SER 55 N -3.57 6.08 0.43 -2.66 0.01 -1.26 -4.59 113.70 108.14 2vjb s SER 55 Ca 0.31 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.49 2vjb s SER 55 Cb -0.01 -1.54 0.00 0.00 0.21 0.00 0.00 66.02 64.68 2vjb s SER 55 CO 0.16 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.20 2vjb n GLY 56 N -1.48 -1.61 3.67 3.44 0.00 -1.26 -4.78 105.19 103.16 2vjb n GLY 56 Ca -0.05 -1.24 -0.36 0.00 0.00 0.00 0.00 46.02 44.37 2vjb n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vjb s VAL 57 N -0.10 5.30 -0.08 1.61 1.01 -1.26 -3.83 120.40 123.04 2vjb s VAL 57 Ca 0.00 0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 2vjb s VAL 57 Cb 0.00 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 2vjb s VAL 57 CO 0.00 0.37 0.98 0.86 0.00 0.00 0.00 175.10 177.31 2vjb s TRP 58 N 0.87 3.55 -0.46 5.22 -0.11 -0.46 -4.86 118.94 122.69 2vjb s TRP 58 Ca 0.07 1.59 -0.29 0.00 1.22 0.00 0.00 56.10 58.69 2vjb s TRP 58 Cb -0.13 -3.15 0.02 0.00 -1.50 0.00 0.00 33.47 28.71 2vjb s TRP 58 CO 0.03 -0.16 1.26 1.21 -4.62 0.00 0.00 176.95 174.66 2vjb s ASN 59 N 1.07 6.49 -0.59 5.86 3.84 -1.26 -0.32 114.94 130.02 2vjb s ASN 59 Ca 0.48 0.57 0.04 0.00 0.21 0.00 0.00 52.86 54.16 2vjb s ASN 59 Cb -0.19 -2.55 0.37 0.00 -0.55 0.00 0.00 41.25 38.34 2vjb s ASN 59 CO 0.20 -1.36 1.19 0.00 -2.79 0.00 0.00 177.10 174.34 2vjb n ALA 60 N 8.32 5.13 0.44 1.71 0.00 -0.02 -4.69 120.51 131.40 2vjb n ALA 60 Ca 0.14 -4.50 0.05 0.00 0.00 0.00 0.00 53.44 49.13 2vjb n ALA 60 Cb 0.49 -0.90 0.04 0.00 0.00 0.00 0.00 19.45 19.08 2vjb n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2vjb n SER 61 N -0.35 1.83 -4.14 0.00 3.41 -1.26 -0.90 113.62 112.22 2vjb n SER 61 Ca 0.38 -1.41 -0.13 0.00 -0.26 0.00 0.00 58.87 57.45 2vjb n SER 61 Cb 0.47 0.03 -0.11 0.00 -0.26 0.00 0.00 64.21 64.34 2vjb n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2vjb s THR 62 N -0.91 0.72 0.60 6.66 -4.23 -1.26 -4.89 115.64 112.34 2vjb s THR 62 Ca 0.12 -1.55 -0.19 0.00 -1.18 0.00 0.00 61.69 58.89 2vjb s THR 62 Cb 0.09 -1.22 -0.03 0.00 1.34 0.00 0.00 72.50 72.67 2vjb s THR 62 CO 0.14 -0.61 1.23 -0.31 -0.54 0.00 0.00 174.62 174.53 2vjb s TYR 63 N -2.49 2.32 0.66 3.99 2.02 -1.26 -3.77 117.35 118.82 2vjb s TYR 63 Ca 0.02 1.50 -0.07 0.00 -0.37 0.00 0.00 57.07 58.16 2vjb s TYR 63 Cb -0.02 -3.54 0.14 0.00 -0.40 0.00 0.00 41.96 38.14 2vjb s TYR 63 CO -0.02 -2.38 0.90 -0.35 -1.57 0.00 0.00 175.55 172.13 2vjb n PRO 64 N -1.63 -0.53 -1.45 -1.71 -0.04 -1.26 -4.88 135.00 123.50 2vjb n PRO 64 Ca 0.14 -1.77 -0.30 0.00 -0.04 0.00 0.00 63.50 61.53 2vjb n PRO 64 Cb 0.49 -0.80 0.11 0.00 -0.04 0.00 0.00 33.50 33.26 2vjb n PRO 64 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2vjb s ASN 65 N -4.42 4.05 0.12 3.54 0.01 -1.26 -4.85 114.94 112.14 2vjb s ASN 65 Ca 0.54 1.31 0.03 0.00 -0.71 0.00 0.00 52.86 54.04 2vjb s ASN 65 Cb -0.02 -2.01 -0.04 0.00 0.41 0.00 0.00 41.25 39.59 2vjb s ASN 65 CO 0.37 -2.25 0.15 0.20 -1.51 0.00 0.00 177.10 174.06 2vjb s ASN 66 N -3.77 5.75 0.75 -1.22 0.02 -0.63 -4.80 114.94 111.04 2vjb s ASN 66 Ca 0.62 -0.00 -0.12 0.00 -1.02 0.00 0.00 52.86 52.34 2vjb s ASN 66 Cb -0.15 -1.59 0.05 0.00 0.02 0.00 0.00 41.25 39.57 2vjb s ASN 66 CO 0.55 0.11 1.11 0.00 0.02 0.00 0.00 177.10 178.88 2vjb s GLN 68 N -4.61 4.22 0.22 0.00 -1.52 -1.23 -4.56 119.66 112.19 2vjb s GLN 68 Ca 0.64 2.35 -0.22 0.00 -1.95 0.00 0.00 55.36 56.18 2vjb s GLN 68 Cb -0.19 -3.15 0.04 0.00 -0.22 0.00 0.00 33.01 29.49 2vjb s GLN 68 CO 0.52 -0.59 0.70 1.14 -0.25 0.00 0.00 175.29 176.80 2vjb s GLN 69 N 1.04 1.55 0.24 2.91 -2.07 -1.26 -4.66 119.66 117.40 2vjb s GLN 69 Ca 0.69 -0.77 -0.30 0.00 -1.82 0.00 0.00 55.36 53.17 2vjb s GLN 69 Cb -0.44 0.58 -0.09 0.00 -1.09 0.00 0.00 33.01 31.97 2vjb s GLN 69 CO 0.32 -0.70 1.32 -0.47 -1.32 0.00 0.00 175.29 174.45 2vjb s TYR 70 N -3.80 3.18 -0.13 9.60 5.04 -1.25 -5.01 117.35 124.98 2vjb s TYR 70 Ca 0.07 1.25 -0.01 0.00 -2.44 0.00 0.00 57.07 55.94 2vjb s TYR 70 Cb -0.04 -3.65 -0.02 0.00 0.35 0.00 0.00 41.96 38.60 2vjb s TYR 70 CO -0.01 -1.97 -0.08 0.08 -1.34 0.00 0.00 175.55 172.23 2vjb s VAL 71 N -0.27 3.51 -0.22 3.14 1.01 -1.26 -4.89 120.40 121.42 2vjb s VAL 71 Ca 0.55 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.73 2vjb s VAL 71 Cb -0.38 -2.50 0.01 0.00 0.00 0.00 0.00 36.38 33.51 2vjb s VAL 71 CO 0.43 0.52 1.09 -0.62 0.00 0.00 0.00 175.10 176.52 2vjb s ASP 72 N 0.17 7.06 -0.12 3.32 2.15 -1.26 -4.90 116.67 123.07 2vjb s ASP 72 Ca -0.04 1.42 0.14 0.00 0.43 0.00 0.00 52.55 54.50 2vjb s ASP 72 Cb -0.14 -2.54 0.32 0.00 -0.30 0.00 0.00 42.92 40.26 2vjb s ASP 72 CO 0.04 -0.70 1.16 -0.62 -0.17 0.00 0.00 175.17 174.87 2vjb n GLU 73 N 6.42 1.04 -0.23 4.34 1.02 -1.26 -4.78 120.64 127.19 2vjb n GLU 73 Ca 0.12 -2.56 -0.07 0.00 -0.02 0.00 0.00 57.16 54.63 2vjb n GLU 73 Cb 0.46 -1.20 0.04 0.00 -0.02 0.00 0.00 31.44 30.72 2vjb n GLU 73 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2vjb h GLN 74 N 0.52 0.94 -3.07 3.49 1.08 -2.01 -3.35 115.11 112.71 2vjb h GLN 74 Ca -0.03 -0.15 -0.62 0.00 -1.45 0.00 0.00 58.65 56.40 2vjb h GLN 74 Cb 1.18 -0.16 -0.41 0.00 -0.05 0.00 0.00 27.48 28.04 2vjb h GLN 74 CO 0.01 0.76 -0.65 -0.06 -0.95 0.00 0.00 178.83 177.95 2vjb s PHE 75 N -5.65 3.02 0.18 2.96 0.08 -1.26 -5.09 117.98 112.22 2vjb s PHE 75 Ca -0.13 -3.08 -0.32 0.00 0.12 0.00 0.00 56.93 53.52 2vjb s PHE 75 Cb 0.13 -2.45 -0.12 0.00 -0.57 0.00 0.00 43.02 40.02 2vjb s PHE 75 CO 0.80 -0.65 1.74 -2.30 -0.10 0.00 0.00 175.22 174.71 2vjb n PRO 76 N 2.53 2.72 0.00 0.24 -0.02 -1.26 -1.75 135.00 137.46 2vjb n PRO 76 Ca 0.16 0.98 0.00 0.00 -2.02 0.00 0.00 63.50 62.62 2vjb n PRO 76 Cb 0.36 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.00 2vjb n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vjb n GLY 77 N 3.99 2.82 3.63 -1.23 0.00 -1.26 -5.00 105.19 108.14 2vjb n GLY 77 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2vjb n GLY 77 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2vjb s PHE 78 N -1.96 2.51 0.46 1.61 5.36 -0.72 -4.89 117.98 120.35 2vjb s PHE 78 Ca 0.00 0.77 0.12 0.00 -0.96 0.00 0.00 56.93 56.86 2vjb s PHE 78 Cb 0.00 -3.92 1.06 0.00 -0.34 0.00 0.00 43.02 39.82 2vjb s PHE 78 CO 0.00 -2.10 2.07 0.66 -1.46 0.00 0.00 175.22 174.39 2vjb h SER 79 N 9.70 0.27 -0.99 6.13 4.64 -1.95 -2.07 113.55 129.28 2vjb h SER 79 Ca -0.28 -0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.15 2vjb h SER 79 Cb 1.12 -0.06 -0.08 0.00 -0.31 0.00 0.00 62.40 63.06 2vjb h SER 79 CO 1.02 0.19 0.62 1.23 -0.87 0.00 0.00 176.83 179.02 2vjb h GLY 80 N 0.31 1.58 0.11 -0.77 0.00 -1.94 -2.38 103.07 99.99 2vjb h GLY 80 Ca 0.13 -0.41 -0.38 0.00 0.00 0.00 0.00 47.33 46.67 2vjb h GLY 80 CO -0.03 0.16 -2.38 -1.14 0.00 0.00 0.00 176.54 173.15 2vjb n SER 81 N -4.60 1.65 0.30 0.19 3.41 -1.04 -4.45 113.62 109.07 2vjb n SER 81 Ca 0.19 -0.06 0.19 0.00 -0.26 0.00 0.00 58.87 58.93 2vjb n SER 81 Cb 0.36 -0.23 0.85 0.00 -0.26 0.00 0.00 64.21 64.93 2vjb n SER 81 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2vjb h GLU 82 N 0.01 0.00 0.00 4.33 5.08 -1.39 -2.30 114.58 120.31 2vjb h GLU 82 Ca -0.55 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.81 2vjb h GLU 82 Cb 1.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.23 2vjb h GLU 82 CO -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 177.97 2vjb n MET 83 N -3.09 0.06 0.00 2.33 0.00 -0.90 -1.35 117.12 114.17 2vjb n MET 83 Ca -0.00 0.29 0.06 0.00 0.00 0.00 0.00 57.70 58.05 2vjb n MET 83 Cb 0.24 -1.50 -0.01 0.00 0.00 0.00 0.00 33.22 31.95 2vjb n MET 83 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 2vjb n TRP 84 N -1.41 0.00 -2.52 3.17 7.02 -0.86 -4.74 117.44 118.10 2vjb n TRP 84 Ca 0.03 0.00 -0.27 0.00 -1.02 0.00 0.00 57.50 56.24 2vjb n TRP 84 Cb 0.09 0.00 0.01 0.00 -2.42 0.00 0.00 31.31 28.99 2vjb n TRP 84 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2vjb s ASN 85 N -1.68 6.05 0.23 -0.99 0.01 -0.45 -4.69 114.94 113.41 2vjb s ASN 85 Ca 0.11 0.88 -0.32 0.00 -0.71 0.00 0.00 52.86 52.82 2vjb s ASN 85 Cb 0.11 -2.09 -0.13 0.00 0.41 0.00 0.00 41.25 39.55 2vjb s ASN 85 CO 0.35 -0.75 1.55 -2.65 -1.51 0.00 0.00 177.10 174.09 2vjb n PRO 86 N -2.39 2.36 -0.36 -0.60 -0.02 -1.26 -4.86 135.00 127.87 2vjb n PRO 86 Ca 0.02 0.85 0.08 0.00 -2.02 0.00 0.00 63.50 62.43 2vjb n PRO 86 Cb 0.56 -2.60 0.24 0.00 -0.02 0.00 0.00 33.50 31.68 2vjb n PRO 86 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2vjb n ASN 87 N 2.78 3.67 -4.14 2.55 6.94 -1.26 -4.95 115.26 120.85 2vjb n ASN 87 Ca 0.13 -2.32 -0.10 0.00 -0.02 0.00 0.00 54.58 52.27 2vjb n ASN 87 Cb 0.33 -0.41 -0.10 0.00 -2.36 0.00 0.00 39.78 37.24 2vjb n ASN 87 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2vjb s ARG 88 N -1.58 1.03 0.34 -3.83 1.81 -1.26 -5.11 118.95 110.34 2vjb s ARG 88 Ca 0.36 -1.46 -0.29 0.00 -1.72 0.00 0.00 55.73 52.63 2vjb s ARG 88 Cb 0.23 0.27 -0.11 0.00 -0.45 0.00 0.00 34.95 34.89 2vjb s ARG 88 CO 0.18 -0.32 1.47 -2.00 -0.68 0.00 0.00 175.30 173.96 2vjb s GLU 89 N -4.07 4.18 0.27 3.54 2.12 -1.26 -4.51 118.70 118.97 2vjb s GLU 89 Ca 0.27 2.48 -0.18 0.00 0.36 0.00 0.00 54.97 57.90 2vjb s GLU 89 Cb 0.07 -3.02 -0.09 0.00 0.26 0.00 0.00 34.13 31.36 2vjb s GLU 89 CO 0.04 -0.48 0.74 -1.64 -0.54 0.00 0.00 175.26 173.39 2vjb s MET 90 N -1.50 4.15 -0.06 4.30 -1.94 -1.26 -1.61 119.30 121.39 2vjb s MET 90 Ca 0.55 0.80 -0.29 0.00 -1.71 0.00 0.00 55.69 55.04 2vjb s MET 90 Cb -0.45 -2.66 0.10 0.00 2.01 0.00 0.00 34.83 33.82 2vjb s MET 90 CO 0.56 0.28 0.82 0.45 -0.01 0.00 0.00 175.02 177.11 2vjb s SER 91 N -1.93 -0.50 0.50 3.03 0.15 0.02 -4.89 113.70 110.08 2vjb s SER 91 Ca 0.48 0.40 0.29 0.00 0.70 0.00 0.00 55.95 57.83 2vjb s SER 91 Cb -0.14 0.44 1.03 0.00 -1.71 0.00 0.00 66.02 65.64 2vjb s SER 91 CO 0.19 -0.56 1.86 -0.33 1.20 0.00 0.00 173.24 175.60 2vjb h GLU 92 N 2.56 0.00 -5.07 5.44 5.08 -1.95 -3.25 114.58 117.40 2vjb h GLU 92 Ca -0.24 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.42 2vjb h GLU 92 Cb 1.18 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 30.28 2vjb h GLU 92 CO 0.35 0.07 1.30 0.34 -1.00 0.00 0.00 179.01 180.07 2vjb s ASP 93 N -5.93 6.86 0.00 1.42 2.15 -1.26 -4.29 116.67 115.62 2vjb s ASP 93 Ca 0.02 -2.52 0.00 0.00 0.43 0.00 0.00 52.55 50.49 2vjb s ASP 93 Cb 0.08 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.27 2vjb s ASP 93 CO 0.60 -0.95 0.42 0.00 -0.17 0.00 0.00 175.17 175.06 2vjb n LEU 95 N -0.08 4.70 -4.35 0.00 4.77 -1.26 -4.79 117.00 115.99 2vjb n LEU 95 Ca 0.00 -3.72 -0.18 0.00 -0.03 0.00 0.00 56.01 52.08 2vjb n LEU 95 Cb 0.29 -1.70 -0.10 0.00 -2.33 0.00 0.00 43.42 39.58 2vjb n LEU 95 CO 0.00 -0.22 -0.33 -0.31 -1.33 0.00 0.00 177.39 175.21 2vjb s TYR 96 N 5.73 1.63 0.08 -1.77 1.51 -1.26 -2.75 117.35 120.51 2vjb s TYR 96 Ca 0.57 -0.90 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 2vjb s TYR 96 Cb 0.05 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.91 2vjb s TYR 96 CO 0.07 -0.01 -0.07 -0.48 -1.11 0.00 0.00 175.55 173.95 2vjb s LEU 97 N -3.33 2.40 0.10 -1.29 0.05 0.46 -3.25 118.68 113.83 2vjb s LEU 97 Ca 0.29 -0.81 0.09 0.00 0.05 0.00 0.00 54.13 53.75 2vjb s LEU 97 Cb 0.06 -0.12 -0.04 0.00 -2.05 0.00 0.00 46.19 44.04 2vjb s LEU 97 CO 0.09 -0.35 -0.20 0.20 -0.55 0.00 0.00 176.35 175.55 2vjb s ASN 98 N -2.42 3.75 -0.01 1.48 0.01 0.19 -1.42 114.94 116.51 2vjb s ASN 98 Ca 0.03 -0.56 0.01 0.00 -0.71 0.00 0.00 52.86 51.62 2vjb s ASN 98 Cb -0.01 -0.50 0.01 0.00 0.41 0.00 0.00 41.25 41.16 2vjb s ASN 98 CO -0.02 0.20 -0.03 -0.63 -1.51 0.00 0.00 177.10 175.10 2vjb s ILE 99 N -1.08 0.29 -0.17 0.60 1.01 0.14 -0.41 121.20 121.59 2vjb s ILE 99 Ca 0.16 -0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.72 2vjb s ILE 99 Cb -0.10 -0.29 0.01 0.00 0.01 0.00 0.00 42.46 42.08 2vjb s ILE 99 CO 0.08 0.11 -0.17 0.26 0.00 0.00 0.00 174.94 175.23 2vjb s TRP 100 N 0.29 2.78 -0.10 3.97 0.51 -0.14 0.09 118.94 126.34 2vjb s TRP 100 Ca -0.03 -1.33 0.04 0.00 -2.12 0.00 0.00 56.10 52.66 2vjb s TRP 100 Cb -0.06 -1.91 0.00 0.00 -0.81 0.00 0.00 33.47 30.69 2vjb s TRP 100 CO -0.01 -0.64 -0.22 0.08 -0.51 0.00 0.00 176.95 175.65 2vjb s VAL 101 N 1.08 1.95 0.71 4.03 1.01 0.04 -2.30 120.40 126.91 2vjb s VAL 101 Ca -0.00 -0.95 -0.16 0.00 0.00 0.00 0.00 61.98 60.86 2vjb s VAL 101 Cb -0.14 -1.69 0.01 0.00 0.00 0.00 0.00 36.38 34.56 2vjb s VAL 101 CO -0.06 0.53 1.07 -2.65 0.00 0.00 0.00 175.10 173.99 2vjb n PRO 102 N 3.59 0.61 -4.09 2.72 -0.02 -1.26 -1.26 135.00 135.30 2vjb n PRO 102 Ca -0.20 0.27 -0.25 0.00 -2.02 0.00 0.00 63.50 61.30 2vjb n PRO 102 Cb 0.53 -2.31 -0.17 0.00 -0.02 0.00 0.00 33.50 31.53 2vjb n PRO 102 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2vjb s SER 103 N -1.63 1.89 0.61 2.55 0.15 -1.26 -2.77 113.70 113.25 2vjb s SER 103 Ca 0.76 -0.26 -0.19 0.00 0.70 0.00 0.00 55.95 56.95 2vjb s SER 103 Cb -0.35 -0.76 -0.02 0.00 -1.71 0.00 0.00 66.02 63.18 2vjb s SER 103 CO 0.48 -0.08 1.28 -2.16 1.20 0.00 0.00 173.24 173.96 2vjb s PRO 104 N 1.39 2.77 0.02 5.44 0.04 -1.26 -4.94 135.00 138.46 2vjb s PRO 104 Ca -0.02 2.04 -0.34 0.00 0.04 0.00 0.00 61.00 62.72 2vjb s PRO 104 Cb -0.14 -1.95 -0.13 0.00 0.04 0.00 0.00 34.50 32.33 2vjb s PRO 104 CO -0.04 -1.42 1.73 -2.13 0.04 0.00 0.00 177.00 175.18 2vjb n ARG 105 N -1.65 2.09 -0.86 4.56 0.63 -1.11 -4.97 116.66 115.35 2vjb n ARG 105 Ca 0.14 0.76 -0.29 0.00 -0.92 0.00 0.00 57.85 57.54 2vjb n ARG 105 Cb 0.48 -2.56 0.19 0.00 0.45 0.00 0.00 32.46 31.02 2vjb n ARG 105 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2vjb s PRO 106 N 2.59 0.26 -0.19 -0.14 0.02 -1.26 -5.00 135.00 131.28 2vjb s PRO 106 Ca 0.87 0.91 -0.22 0.00 0.02 0.00 0.00 61.00 62.58 2vjb s PRO 106 Cb -0.71 -1.69 -0.19 0.00 0.02 0.00 0.00 34.50 31.93 2vjb s PRO 106 CO 0.46 -2.95 0.30 0.87 -0.33 0.00 0.00 177.00 175.36 2vjb h LYS 107 N -2.07 0.00 -0.31 5.54 1.57 -1.94 -3.38 116.57 115.99 2vjb h LYS 107 Ca -0.54 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 57.97 2vjb h LYS 107 Cb 1.31 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 33.44 2vjb h LYS 107 CO 0.51 0.92 -0.58 0.45 -0.57 0.00 0.00 179.45 180.18 2vjb n SER 108 N -4.49 -2.46 -4.88 0.86 2.88 -1.07 -4.36 113.62 100.11 2vjb n SER 108 Ca -0.25 -3.21 -0.21 0.00 -1.33 0.00 0.00 58.87 53.86 2vjb n SER 108 Cb 0.60 1.47 0.07 0.00 -0.75 0.00 0.00 64.21 65.60 2vjb n SER 108 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2vjb s THR 109 N 0.42 2.28 0.43 2.46 -1.32 -0.30 -4.27 115.64 115.34 2vjb s THR 109 Ca 0.32 -0.80 -0.25 0.00 -1.21 0.00 0.00 61.69 59.76 2vjb s THR 109 Cb 0.22 -2.48 -0.08 0.00 -1.51 0.00 0.00 72.50 68.64 2vjb s THR 109 CO -0.23 0.00 1.26 -0.89 -2.21 0.00 0.00 174.62 172.56 2vjb s THR 110 N -2.84 2.72 -0.06 5.08 2.01 -1.26 0.64 115.64 121.92 2vjb s THR 110 Ca 0.63 0.61 0.05 0.00 0.31 0.00 0.00 61.69 63.29 2vjb s THR 110 Cb -0.06 -3.34 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 2vjb s THR 110 CO 0.41 0.06 -0.23 -0.69 -0.69 0.00 0.00 174.62 173.47 2vjb s VAL 111 N -1.34 1.92 -0.12 3.82 1.01 -0.83 -0.75 120.40 124.11 2vjb s VAL 111 Ca 0.60 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.62 2vjb s VAL 111 Cb -0.35 -1.63 0.01 0.00 0.00 0.00 0.00 36.38 34.40 2vjb s VAL 111 CO 0.45 0.53 -0.18 -0.04 0.00 0.00 0.00 175.10 175.87 2vjb s MET 112 N -0.02 2.48 -0.19 2.72 -1.94 -0.12 -0.11 119.30 122.11 2vjb s MET 112 Ca -0.07 -0.66 -0.05 0.00 -1.71 0.00 0.00 55.69 53.21 2vjb s MET 112 Cb -0.14 -2.06 -0.02 0.00 2.01 0.00 0.00 34.83 34.62 2vjb s MET 112 CO 0.04 -0.04 -0.01 0.08 -0.01 0.00 0.00 175.02 175.08 2vjb s VAL 113 N 0.91 3.85 -0.17 -6.03 1.01 0.29 0.19 120.40 120.44 2vjb s VAL 113 Ca -0.07 -0.35 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 2vjb s VAL 113 Cb -0.15 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 2vjb s VAL 113 CO -0.01 0.44 0.37 0.86 0.00 0.00 0.00 175.10 176.75 2vjb s TRP 114 N 0.96 3.43 -0.42 5.22 -0.11 0.27 -1.26 118.94 127.02 2vjb s TRP 114 Ca 0.01 0.64 0.00 0.00 1.22 0.00 0.00 56.10 57.98 2vjb s TRP 114 Cb -0.14 -2.46 0.11 0.00 -1.50 0.00 0.00 33.47 29.48 2vjb s TRP 114 CO 0.02 0.11 0.18 0.42 -4.62 0.00 0.00 176.95 173.05 2vjb s ILE 115 N 0.90 2.89 0.81 5.86 1.01 -0.52 -2.44 121.20 129.71 2vjb s ILE 115 Ca 0.19 -2.40 -0.14 0.00 0.00 0.00 0.00 60.65 58.30 2vjb s ILE 115 Cb -0.14 -3.02 0.02 0.00 0.01 0.00 0.00 42.46 39.33 2vjb s ILE 115 CO 0.07 -0.69 0.70 0.00 0.00 0.00 0.00 174.94 175.02 2vjb n TYR 116 N 4.19 -0.33 -2.53 3.97 0.18 -1.26 -3.92 117.16 117.46 2vjb n TYR 116 Ca 0.02 0.34 0.00 0.00 1.88 0.00 0.00 57.90 60.14 2vjb n TYR 116 Cb 0.40 -1.94 0.00 0.00 -0.38 0.00 0.00 39.34 37.42 2vjb n TYR 116 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2vjb n GLY 117 N 1.28 3.34 0.00 -7.48 0.00 -1.22 -3.74 105.19 97.36 2vjb n GLY 117 Ca 0.10 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 44.06 2vjb n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vjb n GLY 118 N 5.00 0.71 2.84 -0.02 0.00 -1.26 -4.15 105.19 108.31 2vjb n GLY 118 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.96 2vjb n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vjb n GLY 119 N 0.00 0.63 2.38 -0.02 0.00 -1.26 -1.86 105.19 105.06 2vjb n GLY 119 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 2vjb n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vjb n PHE 120 N -2.16 0.00 -0.21 1.61 3.72 -1.26 -4.80 117.46 114.36 2vjb n PHE 120 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 2vjb n PHE 120 Cb 0.54 -0.96 0.00 0.00 -0.94 0.00 0.00 39.48 38.12 2vjb n PHE 120 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2vjb n TYR 121 N -2.62 0.00 -3.83 1.38 0.18 -0.89 0.55 117.16 111.93 2vjb n TYR 121 Ca -0.01 0.00 -0.07 0.00 1.88 0.00 0.00 57.90 59.70 2vjb n TYR 121 Cb 0.21 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.19 2vjb n TYR 121 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 2vjb s SER 122 N -0.14 -0.02 0.00 9.48 1.04 -0.78 -3.83 113.70 119.44 2vjb s SER 122 Ca 0.00 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.47 2vjb s SER 122 Cb 0.00 0.74 0.00 0.00 0.10 0.00 0.00 66.02 66.86 2vjb s SER 122 CO 0.00 -1.46 0.00 0.61 0.98 0.00 0.00 173.24 173.37 2vjb n GLY 123 N -0.57 3.73 3.12 7.32 0.00 -1.26 -4.10 105.19 113.43 2vjb n GLY 123 Ca -0.07 -1.63 -0.11 0.00 0.00 0.00 0.00 46.02 44.21 2vjb n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vjb s SER 124 N 0.00 0.07 0.00 1.61 0.01 -1.26 -4.68 113.70 109.45 2vjb s SER 124 Ca 0.00 -0.32 0.26 0.00 1.31 0.00 0.00 55.95 57.20 2vjb s SER 124 Cb 0.00 0.22 0.70 0.00 0.21 0.00 0.00 66.02 67.15 2vjb s SER 124 CO 0.00 -0.43 1.54 -1.54 0.41 0.00 0.00 173.24 173.22 2vjb n SER 125 N 1.18 0.69 -1.11 2.44 3.41 -1.26 -4.16 113.62 114.80 2vjb n SER 125 Ca -0.21 -0.50 0.11 0.00 -0.26 0.00 0.00 58.87 58.00 2vjb n SER 125 Cb 0.57 0.14 0.22 0.00 -0.26 0.00 0.00 64.21 64.88 2vjb n SER 125 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2vjb n THR 126 N -1.11 0.61 -0.87 6.66 -2.24 -1.26 -4.88 114.28 111.19 2vjb n THR 126 Ca 0.09 -0.81 -0.32 0.00 -2.27 0.00 0.00 64.05 60.74 2vjb n THR 126 Cb 0.34 0.87 0.15 0.00 -2.10 0.00 0.00 70.33 69.58 2vjb n THR 126 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2vjb n LEU 127 N 1.40 3.40 0.10 3.22 4.77 -1.26 -4.90 117.00 123.73 2vjb n LEU 127 Ca 0.19 0.48 -0.02 0.00 -0.03 0.00 0.00 56.01 56.63 2vjb n LEU 127 Cb 0.58 -1.46 0.21 0.00 -2.33 0.00 0.00 43.42 40.42 2vjb n LEU 127 CO 0.15 -2.12 0.61 0.44 -1.33 0.00 0.00 177.39 175.13 2vjb h ASP 128 N -1.44 0.21 0.71 -1.43 3.32 -1.95 -2.53 116.42 113.30 2vjb h ASP 128 Ca -0.44 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.51 2vjb h ASP 128 Cb 1.28 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.77 2vjb h ASP 128 CO 0.42 0.65 0.00 0.55 -1.72 0.00 0.00 179.24 179.14 2vjb n VAL 129 N -3.99 0.85 -0.21 -1.35 3.14 -1.26 -2.17 118.33 113.34 2vjb n VAL 129 Ca -0.02 0.22 0.10 0.00 -2.96 0.00 0.00 64.34 61.69 2vjb n VAL 129 Cb 0.51 -1.13 0.27 0.00 -1.06 0.00 0.00 33.84 32.43 2vjb n VAL 129 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 2vjb n TYR 130 N -2.14 0.78 -1.55 1.45 4.01 -0.96 -4.72 117.16 114.03 2vjb n TYR 130 Ca 0.02 -0.45 -0.47 0.00 -0.16 0.00 0.00 57.90 56.85 2vjb n TYR 130 Cb 0.22 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.20 2vjb n TYR 130 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2vjb n ASN 131 N 1.37 2.88 -0.16 7.72 2.85 -0.92 -4.83 115.26 124.17 2vjb n ASN 131 Ca 0.21 0.41 0.15 0.00 -0.11 0.00 0.00 54.58 55.24 2vjb n ASN 131 Cb 0.57 -1.42 0.67 0.00 1.24 0.00 0.00 39.78 40.85 2vjb n ASN 131 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2vjb n GLY 132 N 5.84 -0.78 0.34 8.20 0.00 -1.26 -4.21 105.19 113.32 2vjb n GLY 132 Ca 0.33 -0.28 0.02 0.00 0.00 0.00 0.00 46.02 46.09 2vjb n GLY 132 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2vjb h LYS 133 N 0.77 0.86 -0.15 1.61 2.10 -1.92 -1.69 116.57 118.15 2vjb h LYS 133 Ca 0.00 -0.05 -0.03 0.00 -2.00 0.00 0.00 60.65 58.57 2vjb h LYS 133 Cb 0.31 -0.19 -0.00 0.00 -0.90 0.00 0.00 32.23 31.44 2vjb h LYS 133 CO 0.00 0.57 -0.03 1.88 -2.00 0.00 0.00 179.45 179.87 2vjb h TYR 134 N 0.89 0.33 -0.19 0.07 -1.99 -1.81 -1.86 116.97 112.40 2vjb h TYR 134 Ca 0.26 -0.07 -0.07 0.00 2.00 0.00 0.00 58.73 60.85 2vjb h TYR 134 Cb -0.05 -0.08 -0.00 0.00 2.00 0.00 0.00 36.73 38.60 2vjb h TYR 134 CO -0.00 0.56 -0.13 1.25 -0.00 0.00 0.00 178.16 179.84 2vjb h LEU 135 N -0.00 0.45 -0.89 3.88 5.85 -1.68 -1.18 115.31 121.74 2vjb h LEU 135 Ca 0.04 -0.44 0.00 0.00 0.84 0.00 0.00 57.88 58.32 2vjb h LEU 135 Cb 0.45 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 2vjb h LEU 135 CO 0.01 0.80 0.58 0.00 -0.34 0.00 0.00 178.44 179.49 2vjb h ALA 136 N 0.67 1.13 -0.11 1.25 0.00 -1.37 -2.24 119.26 118.60 2vjb h ALA 136 Ca 0.04 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 2vjb h ALA 136 Cb 0.65 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2vjb h ALA 136 CO 0.04 0.55 -0.22 -0.92 0.00 0.00 0.00 179.25 178.70 2vjb h TYR 137 N 1.22 0.43 -0.26 0.00 5.03 -1.29 -1.44 116.97 120.65 2vjb h TYR 137 Ca 0.33 -0.16 -0.14 0.00 2.58 0.00 0.00 58.73 61.33 2vjb h TYR 137 Cb -0.11 -0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.08 2vjb h TYR 137 CO -0.01 0.84 -0.43 1.15 -1.32 0.00 0.00 178.16 178.39 2vjb h THR 138 N -0.09 1.30 -0.26 1.81 2.02 -1.14 -3.21 112.91 113.33 2vjb h THR 138 Ca 0.00 -1.61 0.00 0.00 0.77 0.00 0.00 66.41 65.57 2vjb h THR 138 Cb 0.81 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 68.78 2vjb h THR 138 CO 0.05 0.51 0.00 -0.62 0.37 0.00 0.00 175.52 175.83 2vjb n GLU 139 N -4.02 2.13 -3.74 6.66 -0.58 -0.85 -4.99 120.64 115.24 2vjb n GLU 139 Ca -0.02 -1.98 -0.24 0.00 -0.42 0.00 0.00 57.16 54.50 2vjb n GLU 139 Cb 0.54 -1.41 0.02 0.00 -0.57 0.00 0.00 31.44 30.02 2vjb n GLU 139 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2vjb n GLU 140 N 1.16 -3.68 -4.49 3.49 1.02 -0.60 -5.00 120.64 112.54 2vjb n GLU 140 Ca 0.15 0.55 -0.24 0.00 -0.02 0.00 0.00 57.16 57.59 2vjb n GLU 140 Cb 0.51 -4.85 -0.10 0.00 -0.02 0.00 0.00 31.44 26.98 2vjb n GLU 140 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2vjb s VAL 141 N -3.70 2.00 -0.40 2.62 -7.23 -0.87 -4.75 120.40 108.07 2vjb s VAL 141 Ca 0.11 -2.18 -0.19 0.00 -1.81 0.00 0.00 61.98 57.91 2vjb s VAL 141 Cb -0.03 -2.56 0.01 0.00 0.56 0.00 0.00 36.38 34.36 2vjb s VAL 141 CO 0.84 -0.25 0.57 -0.69 -0.31 0.00 0.00 175.10 175.26 2vjb s VAL 142 N -2.78 4.93 -0.22 1.32 1.01 0.07 -4.48 120.40 120.26 2vjb s VAL 142 Ca 0.31 0.18 -0.08 0.00 0.00 0.00 0.00 61.98 62.39 2vjb s VAL 142 Cb 0.03 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 2vjb s VAL 142 CO 0.15 -0.41 0.09 -0.22 0.00 0.00 0.00 175.10 174.70 2vjb s LEU 143 N 2.57 3.78 -0.07 3.92 2.96 -0.97 -0.95 118.68 129.91 2vjb s LEU 143 Ca 0.20 0.01 0.04 0.00 -0.22 0.00 0.00 54.13 54.15 2vjb s LEU 143 Cb -0.15 -1.99 -0.02 0.00 0.50 0.00 0.00 46.19 44.54 2vjb s LEU 143 CO 0.16 0.09 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.40 2vjb s VAL 144 N 0.90 2.65 -0.25 1.68 1.01 0.13 -0.96 120.40 125.56 2vjb s VAL 144 Ca 0.05 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 2vjb s VAL 144 Cb -0.14 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.23 2vjb s VAL 144 CO 0.03 0.56 -0.06 -0.55 0.00 0.00 0.00 175.10 175.09 2vjb s SER 145 N -0.21 4.33 0.51 3.32 0.15 0.45 0.96 113.70 123.21 2vjb s SER 145 Ca -0.01 -0.84 0.07 0.00 0.70 0.00 0.00 55.95 55.87 2vjb s SER 145 Cb -0.13 -1.67 0.03 0.00 -1.71 0.00 0.00 66.02 62.54 2vjb s SER 145 CO 0.03 -0.12 0.49 -1.48 1.20 0.00 0.00 173.24 173.36 2vjb s LEU 146 N 1.34 3.01 0.15 3.45 0.05 -1.02 0.54 118.68 126.19 2vjb s LEU 146 Ca 0.01 -1.00 -0.01 0.00 0.05 0.00 0.00 54.13 53.17 2vjb s LEU 146 Cb -0.16 -1.56 -0.04 0.00 -2.05 0.00 0.00 46.19 42.38 2vjb s LEU 146 CO -0.04 -1.03 0.09 -0.94 -0.55 0.00 0.00 176.35 173.88 2vjb s SER 147 N -4.33 0.26 -0.11 1.48 1.04 -1.20 -4.56 113.70 106.27 2vjb s SER 147 Ca 0.45 -1.23 -0.30 0.00 0.48 0.00 0.00 55.95 55.35 2vjb s SER 147 Cb -0.03 0.32 0.09 0.00 0.10 0.00 0.00 66.02 66.50 2vjb s SER 147 CO 0.27 -0.76 0.78 -0.72 0.98 0.00 0.00 173.24 173.79 2vjb s TYR 148 N -4.07 -0.60 0.27 5.02 1.13 -1.26 -4.52 117.35 113.33 2vjb s TYR 148 Ca 0.27 1.10 -0.30 0.00 -1.41 0.00 0.00 57.07 56.73 2vjb s TYR 148 Cb 0.07 0.40 -0.11 0.00 -1.10 0.00 0.00 41.96 41.22 2vjb s TYR 148 CO 0.04 -0.50 1.62 1.03 -2.51 0.00 0.00 175.55 175.23 2vjb s ARG 149 N -0.92 4.12 0.41 -3.49 0.52 -1.26 -4.94 118.95 113.40 2vjb s ARG 149 Ca -0.07 2.58 0.07 0.00 -0.52 0.00 0.00 55.73 57.79 2vjb s ARG 149 Cb -0.01 -3.04 -0.06 0.00 0.52 0.00 0.00 34.95 32.36 2vjb s ARG 149 CO 0.06 -0.66 0.12 0.14 0.02 0.00 0.00 175.30 174.98 2vjb s VAL 150 N 0.27 2.17 0.00 3.52 -7.23 -1.26 -4.11 120.40 113.76 2vjb s VAL 150 Ca 0.66 -1.81 0.00 0.00 -1.81 0.00 0.00 61.98 59.02 2vjb s VAL 150 Cb -0.48 -2.98 0.00 0.00 0.56 0.00 0.00 36.38 33.48 2vjb s VAL 150 CO 0.44 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.84 2vjb n GLY 151 N -1.14 0.78 0.31 2.32 0.00 0.19 -2.88 105.19 104.78 2vjb n GLY 151 Ca -0.03 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.24 2vjb n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjb h ALA 152 N -0.74 1.17 -0.62 4.61 0.00 -1.88 -0.48 119.26 121.31 2vjb h ALA 152 Ca 0.00 -0.20 0.11 0.00 0.00 0.00 0.00 54.91 54.82 2vjb h ALA 152 Cb 0.00 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 2vjb h ALA 152 CO 0.00 0.58 0.42 0.74 0.00 0.00 0.00 179.25 180.98 2vjb h PHE 153 N 0.90 0.43 -0.01 0.00 0.04 -1.93 -1.68 116.94 114.71 2vjb h PHE 153 Ca 0.20 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.98 2vjb h PHE 153 Cb 0.27 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.28 2vjb h PHE 153 CO 0.02 0.20 -0.37 0.41 -0.60 0.00 0.00 178.31 177.96 2vjb n GLY 154 N -1.52 -0.11 0.11 -1.45 0.00 -0.99 -4.04 105.19 97.19 2vjb n GLY 154 Ca 0.10 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2vjb n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vjb n PHE 155 N -0.60 0.00 -1.71 1.61 3.72 -0.23 -0.58 117.46 119.68 2vjb n PHE 155 Ca 0.04 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.01 2vjb n PHE 155 Cb 0.24 0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.76 2vjb n PHE 155 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2vjb n LEU 156 N 0.00 3.91 -3.85 4.37 7.94 -0.65 -4.52 117.00 124.19 2vjb n LEU 156 Ca 0.00 1.04 -0.25 0.00 -1.11 0.00 0.00 56.01 55.69 2vjb n LEU 156 Cb 0.54 -1.55 -0.17 0.00 0.53 0.00 0.00 43.42 42.76 2vjb n LEU 156 CO 0.00 0.13 -0.42 0.00 -1.11 0.00 0.00 177.39 176.00 2vjb s ALA 157 N 1.57 1.05 -0.58 1.96 0.00 -1.26 -3.37 121.76 121.12 2vjb s ALA 157 Ca 0.77 -0.36 0.05 0.00 0.00 0.00 0.00 51.96 52.43 2vjb s ALA 157 Cb -0.52 -0.82 0.18 0.00 0.00 0.00 0.00 23.12 21.96 2vjb s ALA 157 CO 0.34 -0.41 0.46 1.28 0.00 0.00 0.00 175.76 177.43 2vjb n LEU 158 N 4.98 1.65 -4.57 0.00 4.77 -0.66 -3.13 117.00 120.03 2vjb n LEU 158 Ca -0.11 -4.90 -0.55 0.00 -0.03 0.00 0.00 56.01 50.43 2vjb n LEU 158 Cb 0.50 -0.20 -0.07 0.00 -2.33 0.00 0.00 43.42 41.32 2vjb n LEU 158 CO 0.14 1.83 0.83 1.57 -1.33 0.00 0.00 177.39 180.44 2vjb n HIS 159 N 2.16 1.30 0.00 -1.77 -0.00 -1.26 -1.64 115.22 114.01 2vjb n HIS 159 Ca 0.24 0.76 0.00 0.00 0.46 0.00 0.00 57.72 59.19 2vjb n HIS 159 Cb 0.41 -2.27 0.00 0.00 -0.12 0.00 0.00 29.99 28.01 2vjb n HIS 159 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2vjb n GLY 160 N 2.34 3.17 3.81 1.57 0.00 -1.26 -5.08 105.19 109.75 2vjb n GLY 160 Ca 0.19 -1.06 -0.32 0.00 0.00 0.00 0.00 46.02 44.83 2vjb n GLY 160 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vjb s SER 161 N 0.00 5.84 0.00 1.61 0.15 -0.65 -4.96 113.70 115.69 2vjb s SER 161 Ca 0.00 1.75 0.07 0.00 0.70 0.00 0.00 55.95 58.47 2vjb s SER 161 Cb 0.00 -2.52 0.12 0.00 -1.71 0.00 0.00 66.02 61.91 2vjb s SER 161 CO 0.00 -1.13 0.92 0.00 1.20 0.00 0.00 173.24 174.23 2vjb n GLN 162 N -2.15 1.34 -0.06 5.44 1.13 -1.26 -3.82 117.38 117.99 2vjb n GLN 162 Ca 0.08 -1.35 -0.08 0.00 -1.94 0.00 0.00 57.00 53.71 2vjb n GLN 162 Cb 0.53 -1.15 -0.15 0.00 0.11 0.00 0.00 30.24 29.58 2vjb n GLN 162 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2vjb n GLU 163 N 0.28 0.67 -3.08 -1.09 -0.58 -1.26 -4.60 120.64 110.97 2vjb n GLU 163 Ca 0.06 0.09 -0.18 0.00 -0.42 0.00 0.00 57.16 56.71 2vjb n GLU 163 Cb 0.26 -1.62 -0.02 0.00 -0.57 0.00 0.00 31.44 29.48 2vjb n GLU 163 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vjb n ALA 164 N -2.65 1.41 0.24 0.62 0.00 -1.26 -2.68 120.51 116.19 2vjb n ALA 164 Ca -0.25 -2.91 0.11 0.00 0.00 0.00 0.00 53.44 50.39 2vjb n ALA 164 Cb 1.08 -0.96 0.56 0.00 0.00 0.00 0.00 19.45 20.13 2vjb n ALA 164 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2vjb h PRO 165 N 3.61 0.00 0.00 0.00 0.13 -1.74 -1.76 132.00 132.24 2vjb h PRO 165 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2vjb h PRO 165 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2vjb h PRO 165 CO 0.42 0.20 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2vjb n GLY 166 N -0.16 1.74 2.75 1.56 0.00 -1.22 -4.48 105.19 105.38 2vjb n GLY 166 Ca -0.01 -1.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 2vjb n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vjb n ASN 167 N -0.17 -5.55 0.27 1.61 3.02 -1.26 -4.84 115.26 108.34 2vjb n ASN 167 Ca 0.00 0.22 0.14 0.00 -0.03 0.00 0.00 54.58 54.91 2vjb n ASN 167 Cb 0.00 -3.85 0.76 0.00 -0.61 0.00 0.00 39.78 36.09 2vjb n ASN 167 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2vjb h VAL 168 N 0.00 0.50 -0.24 2.41 -1.51 -1.89 -0.65 116.25 114.88 2vjb h VAL 168 Ca -0.19 -0.47 -0.14 0.00 -1.23 0.00 0.00 66.70 64.68 2vjb h VAL 168 Cb 1.08 1.31 -0.01 0.00 -2.13 0.00 0.00 31.29 31.54 2vjb h VAL 168 CO 0.27 0.10 -0.43 1.23 -1.23 0.00 0.00 177.57 177.51 2vjb h GLY 169 N 0.82 0.63 1.77 5.19 0.00 -1.07 0.23 103.07 110.63 2vjb h GLY 169 Ca -0.00 -0.65 -0.13 0.00 0.00 0.00 0.00 47.33 46.55 2vjb h GLY 169 CO 0.01 0.59 -0.51 1.41 0.00 0.00 0.00 176.54 178.04 2vjb h LEU 170 N 0.47 0.27 -0.79 3.11 3.38 -1.42 -2.66 115.31 117.67 2vjb h LEU 170 Ca 0.04 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.74 2vjb h LEU 170 Cb 0.94 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2vjb h LEU 170 CO 0.08 0.74 -0.54 -0.07 0.09 0.00 0.00 178.44 178.75 2vjb h LEU 171 N 0.20 0.20 -0.77 1.67 3.38 -0.87 -1.79 115.31 117.32 2vjb h LEU 171 Ca 0.01 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2vjb h LEU 171 Cb 0.97 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.63 2vjb h LEU 171 CO 0.08 0.70 0.44 0.44 0.09 0.00 0.00 178.44 180.18 2vjb h ASP 172 N 0.14 0.96 -0.18 -0.43 3.32 -0.63 -0.56 116.42 119.04 2vjb h ASP 172 Ca 0.00 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 2vjb h ASP 172 Cb 0.99 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 2vjb h ASP 172 CO 0.08 0.77 0.07 1.56 -1.72 0.00 0.00 179.24 180.00 2vjb h GLN 173 N 1.07 0.28 -0.39 3.56 4.20 -1.22 -2.25 115.11 120.36 2vjb h GLN 173 Ca 0.27 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.99 2vjb h GLN 173 Cb 0.02 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 27.70 2vjb h GLN 173 CO -0.05 0.36 0.08 -0.09 -0.67 0.00 0.00 178.83 178.46 2vjb h ARG 174 N 0.14 0.20 -0.53 1.46 2.43 -0.89 -0.85 114.38 116.34 2vjb h ARG 174 Ca 0.06 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.23 2vjb h ARG 174 Cb 0.19 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.66 2vjb h ARG 174 CO -0.00 0.13 0.35 1.98 -1.51 0.00 0.00 179.97 180.92 2vjb h MET 175 N 0.20 0.66 -0.35 0.20 4.05 -0.97 0.19 114.93 118.91 2vjb h MET 175 Ca 0.19 -0.04 -0.16 0.00 -0.28 0.00 0.00 59.70 59.41 2vjb h MET 175 Cb 0.22 -0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 2vjb h MET 175 CO -0.25 0.44 -0.40 0.00 0.23 0.00 0.00 176.91 176.93 2vjb h ALA 176 N 1.68 0.62 -0.60 0.39 0.00 -0.69 -0.81 119.26 119.85 2vjb h ALA 176 Ca 0.20 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 2vjb h ALA 176 Cb -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2vjb h ALA 176 CO -0.05 0.67 0.06 -0.07 0.00 0.00 0.00 179.25 179.87 2vjb h LEU 177 N 0.71 0.96 -1.17 0.00 3.38 0.18 -1.07 115.31 118.29 2vjb h LEU 177 Ca 0.06 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 2vjb h LEU 177 Cb 0.98 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.45 2vjb h LEU 177 CO 0.09 0.98 0.17 -0.61 0.09 0.00 0.00 178.44 179.16 2vjb h GLN 178 N 0.93 0.75 -0.48 1.13 5.75 -0.46 -0.01 115.11 122.71 2vjb h GLN 178 Ca 0.18 -0.13 -0.09 0.00 -0.15 0.00 0.00 58.65 58.47 2vjb h GLN 178 Cb 0.46 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.86 2vjb h GLN 178 CO 0.02 0.65 -0.03 2.35 -2.65 0.00 0.00 178.83 179.16 2vjb h TRP 179 N 0.74 0.96 -0.53 3.99 7.01 -0.38 -2.01 115.95 125.72 2vjb h TRP 179 Ca 0.17 -0.18 -0.08 0.00 2.11 0.00 0.00 58.89 60.91 2vjb h TRP 179 Cb 0.21 -0.24 -0.02 0.00 -2.10 0.00 0.00 29.16 27.00 2vjb h TRP 179 CO 0.01 0.92 -0.01 0.28 -2.79 0.00 0.00 178.44 176.85 2vjb h VAL 180 N 0.72 1.26 -0.35 2.65 2.07 -0.68 -0.05 116.25 121.87 2vjb h VAL 180 Ca 0.13 -1.08 -0.02 0.00 0.82 0.00 0.00 66.70 66.54 2vjb h VAL 180 Cb 0.56 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 2vjb h VAL 180 CO 0.03 0.39 0.11 -0.74 0.02 0.00 0.00 177.57 177.38 2vjb h HIS 181 N 0.84 0.49 0.00 1.57 -0.00 -0.76 0.09 115.15 117.38 2vjb h HIS 181 Ca 0.16 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.50 2vjb h HIS 181 Cb 0.51 -0.15 -0.00 0.00 -0.00 0.00 0.00 27.41 27.76 2vjb h HIS 181 CO 0.03 0.41 -1.53 -0.25 -0.00 0.00 0.00 177.93 176.59 2vjb n ASP 182 N -4.37 0.40 0.00 3.26 8.00 -0.78 -4.66 116.55 118.40 2vjb n ASP 182 Ca 0.02 0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.67 2vjb n ASP 182 Cb 0.16 1.26 0.00 0.00 -0.02 0.00 0.00 41.12 42.52 2vjb n ASP 182 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2vjb n ASN 183 N -2.46 0.82 0.25 -2.24 3.02 -0.06 -4.78 115.26 109.80 2vjb n ASN 183 Ca -0.02 -0.25 0.08 0.00 -0.03 0.00 0.00 54.58 54.36 2vjb n ASN 183 Cb 0.56 0.66 0.61 0.00 -0.61 0.00 0.00 39.78 41.00 2vjb n ASN 183 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2vjb h ILE 184 N 0.00 0.97 -0.09 2.41 6.09 -1.12 -0.64 117.51 125.14 2vjb h ILE 184 Ca 0.00 -0.34 0.03 0.00 -1.37 0.00 0.00 64.86 63.17 2vjb h ILE 184 Cb 0.00 1.19 -0.00 0.00 0.47 0.00 0.00 36.82 38.48 2vjb h ILE 184 CO 0.00 0.09 0.08 0.06 -3.07 0.00 0.00 178.15 175.31 2vjb h GLN 185 N 0.00 0.00 0.00 2.19 3.07 -1.77 0.18 115.11 118.78 2vjb h GLN 185 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2vjb h GLN 185 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.74 2vjb h GLN 185 CO 0.01 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.12 2vjb n PHE 186 N -4.27 0.00 -0.40 0.06 3.72 -0.25 -2.27 117.46 114.06 2vjb n PHE 186 Ca -0.01 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.45 2vjb n PHE 186 Cb 0.19 -0.40 0.16 0.00 -0.94 0.00 0.00 39.48 38.49 2vjb n PHE 186 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2vjb n PHE 187 N -1.40 0.50 -0.73 1.38 3.01 0.62 -4.92 117.46 115.92 2vjb n PHE 187 Ca 0.07 -0.62 0.00 0.00 1.01 0.00 0.00 57.45 57.91 2vjb n PHE 187 Cb 0.19 -0.11 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 2vjb n PHE 187 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vjb n GLY 188 N 0.03 0.60 3.54 1.37 0.00 -0.96 -4.72 105.19 105.04 2vjb n GLY 188 Ca 0.13 -0.32 -0.27 0.00 0.00 0.00 0.00 46.02 45.56 2vjb n GLY 188 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vjb s GLY 189 N -2.29 1.72 -0.39 -0.02 0.00 -1.13 -1.15 107.32 104.06 2vjb s GLY 189 Ca 0.00 -1.49 -0.23 0.00 0.00 0.00 0.00 44.72 43.00 2vjb s GLY 189 CO 0.00 -1.51 0.77 -0.35 0.00 0.00 0.00 173.10 172.01 2vjb s ASP 190 N -2.75 6.50 0.14 1.64 2.15 0.21 -3.41 116.67 121.15 2vjb s ASP 190 Ca 0.24 0.20 0.15 0.00 0.43 0.00 0.00 52.55 53.57 2vjb s ASP 190 Cb -0.09 -2.39 0.70 0.00 -0.30 0.00 0.00 42.92 40.84 2vjb s ASP 190 CO 0.14 -0.78 1.47 -0.81 -0.17 0.00 0.00 175.17 175.03 2vjb n PRO 191 N 6.48 0.08 0.00 4.34 -0.04 -1.26 -0.81 135.00 143.79 2vjb n PRO 191 Ca 0.02 0.43 0.14 0.00 -0.04 0.00 0.00 63.50 64.05 2vjb n PRO 191 Cb 0.48 -1.69 0.60 0.00 -0.04 0.00 0.00 33.50 32.85 2vjb n PRO 191 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2vjb n LYS 192 N -1.86 1.11 -3.19 0.54 5.02 -1.26 -4.26 118.16 114.26 2vjb n LYS 192 Ca 0.01 -0.49 -0.22 0.00 -2.02 0.00 0.00 58.31 55.59 2vjb n LYS 192 Cb 0.12 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.59 2vjb n LYS 192 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2vjb n THR 193 N -0.51 0.08 -4.52 -0.18 -1.04 0.01 -4.74 114.28 103.37 2vjb n THR 193 Ca 0.17 -4.46 -0.33 0.00 -2.04 0.00 0.00 64.05 57.39 2vjb n THR 193 Cb 0.29 -1.31 -0.13 0.00 -1.82 0.00 0.00 70.33 67.36 2vjb n THR 193 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2vjb s VAL 194 N -2.02 3.65 -0.19 12.58 0.11 -1.26 -1.96 120.40 131.32 2vjb s VAL 194 Ca 0.38 -0.45 -0.05 0.00 -2.93 0.00 0.00 61.98 58.94 2vjb s VAL 194 Cb 0.24 -2.58 -0.02 0.00 -1.53 0.00 0.00 36.38 32.49 2vjb s VAL 194 CO -0.09 0.50 -0.01 -0.89 -3.33 0.00 0.00 175.10 171.28 2vjb s THR 195 N 0.33 3.86 -0.16 5.04 2.01 0.84 -0.14 115.64 127.40 2vjb s THR 195 Ca -0.06 -0.35 -0.11 0.00 0.31 0.00 0.00 61.69 61.48 2vjb s THR 195 Cb -0.15 -2.73 -0.05 0.00 0.01 0.00 0.00 72.50 69.58 2vjb s THR 195 CO 0.04 0.44 0.20 0.27 -0.69 0.00 0.00 174.62 174.87 2vjb s ILE 196 N 0.94 5.37 -0.01 1.82 -4.36 -0.90 -0.55 121.20 123.51 2vjb s ILE 196 Ca 0.01 0.34 -0.03 0.00 -0.26 0.00 0.00 60.65 60.71 2vjb s ILE 196 Cb -0.14 -3.52 0.00 0.00 1.25 0.00 0.00 42.46 40.04 2vjb s ILE 196 CO 0.02 0.46 0.07 0.72 0.24 0.00 0.00 174.94 176.44 2vjb s PHE 197 N 0.09 0.02 0.16 1.37 -0.71 -0.39 -0.97 117.98 117.55 2vjb s PHE 197 Ca 0.13 -0.03 -0.22 0.00 -1.04 0.00 0.00 56.93 55.77 2vjb s PHE 197 Cb -0.12 -0.04 0.06 0.00 -1.21 0.00 0.00 43.02 41.71 2vjb s PHE 197 CO 0.02 -0.12 0.57 0.20 -1.34 0.00 0.00 175.22 174.55 2vjb s GLY 198 N -0.59 -0.53 0.06 1.99 0.00 -1.08 -1.43 107.32 105.74 2vjb s GLY 198 Ca -0.07 0.35 0.06 0.00 0.00 0.00 0.00 44.72 45.06 2vjb s GLY 198 CO 0.00 0.07 -0.10 1.85 0.00 0.00 0.00 173.10 174.92 2vjb s GLU 199 N -3.77 2.27 5.49 2.90 -6.30 -1.25 -1.19 118.70 116.84 2vjb s GLU 199 Ca 0.02 -0.92 0.00 0.00 -2.50 0.00 0.00 54.97 51.58 2vjb s GLU 199 Cb -0.01 -2.36 0.00 0.00 0.00 0.00 0.00 34.13 31.76 2vjb s GLU 199 CO -0.12 0.54 0.00 0.45 0.02 0.00 0.00 175.26 176.16 2vjb n SER 200 N 1.09 0.00 0.28 -1.70 2.88 0.27 0.27 113.62 116.71 2vjb n SER 200 Ca -0.14 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.54 2vjb n SER 200 Cb 0.52 0.00 0.82 0.00 -0.75 0.00 0.00 64.21 64.80 2vjb n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2vjb h ALA 201 N -0.75 1.27 -0.20 -1.46 0.00 -1.87 0.61 119.26 116.85 2vjb h ALA 201 Ca 0.00 -0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 2vjb h ALA 201 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2vjb h ALA 201 CO 0.00 0.09 -0.63 0.78 0.00 0.00 0.00 179.25 179.50 2vjb h GLY 202 N 0.69 0.78 1.50 0.00 0.00 -0.27 -0.97 103.07 104.80 2vjb h GLY 202 Ca -0.00 -0.98 -0.14 0.00 0.00 0.00 0.00 47.33 46.21 2vjb h GLY 202 CO 0.01 0.87 -0.47 -1.33 0.00 0.00 0.00 176.54 175.63 2vjb h GLY 203 N 0.84 0.59 1.08 4.60 0.00 -0.78 -1.49 103.07 107.91 2vjb h GLY 203 Ca -0.01 -0.63 -0.12 0.00 0.00 0.00 0.00 47.33 46.58 2vjb h GLY 203 CO 0.13 0.57 -0.13 0.00 0.00 0.00 0.00 176.54 177.11 2vjb h ALA 204 N 1.06 0.71 0.05 3.60 0.00 -0.88 -2.54 119.26 121.26 2vjb h ALA 204 Ca 0.03 -0.36 0.02 0.00 0.00 0.00 0.00 54.91 54.60 2vjb h ALA 204 Cb 0.98 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 2vjb h ALA 204 CO 0.09 0.64 -0.15 0.77 0.00 0.00 0.00 179.25 180.60 2vjb h SER 205 N 0.87 -0.43 -0.86 0.00 0.02 -0.90 0.03 113.55 112.28 2vjb h SER 205 Ca 0.13 0.06 0.13 0.00 -0.84 0.00 0.00 61.79 61.27 2vjb h SER 205 Cb 0.70 0.17 -0.09 0.00 0.14 0.00 0.00 62.40 63.32 2vjb h SER 205 CO 0.05 -0.22 0.47 0.58 -1.14 0.00 0.00 176.83 176.57 2vjb h VAL 206 N -0.28 0.80 0.00 2.27 2.07 -1.20 0.49 116.25 120.40 2vjb h VAL 206 Ca 0.04 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 2vjb h VAL 206 Cb 0.32 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2vjb h VAL 206 CO -0.11 0.13 -0.25 1.23 0.02 0.00 0.00 177.57 178.59 2vjb h GLY 207 N 0.70 0.00 1.93 2.17 0.00 -0.93 -2.13 103.07 104.81 2vjb h GLY 207 Ca 0.45 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.59 2vjb h GLY 207 CO -0.32 0.00 -0.86 -0.33 0.00 0.00 0.00 176.54 175.03 2vjb h MET 208 N 0.00 0.06 -0.01 4.80 2.86 0.18 -2.81 114.93 120.00 2vjb h MET 208 Ca -0.00 -0.07 -0.16 0.00 -2.06 0.00 0.00 59.70 57.41 2vjb h MET 208 Cb 0.57 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.24 2vjb h MET 208 CO 0.03 0.88 -0.73 0.45 1.06 0.00 0.00 176.91 178.61 2vjb h HIS 209 N 0.03 0.14 -0.13 -0.22 3.86 -0.58 0.08 115.15 118.34 2vjb h HIS 209 Ca -0.02 -0.06 -0.07 0.00 -1.16 0.00 0.00 60.37 59.05 2vjb h HIS 209 Cb 1.51 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.95 2vjb h HIS 209 CO 0.01 0.79 -0.24 0.82 0.86 0.00 0.00 177.93 180.17 2vjb h ILE 210 N 0.06 1.23 0.10 2.45 2.04 -1.32 -3.13 117.51 118.94 2vjb h ILE 210 Ca -0.02 -1.06 -0.31 0.00 1.00 0.00 0.00 64.86 64.47 2vjb h ILE 210 Cb 1.28 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.75 2vjb h ILE 210 CO 0.10 0.32 -1.65 -0.07 0.00 0.00 0.00 178.15 176.85 2vjb h LEU 211 N 0.20 0.32 -9.13 1.44 3.38 -1.23 0.11 115.31 110.40 2vjb h LEU 211 Ca 0.03 -0.53 -0.57 0.00 0.09 0.00 0.00 57.88 56.91 2vjb h LEU 211 Cb 0.54 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.14 2vjb h LEU 211 CO 0.04 1.45 0.92 -0.55 0.09 0.00 0.00 178.44 180.39 2vjb s SER 212 N -6.83 6.90 0.57 -0.43 0.15 -0.01 -4.71 113.70 109.35 2vjb s SER 212 Ca -0.11 1.65 0.29 0.00 0.70 0.00 0.00 55.95 58.48 2vjb s SER 212 Cb 0.07 -2.54 1.49 0.00 -1.71 0.00 0.00 66.02 63.33 2vjb s SER 212 CO 0.83 -0.81 1.94 -0.65 1.20 0.00 0.00 173.24 175.75 2vjb h PRO 213 N 8.40 0.00 -0.00 5.44 0.11 -1.85 -0.53 132.00 143.56 2vjb h PRO 213 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2vjb h PRO 213 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 2vjb h PRO 213 CO 0.98 0.00 -0.08 0.41 -0.21 0.00 0.00 178.00 179.10 2vjb n GLY 214 N -1.54 -1.35 0.04 -0.55 0.00 -1.26 -3.93 105.19 96.61 2vjb n GLY 214 Ca 0.09 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 45.91 2vjb n GLY 214 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vjb n SER 215 N -1.38 2.48 -0.35 1.61 7.64 -0.23 -4.77 113.62 118.61 2vjb n SER 215 Ca 0.09 0.00 0.13 0.00 1.01 0.00 0.00 58.87 60.10 2vjb n SER 215 Cb 0.31 0.90 0.26 0.00 -1.01 0.00 0.00 64.21 64.66 2vjb n SER 215 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2vjb h ARG 216 N 0.00 0.00 -0.02 1.43 3.08 -1.53 0.76 114.38 118.10 2vjb h ARG 216 Ca -0.22 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.83 2vjb h ARG 216 Cb 1.41 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.46 2vjb h ARG 216 CO 0.01 0.00 0.00 -0.25 -1.07 0.00 0.00 179.97 178.66 2vjb n ASP 217 N -5.53 0.17 -0.97 7.04 8.00 -1.26 -3.65 116.55 120.36 2vjb n ASP 217 Ca 0.22 -1.49 0.12 0.00 0.71 0.00 0.00 54.79 54.35 2vjb n ASP 217 Cb 0.70 -0.01 0.25 0.00 -0.02 0.00 0.00 41.12 42.04 2vjb n ASP 217 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2vjb n LEU 218 N -0.66 2.91 -3.47 0.64 4.77 0.26 -4.96 117.00 116.50 2vjb n LEU 218 Ca 0.13 -1.22 -0.12 0.00 -0.03 0.00 0.00 56.01 54.78 2vjb n LEU 218 Cb 0.09 -0.19 -0.02 0.00 -2.33 0.00 0.00 43.42 40.97 2vjb n LEU 218 CO 0.10 0.61 0.36 0.72 -1.33 0.00 0.00 177.39 177.84 2vjb s PHE 219 N -1.63 -0.47 -0.20 -1.77 -0.71 -1.24 -4.88 117.98 107.08 2vjb s PHE 219 Ca 0.36 0.24 -0.16 0.00 -1.04 0.00 0.00 56.93 56.32 2vjb s PHE 219 Cb 0.21 0.51 -0.12 0.00 -1.21 0.00 0.00 43.02 42.41 2vjb s PHE 219 CO 0.30 -0.83 -0.06 -2.13 -1.34 0.00 0.00 175.22 171.16 2vjb n ARG 220 N -0.35 0.53 -4.43 1.99 3.00 0.80 -4.94 116.66 113.25 2vjb n ARG 220 Ca -0.17 0.47 -0.22 0.00 -0.00 0.00 0.00 57.85 57.93 2vjb n ARG 220 Cb 0.65 -1.66 -0.09 0.00 0.00 0.00 0.00 32.46 31.36 2vjb n ARG 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2vjb s ARG 221 N -2.41 1.75 -0.09 -0.14 0.52 -1.13 -4.69 118.95 112.76 2vjb s ARG 221 Ca -0.26 -2.02 -0.09 0.00 -0.52 0.00 0.00 55.73 52.83 2vjb s ARG 221 Cb 0.06 -0.48 0.02 0.00 0.52 0.00 0.00 34.95 35.08 2vjb s ARG 221 CO 0.45 -0.41 0.26 0.00 0.02 0.00 0.00 175.30 175.62 2vjb s ALA 222 N -3.38 -0.65 -0.14 2.13 0.00 -1.19 -2.12 121.76 116.42 2vjb s ALA 222 Ca 0.31 0.70 0.03 0.00 0.00 0.00 0.00 51.96 52.99 2vjb s ALA 222 Cb 0.05 -0.39 0.01 0.00 0.00 0.00 0.00 23.12 22.78 2vjb s ALA 222 CO 0.16 -0.13 -0.22 0.42 0.00 0.00 0.00 175.76 175.99 2vjb s ILE 223 N 0.02 2.02 -0.19 0.00 1.01 -0.14 -2.19 121.20 121.73 2vjb s ILE 223 Ca -0.01 -0.96 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 2vjb s ILE 223 Cb -0.02 -1.79 0.01 0.00 0.01 0.00 0.00 42.46 40.67 2vjb s ILE 223 CO 0.01 0.54 -0.15 -0.76 0.00 0.00 0.00 174.94 174.58 2vjb s LEU 224 N 0.81 2.39 -0.25 2.97 1.02 -0.70 -2.65 118.68 122.27 2vjb s LEU 224 Ca -0.07 -0.56 -0.04 0.00 0.02 0.00 0.00 54.13 53.47 2vjb s LEU 224 Cb -0.16 -1.57 0.00 0.00 0.02 0.00 0.00 46.19 44.49 2vjb s LEU 224 CO -0.02 -0.01 -0.00 -1.10 0.02 0.00 0.00 176.35 175.24 2vjb s GLN 225 N 1.35 3.17 -1.43 1.70 -0.21 -0.34 -2.40 119.66 121.51 2vjb s GLN 225 Ca 0.05 -0.77 -0.02 0.00 0.02 0.00 0.00 55.36 54.64 2vjb s GLN 225 Cb -0.13 -3.13 0.02 0.00 1.00 0.00 0.00 33.01 30.76 2vjb s GLN 225 CO -0.10 -0.32 0.48 0.43 -2.12 0.00 0.00 175.29 173.67 2vjb n SER 226 N 4.79 -0.73 0.00 5.90 7.64 -0.10 -0.56 113.62 130.56 2vjb n SER 226 Ca -0.17 -0.99 0.00 0.00 1.01 0.00 0.00 58.87 58.73 2vjb n SER 226 Cb 0.49 -3.12 0.00 0.00 -1.01 0.00 0.00 64.21 60.57 2vjb n SER 226 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vjb n GLY 227 N -1.90 1.43 3.20 0.23 0.00 -1.26 -2.96 105.19 103.93 2vjb n GLY 227 Ca -0.27 0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.67 2vjb n GLY 227 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vjb s SER 228 N 0.00 0.10 0.47 1.61 1.04 -1.26 -3.94 113.70 111.72 2vjb s SER 228 Ca 0.00 -0.59 0.16 0.00 0.48 0.00 0.00 55.95 55.99 2vjb s SER 228 Cb 0.00 0.33 1.13 0.00 0.10 0.00 0.00 66.02 67.57 2vjb s SER 228 CO 0.00 -0.69 2.03 1.55 0.98 0.00 0.00 173.24 177.11 2vjb h PRO 229 N 2.90 0.26 -0.30 4.02 0.13 -1.80 -2.77 132.00 134.45 2vjb h PRO 229 Ca -0.34 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2vjb h PRO 229 Cb 1.20 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2vjb h PRO 229 CO 0.55 0.17 0.00 0.27 -0.23 0.00 0.00 178.00 178.76 2vjb n ASN 230 N -4.47 1.53 -4.74 1.44 6.94 -1.26 -4.75 115.26 109.95 2vjb n ASN 230 Ca 0.06 -2.01 -0.40 0.00 -0.02 0.00 0.00 54.58 52.22 2vjb n ASN 230 Cb 0.32 -0.20 0.02 0.00 -2.36 0.00 0.00 39.78 37.57 2vjb n ASN 230 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2vjb n PRO 232 N -0.35 0.13 -0.00 0.00 -0.04 -1.26 -2.05 135.00 131.42 2vjb n PRO 232 Ca 0.07 0.63 0.06 0.00 -0.04 0.00 0.00 63.50 64.22 2vjb n PRO 232 Cb 0.42 -1.93 -0.08 0.00 -0.04 0.00 0.00 33.50 31.87 2vjb n PRO 232 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2vjb n TRP 233 N -2.20 0.00 1.23 0.54 4.27 -1.26 -4.60 117.44 115.41 2vjb n TRP 233 Ca -0.01 0.00 0.13 0.00 -3.89 0.00 0.00 57.50 53.73 2vjb n TRP 233 Cb 0.03 -0.06 0.66 0.00 -1.36 0.00 0.00 31.31 30.58 2vjb n TRP 233 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2vjb n ALA 234 N -1.43 2.31 -3.60 -1.67 0.00 -0.87 -4.69 120.51 110.57 2vjb n ALA 234 Ca 0.01 -0.12 -0.08 0.00 0.00 0.00 0.00 53.44 53.25 2vjb n ALA 234 Cb 0.23 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.23 2vjb n ALA 234 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2vjb s SER 235 N -2.58 -0.36 0.09 0.00 1.04 -1.26 -3.71 113.70 106.93 2vjb s SER 235 Ca 0.25 -0.19 -0.03 0.00 0.48 0.00 0.00 55.95 56.46 2vjb s SER 235 Cb 0.18 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.78 2vjb s SER 235 CO 0.40 -0.89 0.06 0.68 0.98 0.00 0.00 173.24 174.47 2vjb s VAL 236 N -3.44 0.16 0.85 5.02 -7.23 -0.81 -4.99 120.40 109.95 2vjb s VAL 236 Ca 0.07 -1.69 -0.12 0.00 -1.81 0.00 0.00 61.98 58.43 2vjb s VAL 236 Cb -0.02 -1.66 0.10 0.00 0.56 0.00 0.00 36.38 35.36 2vjb s VAL 236 CO -0.05 -0.73 1.11 -0.94 -0.31 0.00 0.00 175.10 174.18 2vjb s SER 237 N -2.95 4.07 0.27 4.85 1.04 -1.26 -2.36 113.70 117.36 2vjb s SER 237 Ca 0.12 1.18 -0.03 0.00 0.48 0.00 0.00 55.95 57.71 2vjb s SER 237 Cb 0.07 -1.86 0.36 0.00 0.10 0.00 0.00 66.02 64.69 2vjb s SER 237 CO -0.06 -2.22 1.86 -0.37 0.98 0.00 0.00 173.24 173.42 2vjb h VAL 238 N -1.27 1.23 -0.20 5.02 -1.51 -1.95 -0.70 116.25 116.87 2vjb h VAL 238 Ca -0.48 -0.70 -0.01 0.00 -1.23 0.00 0.00 66.70 64.28 2vjb h VAL 238 Cb 1.29 0.41 -0.01 0.00 -2.13 0.00 0.00 31.29 30.85 2vjb h VAL 238 CO 0.60 0.28 0.10 0.00 -1.23 0.00 0.00 177.57 177.32 2vjb h ALA 239 N 1.34 0.26 -0.38 5.19 0.00 -1.95 -0.46 119.26 123.26 2vjb h ALA 239 Ca 0.23 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2vjb h ALA 239 Cb 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2vjb h ALA 239 CO -0.02 -0.19 -0.05 1.49 0.00 0.00 0.00 179.25 180.47 2vjb h GLU 240 N 0.20 0.63 -0.59 0.00 4.57 -1.86 -1.02 114.58 116.50 2vjb h GLU 240 Ca 0.07 -0.17 -0.08 0.00 -1.18 0.00 0.00 59.36 58.00 2vjb h GLU 240 Cb 0.10 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 2vjb h GLU 240 CO -0.01 0.69 0.04 0.78 -1.18 0.00 0.00 179.01 179.32 2vjb h GLY 241 N 0.93 1.09 0.73 1.92 0.00 -0.78 -2.02 103.07 104.94 2vjb h GLY 241 Ca 0.11 -0.75 -0.04 0.00 0.00 0.00 0.00 47.33 46.66 2vjb h GLY 241 CO 0.02 0.69 -0.05 -0.09 0.00 0.00 0.00 176.54 177.11 2vjb h ARG 242 N 0.93 0.27 -0.32 4.80 2.43 -0.66 -1.13 114.38 120.70 2vjb h ARG 242 Ca 0.18 -0.11 0.06 0.00 -0.81 0.00 0.00 59.98 59.30 2vjb h ARG 242 Cb 0.49 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.97 2vjb h ARG 242 CO 0.02 0.59 -0.08 -0.09 -1.51 0.00 0.00 179.97 178.91 2vjb h ARG 243 N -0.06 0.00 -0.77 0.20 2.43 -1.10 0.22 114.38 115.30 2vjb h ARG 243 Ca 0.03 -0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.15 2vjb h ARG 243 Cb 0.51 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 2vjb h ARG 243 CO 0.02 0.00 0.30 0.00 -1.51 0.00 0.00 179.97 178.78 2vjb h ARG 244 N 0.00 1.16 -0.25 0.20 3.08 -1.34 0.27 114.38 117.50 2vjb h ARG 244 Ca 0.15 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 2vjb h ARG 244 Cb 0.23 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2vjb h ARG 244 CO -0.32 0.94 0.13 0.00 -1.07 0.00 0.00 179.97 179.65 2vjb h ALA 245 N 1.20 0.32 -0.61 0.04 0.00 -0.31 -0.41 119.26 119.49 2vjb h ALA 245 Ca 0.26 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 2vjb h ALA 245 Cb 0.22 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2vjb h ALA 245 CO -0.02 -0.14 0.07 0.28 0.00 0.00 0.00 179.25 179.45 2vjb h VAL 246 N 0.28 1.26 -0.55 0.00 2.07 -0.31 -2.63 116.25 116.36 2vjb h VAL 246 Ca 0.09 -1.03 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 2vjb h VAL 246 Cb 0.09 0.70 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 2vjb h VAL 246 CO -0.01 0.38 0.23 -0.08 0.02 0.00 0.00 177.57 178.10 2vjb h GLU 247 N 0.95 0.79 -0.66 1.57 4.57 -0.10 -1.14 114.58 120.57 2vjb h GLU 247 Ca 0.19 -0.11 -0.07 0.00 -1.18 0.00 0.00 59.36 58.19 2vjb h GLU 247 Cb 0.45 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.87 2vjb h GLU 247 CO 0.02 0.64 0.15 1.25 -1.18 0.00 0.00 179.01 179.89 2vjb h LEU 248 N 0.78 0.99 -0.41 1.64 5.85 -0.73 -1.36 115.31 122.08 2vjb h LEU 248 Ca 0.19 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 2vjb h LEU 248 Cb 0.14 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2vjb h LEU 248 CO -0.02 0.96 0.02 1.23 -0.34 0.00 0.00 178.44 180.29 2vjb h GLY 249 N 1.06 0.76 1.48 3.75 0.00 -1.07 -2.79 103.07 106.25 2vjb h GLY 249 Ca 0.21 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 2vjb h GLY 249 CO 0.00 0.50 0.31 -0.09 0.00 0.00 0.00 176.54 177.26 2vjb h ARG 250 N 0.54 0.69 0.00 4.80 2.43 -0.90 -0.46 114.38 121.48 2vjb h ARG 250 Ca 0.12 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 2vjb h ARG 250 Cb 0.44 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 2vjb h ARG 250 CO 0.02 0.48 0.00 0.09 -1.51 0.00 0.00 179.97 179.05 2vjb n ASN 251 N -4.43 0.00 -0.13 -3.80 3.02 -0.54 -2.83 115.26 106.54 2vjb n ASN 251 Ca 0.05 0.21 0.04 0.00 -0.03 0.00 0.00 54.58 54.85 2vjb n ASN 251 Cb 0.07 -0.36 0.05 0.00 -0.61 0.00 0.00 39.78 38.93 2vjb n ASN 251 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2vjb n LEU 252 N -1.36 1.40 -3.51 3.41 4.77 -0.31 -5.01 117.00 116.38 2vjb n LEU 252 Ca 0.06 -1.88 -0.19 0.00 -0.03 0.00 0.00 56.01 53.98 2vjb n LEU 252 Cb 0.15 -0.16 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 2vjb n LEU 252 CO 0.13 0.45 0.04 0.59 -1.33 0.00 0.00 177.39 177.27 2vjb n ASN 253 N -0.66 -2.12 -4.91 -1.43 3.02 -0.91 -4.99 115.26 103.24 2vjb n ASN 253 Ca 0.06 -0.70 -0.29 0.00 -0.03 0.00 0.00 54.58 53.62 2vjb n ASN 253 Cb 0.53 -4.74 -0.04 0.00 -0.61 0.00 0.00 39.78 34.92 2vjb n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vjb s ASN 255 N -2.98 6.24 -0.30 0.00 3.84 -1.26 -4.73 114.94 115.76 2vjb s ASN 255 Ca 0.41 1.31 0.09 0.00 0.21 0.00 0.00 52.86 54.88 2vjb s ASN 255 Cb -0.11 -2.53 0.71 0.00 -0.55 0.00 0.00 41.25 38.76 2vjb s ASN 255 CO 0.28 -1.42 1.74 0.18 -2.79 0.00 0.00 177.10 175.08 2vjb n LEU 256 N 9.03 5.83 0.10 3.21 4.77 -1.26 -3.02 117.00 135.66 2vjb n LEU 256 Ca 0.19 -3.02 0.13 0.00 -0.03 0.00 0.00 56.01 53.28 2vjb n LEU 256 Cb 0.46 -0.73 0.43 0.00 -2.33 0.00 0.00 43.42 41.25 2vjb n LEU 256 CO 0.67 0.76 0.89 0.59 -1.33 0.00 0.00 177.39 178.97 2vjb n ASN 257 N -0.05 0.74 -3.56 -1.43 3.02 -1.26 -4.92 115.26 107.81 2vjb n ASN 257 Ca 0.37 0.58 -0.06 0.00 -0.03 0.00 0.00 54.58 55.45 2vjb n ASN 257 Cb 1.31 -0.78 -0.02 0.00 -0.61 0.00 0.00 39.78 39.69 2vjb n ASN 257 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2vjb s SER 258 N -4.39 -0.25 0.29 6.41 1.04 -1.26 -5.03 113.70 110.50 2vjb s SER 258 Ca 0.10 -0.03 -0.02 0.00 0.48 0.00 0.00 55.95 56.48 2vjb s SER 258 Cb 0.12 0.29 0.41 0.00 0.10 0.00 0.00 66.02 66.94 2vjb s SER 258 CO 0.56 -0.47 1.89 0.44 0.98 0.00 0.00 173.24 176.65 2vjb h ASP 259 N 2.00 0.88 -0.41 7.02 3.32 -1.93 -0.53 116.42 126.76 2vjb h ASP 259 Ca -0.17 -0.09 -0.01 0.00 0.02 0.00 0.00 57.03 56.77 2vjb h ASP 259 Cb 1.21 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 40.52 2vjb h ASP 259 CO 0.27 0.74 0.21 -0.33 -1.72 0.00 0.00 179.24 178.41 2vjb h GLU 260 N 0.98 0.59 -0.17 3.56 3.07 -1.97 0.91 114.58 121.55 2vjb h GLU 260 Ca 0.24 -0.08 -0.08 0.00 -0.50 0.00 0.00 59.36 58.94 2vjb h GLU 260 Cb 0.08 -0.11 -0.00 0.00 -0.84 0.00 0.00 28.75 27.88 2vjb h GLU 260 CO -0.03 0.50 -0.21 0.93 -1.40 0.00 0.00 179.01 178.80 2vjb h GLU 261 N 0.53 0.44 0.07 2.33 5.08 -1.80 0.32 114.58 121.54 2vjb h GLU 261 Ca 0.14 -0.25 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2vjb h GLU 261 Cb 0.10 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 2vjb h GLU 261 CO -0.02 0.82 -0.11 1.25 -1.00 0.00 0.00 179.01 179.96 2vjb h LEU 262 N 0.08 -0.29 -1.04 1.33 5.85 -1.00 0.28 115.31 120.50 2vjb h LEU 262 Ca 0.02 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.73 2vjb h LEU 262 Cb 0.76 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 2vjb h LEU 262 CO 0.05 -0.16 0.19 0.40 -0.34 0.00 0.00 178.44 178.58 2vjb h ILE 263 N -0.22 1.22 -0.55 4.05 2.04 -0.83 -0.15 117.51 123.06 2vjb h ILE 263 Ca 0.02 -0.75 -0.11 0.00 1.00 0.00 0.00 64.86 65.02 2vjb h ILE 263 Cb 0.23 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.86 2vjb h ILE 263 CO -0.06 0.29 -0.08 -0.74 0.00 0.00 0.00 178.15 177.56 2vjb h HIS 264 N 0.86 1.13 -0.44 1.37 2.76 -0.42 -1.15 115.15 119.26 2vjb h HIS 264 Ca 0.20 -0.22 -0.02 0.00 -2.20 0.00 0.00 60.37 58.12 2vjb h HIS 264 Cb 0.23 -0.28 -0.02 0.00 1.55 0.00 0.00 27.41 28.89 2vjb h HIS 264 CO 0.02 1.03 0.18 0.00 -1.30 0.00 0.00 177.93 177.86 2vjb h LEU 266 N 0.57 0.00 0.00 0.00 3.38 -0.83 -2.71 115.31 115.72 2vjb h LEU 266 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2vjb h LEU 266 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2vjb h LEU 266 CO -0.01 0.14 -0.10 0.03 0.09 0.00 0.00 178.44 178.59 2vjb h ARG 267 N 0.00 0.00 0.00 1.13 3.08 -0.98 -3.20 114.38 114.42 2vjb h ARG 267 Ca -0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 2vjb h ARG 267 Cb 0.63 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 2vjb h ARG 267 CO 0.02 0.00 -0.52 0.93 -1.07 0.00 0.00 179.97 179.33 2vjb h GLU 268 N 0.00 0.00 -7.12 0.04 4.39 -1.32 -3.47 114.58 107.10 2vjb h GLU 268 Ca 0.00 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.21 2vjb h GLU 268 Cb 0.89 0.00 0.06 0.00 -0.10 0.00 0.00 28.75 29.60 2vjb h GLU 268 CO 0.00 0.21 0.40 0.15 -1.16 0.00 0.00 179.01 178.61 2vjb s LYS 269 N -3.11 3.41 0.42 2.33 -0.14 -1.21 -5.03 119.74 116.41 2vjb s LYS 269 Ca 0.03 1.44 -0.22 0.00 -1.36 0.00 0.00 55.97 55.86 2vjb s LYS 269 Cb 0.07 -2.03 -0.09 0.00 -1.68 0.00 0.00 37.83 34.10 2vjb s LYS 269 CO 0.73 -0.77 1.01 0.15 -0.76 0.00 0.00 175.35 175.71 2vjb s LYS 270 N -3.51 4.14 0.19 1.68 1.02 -1.26 -4.96 119.74 117.04 2vjb s LYS 270 Ca 0.69 1.34 -0.21 0.00 0.02 0.00 0.00 55.97 57.81 2vjb s LYS 270 Cb -0.20 -2.36 0.12 0.00 -0.52 0.00 0.00 37.83 34.87 2vjb s LYS 270 CO 0.28 -0.13 1.58 -1.35 -0.92 0.00 0.00 175.35 174.81 2vjb h PRO 271 N 2.18 -0.16 0.00 -1.68 0.11 -1.96 0.79 132.00 131.29 2vjb h PRO 271 Ca -0.49 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 2vjb h PRO 271 Cb 1.20 0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2vjb h PRO 271 CO 0.61 -0.10 -0.01 0.37 -0.21 0.00 0.00 178.00 178.66 2vjb h GLN 272 N -0.16 0.00 -0.19 1.05 5.75 -1.99 -1.68 115.11 117.89 2vjb h GLN 272 Ca 0.23 0.00 -0.18 0.00 -0.15 0.00 0.00 58.65 58.55 2vjb h GLN 272 Cb 0.56 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.11 2vjb h GLN 272 CO -0.70 0.01 -0.62 0.93 -2.65 0.00 0.00 178.83 175.79 2vjb h GLU 273 N 0.00 0.65 -0.07 1.69 5.08 -1.21 -0.89 114.58 119.83 2vjb h GLU 273 Ca -0.00 -0.45 -0.04 0.00 -1.00 0.00 0.00 59.36 57.87 2vjb h GLU 273 Cb 0.05 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2vjb h GLU 273 CO 0.00 1.07 -0.10 -0.07 -1.00 0.00 0.00 179.01 178.91 2vjb h LEU 274 N 0.48 0.21 -1.02 1.33 4.07 -1.23 -3.23 115.31 115.92 2vjb h LEU 274 Ca -0.01 -0.53 0.09 0.00 0.08 0.00 0.00 57.88 57.51 2vjb h LEU 274 Cb 1.20 -0.06 -0.07 0.00 1.08 0.00 0.00 40.66 42.81 2vjb h LEU 274 CO 0.12 0.70 0.64 0.40 -1.08 0.00 0.00 178.44 179.22 2vjb h ILE 275 N -0.28 1.01 -0.26 1.22 2.04 -1.42 -2.28 117.51 117.55 2vjb h ILE 275 Ca 0.01 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.56 2vjb h ILE 275 Cb 0.65 -0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.54 2vjb h ILE 275 CO 0.02 0.20 0.20 0.44 0.00 0.00 0.00 178.15 179.01 2vjb h ASP 276 N 1.10 0.00 -0.11 1.72 3.32 -1.17 -2.63 116.42 118.64 2vjb h ASP 276 Ca 0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 2vjb h ASP 276 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 2vjb h ASP 276 CO -0.21 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.64 2vjb n VAL 277 N -4.33 0.35 -0.32 -1.35 0.24 -0.92 -4.76 118.33 107.24 2vjb n VAL 277 Ca 0.03 -0.67 0.03 0.00 -2.04 0.00 0.00 64.34 61.69 2vjb n VAL 277 Cb 0.35 0.96 0.10 0.00 -1.47 0.00 0.00 33.84 33.78 2vjb n VAL 277 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2vjb h GLU 278 N 1.87 -0.01 0.00 7.34 4.81 -1.03 0.46 114.58 128.01 2vjb h GLU 278 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2vjb h GLU 278 Cb 0.51 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.89 2vjb h GLU 278 CO 0.00 -0.01 0.00 0.91 -0.73 0.00 0.00 179.01 179.18 2vjb n TRP 279 N -5.55 0.00 0.28 0.92 7.02 -1.26 -3.31 117.44 115.54 2vjb n TRP 279 Ca 0.13 0.00 0.15 0.00 -1.02 0.00 0.00 57.50 56.75 2vjb n TRP 279 Cb 0.44 -0.42 0.47 0.00 -2.42 0.00 0.00 31.31 29.38 2vjb n TRP 279 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 2vjb h ASN 280 N 0.00 0.00 0.32 -0.99 2.35 -1.25 -3.21 115.58 112.80 2vjb h ASN 280 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2vjb h ASN 280 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2vjb h ASN 280 CO 0.00 0.00 -0.06 1.33 -1.65 0.00 0.00 177.43 177.05 2vjb n VAL 281 N -3.02 0.00 -2.12 2.81 0.24 -1.21 -4.90 118.33 110.13 2vjb n VAL 281 Ca 0.02 -0.05 -0.39 0.00 -2.04 0.00 0.00 64.34 61.88 2vjb n VAL 281 Cb 0.39 -0.22 -0.01 0.00 -1.47 0.00 0.00 33.84 32.54 2vjb n VAL 281 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2vjb s LEU 282 N -2.39 4.25 0.15 1.34 1.43 -1.22 -4.76 118.68 117.47 2vjb s LEU 282 Ca 0.33 2.58 -0.18 0.00 -1.03 0.00 0.00 54.13 55.83 2vjb s LEU 282 Cb 0.20 -3.89 0.04 0.00 0.03 0.00 0.00 46.19 42.58 2vjb s LEU 282 CO 0.45 -0.75 1.72 -0.65 0.23 0.00 0.00 176.35 177.34 2vjb h PRO 283 N 2.79 0.11 -4.74 1.29 0.11 -1.94 -3.46 132.00 126.17 2vjb h PRO 283 Ca -0.49 -0.01 -0.34 0.00 0.11 0.00 0.00 66.00 65.28 2vjb h PRO 283 Cb 1.24 -0.03 -0.14 0.00 0.11 0.00 0.00 31.00 32.18 2vjb h PRO 283 CO 0.63 0.07 -0.57 -0.06 -0.21 0.00 0.00 178.00 177.86 2vjb s PHE 284 N -6.18 1.41 0.31 0.65 0.08 -1.26 -5.11 117.98 107.88 2vjb s PHE 284 Ca -0.13 -1.45 -0.29 0.00 0.12 0.00 0.00 56.93 55.18 2vjb s PHE 284 Cb 0.12 -0.67 -0.10 0.00 -0.57 0.00 0.00 43.02 41.80 2vjb s PHE 284 CO 0.70 -0.67 1.38 -0.51 -0.10 0.00 0.00 175.22 176.01 2vjb s ASP 285 N -3.26 6.68 0.12 1.36 -0.00 -1.26 -4.95 116.67 115.36 2vjb s ASP 285 Ca 0.39 2.73 -0.26 0.00 -0.00 0.00 0.00 52.55 55.41 2vjb s ASP 285 Cb 0.05 -2.64 0.08 0.00 -0.00 0.00 0.00 42.92 40.41 2vjb s ASP 285 CO 0.17 -0.64 1.05 -0.94 -0.00 0.00 0.00 175.17 174.81 2vjb s SER 286 N -0.15 -0.12 0.03 0.27 1.04 -1.26 -4.82 113.70 108.69 2vjb s SER 286 Ca 0.53 -0.38 0.04 0.00 0.48 0.00 0.00 55.95 56.62 2vjb s SER 286 Cb -0.41 0.42 -0.02 0.00 0.10 0.00 0.00 66.02 66.10 2vjb s SER 286 CO 0.51 -0.78 -0.12 0.27 0.98 0.00 0.00 173.24 174.10 2vjb s ILE 287 N -2.94 0.91 -1.07 -1.02 -4.36 -1.17 -4.76 121.20 106.79 2vjb s ILE 287 Ca 0.14 -0.89 -0.04 0.00 -0.26 0.00 0.00 60.65 59.60 2vjb s ILE 287 Cb -0.00 -0.84 0.00 0.00 1.25 0.00 0.00 42.46 42.87 2vjb s ILE 287 CO 0.01 -0.04 0.59 0.33 0.24 0.00 0.00 174.94 176.08 2vjb n PHE 288 N 2.00 -1.66 -4.35 1.37 -0.00 -1.26 -4.82 117.46 108.74 2vjb n PHE 288 Ca -0.18 0.51 -0.21 0.00 -0.00 0.00 0.00 57.45 57.57 2vjb n PHE 288 Cb 0.55 -3.67 -0.16 0.00 -0.00 0.00 0.00 39.48 36.20 2vjb n PHE 288 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2vjb s ARG 289 N -5.58 1.03 0.02 -4.13 1.81 -1.26 -4.71 118.95 106.13 2vjb s ARG 289 Ca 0.29 -0.25 0.07 0.00 -1.72 0.00 0.00 55.73 54.12 2vjb s ARG 289 Cb -0.13 -0.95 -0.02 0.00 -0.45 0.00 0.00 34.95 33.40 2vjb s ARG 289 CO 0.36 0.04 -0.20 -0.06 -0.68 0.00 0.00 175.30 174.76 2vjb s PHE 290 N 0.50 1.80 0.07 -0.53 0.08 -1.26 -5.06 117.98 113.58 2vjb s PHE 290 Ca -0.08 -0.36 -0.31 0.00 0.12 0.00 0.00 56.93 56.30 2vjb s PHE 290 Cb -0.12 -1.10 -0.18 0.00 -0.57 0.00 0.00 43.02 41.05 2vjb s PHE 290 CO 0.01 0.05 1.64 0.77 -0.10 0.00 0.00 175.22 177.59 2vjb h SER 291 N 5.14 -0.65 -3.69 1.36 0.02 -1.91 -3.42 113.55 110.40 2vjb h SER 291 Ca -0.41 0.02 -0.68 0.00 -0.84 0.00 0.00 61.79 59.88 2vjb h SER 291 Cb 1.15 0.17 -0.34 0.00 0.14 0.00 0.00 62.40 63.52 2vjb h SER 291 CO 0.45 -0.46 -0.67 -0.36 -1.14 0.00 0.00 176.83 174.65 2vjb s PHE 292 N -6.08 3.40 0.33 3.45 0.08 -1.26 -5.00 117.98 112.91 2vjb s PHE 292 Ca -0.17 -2.16 0.03 0.00 0.12 0.00 0.00 56.93 54.75 2vjb s PHE 292 Cb 0.04 -2.48 -0.04 0.00 -0.57 0.00 0.00 43.02 39.97 2vjb s PHE 292 CO 0.63 -0.87 0.11 0.14 -0.10 0.00 0.00 175.22 175.13 2vjb s VAL 293 N 1.18 0.72 0.80 -0.44 -7.23 -1.26 -4.42 120.40 109.75 2vjb s VAL 293 Ca -0.00 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.02 2vjb s VAL 293 Cb -0.20 -2.58 -0.02 0.00 0.56 0.00 0.00 36.38 34.13 2vjb s VAL 293 CO -0.03 0.00 0.40 -2.65 -0.31 0.00 0.00 175.10 172.51 2vjb n PRO 294 N -0.69 0.09 -4.53 4.82 -0.02 -1.24 -4.69 135.00 128.75 2vjb n PRO 294 Ca -0.02 0.07 -0.23 0.00 -2.02 0.00 0.00 63.50 61.30 2vjb n PRO 294 Cb 0.66 -1.77 -0.14 0.00 -0.02 0.00 0.00 33.50 32.23 2vjb n PRO 294 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2vjb s VAL 295 N -2.07 1.34 -1.10 -1.45 -7.23 -1.26 -1.93 120.40 106.71 2vjb s VAL 295 Ca 0.61 -1.02 -0.22 0.00 -1.81 0.00 0.00 61.98 59.55 2vjb s VAL 295 Cb -0.30 -1.18 0.06 0.00 0.56 0.00 0.00 36.38 35.52 2vjb s VAL 295 CO 0.63 0.14 1.52 -0.63 -0.31 0.00 0.00 175.10 176.45 2vjb s ILE 296 N -0.75 3.99 -1.21 -0.62 -1.09 -0.99 -4.78 121.20 115.75 2vjb s ILE 296 Ca 0.05 -1.09 0.26 0.00 -2.23 0.00 0.00 60.65 57.63 2vjb s ILE 296 Cb -0.08 -5.09 0.12 0.00 -1.58 0.00 0.00 42.46 35.82 2vjb s ILE 296 CO 0.01 -1.96 1.52 -0.90 -1.23 0.00 0.00 174.94 172.39 2vjb n ASP 297 N 8.71 0.57 0.00 3.58 5.75 -1.26 -4.32 116.55 129.58 2vjb n ASP 297 Ca 0.37 -0.35 0.00 0.00 -0.01 0.00 0.00 54.79 54.80 2vjb n ASP 297 Cb 0.50 0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.72 2vjb n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vjb n GLY 298 N 1.45 0.73 0.04 6.12 0.00 -0.23 -4.83 105.19 108.47 2vjb n GLY 298 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2vjb n GLY 298 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vjb n GLU 299 N -2.20 0.00 -0.27 1.61 2.13 -1.26 -4.39 120.64 116.26 2vjb n GLU 299 Ca 0.00 0.00 0.07 0.00 0.66 0.00 0.00 57.16 57.89 2vjb n GLU 299 Cb 0.02 -0.00 0.30 0.00 0.27 0.00 0.00 31.44 32.03 2vjb n GLU 299 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 2vjb h PHE 300 N 0.00 0.93 -3.58 4.31 3.04 -1.92 -3.30 116.94 116.41 2vjb h PHE 300 Ca 0.00 0.02 -0.68 0.00 3.98 0.00 0.00 57.97 61.29 2vjb h PHE 300 Cb 0.00 -0.30 -0.35 0.00 2.56 0.00 0.00 35.95 37.85 2vjb h PHE 300 CO 0.00 0.44 -0.62 -0.06 -2.02 0.00 0.00 178.31 176.06 2vjb s PHE 301 N -5.80 3.56 0.21 0.41 0.08 -1.26 -4.45 117.98 110.74 2vjb s PHE 301 Ca -0.11 -2.43 -0.17 0.00 0.12 0.00 0.00 56.93 54.34 2vjb s PHE 301 Cb 0.20 -2.94 0.22 0.00 -0.57 0.00 0.00 43.02 39.93 2vjb s PHE 301 CO 0.79 -0.94 1.59 -1.35 -0.10 0.00 0.00 175.22 175.21 2vjb h PRO 302 N 7.95 -0.07 0.00 0.24 0.11 -1.77 -0.59 132.00 137.87 2vjb h PRO 302 Ca -0.13 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.84 2vjb h PRO 302 Cb 1.04 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 2vjb h PRO 302 CO 0.63 -0.05 -0.12 0.25 -0.21 0.00 0.00 178.00 178.50 2vjb n THR 303 N -5.47 0.00 -1.62 -1.15 -2.24 -1.26 -4.49 114.28 98.05 2vjb n THR 303 Ca 0.08 -0.86 -0.43 0.00 -2.27 0.00 0.00 64.05 60.56 2vjb n THR 303 Cb 0.38 0.49 -0.00 0.00 -2.10 0.00 0.00 70.33 69.09 2vjb n THR 303 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2vjb n SER 304 N -2.13 1.59 -0.27 3.42 3.41 -1.26 -4.80 113.62 113.58 2vjb n SER 304 Ca 0.01 1.13 0.03 0.00 -0.26 0.00 0.00 58.87 59.79 2vjb n SER 304 Cb 0.25 -1.35 0.16 0.00 -0.26 0.00 0.00 64.21 63.01 2vjb n SER 304 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2vjb h LEU 305 N 1.94 0.55 0.00 1.04 3.38 -1.99 -1.96 115.31 118.28 2vjb h LEU 305 Ca -0.43 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 2vjb h LEU 305 Cb 1.33 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2vjb h LEU 305 CO 0.60 0.30 -0.00 -0.08 0.09 0.00 0.00 178.44 179.35 2vjb h GLU 306 N 0.68 -0.00 0.00 1.13 4.57 -2.00 -2.16 114.58 116.79 2vjb h GLU 306 Ca 0.39 0.00 -0.03 0.00 -1.18 0.00 0.00 59.36 58.54 2vjb h GLU 306 Cb 0.42 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 2vjb h GLU 306 CO -0.28 0.03 -0.15 0.66 -1.18 0.00 0.00 179.01 178.09 2vjb h SER 307 N -0.04 0.00 0.18 1.04 4.64 -1.82 -1.58 113.55 115.97 2vjb h SER 307 Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 2vjb h SER 307 Cb 0.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.12 2vjb h SER 307 CO 0.00 0.15 -0.53 0.24 -0.87 0.00 0.00 176.83 175.82 2vjb h MET 308 N 0.00 0.38 -0.05 4.77 2.86 -1.03 -2.58 114.93 119.29 2vjb h MET 308 Ca -0.00 -0.23 -0.23 0.00 -2.06 0.00 0.00 59.70 57.18 2vjb h MET 308 Cb 0.28 0.02 0.01 0.00 0.06 0.00 0.00 31.60 31.97 2vjb h MET 308 CO 0.02 0.82 -0.89 -0.07 1.06 0.00 0.00 176.91 177.86 2vjb h LEU 309 N 0.30 0.70 -1.18 1.22 3.38 -0.75 -0.08 115.31 118.89 2vjb h LEU 309 Ca 0.01 -0.52 -0.08 0.00 0.09 0.00 0.00 57.88 57.38 2vjb h LEU 309 Cb 1.04 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 2vjb h LEU 309 CO 0.09 1.30 -0.36 0.78 0.09 0.00 0.00 178.44 180.34 2vjb h ASN 310 N 0.35 0.00 -0.02 -0.43 2.35 -1.29 -3.06 115.58 113.48 2vjb h ASN 310 Ca -0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2vjb h ASN 310 Cb 1.51 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.88 2vjb h ASN 310 CO 0.16 0.36 -0.08 -1.54 -1.65 0.00 0.00 177.43 174.69 2vjb n SER 311 N -3.78 2.56 -0.54 5.81 3.41 -0.98 -4.95 113.62 115.14 2vjb n SER 311 Ca -0.01 -1.81 -0.07 0.00 -0.26 0.00 0.00 58.87 56.71 2vjb n SER 311 Cb 0.44 0.08 -0.03 0.00 -0.26 0.00 0.00 64.21 64.44 2vjb n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vjb n GLY 312 N 1.33 0.93 3.50 5.00 0.00 -0.99 -4.93 105.19 110.03 2vjb n GLY 312 Ca 0.14 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 2vjb n GLY 312 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2vjb n ASN 313 N 0.81 4.59 -3.62 1.61 5.15 -0.08 -4.82 115.26 118.90 2vjb n ASN 313 Ca -0.07 -2.88 -0.01 0.00 -0.60 0.00 0.00 54.58 51.02 2vjb n ASN 313 Cb 0.24 -1.73 -0.01 0.00 -0.53 0.00 0.00 39.78 37.74 2vjb n ASN 313 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 2vjb s PHE 314 N 4.96 -0.08 0.25 1.20 -0.12 -1.26 -4.76 117.98 118.17 2vjb s PHE 314 Ca 0.55 -0.02 -0.31 0.00 -0.05 0.00 0.00 56.93 57.10 2vjb s PHE 314 Cb 0.04 0.54 -0.12 0.00 -0.63 0.00 0.00 43.02 42.86 2vjb s PHE 314 CO 0.07 -0.30 1.67 1.17 -0.05 0.00 0.00 175.22 177.78 2vjb n LYS 315 N -0.36 2.77 -3.50 1.99 4.81 0.02 -4.95 118.16 118.95 2vjb n LYS 315 Ca -0.06 0.99 -0.42 0.00 -0.87 0.00 0.00 58.31 57.95 2vjb n LYS 315 Cb 0.61 -2.81 -0.08 0.00 0.02 0.00 0.00 35.03 32.77 2vjb n LYS 315 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2vjb s LYS 316 N 0.36 2.69 0.00 1.64 3.01 -1.26 -4.94 119.74 121.24 2vjb s LYS 316 Ca 0.70 -1.60 0.00 0.00 -1.01 0.00 0.00 55.97 54.06 2vjb s LYS 316 Cb -0.49 -3.98 0.00 0.00 -1.01 0.00 0.00 37.83 32.34 2vjb s LYS 316 CO 0.40 -1.12 0.00 -2.37 0.51 0.00 0.00 175.35 172.77 2vjb n THR 317 N 5.02 0.00 -3.87 2.17 5.66 -1.26 -4.73 114.28 117.27 2vjb n THR 317 Ca -0.10 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.53 2vjb n THR 317 Cb 0.42 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.14 2vjb n THR 317 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2vjb s GLN 318 N 1.11 3.46 0.06 1.09 1.11 -1.26 -1.38 119.66 123.84 2vjb s GLN 318 Ca 0.00 -0.14 0.04 0.00 0.01 0.00 0.00 55.36 55.27 2vjb s GLN 318 Cb 0.00 -3.18 -0.03 0.00 -1.01 0.00 0.00 33.01 28.80 2vjb s GLN 318 CO 0.00 0.76 -0.12 0.96 0.01 0.00 0.00 175.29 176.91 2vjb s ILE 319 N -1.07 0.88 -0.14 1.08 -4.36 -0.30 -3.16 121.20 114.13 2vjb s ILE 319 Ca 0.17 -1.20 -0.01 0.00 -0.26 0.00 0.00 60.65 59.35 2vjb s ILE 319 Cb -0.12 -0.88 0.04 0.00 1.25 0.00 0.00 42.46 42.74 2vjb s ILE 319 CO 0.06 -0.28 -0.03 -0.22 0.24 0.00 0.00 174.94 174.71 2vjb s LEU 320 N -1.65 1.22 0.18 0.37 0.20 -0.93 -1.77 118.68 116.31 2vjb s LEU 320 Ca -0.05 -0.47 -0.02 0.00 0.69 0.00 0.00 54.13 54.28 2vjb s LEU 320 Cb -0.10 -0.75 -0.04 0.00 -0.43 0.00 0.00 46.19 44.88 2vjb s LEU 320 CO 0.01 -0.19 0.13 -1.48 -0.29 0.00 0.00 176.35 174.54 2vjb s LEU 321 N 1.76 1.26 0.00 -0.68 2.34 -0.35 -1.72 118.68 121.29 2vjb s LEU 321 Ca 0.02 -1.30 -0.15 0.00 0.06 0.00 0.00 54.13 52.77 2vjb s LEU 321 Cb -0.14 0.46 0.05 0.00 -0.56 0.00 0.00 46.19 46.00 2vjb s LEU 321 CO -0.07 -0.83 0.66 0.61 -1.06 0.00 0.00 176.35 175.66 2vjb n GLY 322 N -0.23 0.27 3.32 -3.48 0.00 -1.01 -0.43 105.19 103.64 2vjb n GLY 322 Ca -0.00 -0.91 -0.11 0.00 0.00 0.00 0.00 46.02 45.00 2vjb n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vjb s VAL 323 N -2.02 0.00 0.15 1.61 -7.23 -0.97 -0.92 120.40 111.03 2vjb s VAL 323 Ca 0.16 -1.81 0.03 0.00 -1.81 0.00 0.00 61.98 58.55 2vjb s VAL 323 Cb -0.00 -2.39 -0.04 0.00 0.56 0.00 0.00 36.38 34.51 2vjb s VAL 323 CO -0.01 -0.02 0.24 0.20 -0.31 0.00 0.00 175.10 175.20 2vjb s ASN 324 N -3.11 6.08 0.36 4.85 0.01 -1.26 -0.19 114.94 121.69 2vjb s ASN 324 Ca 0.33 0.08 0.05 0.00 -0.71 0.00 0.00 52.86 52.62 2vjb s ASN 324 Cb 0.05 -1.76 0.74 0.00 0.41 0.00 0.00 41.25 40.68 2vjb s ASN 324 CO 0.11 0.06 1.97 0.50 -1.51 0.00 0.00 177.10 178.23 2vjb h LYS 325 N 2.24 0.73 -2.19 -0.60 3.64 -1.30 -3.30 116.57 115.79 2vjb h LYS 325 Ca -0.48 -0.04 -0.57 0.00 -1.27 0.00 0.00 60.65 58.28 2vjb h LYS 325 Cb 1.20 -0.16 -0.41 0.00 -0.41 0.00 0.00 32.23 32.44 2vjb h LYS 325 CO 0.67 0.48 -0.75 -0.25 -2.27 0.00 0.00 179.45 177.34 2vjb n ASP 326 N -4.47 3.40 -0.15 4.20 8.00 -0.65 -4.92 116.55 121.95 2vjb n ASP 326 Ca 0.09 -3.44 0.08 0.00 0.71 0.00 0.00 54.79 52.24 2vjb n ASP 326 Cb 0.19 -0.61 0.40 0.00 -0.02 0.00 0.00 41.12 41.08 2vjb n ASP 326 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2vjb h GLU 327 N 3.41 0.62 0.00 -1.24 4.39 -1.73 -3.25 114.58 116.78 2vjb h GLU 327 Ca 0.14 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.80 2vjb h GLU 327 Cb 0.65 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.16 2vjb h GLU 327 CO 0.75 0.41 -0.50 0.41 -1.16 0.00 0.00 179.01 178.92 2vjb n GLY 328 N -1.47 -1.38 0.37 -3.84 0.00 -1.26 -4.39 105.19 93.22 2vjb n GLY 328 Ca 0.11 -0.26 0.02 0.00 0.00 0.00 0.00 46.02 45.88 2vjb n GLY 328 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2vjb h SER 329 N 0.00 0.97 -0.96 1.61 4.64 -1.82 -2.70 113.55 115.29 2vjb h SER 329 Ca 0.00 -0.01 0.02 0.00 -0.47 0.00 0.00 61.79 61.33 2vjb h SER 329 Cb 0.64 -0.22 -0.05 0.00 -0.31 0.00 0.00 62.40 62.46 2vjb h SER 329 CO 0.00 0.66 0.64 0.15 -0.87 0.00 0.00 176.83 177.40 2vjb h PHE 330 N 1.12 1.20 0.00 4.77 3.04 -1.83 -1.99 116.94 123.25 2vjb h PHE 330 Ca 0.36 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.33 2vjb h PHE 330 Cb 0.04 -0.41 -0.00 0.00 2.56 0.00 0.00 35.95 38.14 2vjb h PHE 330 CO -0.00 0.74 -0.05 0.74 -2.02 0.00 0.00 178.31 177.73 2vjb h PHE 331 N 1.29 0.00 0.04 0.41 -1.00 -1.78 -3.17 116.94 112.73 2vjb h PHE 331 Ca 0.36 0.00 -0.28 0.00 2.81 0.00 0.00 57.97 60.86 2vjb h PHE 331 Cb -0.12 0.00 0.02 0.00 3.61 0.00 0.00 35.95 39.47 2vjb h PHE 331 CO -0.00 0.05 -1.11 -0.07 -1.61 0.00 0.00 178.31 175.56 2vjb h LEU 332 N 0.00 0.90 -1.25 1.54 3.38 -1.14 -2.83 115.31 115.92 2vjb h LEU 332 Ca -0.00 -0.76 0.05 0.00 0.09 0.00 0.00 57.88 57.26 2vjb h LEU 332 Cb 0.98 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.40 2vjb h LEU 332 CO 0.01 1.56 0.53 0.25 0.09 0.00 0.00 178.44 180.88 2vjb h LEU 333 N 0.36 0.81 0.00 1.67 5.85 -1.37 -0.73 115.31 121.89 2vjb h LEU 333 Ca -0.15 -0.00 -0.20 0.00 0.84 0.00 0.00 57.88 58.37 2vjb h LEU 333 Cb 1.77 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.60 2vjb h LEU 333 CO 0.22 0.53 -1.05 1.88 -0.34 0.00 0.00 178.44 179.68 2vjb h TYR 334 N 0.93 0.00 0.00 1.25 -1.99 -1.56 -3.42 116.97 112.17 2vjb h TYR 334 Ca 0.34 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.07 2vjb h TYR 334 Cb 0.16 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.89 2vjb h TYR 334 CO -0.00 0.84 -0.09 0.41 -0.00 0.00 0.00 178.16 179.32 2vjb n GLY 335 N 1.36 -0.88 3.27 3.88 0.00 -1.07 -5.07 105.19 106.68 2vjb n GLY 335 Ca -0.04 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 2vjb n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vjb s ALA 336 N -0.33 2.27 0.42 4.61 0.00 -0.30 -4.92 121.76 123.52 2vjb s ALA 336 Ca 0.02 -0.98 -0.26 0.00 0.00 0.00 0.00 51.96 50.74 2vjb s ALA 336 Cb 0.02 -0.86 -0.10 0.00 0.00 0.00 0.00 23.12 22.18 2vjb s ALA 336 CO 0.00 0.33 1.36 -0.35 0.00 0.00 0.00 175.76 177.10 2vjb n PRO 337 N 3.33 2.15 0.00 0.00 -0.04 -1.26 -2.88 135.00 136.30 2vjb n PRO 337 Ca -0.18 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.04 2vjb n PRO 337 Cb 0.53 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 2vjb n PRO 337 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2vjb n GLY 338 N 0.68 3.11 3.80 0.55 0.00 -1.26 -4.89 105.19 107.18 2vjb n GLY 338 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 2vjb n GLY 338 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vjb s PHE 339 N -2.54 3.82 -0.08 1.61 0.08 -1.14 -4.58 117.98 115.16 2vjb s PHE 339 Ca 0.00 1.34 -0.16 0.00 0.12 0.00 0.00 56.93 58.23 2vjb s PHE 339 Cb 0.00 -2.56 0.03 0.00 -0.57 0.00 0.00 43.02 39.93 2vjb s PHE 339 CO 0.00 0.56 0.38 0.45 -0.10 0.00 0.00 175.22 176.51 2vjb s SER 340 N -1.06 -0.33 0.24 1.36 0.15 -1.26 -4.92 113.70 107.87 2vjb s SER 340 Ca 0.30 0.46 0.05 0.00 0.70 0.00 0.00 55.95 57.47 2vjb s SER 340 Cb -0.20 0.56 0.25 0.00 -1.71 0.00 0.00 66.02 64.92 2vjb s SER 340 CO 0.20 -0.32 1.56 0.50 1.20 0.00 0.00 173.24 176.38 2vjb h LYS 341 N 4.54 0.20 -0.96 5.44 3.64 -1.97 -3.26 116.57 124.20 2vjb h LYS 341 Ca -0.28 -0.14 -0.66 0.00 -1.27 0.00 0.00 60.65 58.30 2vjb h LYS 341 Cb 1.18 0.02 -0.32 0.00 -0.41 0.00 0.00 32.23 32.70 2vjb h LYS 341 CO 0.33 0.75 0.57 -0.25 -2.27 0.00 0.00 179.45 178.59 2vjb n ASP 342 N -3.85 7.21 -3.68 4.20 8.00 -1.26 -4.41 116.55 122.75 2vjb n ASP 342 Ca -0.02 -3.78 -0.08 0.00 0.71 0.00 0.00 54.79 51.61 2vjb n ASP 342 Cb 0.63 -0.86 -0.02 0.00 -0.02 0.00 0.00 41.12 40.84 2vjb n ASP 342 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2vjb s SER 343 N -2.15 -0.11 0.00 -2.24 0.15 -1.23 -5.02 113.70 103.10 2vjb s SER 343 Ca 0.62 -0.83 0.28 0.00 0.70 0.00 0.00 55.95 56.73 2vjb s SER 343 Cb 0.49 0.72 1.13 0.00 -1.71 0.00 0.00 66.02 66.65 2vjb s SER 343 CO -0.00 -1.37 1.85 1.21 1.20 0.00 0.00 173.24 176.13 2vjb n GLU 344 N -0.46 0.01 -3.72 5.44 2.13 -1.26 -4.82 120.64 117.96 2vjb n GLU 344 Ca -0.04 -0.00 -0.23 0.00 0.66 0.00 0.00 57.16 57.55 2vjb n GLU 344 Cb 0.60 -1.50 0.03 0.00 0.27 0.00 0.00 31.44 30.84 2vjb n GLU 344 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2vjb n SER 345 N -1.49 -1.78 -4.68 4.31 7.64 -1.26 -4.90 113.62 111.46 2vjb n SER 345 Ca 0.07 -0.80 -0.42 0.00 1.01 0.00 0.00 58.87 58.72 2vjb n SER 345 Cb 0.34 -4.07 -0.03 0.00 -1.01 0.00 0.00 64.21 59.44 2vjb n SER 345 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2vjb s LYS 346 N -6.06 4.29 -0.19 1.43 1.02 -1.26 -4.74 119.74 114.21 2vjb s LYS 346 Ca 0.11 1.80 -0.14 0.00 0.02 0.00 0.00 55.97 57.76 2vjb s LYS 346 Cb -0.05 -3.65 -0.04 0.00 -0.52 0.00 0.00 37.83 33.56 2vjb s LYS 346 CO 0.81 -0.59 0.30 0.42 -0.92 0.00 0.00 175.35 175.38 2vjb s ILE 347 N 2.75 5.28 0.94 2.17 -1.09 -0.86 -4.97 121.20 125.41 2vjb s ILE 347 Ca 0.59 0.52 -0.13 0.00 -2.23 0.00 0.00 60.65 59.41 2vjb s ILE 347 Cb -0.27 -3.64 0.15 0.00 -1.58 0.00 0.00 42.46 37.13 2vjb s ILE 347 CO 0.22 0.33 1.14 -0.94 -1.23 0.00 0.00 174.94 174.46 2vjb s SER 348 N 0.82 3.25 0.20 3.58 1.04 -1.26 -4.22 113.70 117.11 2vjb s SER 348 Ca 0.15 0.92 -0.08 0.00 0.48 0.00 0.00 55.95 57.42 2vjb s SER 348 Cb -0.14 -1.45 0.12 0.00 0.10 0.00 0.00 66.02 64.65 2vjb s SER 348 CO 0.05 -2.71 1.72 -0.09 0.98 0.00 0.00 173.24 173.20 2vjb h ARG 349 N -1.61 1.15 -0.07 4.02 9.65 -1.90 -1.66 114.38 123.96 2vjb h ARG 349 Ca -0.50 -0.27 0.02 0.00 -1.10 0.00 0.00 59.98 58.12 2vjb h ARG 349 Cb 1.33 -0.15 -0.02 0.00 -1.39 0.00 0.00 29.97 29.73 2vjb h ARG 349 CO 0.59 1.01 -0.04 1.49 2.80 0.00 0.00 179.97 185.81 2vjb h GLU 350 N 1.09 -0.04 0.00 0.20 4.81 -1.97 -1.57 114.58 117.09 2vjb h GLU 350 Ca 0.23 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.39 2vjb h GLU 350 Cb 0.37 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 2vjb h GLU 350 CO 0.00 -0.03 -0.35 -0.44 -0.73 0.00 0.00 179.01 177.46 2vjb h ASP 351 N -0.05 0.00 -0.09 1.04 3.32 -1.88 -2.38 116.42 116.39 2vjb h ASP 351 Ca 0.04 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 2vjb h ASP 351 Cb 0.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.66 2vjb h ASP 351 CO -0.10 0.35 0.04 0.15 -1.72 0.00 0.00 179.24 177.96 2vjb h PHE 352 N 0.00 0.13 0.08 4.55 3.57 -0.79 0.33 116.94 124.82 2vjb h PHE 352 Ca -0.00 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.51 2vjb h PHE 352 Cb 0.72 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.37 2vjb h PHE 352 CO 0.00 0.24 -0.31 0.52 -2.23 0.00 0.00 178.31 176.53 2vjb h MET 353 N -0.01 -0.49 -0.73 1.11 2.86 -1.06 -0.98 114.93 115.63 2vjb h MET 353 Ca 0.03 0.03 0.11 0.00 -2.06 0.00 0.00 59.70 57.81 2vjb h MET 353 Cb 0.16 0.11 -0.08 0.00 0.06 0.00 0.00 31.60 31.86 2vjb h MET 353 CO -0.00 -0.33 0.35 0.77 1.06 0.00 0.00 176.91 178.76 2vjb h SER 354 N -0.51 0.42 -0.08 1.22 0.02 -1.23 -2.16 113.55 111.24 2vjb h SER 354 Ca 0.04 0.07 0.02 0.00 -0.84 0.00 0.00 61.79 61.09 2vjb h SER 354 Cb 0.56 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 2vjb h SER 354 CO -0.21 0.23 -0.06 1.23 -1.14 0.00 0.00 176.83 176.88 2vjb h GLY 355 N 0.57 0.02 1.01 -3.77 0.00 0.49 -1.28 103.07 100.11 2vjb h GLY 355 Ca 0.37 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.76 2vjb h GLY 355 CO -0.30 -0.07 0.52 -0.39 0.00 0.00 0.00 176.54 176.30 2vjb h VAL 356 N -0.06 1.23 -0.66 4.60 -1.51 -0.79 0.28 116.25 119.36 2vjb h VAL 356 Ca 0.05 -0.51 0.05 0.00 -1.23 0.00 0.00 66.70 65.07 2vjb h VAL 356 Cb 0.14 0.03 -0.05 0.00 -2.13 0.00 0.00 31.29 29.28 2vjb h VAL 356 CO -0.12 0.24 0.37 0.50 -1.23 0.00 0.00 177.57 177.33 2vjb h LYS 357 N 1.17 0.68 -0.27 5.19 1.63 -1.09 -1.41 116.57 122.46 2vjb h LYS 357 Ca 0.31 -0.04 -0.12 0.00 -0.85 0.00 0.00 60.65 59.95 2vjb h LYS 357 Cb -0.06 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.41 2vjb h LYS 357 CO -0.06 0.45 -0.32 -0.07 -3.45 0.00 0.00 179.45 176.00 2vjb h LEU 358 N 0.70 0.59 -0.31 5.20 4.07 -0.06 -3.14 115.31 122.36 2vjb h LEU 358 Ca 0.29 -0.23 -0.20 0.00 0.08 0.00 0.00 57.88 57.82 2vjb h LEU 358 Cb 0.15 -0.16 -0.00 0.00 1.08 0.00 0.00 40.66 41.73 2vjb h LEU 358 CO -0.17 0.87 -0.82 0.28 -1.08 0.00 0.00 178.44 177.52 2vjb h SER 359 N 0.49 0.46 -2.22 -0.43 0.02 0.14 -3.09 113.55 108.91 2vjb h SER 359 Ca 0.06 -0.33 -0.60 0.00 -0.84 0.00 0.00 61.79 60.07 2vjb h SER 359 Cb 0.80 -0.14 -0.42 0.00 0.14 0.00 0.00 62.40 62.78 2vjb h SER 359 CO 0.06 1.10 -0.57 0.52 -1.14 0.00 0.00 176.83 176.80 2vjb n VAL 360 N -3.78 2.40 0.32 2.27 0.31 -0.59 -4.86 118.33 114.39 2vjb n VAL 360 Ca -0.05 -5.23 0.19 0.00 -0.01 0.00 0.00 64.34 59.25 2vjb n VAL 360 Cb 0.76 -2.10 1.08 0.00 -0.91 0.00 0.00 33.84 32.67 2vjb n VAL 360 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2vjb h PRO 361 N 4.21 0.00 -0.35 5.55 0.13 -1.68 -2.59 132.00 137.28 2vjb h PRO 361 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 2vjb h PRO 361 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2vjb h PRO 361 CO 0.84 0.01 0.00 -2.39 -0.23 0.00 0.00 178.00 176.23 2vjb n HIS 362 N -3.38 0.46 -3.38 1.56 1.44 -1.26 -4.95 115.22 105.70 2vjb n HIS 362 Ca -0.03 -0.23 -0.35 0.00 -2.01 0.00 0.00 57.72 55.11 2vjb n HIS 362 Cb 0.09 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.14 2vjb n HIS 362 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2vjb s ALA 363 N -1.54 3.58 0.75 1.59 0.00 -0.98 -5.09 121.76 120.08 2vjb s ALA 363 Ca 0.35 -0.17 -0.07 0.00 0.00 0.00 0.00 51.96 52.06 2vjb s ALA 363 Cb 0.19 -2.49 0.09 0.00 0.00 0.00 0.00 23.12 20.91 2vjb s ALA 363 CO 0.27 0.47 1.06 0.54 0.00 0.00 0.00 175.76 178.10 2vjb s ASN 364 N -1.84 4.50 0.26 0.00 2.20 -1.26 -4.81 114.94 113.99 2vjb s ASN 364 Ca 0.39 0.35 -0.01 0.00 -0.94 0.00 0.00 52.86 52.65 2vjb s ASN 364 Cb -0.14 -0.87 0.54 0.00 -2.00 0.00 0.00 41.25 38.78 2vjb s ASN 364 CO 0.19 -1.81 1.75 -0.78 -2.94 0.00 0.00 177.10 173.52 2vjb h ASP 365 N -0.76 0.48 -0.50 3.54 3.58 -1.99 -0.65 116.42 120.11 2vjb h ASP 365 Ca -0.44 0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.11 2vjb h ASP 365 Cb 1.30 0.03 -0.02 0.00 1.72 0.00 0.00 39.33 42.35 2vjb h ASP 365 CO 0.55 0.19 0.29 0.25 -2.88 0.00 0.00 179.24 177.64 2vjb h LEU 366 N 0.58 0.62 -1.50 2.28 5.85 -2.00 -1.27 115.31 119.88 2vjb h LEU 366 Ca 0.46 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 59.07 2vjb h LEU 366 Cb 0.68 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 2vjb h LEU 366 CO -0.38 0.52 -0.07 1.23 -0.34 0.00 0.00 178.44 179.40 2vjb h GLY 367 N 0.67 0.25 0.77 3.75 0.00 -1.53 -1.53 103.07 105.46 2vjb h GLY 367 Ca 0.18 -0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.32 2vjb h GLY 367 CO -0.03 0.13 -0.10 1.41 0.00 0.00 0.00 176.54 177.95 2vjb h LEU 368 N 0.22 0.38 -1.23 3.11 3.38 -0.52 -2.19 115.31 118.47 2vjb h LEU 368 Ca 0.05 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 57.59 2vjb h LEU 368 Cb 0.28 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 2vjb h LEU 368 CO 0.01 0.72 0.38 0.44 0.09 0.00 0.00 178.44 180.09 2vjb h ASP 369 N 0.05 0.81 -0.33 -0.43 3.32 -0.90 -0.72 116.42 118.21 2vjb h ASP 369 Ca 0.04 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2vjb h ASP 369 Cb 0.58 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.92 2vjb h ASP 369 CO 0.03 0.64 0.18 0.00 -1.72 0.00 0.00 179.24 178.37 2vjb h ALA 370 N 1.50 0.42 -0.16 3.45 0.00 -1.13 0.02 119.26 123.35 2vjb h ALA 370 Ca 0.24 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2vjb h ALA 370 Cb -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2vjb h ALA 370 CO -0.04 -0.06 0.04 0.28 0.00 0.00 0.00 179.25 179.47 2vjb h VAL 371 N 0.41 1.19 -0.28 0.00 2.07 -0.91 -1.20 116.25 117.53 2vjb h VAL 371 Ca 0.12 -0.61 0.05 0.00 0.82 0.00 0.00 66.70 67.08 2vjb h VAL 371 Cb 0.06 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 2vjb h VAL 371 CO -0.02 0.18 -0.00 0.74 0.02 0.00 0.00 177.57 178.49 2vjb h THR 372 N 0.06 0.80 -0.51 2.57 2.02 -1.01 -1.69 112.91 115.14 2vjb h THR 372 Ca 0.05 -0.03 -0.04 0.00 0.77 0.00 0.00 66.41 67.16 2vjb h THR 372 Cb 0.25 0.71 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 2vjb h THR 372 CO -0.00 0.02 0.15 0.25 0.37 0.00 0.00 175.52 176.31 2vjb h LEU 373 N 0.08 0.70 -1.30 2.58 5.85 -0.89 -2.07 115.31 120.27 2vjb h LEU 373 Ca 0.13 -0.11 -0.06 0.00 0.84 0.00 0.00 57.88 58.68 2vjb h LEU 373 Cb 0.18 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 2vjb h LEU 373 CO -0.22 0.68 -0.31 -0.61 -0.34 0.00 0.00 178.44 177.63 2vjb h GLN 374 N 0.75 0.00 -0.08 1.25 5.75 -0.38 -3.24 115.11 119.16 2vjb h GLN 374 Ca 0.17 0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.65 2vjb h GLN 374 Cb 0.23 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.77 2vjb h GLN 374 CO -0.01 0.31 -0.13 0.66 -2.65 0.00 0.00 178.83 177.01 2vjb n TYR 375 N -3.75 0.26 -4.88 3.99 4.01 -0.72 -5.01 117.16 111.07 2vjb n TYR 375 Ca -0.01 -1.16 -0.32 0.00 -0.16 0.00 0.00 57.90 56.25 2vjb n TYR 375 Cb 0.40 -0.23 -0.17 0.00 -0.31 0.00 0.00 39.34 39.03 2vjb n TYR 375 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2vjb s THR 376 N -3.00 2.01 -0.69 -0.72 2.01 -0.81 -4.83 115.64 109.60 2vjb s THR 376 Ca 0.36 -0.97 -0.20 0.00 0.31 0.00 0.00 61.69 61.20 2vjb s THR 376 Cb 0.32 -1.76 0.10 0.00 0.01 0.00 0.00 72.50 71.17 2vjb s THR 376 CO 0.01 0.54 0.88 -0.62 -0.69 0.00 0.00 174.62 174.75 2vjb s ASP 377 N 0.63 6.29 0.00 3.53 -1.08 -1.26 -4.91 116.67 119.87 2vjb s ASP 377 Ca -0.12 -1.45 0.09 0.00 -0.52 0.00 0.00 52.55 50.54 2vjb s ASP 377 Cb -0.16 -2.36 0.44 0.00 -1.46 0.00 0.00 42.92 39.37 2vjb s ASP 377 CO 0.03 -1.20 1.16 0.79 0.52 0.00 0.00 175.17 176.46 2vjb n TRP 378 N 6.76 0.00 1.48 -5.34 7.02 -1.26 -1.15 117.44 124.95 2vjb n TRP 378 Ca 0.00 0.00 0.14 0.00 -1.02 0.00 0.00 57.50 56.62 2vjb n TRP 378 Cb 0.45 -0.29 0.54 0.00 -2.42 0.00 0.00 31.31 29.59 2vjb n TRP 378 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2vjb n MET 379 N -1.29 1.32 -2.69 -0.99 2.81 -1.26 -4.37 117.12 110.64 2vjb n MET 379 Ca 0.04 -0.69 -0.06 0.00 -1.81 0.00 0.00 57.70 55.17 2vjb n MET 379 Cb 0.07 -1.49 0.08 0.00 -0.71 0.00 0.00 33.22 31.18 2vjb n MET 379 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2vjb n ASP 380 N -0.24 -1.77 0.30 7.83 2.03 -0.30 -5.03 116.55 119.37 2vjb n ASP 380 Ca 0.17 -2.49 0.19 0.00 0.52 0.00 0.00 54.79 53.18 2vjb n ASP 380 Cb 0.32 1.22 0.87 0.00 -0.72 0.00 0.00 41.12 42.81 2vjb n ASP 380 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 2vjb h ASP 381 N 2.05 0.00 -0.60 1.67 2.03 -1.63 -2.90 116.42 117.04 2vjb h ASP 381 Ca -0.31 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.99 2vjb h ASP 381 Cb 1.24 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.74 2vjb h ASP 381 CO -0.05 0.01 0.00 0.59 -1.03 0.00 0.00 179.24 178.76 2vjb n ASN 382 N -3.13 4.04 -4.58 4.15 3.02 -1.26 -4.68 115.26 112.82 2vjb n ASN 382 Ca -0.01 -2.28 -0.42 0.00 -0.03 0.00 0.00 54.58 51.85 2vjb n ASN 382 Cb 0.22 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.86 2vjb n ASN 382 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2vjb s ASN 383 N -0.89 6.05 0.32 6.41 3.84 -1.10 -4.88 114.94 124.69 2vjb s ASN 383 Ca 0.45 0.58 0.07 0.00 0.21 0.00 0.00 52.86 54.17 2vjb s ASN 383 Cb 0.27 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 39.19 2vjb s ASN 383 CO 0.24 -1.71 1.81 1.23 -2.79 0.00 0.00 177.10 175.87 2vjb h GLY 384 N 13.32 1.59 1.08 1.21 0.00 -1.90 -1.65 103.07 116.71 2vjb h GLY 384 Ca -0.28 -0.35 -0.19 0.00 0.00 0.00 0.00 47.33 46.51 2vjb h GLY 384 CO 1.14 0.00 -0.66 -2.22 0.00 0.00 0.00 176.54 174.80 2vjb h ILE 385 N 0.76 1.30 0.00 2.60 2.04 -1.90 -2.10 117.51 120.21 2vjb h ILE 385 Ca 0.54 -1.89 -0.08 0.00 1.00 0.00 0.00 64.86 64.44 2vjb h ILE 385 Cb 0.85 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.92 2vjb h ILE 385 CO -0.32 0.59 -0.36 0.11 0.00 0.00 0.00 178.15 178.17 2vjb h LYS 386 N 0.42 0.00 -0.09 2.37 1.57 -1.84 -1.51 116.57 117.49 2vjb h LYS 386 Ca -0.04 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.57 2vjb h LYS 386 Cb 1.29 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 2vjb h LYS 386 CO 0.14 0.36 -0.67 -0.91 -0.57 0.00 0.00 179.45 177.80 2vjb h ASN 387 N 0.00 0.45 0.02 0.86 2.35 -1.27 -0.09 115.58 117.90 2vjb h ASN 387 Ca -0.00 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2vjb h ASN 387 Cb 0.65 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 38.89 2vjb h ASN 387 CO 0.05 0.99 -0.01 -0.09 -1.65 0.00 0.00 177.43 176.71 2vjb h ARG 388 N 0.27 -0.03 -0.19 0.81 2.43 -0.99 -2.60 114.38 114.08 2vjb h ARG 388 Ca -0.02 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.08 2vjb h ARG 388 Cb 1.22 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 2vjb h ARG 388 CO 0.11 0.48 -0.20 -0.44 -1.51 0.00 0.00 179.97 178.42 2vjb h ASP 389 N -0.55 0.33 -0.19 -3.80 3.32 -1.34 -1.85 116.42 112.34 2vjb h ASP 389 Ca -0.00 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.96 2vjb h ASP 389 Cb 0.52 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.98 2vjb h ASP 389 CO 0.01 0.54 0.12 1.23 -1.72 0.00 0.00 179.24 179.42 2vjb h GLY 390 N 0.93 0.27 1.00 2.75 0.00 -0.98 -0.39 103.07 106.65 2vjb h GLY 390 Ca 0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.28 2vjb h GLY 390 CO 0.04 0.10 0.35 -2.00 0.00 0.00 0.00 176.54 175.03 2vjb h LEU 391 N 0.24 0.68 -0.32 3.11 5.85 -1.17 0.11 115.31 123.81 2vjb h LEU 391 Ca 0.07 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.78 2vjb h LEU 391 Cb -0.00 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.81 2vjb h LEU 391 CO -0.01 0.53 0.07 -0.78 -0.34 0.00 0.00 178.44 177.91 2vjb h ASP 392 N 0.77 0.03 -0.54 1.25 3.58 -1.04 -0.82 116.42 119.66 2vjb h ASP 392 Ca 0.21 0.05 -0.02 0.00 0.42 0.00 0.00 57.03 57.69 2vjb h ASP 392 Cb -0.03 0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.05 2vjb h ASP 392 CO -0.04 0.06 0.27 0.44 -2.88 0.00 0.00 179.24 177.09 2vjb h ASP 393 N 0.19 0.70 0.30 2.28 3.32 -0.49 -1.27 116.42 121.45 2vjb h ASP 393 Ca 0.15 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2vjb h ASP 393 Cb 0.15 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2vjb h ASP 393 CO -0.19 0.62 -0.30 0.40 -1.72 0.00 0.00 179.24 178.06 2vjb h ILE 394 N 0.73 0.37 -0.95 0.35 2.04 -0.19 0.21 117.51 120.08 2vjb h ILE 394 Ca 0.19 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.07 2vjb h ILE 394 Cb 0.10 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 2vjb h ILE 394 CO -0.03 0.00 0.63 0.58 0.00 0.00 0.00 178.15 179.33 2vjb h VAL 395 N -0.63 1.21 -0.15 1.67 2.07 -1.08 -0.93 116.25 118.41 2vjb h VAL 395 Ca -0.01 -0.43 -0.21 0.00 0.82 0.00 0.00 66.70 66.87 2vjb h VAL 395 Cb 0.58 -0.14 0.01 0.00 -1.52 0.00 0.00 31.29 30.21 2vjb h VAL 395 CO -0.06 0.23 -0.75 1.23 0.02 0.00 0.00 177.57 178.23 2vjb h GLY 396 N 1.24 0.81 0.65 2.17 0.00 -0.95 -2.61 103.07 104.38 2vjb h GLY 396 Ca 0.36 -1.12 -0.03 0.00 0.00 0.00 0.00 47.33 46.54 2vjb h GLY 396 CO -0.09 1.00 -0.07 -0.55 0.00 0.00 0.00 176.54 176.83 2vjb h ASP 397 N 0.51 0.20 -0.47 0.19 3.32 -0.33 -0.76 116.42 119.08 2vjb h ASP 397 Ca -0.04 -0.47 -0.09 0.00 0.02 0.00 0.00 57.03 56.45 2vjb h ASP 397 Cb 1.37 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.85 2vjb h ASP 397 CO 0.15 0.63 -0.07 -0.74 -1.72 0.00 0.00 179.24 177.49 2vjb h HIS 398 N -0.22 0.97 0.01 4.55 2.76 -1.29 -1.61 115.15 120.33 2vjb h HIS 398 Ca 0.01 -0.20 -0.29 0.00 -2.20 0.00 0.00 60.37 57.70 2vjb h HIS 398 Cb 0.56 -0.24 -0.05 0.00 1.55 0.00 0.00 27.41 29.23 2vjb h HIS 398 CO 0.08 0.95 -1.67 -0.91 -1.30 0.00 0.00 177.93 175.08 2vjb h ASN 399 N 0.72 0.02 0.00 3.26 2.35 -1.54 -3.42 115.58 116.97 2vjb h ASN 399 Ca 0.12 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2vjb h ASN 399 Cb 0.61 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.97 2vjb h ASN 399 CO 0.04 1.04 0.00 0.52 -1.65 0.00 0.00 177.43 177.38 2vjb n VAL 400 N -3.09 0.31 0.16 2.81 0.31 -0.48 -4.60 118.33 113.74 2vjb n VAL 400 Ca -0.16 0.10 -0.15 0.00 -0.01 0.00 0.00 64.34 64.12 2vjb n VAL 400 Cb 1.04 -0.92 -0.07 0.00 -0.91 0.00 0.00 33.84 32.99 2vjb n VAL 400 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2vjb h ILE 401 N 0.00 0.23 -0.30 2.52 2.04 -1.33 -1.60 117.51 119.07 2vjb h ILE 401 Ca 0.00 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 2vjb h ILE 401 Cb 0.00 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.30 2vjb h ILE 401 CO 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 178.15 177.91 2vjb h PRO 403 N 0.51 0.45 -0.17 0.00 0.11 -1.70 -1.14 132.00 130.06 2vjb h PRO 403 Ca 0.07 -0.13 -0.17 0.00 0.11 0.00 0.00 66.00 65.88 2vjb h PRO 403 Cb 0.68 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.74 2vjb h PRO 403 CO 0.05 0.59 -0.59 1.25 -0.21 0.00 0.00 178.00 179.10 2vjb h LEU 404 N 0.42 0.64 -0.88 2.35 6.46 -0.85 -1.89 115.31 121.56 2vjb h LEU 404 Ca 0.08 -0.36 -0.10 0.00 -0.12 0.00 0.00 57.88 57.38 2vjb h LEU 404 Cb 0.51 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 2vjb h LEU 404 CO 0.03 1.09 -0.21 0.24 -0.62 0.00 0.00 178.44 178.97 2vjb h MET 405 N 0.43 0.59 -0.19 1.25 2.86 -0.77 0.75 114.93 119.84 2vjb h MET 405 Ca -0.00 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.42 2vjb h MET 405 Cb 1.15 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 2vjb h MET 405 CO 0.11 0.76 0.10 1.25 1.06 0.00 0.00 176.91 180.19 2vjb h HIS 406 N 0.53 0.27 0.20 -0.22 -0.00 -1.03 -1.63 115.15 113.25 2vjb h HIS 406 Ca 0.08 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.44 2vjb h HIS 406 Cb 0.65 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 27.96 2vjb h HIS 406 CO 0.03 0.26 -0.16 0.35 -0.00 0.00 0.00 177.93 178.40 2vjb h PHE 407 N 0.20 -0.42 -0.96 5.26 3.57 -0.86 -2.11 116.94 121.61 2vjb h PHE 407 Ca 0.07 0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.64 2vjb h PHE 407 Cb 0.09 0.16 -0.07 0.00 2.79 0.00 0.00 35.95 38.92 2vjb h PHE 407 CO -0.03 -0.25 0.62 -0.24 -2.23 0.00 0.00 178.31 176.18 2vjb h VAL 408 N -0.37 1.04 -0.04 1.41 3.04 -0.73 0.63 116.25 121.23 2vjb h VAL 408 Ca -0.01 -0.37 -0.16 0.00 -1.01 0.00 0.00 66.70 65.16 2vjb h VAL 408 Cb 0.34 -0.12 -0.01 0.00 -2.01 0.00 0.00 31.29 29.49 2vjb h VAL 408 CO -0.02 0.19 -0.69 0.78 -1.01 0.00 0.00 177.57 176.82 2vjb h ASN 409 N 1.07 0.23 0.01 3.17 2.35 -1.14 -2.36 115.58 118.91 2vjb h ASN 409 Ca 0.43 -0.15 -0.09 0.00 -0.55 0.00 0.00 56.30 55.93 2vjb h ASN 409 Cb 0.26 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.57 2vjb h ASN 409 CO -0.18 0.85 -0.36 0.11 -1.65 0.00 0.00 177.43 176.20 2vjb h LYS 410 N 0.13 0.22 -0.49 0.81 1.79 -0.77 -3.32 116.57 114.94 2vjb h LYS 410 Ca -0.02 -0.26 -0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2vjb h LYS 410 Cb 1.24 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 31.94 2vjb h LYS 410 CO 0.10 0.99 0.31 -0.92 -1.08 0.00 0.00 179.45 178.86 2vjb h TYR 411 N -0.43 0.64 -0.20 -1.35 3.20 -0.96 -2.78 116.97 115.09 2vjb h TYR 411 Ca -0.05 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.88 2vjb h TYR 411 Cb 1.13 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 2vjb h TYR 411 CO 0.18 0.43 0.26 1.15 -1.64 0.00 0.00 178.16 178.54 2vjb h THR 412 N 0.66 0.35 0.00 1.81 2.02 -1.53 0.26 112.91 116.48 2vjb h THR 412 Ca 0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.36 2vjb h THR 412 Cb -0.03 0.78 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2vjb h THR 412 CO -0.04 0.00 0.00 0.11 0.37 0.00 0.00 175.52 175.96 2vjb h LYS 413 N 0.00 0.00 0.00 6.66 1.79 -1.59 -3.31 116.57 120.12 2vjb h LYS 413 Ca 0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 2vjb h LYS 413 Cb 0.62 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.27 2vjb h LYS 413 CO -0.00 0.00 -0.68 1.19 -1.08 0.00 0.00 179.45 178.88 2vjb n PHE 414 N -3.02 0.00 -0.28 -1.35 3.72 -0.44 -5.10 117.46 110.99 2vjb n PHE 414 Ca 0.00 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.10 2vjb n PHE 414 Cb 0.26 0.00 0.29 0.00 -0.94 0.00 0.00 39.48 39.09 2vjb n PHE 414 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vjb n GLY 415 N 1.89 -3.57 0.30 1.37 0.00 0.78 -4.87 105.19 101.09 2vjb n GLY 415 Ca 0.00 -1.59 0.09 0.00 0.00 0.00 0.00 46.02 44.52 2vjb n GLY 415 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2vjb n ASN 416 N -5.56 2.57 0.00 1.61 4.05 -0.48 -4.90 115.26 112.54 2vjb n ASN 416 Ca 0.11 -3.18 0.00 0.00 0.45 0.00 0.00 54.58 51.97 2vjb n ASN 416 Cb 0.59 -0.47 0.00 0.00 1.23 0.00 0.00 39.78 41.13 2vjb n ASN 416 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2vjb n GLY 417 N -1.24 3.04 3.03 8.20 0.00 -1.24 -4.68 105.19 112.30 2vjb n GLY 417 Ca 0.18 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 2vjb n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vjb s THR 418 N 0.00 1.09 -0.11 2.61 2.01 -1.26 -1.15 115.64 118.82 2vjb s THR 418 Ca 0.00 -0.48 0.01 0.00 0.31 0.00 0.00 61.69 61.54 2vjb s THR 418 Cb 0.00 -0.98 0.02 0.00 0.01 0.00 0.00 72.50 71.54 2vjb s THR 418 CO 0.00 0.34 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.81 2vjb s TYR 419 N 0.49 1.96 -0.08 4.92 1.51 -0.73 0.62 117.35 126.05 2vjb s TYR 419 Ca -0.11 -0.96 0.02 0.00 -1.01 0.00 0.00 57.07 55.01 2vjb s TYR 419 Cb -0.14 -1.43 -0.02 0.00 -0.11 0.00 0.00 41.96 40.26 2vjb s TYR 419 CO 0.03 -0.51 -0.12 -1.17 -1.11 0.00 0.00 175.55 172.67 2vjb s LEU 420 N 1.12 2.83 0.18 -1.29 2.96 -1.26 -1.21 118.68 122.01 2vjb s LEU 420 Ca -0.04 -0.20 0.08 0.00 -0.22 0.00 0.00 54.13 53.75 2vjb s LEU 420 Cb -0.14 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.90 2vjb s LEU 420 CO -0.04 0.29 -0.17 -0.72 -1.32 0.00 0.00 176.35 174.40 2vjb s TYR 421 N -0.37 1.77 -0.35 5.38 -0.85 0.43 -2.79 117.35 120.57 2vjb s TYR 421 Ca 0.04 -0.51 0.00 0.00 -0.52 0.00 0.00 57.07 56.09 2vjb s TYR 421 Cb -0.12 -0.85 0.11 0.00 0.38 0.00 0.00 41.96 41.47 2vjb s TYR 421 CO 0.02 0.34 0.14 0.12 -1.52 0.00 0.00 175.55 174.65 2vjb s PHE 422 N -2.43 1.83 -0.40 -3.49 5.36 -0.44 -2.30 117.98 116.11 2vjb s PHE 422 Ca 0.18 -1.97 -0.29 0.00 -0.96 0.00 0.00 56.93 53.89 2vjb s PHE 422 Cb -0.04 -1.78 0.02 0.00 -0.34 0.00 0.00 43.02 40.88 2vjb s PHE 422 CO 0.07 -0.85 1.13 0.12 -1.46 0.00 0.00 175.22 174.22 2vjb s PHE 423 N 1.23 2.95 -0.30 10.12 5.36 0.74 -1.56 117.98 136.52 2vjb s PHE 423 Ca 0.12 0.94 0.16 0.00 -0.96 0.00 0.00 56.93 57.19 2vjb s PHE 423 Cb -0.19 -4.08 0.48 0.00 -0.34 0.00 0.00 43.02 38.89 2vjb s PHE 423 CO -0.17 -1.09 1.10 0.27 -1.46 0.00 0.00 175.22 173.88 2vjb n ASN 424 N 7.42 2.81 -4.46 6.13 6.94 -1.19 -1.16 115.26 131.75 2vjb n ASN 424 Ca 0.12 -2.80 -0.34 0.00 -0.02 0.00 0.00 54.58 51.54 2vjb n ASN 424 Cb 0.48 -0.45 -0.12 0.00 -2.36 0.00 0.00 39.78 37.33 2vjb n ASN 424 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2vjb s HIS 425 N -3.60 3.02 -0.37 -2.53 2.46 -1.26 -4.97 115.29 108.04 2vjb s HIS 425 Ca 0.36 -0.42 -0.20 0.00 0.47 0.00 0.00 55.06 55.27 2vjb s HIS 425 Cb 0.38 -2.01 0.00 0.00 -0.13 0.00 0.00 32.58 30.82 2vjb s HIS 425 CO -0.02 -0.16 0.60 0.50 -2.47 0.00 0.00 174.74 173.19 2vjb s ARG 426 N 0.69 3.59 0.27 2.88 6.06 -1.26 -4.84 118.95 126.33 2vjb s ARG 426 Ca -0.02 -0.09 -0.31 0.00 -2.50 0.00 0.00 55.73 52.82 2vjb s ARG 426 Cb -0.14 -3.84 -0.12 0.00 0.06 0.00 0.00 34.95 30.91 2vjb s ARG 426 CO 0.02 -0.76 1.56 0.00 -2.50 0.00 0.00 175.30 173.62 2vjb n ALA 427 N 6.00 2.17 0.31 6.12 0.00 -1.26 -4.87 120.51 128.98 2vjb n ALA 427 Ca -0.02 0.39 0.18 0.00 0.00 0.00 0.00 53.44 53.98 2vjb n ALA 427 Cb 0.48 -2.42 1.02 0.00 0.00 0.00 0.00 19.45 18.54 2vjb n ALA 427 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2vjb h SER 428 N 4.82 0.00 -0.40 0.00 4.64 -1.95 -2.68 113.55 117.97 2vjb h SER 428 Ca -0.46 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 60.67 2vjb h SER 428 Cb 1.24 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.21 2vjb h SER 428 CO 0.80 0.01 -0.00 -0.46 -0.87 0.00 0.00 176.83 176.30 2vjb n ASN 429 N -3.54 2.77 -4.76 4.97 0.23 -1.26 -5.04 115.26 108.63 2vjb n ASN 429 Ca -0.03 -3.67 -0.41 0.00 -0.53 0.00 0.00 54.58 49.95 2vjb n ASN 429 Cb 0.09 -0.64 -0.02 0.00 -2.08 0.00 0.00 39.78 37.12 2vjb n ASN 429 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2vjb s LEU 430 N -3.20 4.43 0.08 -4.53 2.96 -1.01 -4.93 118.68 112.48 2vjb s LEU 430 Ca 0.45 2.61 0.23 0.00 -0.22 0.00 0.00 54.13 57.21 2vjb s LEU 430 Cb 0.41 -3.64 0.17 0.00 0.50 0.00 0.00 46.19 43.63 2vjb s LEU 430 CO 0.02 -0.51 1.15 1.33 -1.32 0.00 0.00 176.35 177.01 2vjb n VAL 431 N 1.21 0.27 -2.22 1.68 0.24 -1.26 -4.92 118.33 113.33 2vjb n VAL 431 Ca 0.01 -0.27 -0.31 0.00 -2.04 0.00 0.00 64.34 61.73 2vjb n VAL 431 Cb 0.42 0.04 -0.01 0.00 -1.47 0.00 0.00 33.84 32.82 2vjb n VAL 431 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2vjb s TRP 432 N -3.20 3.56 0.59 6.34 0.52 -1.26 -4.98 118.94 120.51 2vjb s TRP 432 Ca 0.04 1.24 -0.20 0.00 0.02 0.00 0.00 56.10 57.21 2vjb s TRP 432 Cb 0.14 -2.65 -0.03 0.00 -1.15 0.00 0.00 33.47 29.78 2vjb s TRP 432 CO 0.77 -0.49 1.31 -1.25 0.02 0.00 0.00 176.95 177.31 2vjb s PRO 433 N -4.69 2.91 0.37 4.98 0.04 -1.26 -4.92 135.00 132.43 2vjb s PRO 433 Ca 0.55 2.10 0.13 0.00 0.04 0.00 0.00 61.00 63.82 2vjb s PRO 433 Cb -0.11 -2.06 0.94 0.00 0.04 0.00 0.00 34.50 33.32 2vjb s PRO 433 CO 0.44 -1.33 1.82 1.49 0.04 0.00 0.00 177.00 179.46 2vjb h GLU 434 N 1.05 0.54 0.00 4.56 4.57 -1.93 -1.97 114.58 121.40 2vjb h GLU 434 Ca -0.51 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 57.62 2vjb h GLU 434 Cb 1.31 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2vjb h GLU 434 CO 0.55 0.36 -0.08 0.11 -1.18 0.00 0.00 179.01 178.77 2vjb h TRP 435 N 0.56 0.00 0.00 0.92 5.08 -1.90 -2.20 115.95 118.40 2vjb h TRP 435 Ca 0.52 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.49 2vjb h TRP 435 Cb 1.07 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.23 2vjb h TRP 435 CO -0.00 0.08 0.00 0.52 -1.28 0.00 0.00 178.44 177.75 2vjb h MET 436 N 0.00 0.00 0.00 0.12 2.86 -1.72 -3.48 114.93 112.71 2vjb h MET 436 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2vjb h MET 436 Cb 0.17 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.83 2vjb h MET 436 CO 0.01 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.39 2vjb n GLY 437 N -0.00 2.87 3.48 8.32 0.00 -0.83 -4.14 105.19 114.88 2vjb n GLY 437 Ca 0.01 -0.34 -0.43 0.00 0.00 0.00 0.00 46.02 45.25 2vjb n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vjb s VAL 438 N 0.00 4.50 0.46 1.61 1.01 -1.26 -4.90 120.40 121.82 2vjb s VAL 438 Ca 0.00 -1.37 -0.24 0.00 0.00 0.00 0.00 61.98 60.37 2vjb s VAL 438 Cb 0.00 -4.86 -0.07 0.00 0.00 0.00 0.00 36.38 31.44 2vjb s VAL 438 CO 0.00 -1.64 1.30 -0.63 0.00 0.00 0.00 175.10 174.14 2vjb s ILE 439 N 3.33 2.51 -0.09 2.22 1.01 -1.26 -1.64 121.20 127.28 2vjb s ILE 439 Ca 0.37 0.42 -0.34 0.00 0.00 0.00 0.00 60.65 61.09 2vjb s ILE 439 Cb -0.03 -3.23 -0.12 0.00 0.01 0.00 0.00 42.46 39.08 2vjb s ILE 439 CO -0.09 0.03 1.86 1.57 0.00 0.00 0.00 174.94 178.31 2vjb n HIS 440 N -0.34 2.31 -0.03 3.97 -0.00 -1.25 -1.57 115.22 118.32 2vjb n HIS 440 Ca 0.06 0.04 0.00 0.00 -0.00 0.00 0.00 57.72 57.82 2vjb n HIS 440 Cb 0.45 -2.65 0.00 0.00 -0.00 0.00 0.00 29.99 27.79 2vjb n HIS 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2vjb n GLY 441 N 4.34 1.00 0.74 1.57 0.00 -1.26 -4.95 105.19 106.63 2vjb n GLY 441 Ca 0.23 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.27 2vjb n GLY 441 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2vjb n TYR 442 N -2.00 0.52 0.49 1.61 4.02 -0.61 -2.82 117.16 118.36 2vjb n TYR 442 Ca 0.00 -0.20 0.11 0.00 -0.01 0.00 0.00 57.90 57.80 2vjb n TYR 442 Cb 0.00 -0.14 -0.10 0.00 -0.02 0.00 0.00 39.34 39.08 2vjb n TYR 442 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2vjb n GLU 443 N 0.19 0.34 -0.27 -0.72 0.00 -1.26 -4.32 120.64 114.59 2vjb n GLU 443 Ca 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 57.16 57.14 2vjb n GLU 443 Cb 0.41 -1.54 0.09 0.00 0.00 0.00 0.00 31.44 30.41 2vjb n GLU 443 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2vjb h ILE 444 N 0.00 1.09 -0.31 3.84 2.04 -1.93 -1.64 117.51 120.60 2vjb h ILE 444 Ca 0.00 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.57 2vjb h ILE 444 Cb 0.76 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2vjb h ILE 444 CO 0.00 0.17 0.20 1.05 0.00 0.00 0.00 178.15 179.57 2vjb h GLU 445 N 0.91 0.34 -0.03 2.37 4.11 -1.80 -0.83 114.58 119.65 2vjb h GLU 445 Ca 0.30 -0.02 -0.20 0.00 0.07 0.00 0.00 59.36 59.51 2vjb h GLU 445 Cb 0.04 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.21 2vjb h GLU 445 CO -0.12 0.23 -0.84 0.74 0.07 0.00 0.00 179.01 179.09 2vjb h PHE 446 N 0.35 0.52 -0.62 2.06 -1.00 -1.59 -0.99 116.94 115.67 2vjb h PHE 446 Ca 0.12 -0.26 -0.08 0.00 2.81 0.00 0.00 57.97 60.56 2vjb h PHE 446 Cb 0.05 -0.07 -0.03 0.00 3.61 0.00 0.00 35.95 39.52 2vjb h PHE 446 CO -0.00 1.05 0.09 0.28 -1.61 0.00 0.00 178.31 178.12 2vjb h VAL 447 N 0.22 1.26 -0.48 -0.55 2.07 -0.42 -2.98 116.25 115.36 2vjb h VAL 447 Ca -0.05 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.45 2vjb h VAL 447 Cb 1.45 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 2vjb h VAL 447 CO 0.14 0.38 0.00 0.49 0.02 0.00 0.00 177.57 178.60 2vjb n PHE 448 N -4.22 0.89 -1.09 1.57 3.01 -0.43 -4.66 117.46 112.52 2vjb n PHE 448 Ca 0.04 -0.39 -0.03 0.00 1.01 0.00 0.00 57.45 58.08 2vjb n PHE 448 Cb 0.29 -0.10 -0.01 0.00 -0.01 0.00 0.00 39.48 39.64 2vjb n PHE 448 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vjb n GLY 449 N 1.08 0.57 0.40 1.37 0.00 -1.08 -4.11 105.19 103.42 2vjb n GLY 449 Ca 0.18 -0.23 0.22 0.00 0.00 0.00 0.00 46.02 46.18 2vjb n GLY 449 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vjb h LEU 450 N 0.00 0.47 0.00 0.99 -0.00 -1.46 0.16 115.31 115.47 2vjb h LEU 450 Ca -0.07 0.08 0.00 0.00 -0.00 0.00 0.00 57.88 57.89 2vjb h LEU 450 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.15 2vjb h LEU 450 CO 0.10 0.11 0.00 -2.65 -0.00 0.00 0.00 178.44 176.00 2vjb n PRO 451 N -4.62 0.02 0.11 1.13 -0.02 -1.26 -2.06 135.00 128.30 2vjb n PRO 451 Ca 0.24 0.35 0.13 0.00 -2.02 0.00 0.00 63.50 62.20 2vjb n PRO 451 Cb 0.83 -1.50 0.28 0.00 -0.02 0.00 0.00 33.50 33.10 2vjb n PRO 451 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2vjb h LEU 452 N 0.00 0.00 -8.62 2.45 4.07 -1.00 -3.41 115.31 108.80 2vjb h LEU 452 Ca 0.00 -0.06 -0.67 0.00 0.08 0.00 0.00 57.88 57.23 2vjb h LEU 452 Cb 0.05 0.00 -0.17 0.00 1.08 0.00 0.00 40.66 41.61 2vjb h LEU 452 CO 0.00 0.03 -0.15 0.54 -1.08 0.00 0.00 178.44 177.77 2vjb s VAL 453 N -3.15 5.06 0.25 1.22 0.11 -0.87 -4.98 120.40 118.03 2vjb s VAL 453 Ca 0.08 -0.10 -0.07 0.00 -2.93 0.00 0.00 61.98 58.96 2vjb s VAL 453 Cb 0.11 -4.01 0.31 0.00 -1.53 0.00 0.00 36.38 31.27 2vjb s VAL 453 CO 0.65 -0.35 1.61 0.11 -3.33 0.00 0.00 175.10 173.80 2vjb h LYS 454 N 8.65 0.06 0.00 1.54 1.79 -1.88 -1.29 116.57 125.44 2vjb h LYS 454 Ca -0.27 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2vjb h LYS 454 Cb 1.12 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 2vjb h LYS 454 CO 0.78 0.04 0.01 -0.85 -1.08 0.00 0.00 179.45 178.35 2vjb n GLU 455 N -5.42 0.05 0.00 3.15 0.00 -1.26 -0.81 120.64 116.34 2vjb n GLU 455 Ca 0.14 0.54 0.14 0.00 0.00 0.00 0.00 57.16 57.98 2vjb n GLU 455 Cb 0.48 -1.66 0.61 0.00 0.00 0.00 0.00 31.44 30.87 2vjb n GLU 455 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2vjb n LEU 456 N -1.75 0.23 -2.04 -1.84 4.77 -0.49 -4.95 117.00 110.94 2vjb n LEU 456 Ca -0.00 0.20 -0.19 0.00 -0.03 0.00 0.00 56.01 55.99 2vjb n LEU 456 Cb 0.02 -0.30 -0.02 0.00 -2.33 0.00 0.00 43.42 40.80 2vjb n LEU 456 CO 0.03 0.05 -0.23 0.59 -1.33 0.00 0.00 177.39 176.50 2vjb n ASN 457 N -1.24 -5.41 -4.83 -1.43 5.03 0.01 -5.01 115.26 102.38 2vjb n ASN 457 Ca 0.12 0.05 -0.31 0.00 0.87 0.00 0.00 54.58 55.31 2vjb n ASN 457 Cb 0.29 -4.47 0.04 0.00 -1.02 0.00 0.00 39.78 34.62 2vjb n ASN 457 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2vjb s TYR 458 N -2.90 3.18 0.78 3.10 1.51 -1.26 -4.83 117.35 116.92 2vjb s TYR 458 Ca 0.00 1.41 -0.12 0.00 -1.01 0.00 0.00 57.07 57.35 2vjb s TYR 458 Cb 0.00 -2.86 0.06 0.00 -0.11 0.00 0.00 41.96 39.04 2vjb s TYR 458 CO 0.00 -1.15 1.12 0.95 -1.11 0.00 0.00 175.55 175.36 2vjb s THR 459 N -3.03 2.92 0.37 -0.71 -4.23 -1.26 -4.90 115.64 104.81 2vjb s THR 459 Ca 0.58 0.30 0.06 0.00 -1.18 0.00 0.00 61.69 61.45 2vjb s THR 459 Cb -0.14 -3.19 0.19 0.00 1.34 0.00 0.00 72.50 70.70 2vjb s THR 459 CO 0.54 -0.39 1.93 0.00 -0.54 0.00 0.00 174.62 176.16 2vjb h ALA 460 N -0.96 1.49 0.00 3.99 0.00 -1.96 -1.69 119.26 120.13 2vjb h ALA 460 Ca -0.46 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.22 2vjb h ALA 460 Cb 1.28 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 2vjb h ALA 460 CO 0.63 0.37 -0.32 1.05 0.00 0.00 0.00 179.25 180.97 2vjb h GLU 461 N 0.45 0.00 0.00 0.00 9.09 -1.99 -2.76 114.58 119.37 2vjb h GLU 461 Ca 0.10 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.33 2vjb h GLU 461 Cb 0.24 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.31 2vjb h GLU 461 CO 0.00 0.32 -0.85 0.93 0.05 0.00 0.00 179.01 179.46 2vjb h GLU 462 N 0.00 0.00 -0.37 1.06 5.08 -1.69 -1.93 114.58 116.72 2vjb h GLU 462 Ca -0.00 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 2vjb h GLU 462 Cb 0.97 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.21 2vjb h GLU 462 CO 0.04 0.85 -0.18 1.49 -1.00 0.00 0.00 179.01 180.21 2vjb h GLU 463 N 0.00 0.78 -0.48 2.33 4.81 -1.24 -0.56 114.58 120.22 2vjb h GLU 463 Ca -0.01 -0.34 -0.10 0.00 -0.13 0.00 0.00 59.36 58.78 2vjb h GLU 463 Cb 1.58 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.92 2vjb h GLU 463 CO 0.11 0.96 -0.11 0.00 -0.73 0.00 0.00 179.01 179.24 2vjb h ALA 464 N 0.80 0.90 -0.31 2.92 0.00 -1.48 -0.79 119.26 121.29 2vjb h ALA 464 Ca 0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2vjb h ALA 464 Cb 0.73 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2vjb h ALA 464 CO 0.05 0.63 0.14 1.25 0.00 0.00 0.00 179.25 181.32 2vjb h LEU 465 N 0.79 0.42 -0.53 0.00 5.85 -1.17 -1.26 115.31 119.41 2vjb h LEU 465 Ca 0.13 -0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.73 2vjb h LEU 465 Cb 0.63 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.51 2vjb h LEU 465 CO 0.04 0.45 0.30 -1.28 -0.34 0.00 0.00 178.44 177.62 2vjb h SER 466 N 0.36 0.47 -0.70 1.25 0.87 -0.82 -0.81 113.55 114.17 2vjb h SER 466 Ca 0.10 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.66 2vjb h SER 466 Cb 0.15 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.00 2vjb h SER 466 CO -0.01 0.33 0.36 0.03 -0.53 0.00 0.00 176.83 177.01 2vjb h ARG 467 N 0.59 0.99 0.00 2.24 3.08 -0.84 -0.24 114.38 120.20 2vjb h ARG 467 Ca 0.22 -0.13 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 2vjb h ARG 467 Cb 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2vjb h ARG 467 CO -0.12 0.76 -0.44 0.07 -1.07 0.00 0.00 179.97 179.17 2vjb h ARG 468 N 0.96 0.00 -0.04 0.04 0.11 -0.90 -1.20 114.38 113.35 2vjb h ARG 468 Ca 0.24 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.19 2vjb h ARG 468 Cb 0.07 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.16 2vjb h ARG 468 CO -0.04 0.44 -0.49 0.82 0.10 0.00 0.00 179.97 180.80 2vjb h ILE 469 N 0.00 1.42 -0.60 0.08 2.04 -0.81 -0.36 117.51 119.28 2vjb h ILE 469 Ca -0.00 -1.92 -0.02 0.00 1.00 0.00 0.00 64.86 63.91 2vjb h ILE 469 Cb 1.07 2.43 -0.03 0.00 -0.74 0.00 0.00 36.82 39.55 2vjb h ILE 469 CO 0.06 0.56 0.27 0.24 0.00 0.00 0.00 178.15 179.28 2vjb h MET 470 N -0.08 0.85 -0.25 2.37 2.86 -1.01 0.07 114.93 119.74 2vjb h MET 470 Ca -0.05 -0.11 -0.17 0.00 -2.06 0.00 0.00 59.70 57.31 2vjb h MET 470 Cb 1.17 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 32.67 2vjb h MET 470 CO 0.10 0.67 -0.51 1.25 1.06 0.00 0.00 176.91 179.48 2vjb h HIS 471 N 0.84 0.88 0.17 -0.22 -0.00 -1.15 -0.29 115.15 115.39 2vjb h HIS 471 Ca 0.21 -0.30 -0.01 0.00 -0.00 0.00 0.00 60.37 60.27 2vjb h HIS 471 Cb 0.11 -0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.35 2vjb h HIS 471 CO 0.01 1.07 -0.08 1.88 -0.00 0.00 0.00 177.93 180.81 2vjb h TYR 472 N 0.56 -0.21 -0.03 5.26 0.05 -0.48 -0.71 116.97 121.41 2vjb h TYR 472 Ca 0.02 -0.01 0.03 0.00 0.05 0.00 0.00 58.73 58.83 2vjb h TYR 472 Cb 1.07 0.07 -0.04 0.00 1.01 0.00 0.00 36.73 38.85 2vjb h TYR 472 CO 0.06 -0.04 -0.19 -1.49 -1.05 0.00 0.00 178.16 175.44 2vjb h TRP 473 N -0.34 -0.49 -0.10 4.88 -0.00 -0.93 -0.96 115.95 118.00 2vjb h TRP 473 Ca -0.02 0.02 -0.02 0.00 -0.00 0.00 0.00 58.89 58.87 2vjb h TRP 473 Cb 0.27 0.22 -0.00 0.00 -0.00 0.00 0.00 29.16 29.65 2vjb h TRP 473 CO -0.03 -0.27 0.00 0.00 -0.00 0.00 0.00 178.44 178.14 2vjb h ALA 474 N 0.64 0.14 -0.80 1.49 0.00 -1.06 -0.73 119.26 118.94 2vjb h ALA 474 Ca 0.07 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.84 2vjb h ALA 474 Cb 0.38 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.08 2vjb h ALA 474 CO -0.20 -0.18 0.52 1.15 0.00 0.00 0.00 179.25 180.55 2vjb h THR 475 N -0.09 1.08 -0.25 0.00 2.02 -1.09 0.16 112.91 114.74 2vjb h THR 475 Ca 0.03 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.86 2vjb h THR 475 Cb 0.35 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 2vjb h THR 475 CO 0.01 0.17 0.04 0.15 0.37 0.00 0.00 175.52 176.25 2vjb h PHE 476 N 0.92 0.44 -0.94 3.16 3.57 -0.99 -0.97 116.94 122.14 2vjb h PHE 476 Ca 0.33 -0.06 0.10 0.00 3.53 0.00 0.00 57.97 61.86 2vjb h PHE 476 Cb 0.14 -0.12 -0.08 0.00 2.79 0.00 0.00 35.95 38.68 2vjb h PHE 476 CO -0.00 0.54 0.58 0.00 -2.23 0.00 0.00 178.31 177.20 2vjb h ALA 477 N 0.85 1.37 -0.01 2.41 0.00 0.36 0.71 119.26 124.94 2vjb h ALA 477 Ca 0.08 0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.79 2vjb h ALA 477 Cb 0.33 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 2vjb h ALA 477 CO 0.01 0.24 -0.89 0.87 0.00 0.00 0.00 179.25 179.48 2vjb h LYS 478 N 0.97 0.35 0.00 0.00 1.57 -0.77 -3.41 116.57 115.28 2vjb h LYS 478 Ca 0.45 -0.36 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 2vjb h LYS 478 Cb 0.36 0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.77 2vjb h LYS 478 CO -0.23 1.04 -0.35 0.25 -0.57 0.00 0.00 179.45 179.58 2vjb n THR 479 N -3.74 0.00 -0.50 -0.16 -2.24 -0.39 -5.02 114.28 102.23 2vjb n THR 479 Ca -0.05 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.56 2vjb n THR 479 Cb 0.80 0.66 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 2vjb n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vjb n GLY 480 N 1.21 0.75 2.80 3.38 0.00 0.24 -5.03 105.19 108.55 2vjb n GLY 480 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2vjb n GLY 480 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vjb s ASN 481 N -2.13 0.83 0.00 1.61 3.84 -1.25 -4.92 114.94 112.93 2vjb s ASN 481 Ca 0.00 0.28 0.13 0.00 0.21 0.00 0.00 52.86 53.48 2vjb s ASN 481 Cb 0.00 0.19 0.57 0.00 -0.55 0.00 0.00 41.25 41.47 2vjb s ASN 481 CO 0.00 -0.25 1.39 -0.81 -2.79 0.00 0.00 177.10 174.64 2vjb n PRO 482 N 5.32 0.05 -3.71 0.43 -0.04 -1.26 -3.51 135.00 132.27 2vjb n PRO 482 Ca -0.04 0.25 -0.37 0.00 -0.04 0.00 0.00 63.50 63.30 2vjb n PRO 482 Cb 0.50 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.40 2vjb n PRO 482 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2vjb s ASN 483 N -2.89 6.52 -0.21 3.54 0.01 -1.26 -4.51 114.94 116.14 2vjb s ASN 483 Ca 0.08 0.61 -0.26 0.00 -0.71 0.00 0.00 52.86 52.59 2vjb s ASN 483 Cb 0.08 -2.14 -0.01 0.00 0.41 0.00 0.00 41.25 39.60 2vjb s ASN 483 CO 0.22 0.33 0.87 -1.61 -1.51 0.00 0.00 177.10 175.40 2vjb s GLU 484 N -0.78 4.24 0.60 -0.60 2.02 -1.26 -5.00 118.70 117.92 2vjb s GLU 484 Ca 0.17 1.05 -0.18 0.00 0.02 0.00 0.00 54.97 56.03 2vjb s GLU 484 Cb -0.14 -3.62 -0.08 0.00 0.10 0.00 0.00 34.13 30.39 2vjb s GLU 484 CO 0.07 -0.46 0.45 -0.35 0.02 0.00 0.00 175.26 174.98 2vjb n PRO 485 N 5.76 0.42 -3.28 0.39 -0.04 -1.26 -2.40 135.00 134.58 2vjb n PRO 485 Ca 0.06 0.17 -0.22 0.00 -0.04 0.00 0.00 63.50 63.47 2vjb n PRO 485 Cb 0.48 -1.66 -0.04 0.00 -0.04 0.00 0.00 33.50 32.24 2vjb n PRO 485 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2vjb n HIS 486 N -1.82 -1.18 -2.99 0.54 1.44 -1.26 -4.92 115.22 105.03 2vjb n HIS 486 Ca 0.11 0.35 -0.22 0.00 -2.01 0.00 0.00 57.72 55.95 2vjb n HIS 486 Cb 0.48 -1.25 0.01 0.00 0.12 0.00 0.00 29.99 29.36 2vjb n HIS 486 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 2vjb s SER 487 N -2.37 5.75 -0.07 4.39 1.04 -1.01 -5.04 113.70 116.38 2vjb s SER 487 Ca 0.43 0.14 -0.25 0.00 0.48 0.00 0.00 55.95 56.75 2vjb s SER 487 Cb -0.25 -1.35 -0.24 0.00 0.10 0.00 0.00 66.02 64.28 2vjb s SER 487 CO 0.53 -0.74 0.98 1.56 0.98 0.00 0.00 173.24 176.55 2vjb h GLN 488 N 0.42 0.14 -6.00 4.02 7.50 -1.91 -3.48 115.11 115.80 2vjb h GLN 488 Ca -0.45 -0.16 -0.61 0.00 0.50 0.00 0.00 58.65 57.92 2vjb h GLN 488 Cb 1.26 0.05 0.17 0.00 0.05 0.00 0.00 27.48 29.01 2vjb h GLN 488 CO 0.55 0.93 -1.01 0.39 -1.50 0.00 0.00 178.83 178.19 2vjb n GLU 489 N -4.52 0.01 -1.67 1.46 4.71 -1.26 -4.84 120.64 114.53 2vjb n GLU 489 Ca -0.10 0.00 -0.42 0.00 -0.01 0.00 0.00 57.16 56.63 2vjb n GLU 489 Cb 0.51 -1.01 0.00 0.00 -1.01 0.00 0.00 31.44 29.93 2vjb n GLU 489 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 2vjb n SER 490 N 2.38 2.26 -4.78 1.62 3.41 -1.26 -4.95 113.62 112.30 2vjb n SER 490 Ca 0.10 1.14 -0.39 0.00 -0.26 0.00 0.00 58.87 59.47 2vjb n SER 490 Cb 0.42 -1.44 -0.06 0.00 -0.26 0.00 0.00 64.21 62.87 2vjb n SER 490 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2vjb s LYS 491 N -1.96 4.24 -0.49 4.33 -0.14 -1.26 -5.03 119.74 119.42 2vjb s LYS 491 Ca 0.59 0.67 -0.26 0.00 -1.36 0.00 0.00 55.97 55.61 2vjb s LYS 491 Cb -0.56 -3.30 0.03 0.00 -1.68 0.00 0.00 37.83 32.31 2vjb s LYS 491 CO 0.60 0.47 1.00 -0.46 -0.76 0.00 0.00 175.35 176.20 2vjb s TRP 492 N -0.52 2.85 0.56 3.18 -0.11 -1.26 -5.01 118.94 118.63 2vjb s TRP 492 Ca 0.29 0.40 -0.18 0.00 1.22 0.00 0.00 56.10 57.84 2vjb s TRP 492 Cb -0.18 -4.15 -0.05 0.00 -1.50 0.00 0.00 33.47 27.59 2vjb s TRP 492 CO 0.17 -1.22 1.07 -1.25 -4.62 0.00 0.00 176.95 171.10 2vjb s PRO 493 N 4.06 3.40 0.51 5.86 0.04 -1.26 -4.89 135.00 142.73 2vjb s PRO 493 Ca 0.39 1.36 -0.21 0.00 0.04 0.00 0.00 61.00 62.58 2vjb s PRO 493 Cb -0.09 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 2vjb s PRO 493 CO 0.27 -0.76 1.19 -0.51 0.04 0.00 0.00 177.00 177.22 2vjb s LEU 494 N -4.10 3.87 -0.17 -3.56 1.43 -1.26 -4.74 118.68 110.15 2vjb s LEU 494 Ca 0.67 2.34 -0.21 0.00 -1.03 0.00 0.00 54.13 55.90 2vjb s LEU 494 Cb -0.18 -4.39 -0.03 0.00 0.03 0.00 0.00 46.19 41.61 2vjb s LEU 494 CO 0.30 -1.18 0.63 0.12 0.23 0.00 0.00 176.35 176.45 2vjb s PHE 495 N -1.58 3.42 0.13 0.29 2.19 0.20 -4.45 117.98 118.19 2vjb s PHE 495 Ca 0.69 0.99 0.10 0.00 0.33 0.00 0.00 56.93 59.05 2vjb s PHE 495 Cb -0.29 -2.78 -0.04 0.00 -1.31 0.00 0.00 43.02 38.60 2vjb s PHE 495 CO 0.34 -0.10 -0.24 0.95 1.83 0.00 0.00 175.22 178.00 2vjb s THR 496 N 1.59 2.43 0.50 0.12 -4.23 -1.26 -4.44 115.64 110.36 2vjb s THR 496 Ca 0.30 -1.72 0.22 0.00 -1.18 0.00 0.00 61.69 59.31 2vjb s THR 496 Cb -0.16 -2.10 0.38 0.00 1.34 0.00 0.00 72.50 71.96 2vjb s THR 496 CO 0.12 0.07 1.98 0.00 -0.54 0.00 0.00 174.62 176.24 2vjb h THR 497 N 3.70 0.77 0.00 3.99 1.03 -1.95 0.46 112.91 120.91 2vjb h THR 497 Ca -0.50 -0.04 -0.00 0.00 -0.01 0.00 0.00 66.41 65.86 2vjb h THR 497 Cb 1.17 0.63 -0.00 0.00 -1.07 0.00 0.00 68.15 68.89 2vjb h THR 497 CO 0.42 0.02 -0.00 0.50 -0.01 0.00 0.00 175.52 176.45 2vjb h LYS 498 N 0.13 0.00 0.00 0.00 3.64 -2.02 -3.39 116.57 114.93 2vjb h LYS 498 Ca 0.27 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.60 2vjb h LYS 498 Cb 0.91 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 2vjb h LYS 498 CO -0.03 0.10 -0.81 0.93 -2.27 0.00 0.00 179.45 177.36 2vjb h GLU 499 N -1.00 0.00 -6.68 1.90 5.08 -1.96 -3.49 114.58 108.43 2vjb h GLU 499 Ca -0.00 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 57.82 2vjb h GLU 499 Cb 0.10 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 2vjb h GLU 499 CO -0.00 0.12 -0.96 1.04 -1.00 0.00 0.00 179.01 178.21 2vjb n GLN 500 N -2.88 -1.21 -2.76 2.33 6.02 0.16 -4.40 117.38 114.64 2vjb n GLN 500 Ca -0.01 0.24 -0.31 0.00 -0.01 0.00 0.00 57.00 56.92 2vjb n GLN 500 Cb 0.63 -3.52 -0.03 0.00 1.02 0.00 0.00 30.24 28.33 2vjb n GLN 500 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2vjb s LYS 501 N -6.86 3.84 0.17 -1.09 1.02 -1.26 -1.76 119.74 113.80 2vjb s LYS 501 Ca 0.31 0.61 -0.20 0.00 0.02 0.00 0.00 55.97 56.72 2vjb s LYS 501 Cb -0.15 -2.33 0.05 0.00 -0.52 0.00 0.00 37.83 34.88 2vjb s LYS 501 CO 0.93 -0.08 0.54 -0.59 -0.92 0.00 0.00 175.35 175.23 2vjb s PHE 502 N -2.40 -0.31 0.21 3.18 -0.12 -0.94 -4.31 117.98 113.28 2vjb s PHE 502 Ca 0.53 0.02 0.11 0.00 -0.05 0.00 0.00 56.93 57.54 2vjb s PHE 502 Cb -0.10 0.46 -0.05 0.00 -0.63 0.00 0.00 43.02 42.70 2vjb s PHE 502 CO 0.30 -0.87 -0.22 0.96 -0.05 0.00 0.00 175.22 175.34 2vjb s ILE 503 N -3.81 2.28 0.36 -4.49 -4.36 -1.12 -0.44 121.20 109.62 2vjb s ILE 503 Ca 0.05 -2.12 -0.13 0.00 -0.26 0.00 0.00 60.65 58.19 2vjb s ILE 503 Cb -0.01 -2.12 -0.08 0.00 1.25 0.00 0.00 42.46 41.50 2vjb s ILE 503 CO -0.08 -0.23 0.75 -1.81 0.24 0.00 0.00 174.94 173.80 2vjb s ASP 504 N -2.90 6.66 -0.31 4.36 1.01 -1.16 -1.33 116.67 123.01 2vjb s ASP 504 Ca 0.22 1.21 0.03 0.00 0.71 0.00 0.00 52.55 54.72 2vjb s ASP 504 Cb -0.07 -2.35 0.09 0.00 1.01 0.00 0.00 42.92 41.60 2vjb s ASP 504 CO 0.11 -0.29 0.01 -0.22 0.21 0.00 0.00 175.17 174.99 2vjb s LEU 505 N -3.36 3.86 0.00 1.23 2.96 -0.60 -4.63 118.68 118.15 2vjb s LEU 505 Ca 0.53 -1.80 0.00 0.00 -0.22 0.00 0.00 54.13 52.64 2vjb s LEU 505 Cb -0.10 -1.45 0.00 0.00 0.50 0.00 0.00 46.19 45.14 2vjb s LEU 505 CO 0.23 -0.33 0.00 -0.46 -1.32 0.00 0.00 176.35 174.48 2vjb n ASN 506 N 4.42 0.00 0.17 3.68 0.23 -1.26 -3.19 115.26 119.32 2vjb n ASN 506 Ca -0.03 -0.63 0.13 0.00 -0.53 0.00 0.00 54.58 53.52 2vjb n ASN 506 Cb 0.42 0.00 0.33 0.00 -2.08 0.00 0.00 39.78 38.46 2vjb n ASN 506 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 2vjb h THR 507 N 0.63 0.00 -4.25 5.53 1.35 -1.97 -3.46 112.91 110.75 2vjb h THR 507 Ca 0.00 -0.69 -0.48 0.00 -0.55 0.00 0.00 66.41 64.68 2vjb h THR 507 Cb 0.00 1.68 0.08 0.00 -1.73 0.00 0.00 68.15 68.17 2vjb h THR 507 CO 0.00 0.00 0.34 -1.61 -0.25 0.00 0.00 175.52 174.00 2vjb s GLU 508 N -3.22 2.70 0.97 4.72 2.02 -1.26 -5.03 118.70 119.60 2vjb s GLU 508 Ca 0.08 0.24 -0.12 0.00 0.02 0.00 0.00 54.97 55.19 2vjb s GLU 508 Cb 0.09 -2.08 0.13 0.00 0.10 0.00 0.00 34.13 32.36 2vjb s GLU 508 CO 0.61 -1.05 0.85 -2.30 0.02 0.00 0.00 175.26 173.38 2vjb n PRO 509 N -2.94 -0.74 -2.04 0.39 -0.02 -1.26 -4.90 135.00 123.48 2vjb n PRO 509 Ca 0.07 -0.16 -0.41 0.00 -2.02 0.00 0.00 63.50 60.98 2vjb n PRO 509 Cb 0.58 -2.16 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 2vjb n PRO 509 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2vjb s MET 510 N -4.24 4.24 -0.02 -0.52 1.75 -1.26 -4.98 119.30 114.26 2vjb s MET 510 Ca 0.64 2.28 0.03 0.00 -1.25 0.00 0.00 55.69 57.39 2vjb s MET 510 Cb -0.22 -3.00 -0.00 0.00 2.84 0.00 0.00 34.83 34.45 2vjb s MET 510 CO 0.62 -0.31 -0.12 0.15 -0.65 0.00 0.00 175.02 174.71 2vjb s LYS 511 N -1.93 1.18 -0.18 4.11 1.02 -1.26 -5.06 119.74 117.61 2vjb s LYS 511 Ca 0.51 -0.43 -0.07 0.00 0.02 0.00 0.00 55.97 56.00 2vjb s LYS 511 Cb -0.41 -1.09 -0.04 0.00 -0.52 0.00 0.00 37.83 35.77 2vjb s LYS 511 CO 0.54 0.21 0.04 0.08 -0.92 0.00 0.00 175.35 175.30 2vjb s VAL 512 N -0.03 4.55 0.46 3.17 1.01 -1.26 -2.96 120.40 125.33 2vjb s VAL 512 Ca -0.00 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2vjb s VAL 512 Cb -0.08 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.25 2vjb s VAL 512 CO 0.00 0.45 0.02 1.41 0.00 0.00 0.00 175.10 176.98 2vjb n HIS 513 N 3.70 0.97 -3.80 5.22 8.25 0.42 -4.97 115.22 125.01 2vjb n HIS 513 Ca -0.17 -2.23 -0.12 0.00 -0.26 0.00 0.00 57.72 54.94 2vjb n HIS 513 Cb 0.52 -0.30 -0.11 0.00 1.12 0.00 0.00 29.99 31.21 2vjb n HIS 513 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2vjb s GLN 514 N -3.65 0.32 -0.98 -0.41 -0.21 -1.26 -2.21 119.66 111.26 2vjb s GLN 514 Ca 0.01 0.17 -0.06 0.00 0.02 0.00 0.00 55.36 55.50 2vjb s GLN 514 Cb -0.00 0.15 -0.05 0.00 1.00 0.00 0.00 33.01 34.11 2vjb s GLN 514 CO 0.01 -0.05 0.85 0.54 -2.12 0.00 0.00 175.29 174.51 2vjb n ARG 515 N 2.62 -1.91 -1.51 2.91 1.74 -0.72 -4.84 116.66 114.94 2vjb n ARG 515 Ca -0.15 0.98 -0.53 0.00 -0.77 0.00 0.00 57.85 57.38 2vjb n ARG 515 Cb 0.58 -5.60 -0.07 0.00 -1.02 0.00 0.00 32.46 26.34 2vjb n ARG 515 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2vjb n LEU 516 N -2.95 2.15 -4.24 0.55 7.94 -1.26 -2.21 117.00 116.98 2vjb n LEU 516 Ca -0.06 0.64 -0.33 0.00 -1.11 0.00 0.00 56.01 55.15 2vjb n LEU 516 Cb 0.59 -1.20 -0.05 0.00 0.53 0.00 0.00 43.42 43.28 2vjb n LEU 516 CO 0.58 -0.61 -0.22 0.54 -1.11 0.00 0.00 177.39 176.57 2vjb n ARG 517 N 7.32 -2.16 -0.18 1.96 1.74 -1.26 -4.88 116.66 119.20 2vjb n ARG 517 Ca 0.38 0.26 -0.03 0.00 -0.77 0.00 0.00 57.85 57.69 2vjb n ARG 517 Cb 0.18 -4.49 0.07 0.00 -1.02 0.00 0.00 32.46 27.21 2vjb n ARG 517 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2vjb h VAL 518 N -1.55 0.90 0.12 1.55 -1.51 -1.81 -1.28 116.25 112.67 2vjb h VAL 518 Ca -0.62 -0.17 0.01 0.00 -1.23 0.00 0.00 66.70 64.69 2vjb h VAL 518 Cb 1.39 0.37 -0.04 0.00 -2.13 0.00 0.00 31.29 30.87 2vjb h VAL 518 CO 0.74 0.09 -0.47 -0.61 -1.23 0.00 0.00 177.57 176.09 2vjb h GLN 519 N 0.49 -0.65 -0.69 5.19 5.75 -1.89 0.24 115.11 123.54 2vjb h GLN 519 Ca 0.26 0.04 -0.03 0.00 -0.15 0.00 0.00 58.65 58.78 2vjb h GLN 519 Cb 0.22 0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.88 2vjb h GLN 519 CO -0.21 -0.43 0.33 0.52 -2.65 0.00 0.00 178.83 176.39 2vjb h MET 520 N -0.68 1.00 0.00 1.69 2.86 -1.94 -2.58 114.93 115.28 2vjb h MET 520 Ca -0.01 -0.15 -0.05 0.00 -2.06 0.00 0.00 59.70 57.44 2vjb h MET 520 Cb 0.68 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 2vjb h MET 520 CO -0.25 0.79 -0.22 0.00 1.06 0.00 0.00 176.91 178.29 2vjb h VAL 522 N 0.00 1.26 0.38 0.00 2.07 -0.14 0.33 116.25 120.15 2vjb h VAL 522 Ca -0.00 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.40 2vjb h VAL 522 Cb 0.48 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2vjb h VAL 522 CO 0.03 0.40 -0.18 0.15 0.02 0.00 0.00 177.57 177.99 2vjb h PHE 523 N 0.94 -0.47 -0.33 1.57 3.57 -0.85 0.52 116.94 121.88 2vjb h PHE 523 Ca 0.17 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.51 2vjb h PHE 523 Cb 0.51 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 2vjb h PHE 523 CO 0.03 -0.25 -0.39 -1.49 -2.23 0.00 0.00 178.31 173.99 2vjb h TRP 524 N -0.58 0.96 0.00 0.41 4.06 -0.94 0.12 115.95 119.97 2vjb h TRP 524 Ca -0.05 -0.28 -0.15 0.00 2.06 0.00 0.00 58.89 60.47 2vjb h TRP 524 Cb 0.43 -0.20 -0.03 0.00 -1.00 0.00 0.00 29.16 28.36 2vjb h TRP 524 CO -0.03 1.06 -1.29 -0.91 -3.56 0.00 0.00 178.44 173.71 2vjb h ASN 525 N 0.66 0.00 0.00 -3.49 2.35 -0.37 -3.40 115.58 111.33 2vjb h ASN 525 Ca 0.06 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.77 2vjb h ASN 525 Cb 0.95 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.31 2vjb h ASN 525 CO 0.09 0.53 -0.56 0.00 -1.65 0.00 0.00 177.43 175.84 2vjb n GLN 526 N -2.91 0.16 0.16 0.81 6.02 0.12 -4.81 117.38 116.93 2vjb n GLN 526 Ca -0.08 0.06 -0.12 0.00 -0.01 0.00 0.00 57.00 56.86 2vjb n GLN 526 Cb 0.81 -0.77 -0.07 0.00 1.02 0.00 0.00 30.24 31.23 2vjb n GLN 526 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2vjb h PHE 527 N -0.29 -0.42 -0.45 1.08 3.57 -1.21 -3.24 116.94 115.99 2vjb h PHE 527 Ca -0.05 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.52 2vjb h PHE 527 Cb 0.49 0.14 -0.06 0.00 2.79 0.00 0.00 35.95 39.31 2vjb h PHE 527 CO -0.10 -0.08 0.07 1.25 -2.23 0.00 0.00 178.31 177.22 2vjb h LEU 528 N -0.91 -0.03 -0.87 0.59 5.85 -1.01 -1.91 115.31 117.02 2vjb h LEU 528 Ca -0.05 0.08 0.10 0.00 0.84 0.00 0.00 57.88 58.86 2vjb h LEU 528 Cb 0.52 0.12 -0.08 0.00 0.37 0.00 0.00 40.66 41.60 2vjb h LEU 528 CO 0.08 0.02 0.51 -0.65 -0.34 0.00 0.00 178.44 178.05 2vjb h PRO 529 N 0.20 0.81 -0.22 5.25 0.11 -1.77 -0.14 132.00 136.24 2vjb h PRO 529 Ca 0.22 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 66.20 2vjb h PRO 529 Cb 0.29 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.20 2vjb h PRO 529 CO -0.30 0.54 -0.22 0.87 -0.21 0.00 0.00 178.00 178.67 2vjb h LYS 530 N 0.84 0.40 -0.03 1.05 1.57 -1.44 -1.92 116.57 117.03 2vjb h LYS 530 Ca 0.42 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 59.06 2vjb h LYS 530 Cb 0.40 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2vjb h LYS 530 CO -0.26 0.60 -0.03 1.25 -0.57 0.00 0.00 179.45 180.45 2vjb h LEU 531 N 0.36 0.08 -1.73 2.94 6.46 -0.40 -2.90 115.31 120.13 2vjb h LEU 531 Ca 0.06 -0.46 -0.04 0.00 -0.12 0.00 0.00 57.88 57.32 2vjb h LEU 531 Cb 0.59 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.49 2vjb h LEU 531 CO 0.04 0.53 -0.17 -0.07 -0.62 0.00 0.00 178.44 178.14 2vjb h LEU 532 N -0.37 0.00 0.20 2.25 3.38 -1.04 -3.07 115.31 116.67 2vjb h LEU 532 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 2vjb h LEU 532 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2vjb h LEU 532 CO 0.01 0.17 -0.10 -1.13 0.09 0.00 0.00 178.44 177.48 2vjb h ASN 533 N 0.00 -0.23 -3.29 -0.43 -1.24 -1.28 -3.45 115.58 105.67 2vjb h ASN 533 Ca -0.00 -0.25 -0.50 0.00 0.71 0.00 0.00 56.30 56.26 2vjb h ASN 533 Cb 0.39 0.06 0.22 0.00 0.73 0.00 0.00 38.32 39.72 2vjb h ASN 533 CO 0.02 0.15 -0.50 0.00 -1.29 0.00 0.00 177.43 175.81 2vjb n ALA 534 N -2.42 -2.69 -1.89 1.57 0.00 -1.10 -5.12 120.51 108.87 2vjb n ALA 534 Ca -0.09 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2vjb n ALA 534 Cb 0.24 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 17.87 2vjb n ALA 534 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13