#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vja h GLU 5 N 0.00 0.66 -0.00 -1.46 4.81 -2.03 -2.56 114.58 113.99 2vja h GLU 5 Ca 0.00 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2vja h GLU 5 Cb 0.00 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.24 2vja h GLU 5 CO 0.00 0.45 -0.25 1.28 -0.73 0.00 0.00 179.01 179.77 2vja n LEU 6 N -4.44 0.44 -4.32 1.64 4.77 -1.26 -4.76 117.00 109.07 2vja n LEU 6 Ca 0.04 0.08 -0.38 0.00 -0.03 0.00 0.00 56.01 55.73 2vja n LEU 6 Cb 0.07 -0.27 -0.12 0.00 -2.33 0.00 0.00 43.42 40.76 2vja n LEU 6 CO 0.36 0.09 -0.26 -0.22 -1.33 0.00 0.00 177.39 176.03 2vja s LEU 7 N -2.79 4.04 -0.02 2.23 2.96 -0.97 -0.60 118.68 123.53 2vja s LEU 7 Ca 0.18 -0.86 0.04 0.00 -0.22 0.00 0.00 54.13 53.28 2vja s LEU 7 Cb 0.19 -1.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.99 2vja s LEU 7 CO 0.58 -0.24 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.53 2vja s VAL 8 N 1.47 1.19 -0.22 1.68 1.01 -0.72 -4.76 120.40 120.03 2vja s VAL 8 Ca 0.01 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.32 2vja s VAL 8 Cb -0.18 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.17 2vja s VAL 8 CO 0.03 0.34 0.02 0.54 0.00 0.00 0.00 175.10 176.03 2vja s ASN 9 N -0.18 4.89 0.55 3.32 2.20 -1.26 -0.33 114.94 124.13 2vja s ASN 9 Ca 0.02 -0.23 0.09 0.00 -0.94 0.00 0.00 52.86 51.80 2vja s ASN 9 Cb -0.08 -1.86 0.07 0.00 -2.00 0.00 0.00 41.25 37.39 2vja s ASN 9 CO 0.00 0.01 0.74 0.42 -2.94 0.00 0.00 177.10 175.33 2vja s THR 10 N 1.33 2.25 0.44 0.54 -4.23 0.59 -4.94 115.64 111.62 2vja s THR 10 Ca 0.04 -1.03 0.40 0.00 -1.18 0.00 0.00 61.69 59.92 2vja s THR 10 Cb -0.15 -2.27 0.41 0.00 1.34 0.00 0.00 72.50 71.83 2vja s THR 10 CO 0.02 0.00 2.21 0.11 -0.54 0.00 0.00 174.62 176.42 2vja h LYS 11 N 0.28 0.00 -0.01 3.99 6.56 -1.95 -2.18 116.57 123.27 2vja h LYS 11 Ca -0.32 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.27 2vja h LYS 11 Cb 1.29 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.95 2vja h LYS 11 CO 0.42 0.00 -0.52 0.43 -2.06 0.00 0.00 179.45 177.72 2vja n SER 12 N -2.99 1.54 0.00 0.86 7.64 -1.26 -4.90 113.62 114.51 2vja n SER 12 Ca -0.02 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.59 2vja n SER 12 Cb 0.12 0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.94 2vja n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vja n GLY 13 N 1.31 1.39 3.85 0.23 0.00 -0.82 -1.47 105.19 109.69 2vja n GLY 13 Ca 0.07 -1.83 -0.32 0.00 0.00 0.00 0.00 46.02 43.94 2vja n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vja s LYS 14 N -1.32 3.89 -0.00 1.61 1.02 -1.25 -0.30 119.74 123.39 2vja s LYS 14 Ca 0.00 0.83 -0.01 0.00 0.02 0.00 0.00 55.97 56.82 2vja s LYS 14 Cb 0.00 -2.19 -0.00 0.00 -0.52 0.00 0.00 37.83 35.12 2vja s LYS 14 CO 0.00 -0.24 0.01 0.08 -0.92 0.00 0.00 175.35 174.28 2vja s VAL 15 N -2.61 0.03 -0.23 3.17 1.01 0.56 -1.50 120.40 120.82 2vja s VAL 15 Ca 0.57 -0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.36 2vja s VAL 15 Cb -0.10 -0.10 0.05 0.00 0.00 0.00 0.00 36.38 36.23 2vja s VAL 15 CO 0.33 -0.12 -0.13 -0.32 0.00 0.00 0.00 175.10 174.86 2vja s MET 16 N -0.34 2.38 0.00 2.72 1.75 0.40 -1.76 119.30 124.44 2vja s MET 16 Ca -0.04 -1.17 0.00 0.00 -1.25 0.00 0.00 55.69 53.23 2vja s MET 16 Cb -0.02 -2.76 0.00 0.00 2.84 0.00 0.00 34.83 34.88 2vja s MET 16 CO -0.00 -0.47 0.00 0.41 -0.65 0.00 0.00 175.02 174.31 2vja n GLY 17 N 4.51 -0.25 3.05 2.11 0.00 0.23 -0.99 105.19 113.85 2vja n GLY 17 Ca -0.16 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.01 2vja n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2vja s THR 18 N -0.08 0.12 -0.20 2.61 -1.32 -0.08 -4.77 115.64 111.93 2vja s THR 18 Ca 0.00 -1.02 -0.23 0.00 -1.21 0.00 0.00 61.69 59.23 2vja s THR 18 Cb 0.00 -0.61 -0.02 0.00 -1.51 0.00 0.00 72.50 70.37 2vja s THR 18 CO 0.00 -0.56 0.73 -0.60 -2.21 0.00 0.00 174.62 171.98 2vja s ARG 19 N -2.04 4.23 -0.07 7.08 6.06 -1.26 -0.97 118.95 131.98 2vja s ARG 19 Ca -0.10 0.81 0.04 0.00 -2.50 0.00 0.00 55.73 53.98 2vja s ARG 19 Cb -0.05 -3.59 -0.02 0.00 0.06 0.00 0.00 34.95 31.35 2vja s ARG 19 CO -0.02 -0.33 -0.19 0.14 -2.50 0.00 0.00 175.30 172.40 2vja s VAL 20 N 2.19 2.60 0.59 7.11 -7.23 -0.02 -4.97 120.40 120.68 2vja s VAL 20 Ca 0.33 -0.87 -0.17 0.00 -1.81 0.00 0.00 61.98 59.46 2vja s VAL 20 Cb -0.16 -2.00 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 2vja s VAL 20 CO 0.10 0.57 1.07 -2.16 -0.31 0.00 0.00 175.10 174.37 2vja s PRO 21 N -0.29 3.30 -0.30 4.82 0.04 -1.26 -1.11 135.00 140.19 2vja s PRO 21 Ca 0.01 1.29 -0.09 0.00 0.04 0.00 0.00 61.00 62.25 2vja s PRO 21 Cb -0.13 -2.02 0.17 0.00 0.04 0.00 0.00 34.50 32.55 2vja s PRO 21 CO 0.03 -0.84 0.80 0.54 0.04 0.00 0.00 177.00 177.57 2vja s VAL 22 N -2.31 -0.74 -1.20 -0.36 0.11 0.24 -4.84 120.40 111.31 2vja s VAL 22 Ca 0.65 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 59.41 2vja s VAL 22 Cb -0.18 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.70 2vja s VAL 22 CO 0.34 0.00 0.71 0.18 -3.33 0.00 0.00 175.10 173.00 2vja n LEU 23 N 5.32 -1.18 0.00 2.54 4.77 -1.26 -0.32 117.00 126.87 2vja n LEU 23 Ca -0.07 -1.20 0.00 0.00 -0.03 0.00 0.00 56.01 54.71 2vja n LEU 23 Cb 0.51 -1.90 0.00 0.00 -2.33 0.00 0.00 43.42 39.71 2vja n LEU 23 CO -0.03 0.69 0.00 -1.20 -1.33 0.00 0.00 177.39 175.51 2vja n SER 24 N -2.36 0.00 0.00 -1.43 7.64 -1.26 -4.92 113.62 111.29 2vja n SER 24 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.77 2vja n SER 24 Cb 0.58 -1.15 0.00 0.00 -1.01 0.00 0.00 64.21 62.62 2vja n SER 24 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2vja n SER 25 N 0.00 1.38 -3.85 6.43 2.88 0.57 -5.18 113.62 115.86 2vja n SER 25 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 2vja n SER 25 Cb 0.00 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.39 2vja n SER 25 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2vja s HIS 26 N 0.57 0.16 0.17 0.66 3.76 -1.26 -0.59 115.29 118.76 2vja s HIS 26 Ca 0.00 -0.55 -0.12 0.00 -0.15 0.00 0.00 55.06 54.24 2vja s HIS 26 Cb 0.00 0.01 0.00 0.00 1.11 0.00 0.00 32.58 33.71 2vja s HIS 26 CO 0.00 -0.64 0.36 0.96 -0.85 0.00 0.00 174.74 174.57 2vja s ILE 27 N -3.89 0.06 0.16 0.60 -4.36 -0.27 -4.44 121.20 109.06 2vja s ILE 27 Ca 0.09 -1.16 -0.16 0.00 -0.26 0.00 0.00 60.65 59.16 2vja s ILE 27 Cb 0.04 -1.72 -0.07 0.00 1.25 0.00 0.00 42.46 41.96 2vja s ILE 27 CO -0.07 -0.25 0.59 -0.44 0.24 0.00 0.00 174.94 175.01 2vja s SER 28 N -2.93 6.89 -0.03 4.36 0.01 -0.47 -0.84 113.70 120.69 2vja s SER 28 Ca 0.14 1.17 0.01 0.00 1.31 0.00 0.00 55.95 58.57 2vja s SER 28 Cb 0.02 -2.32 0.02 0.00 0.21 0.00 0.00 66.02 63.94 2vja s SER 28 CO -0.02 0.09 -0.03 0.00 0.41 0.00 0.00 173.24 173.69 2vja s ALA 29 N -1.47 0.54 -0.36 1.44 0.00 -0.15 -1.40 121.76 120.36 2vja s ALA 29 Ca 0.39 -0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.37 2vja s ALA 29 Cb -0.16 -0.33 0.10 0.00 0.00 0.00 0.00 23.12 22.73 2vja s ALA 29 CO 0.20 0.00 0.07 -0.06 0.00 0.00 0.00 175.76 175.97 2vja s PHE 30 N 0.74 3.71 -0.09 0.00 0.40 0.13 -0.90 117.98 121.98 2vja s PHE 30 Ca -0.09 -3.02 -0.04 0.00 -0.60 0.00 0.00 56.93 53.17 2vja s PHE 30 Cb -0.12 -2.92 -0.04 0.00 0.51 0.00 0.00 43.02 40.45 2vja s PHE 30 CO -0.00 -0.93 0.08 -0.51 0.70 0.00 0.00 175.22 174.55 2vja s LEU 31 N 0.78 3.99 -0.77 -0.37 1.43 -0.32 0.24 118.68 123.67 2vja s LEU 31 Ca 0.12 0.30 -0.05 0.00 -1.03 0.00 0.00 54.13 53.47 2vja s LEU 31 Cb -0.20 -1.99 0.01 0.00 0.03 0.00 0.00 46.19 44.04 2vja s LEU 31 CO -0.07 0.38 0.67 0.61 0.23 0.00 0.00 176.35 178.17 2vja n GLY 32 N 1.96 0.07 3.71 -3.19 0.00 -1.17 -3.97 105.19 102.60 2vja n GLY 32 Ca -0.19 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.29 2vja n GLY 32 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vja s ILE 33 N -3.19 5.00 0.24 -0.61 1.01 -0.38 -4.80 121.20 118.47 2vja s ILE 33 Ca 0.30 1.56 -0.30 0.00 0.00 0.00 0.00 60.65 62.20 2vja s ILE 33 Cb -0.13 -4.09 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 2vja s ILE 33 CO 0.42 0.21 0.98 -2.16 0.00 0.00 0.00 174.94 174.39 2vja s PRO 34 N 1.00 4.79 0.00 2.79 0.04 -1.26 -0.15 135.00 142.21 2vja s PRO 34 Ca 0.40 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.99 2vja s PRO 34 Cb -0.18 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.09 2vja s PRO 34 CO 0.19 0.42 0.19 1.97 0.04 0.00 0.00 177.00 179.80 2vja n PHE 35 N 1.57 0.00 -4.03 0.56 1.16 -1.12 -4.89 117.46 110.70 2vja n PHE 35 Ca -0.01 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.47 2vja n PHE 35 Cb 0.47 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.26 2vja n PHE 35 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 2vja s ALA 36 N -0.45 0.27 0.33 1.98 0.00 -1.25 -3.10 121.76 119.54 2vja s ALA 36 Ca 0.00 -1.10 -0.26 0.00 0.00 0.00 0.00 51.96 50.60 2vja s ALA 36 Cb 0.00 0.98 -0.10 0.00 0.00 0.00 0.00 23.12 24.00 2vja s ALA 36 CO 0.00 -0.65 0.96 -1.21 0.00 0.00 0.00 175.76 174.86 2vja s GLU 37 N -4.02 4.55 -0.26 0.00 0.41 0.12 -4.31 118.70 115.19 2vja s GLU 37 Ca 0.22 1.35 -0.34 0.00 -0.41 0.00 0.00 54.97 55.80 2vja s GLU 37 Cb 0.04 -2.78 -0.10 0.00 -1.78 0.00 0.00 34.13 29.51 2vja s GLU 37 CO 0.04 0.24 2.11 -2.30 -0.49 0.00 0.00 175.26 174.85 2vja n PRO 38 N 0.50 1.50 -0.88 0.39 -0.02 -1.26 -4.67 135.00 130.56 2vja n PRO 38 Ca 0.02 0.46 -0.23 0.00 -2.02 0.00 0.00 63.50 61.73 2vja n PRO 38 Cb 0.50 -2.64 -0.05 0.00 -0.02 0.00 0.00 33.50 31.29 2vja n PRO 38 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2vja n PRO 39 N 7.82 2.34 -3.55 0.52 -0.04 -1.26 -4.86 135.00 135.96 2vja n PRO 39 Ca 0.34 -1.46 -0.20 0.00 -0.04 0.00 0.00 63.50 62.14 2vja n PRO 39 Cb 0.28 -2.39 -0.02 0.00 -0.04 0.00 0.00 33.50 31.33 2vja n PRO 39 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2vja s VAL 40 N 2.62 3.17 0.00 0.52 -7.23 -1.26 -3.54 120.40 114.68 2vja s VAL 40 Ca 0.49 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 59.40 2vja s VAL 40 Cb 0.15 -3.11 0.00 0.00 0.56 0.00 0.00 36.38 33.99 2vja s VAL 40 CO -0.03 -0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.29 2vja n GLY 41 N -1.54 3.67 0.00 2.32 0.00 -1.26 -0.62 105.19 107.75 2vja n GLY 41 Ca 0.02 0.22 0.08 0.00 0.00 0.00 0.00 46.02 46.35 2vja n GLY 41 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2vja n ASN 42 N 7.84 0.00 0.06 1.61 0.23 -1.26 -2.26 115.26 121.48 2vja n ASN 42 Ca 0.00 -0.01 0.12 0.00 -0.53 0.00 0.00 54.58 54.15 2vja n ASN 42 Cb 0.00 -0.26 0.13 0.00 -2.08 0.00 0.00 39.78 37.58 2vja n ASN 42 CO 0.00 0.00 0.00 0.24 -0.93 0.00 0.00 177.26 176.57 2vja h MET 43 N 0.00 0.00 -6.66 -3.83 2.86 -1.14 -3.46 114.93 102.70 2vja h MET 43 Ca 0.00 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 57.08 2vja h MET 43 Cb 0.14 0.00 0.08 0.00 0.06 0.00 0.00 31.60 31.88 2vja h MET 43 CO 0.00 0.00 0.76 -2.13 1.06 0.00 0.00 176.91 176.60 2vja n ARG 44 N -2.15 2.36 -0.04 1.72 0.63 -0.96 -0.91 116.66 117.31 2vja n ARG 44 Ca 0.03 0.84 0.00 0.00 -0.92 0.00 0.00 57.85 57.80 2vja n ARG 44 Cb 0.45 -2.57 0.00 0.00 0.45 0.00 0.00 32.46 30.79 2vja n ARG 44 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2vja n PHE 45 N 2.30 0.00 -2.80 -0.14 3.72 -1.26 -4.89 117.46 114.40 2vja n PHE 45 Ca 0.11 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.22 2vja n PHE 45 Cb 0.33 -0.20 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 2vja n PHE 45 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2vja s ARG 46 N -0.01 3.69 0.51 -1.08 3.52 -0.09 -4.11 118.95 121.39 2vja s ARG 46 Ca 0.00 0.36 -0.22 0.00 -0.13 0.00 0.00 55.73 55.73 2vja s ARG 46 Cb 0.00 -2.40 -0.06 0.00 -1.56 0.00 0.00 34.95 30.93 2vja s ARG 46 CO 0.00 -0.09 1.28 0.54 -0.81 0.00 0.00 175.30 176.22 2vja n ARG 47 N -1.61 1.66 -1.49 5.12 1.74 -1.26 -4.93 116.66 115.88 2vja n ARG 47 Ca 0.02 0.61 -0.32 0.00 -0.77 0.00 0.00 57.85 57.38 2vja n ARG 47 Cb 0.54 -2.46 0.07 0.00 -1.02 0.00 0.00 32.46 29.60 2vja n ARG 47 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2vja s PRO 48 N -2.65 2.43 -0.01 5.56 0.04 -1.26 -5.05 135.00 134.06 2vja s PRO 48 Ca 0.69 1.38 0.07 0.00 0.04 0.00 0.00 61.00 63.17 2vja s PRO 48 Cb -0.45 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.17 2vja s PRO 48 CO 0.52 -1.53 -0.21 -2.00 0.04 0.00 0.00 177.00 173.81 2vja s GLU 49 N -4.36 1.67 0.32 4.56 2.56 -1.26 -5.03 118.70 117.17 2vja s GLU 49 Ca 0.66 -0.78 -0.28 0.00 0.00 0.00 0.00 54.97 54.57 2vja s GLU 49 Cb -0.21 -1.64 -0.13 0.00 2.00 0.00 0.00 34.13 34.16 2vja s GLU 49 CO 0.47 0.45 1.27 -2.30 -0.56 0.00 0.00 175.26 174.59 2vja n PRO 50 N 2.47 2.01 -1.87 4.30 -0.02 -1.26 0.14 135.00 140.77 2vja n PRO 50 Ca -0.15 0.71 -0.42 0.00 -2.02 0.00 0.00 63.50 61.61 2vja n PRO 50 Cb 0.53 -2.27 -0.03 0.00 -0.02 0.00 0.00 33.50 31.71 2vja n PRO 50 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2vja s LYS 51 N -1.64 4.18 0.37 -0.52 2.47 -1.18 -4.15 119.74 119.26 2vja s LYS 51 Ca 0.57 2.41 -0.24 0.00 -1.56 0.00 0.00 55.97 57.15 2vja s LYS 51 Cb -0.60 -3.49 -0.10 0.00 -1.46 0.00 0.00 37.83 32.18 2vja s LYS 51 CO 0.60 -0.74 0.96 -1.59 0.16 0.00 0.00 175.35 174.75 2vja s LYS 52 N 2.32 4.42 0.32 4.03 -2.85 -1.26 -4.91 119.74 121.80 2vja s LYS 52 Ca 0.75 1.29 -0.26 0.00 -1.00 0.00 0.00 55.97 56.75 2vja s LYS 52 Cb -0.42 -2.58 -0.14 0.00 -2.06 0.00 0.00 37.83 32.63 2vja s LYS 52 CO 0.33 0.12 0.69 -2.30 0.10 0.00 0.00 175.35 174.29 2vja n PRO 53 N 0.11 0.68 -4.52 1.78 -0.02 -1.26 -5.01 135.00 126.76 2vja n PRO 53 Ca 0.04 0.24 -0.25 0.00 -2.02 0.00 0.00 63.50 61.51 2vja n PRO 53 Cb 0.51 -1.48 -0.10 0.00 -0.02 0.00 0.00 33.50 32.41 2vja n PRO 53 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 2vja s TRP 54 N -1.21 2.35 0.28 6.00 -2.14 -0.54 -5.03 118.94 118.64 2vja s TRP 54 Ca 0.62 -0.49 0.07 0.00 2.66 0.00 0.00 56.10 58.95 2vja s TRP 54 Cb -0.72 -1.30 -0.03 0.00 -3.10 0.00 0.00 33.47 28.32 2vja s TRP 54 CO 0.58 0.58 0.30 -1.12 -2.66 0.00 0.00 176.95 174.63 2vja s SER 55 N -3.58 5.73 0.39 -2.66 0.01 -1.26 -4.60 113.70 107.73 2vja s SER 55 Ca 0.32 -0.22 0.00 0.00 1.31 0.00 0.00 55.95 57.36 2vja s SER 55 Cb 0.01 -1.39 0.00 0.00 0.21 0.00 0.00 66.02 64.85 2vja s SER 55 CO 0.16 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.25 2vja n GLY 56 N -1.34 -1.63 3.63 3.44 0.00 -1.26 -4.78 105.19 103.25 2vja n GLY 56 Ca -0.06 -1.26 -0.38 0.00 0.00 0.00 0.00 46.02 44.33 2vja n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vja s VAL 57 N 0.00 5.28 -0.11 1.61 1.01 -1.26 -3.84 120.40 123.09 2vja s VAL 57 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 2vja s VAL 57 Cb 0.00 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 2vja s VAL 57 CO 0.00 0.26 1.02 0.86 0.00 0.00 0.00 175.10 177.24 2vja s TRP 58 N 1.51 3.49 -0.49 5.22 -0.11 -0.56 -4.87 118.94 123.12 2vja s TRP 58 Ca 0.11 1.57 -0.29 0.00 1.22 0.00 0.00 56.10 58.71 2vja s TRP 58 Cb -0.15 -3.21 0.02 0.00 -1.50 0.00 0.00 33.47 28.63 2vja s TRP 58 CO 0.08 -0.30 1.32 1.21 -4.62 0.00 0.00 176.95 174.64 2vja s ASN 59 N 1.12 6.36 -0.64 5.86 3.84 -1.26 -0.45 114.94 129.78 2vja s ASN 59 Ca 0.49 0.52 0.03 0.00 0.21 0.00 0.00 52.86 54.10 2vja s ASN 59 Cb -0.18 -2.55 0.37 0.00 -0.55 0.00 0.00 41.25 38.34 2vja s ASN 59 CO 0.18 -1.47 1.29 0.00 -2.79 0.00 0.00 177.10 174.30 2vja n ALA 60 N 8.76 5.28 0.44 1.71 0.00 -0.16 -4.66 120.51 131.89 2vja n ALA 60 Ca 0.13 -4.48 0.05 0.00 0.00 0.00 0.00 53.44 49.14 2vja n ALA 60 Cb 0.49 -1.06 -0.00 0.00 0.00 0.00 0.00 19.45 18.87 2vja n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2vja n SER 61 N -0.34 1.21 -4.21 0.00 3.41 -1.25 -1.17 113.62 111.27 2vja n SER 61 Ca 0.39 -1.11 -0.18 0.00 -0.26 0.00 0.00 58.87 57.72 2vja n SER 61 Cb 0.44 0.47 -0.11 0.00 -0.26 0.00 0.00 64.21 64.74 2vja n SER 61 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2vja s THR 62 N -1.35 1.23 0.62 6.66 -4.23 -1.26 -4.86 115.64 112.45 2vja s THR 62 Ca 0.08 -1.55 -0.18 0.00 -1.18 0.00 0.00 61.69 58.86 2vja s THR 62 Cb 0.08 -1.35 -0.02 0.00 1.34 0.00 0.00 72.50 72.55 2vja s THR 62 CO 0.25 -0.34 1.23 -0.31 -0.54 0.00 0.00 174.62 174.91 2vja s TYR 63 N -1.80 2.27 0.82 3.99 2.02 -1.26 -3.64 117.35 119.76 2vja s TYR 63 Ca 0.04 1.52 -0.08 0.00 -0.37 0.00 0.00 57.07 58.18 2vja s TYR 63 Cb -0.07 -3.53 0.15 0.00 -0.40 0.00 0.00 41.96 38.11 2vja s TYR 63 CO 0.03 -2.45 1.14 -1.25 -1.57 0.00 0.00 175.55 171.45 2vja s PRO 64 N -3.42 1.27 0.85 -1.71 0.04 -1.26 -4.86 135.00 125.91 2vja s PRO 64 Ca 0.78 -0.73 -0.11 0.00 0.04 0.00 0.00 61.00 60.98 2vja s PRO 64 Cb -0.32 -2.11 0.10 0.00 0.04 0.00 0.00 34.50 32.22 2vja s PRO 64 CO 0.36 -1.85 1.09 -0.80 0.04 0.00 0.00 177.00 175.85 2vja s ASN 65 N -4.79 3.86 0.13 6.66 0.01 -1.26 -4.85 114.94 114.70 2vja s ASN 65 Ca 0.69 1.56 0.03 0.00 -0.71 0.00 0.00 52.86 54.43 2vja s ASN 65 Cb -0.05 -2.25 -0.04 0.00 0.41 0.00 0.00 41.25 39.32 2vja s ASN 65 CO 0.48 -2.41 0.20 0.20 -1.51 0.00 0.00 177.10 174.07 2vja s ASN 66 N -3.46 5.98 0.67 -1.22 0.02 -0.53 -4.78 114.94 111.63 2vja s ASN 66 Ca 0.62 0.07 -0.15 0.00 -1.02 0.00 0.00 52.86 52.38 2vja s ASN 66 Cb -0.17 -1.72 0.01 0.00 0.02 0.00 0.00 41.25 39.39 2vja s ASN 66 CO 0.56 0.09 1.14 0.00 0.02 0.00 0.00 177.10 178.92 2vja s GLN 68 N -3.97 4.14 0.22 0.00 -1.52 -1.23 -4.62 119.66 112.67 2vja s GLN 68 Ca 0.70 2.57 -0.22 0.00 -1.95 0.00 0.00 55.36 56.46 2vja s GLN 68 Cb -0.23 -3.24 0.04 0.00 -0.22 0.00 0.00 33.01 29.36 2vja s GLN 68 CO 0.41 -0.76 0.65 1.14 -0.25 0.00 0.00 175.29 176.48 2vja s GLN 69 N 1.65 1.53 0.40 2.91 -2.07 -1.26 -4.68 119.66 118.14 2vja s GLN 69 Ca 0.76 -0.75 -0.26 0.00 -1.82 0.00 0.00 55.36 53.28 2vja s GLN 69 Cb -0.48 0.59 -0.09 0.00 -1.09 0.00 0.00 33.01 31.95 2vja s GLN 69 CO 0.33 -0.69 1.33 -0.47 -1.32 0.00 0.00 175.29 174.47 2vja s TYR 70 N -3.84 2.78 -0.12 9.60 5.04 -1.25 -5.01 117.35 124.54 2vja s TYR 70 Ca 0.07 1.38 0.01 0.00 -2.44 0.00 0.00 57.07 56.09 2vja s TYR 70 Cb -0.03 -3.72 -0.01 0.00 0.35 0.00 0.00 41.96 38.55 2vja s TYR 70 CO -0.02 -2.23 -0.16 0.08 -1.34 0.00 0.00 175.55 171.87 2vja s VAL 71 N -1.24 2.74 -0.29 3.14 1.01 -1.26 -4.90 120.40 119.61 2vja s VAL 71 Ca 0.57 -0.77 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 2vja s VAL 71 Cb -0.39 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 33.87 2vja s VAL 71 CO 0.51 0.53 1.15 -0.62 0.00 0.00 0.00 175.10 176.67 2vja s ASP 72 N 0.36 6.89 -0.17 3.32 2.15 -1.26 -4.89 116.67 123.07 2vja s ASP 72 Ca -0.13 1.20 0.14 0.00 0.43 0.00 0.00 52.55 54.18 2vja s ASP 72 Cb -0.17 -2.54 0.39 0.00 -0.30 0.00 0.00 42.92 40.31 2vja s ASP 72 CO 0.06 -0.89 1.20 -0.62 -0.17 0.00 0.00 175.17 174.75 2vja n GLU 73 N 6.89 1.35 -0.14 4.34 1.02 -1.26 -4.75 120.64 128.08 2vja n GLU 73 Ca 0.13 -3.02 -0.11 0.00 -0.02 0.00 0.00 57.16 54.15 2vja n GLU 73 Cb 0.47 -1.41 0.02 0.00 -0.02 0.00 0.00 31.44 30.49 2vja n GLU 73 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2vja h GLN 74 N 0.83 0.95 -2.89 3.49 1.08 -2.01 -3.37 115.11 113.18 2vja h GLN 74 Ca -0.02 -0.41 -0.61 0.00 -1.45 0.00 0.00 58.65 56.16 2vja h GLN 74 Cb 1.10 -0.03 -0.40 0.00 -0.05 0.00 0.00 27.48 28.09 2vja h GLN 74 CO 0.01 1.07 -0.72 -0.06 -0.95 0.00 0.00 178.83 178.19 2vja s PHE 75 N -4.64 2.57 0.19 2.96 0.08 -1.26 -5.10 117.98 112.78 2vja s PHE 75 Ca -0.11 -2.88 -0.33 0.00 0.12 0.00 0.00 56.93 53.73 2vja s PHE 75 Cb 0.12 -2.07 -0.13 0.00 -0.57 0.00 0.00 43.02 40.37 2vja s PHE 75 CO 0.87 -0.68 1.65 -2.30 -0.10 0.00 0.00 175.22 174.66 2vja n PRO 76 N 2.58 2.48 0.00 0.24 -0.02 -1.26 -1.77 135.00 137.25 2vja n PRO 76 Ca 0.19 0.89 0.00 0.00 -2.02 0.00 0.00 63.50 62.57 2vja n PRO 76 Cb 0.38 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 2vja n PRO 76 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vja n GLY 77 N 3.67 3.09 3.65 -1.23 0.00 -1.26 -4.99 105.19 108.12 2vja n GLY 77 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2vja n GLY 77 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2vja s PHE 78 N -1.38 2.48 0.36 1.61 5.36 -0.73 -4.91 117.98 120.77 2vja s PHE 78 Ca 0.00 0.71 0.06 0.00 -0.96 0.00 0.00 56.93 56.74 2vja s PHE 78 Cb 0.00 -3.75 0.69 0.00 -0.34 0.00 0.00 43.02 39.62 2vja s PHE 78 CO 0.00 -2.43 1.92 0.66 -1.46 0.00 0.00 175.22 173.91 2vja h SER 79 N 9.15 0.44 -0.44 6.13 4.64 -1.94 -2.15 113.55 129.36 2vja h SER 79 Ca -0.31 -0.07 0.10 0.00 -0.47 0.00 0.00 61.79 61.05 2vja h SER 79 Cb 1.13 -0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 2vja h SER 79 CO 0.98 0.48 0.31 1.23 -0.87 0.00 0.00 176.83 178.97 2vja h GLY 80 N 0.75 0.20 0.00 -0.77 0.00 -1.93 -2.01 103.07 99.32 2vja h GLY 80 Ca 0.11 -0.06 -0.33 0.00 0.00 0.00 0.00 47.33 47.05 2vja h GLY 80 CO 0.00 0.04 -2.25 -1.14 0.00 0.00 0.00 176.54 173.19 2vja n SER 81 N -4.44 2.25 0.28 0.19 3.41 -1.12 -4.53 113.62 109.65 2vja n SER 81 Ca 0.07 -0.12 0.18 0.00 -0.26 0.00 0.00 58.87 58.74 2vja n SER 81 Cb 0.42 -0.32 0.77 0.00 -0.26 0.00 0.00 64.21 64.82 2vja n SER 81 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2vja h GLU 82 N 0.00 0.00 0.00 4.33 5.08 -1.35 -2.41 114.58 120.23 2vja h GLU 82 Ca -0.49 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 2vja h GLU 82 Cb 1.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.02 2vja h GLU 82 CO -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 177.94 2vja n MET 83 N -3.00 0.03 0.00 2.33 0.00 -0.76 -1.39 117.12 114.33 2vja n MET 83 Ca -0.00 0.33 0.06 0.00 0.00 0.00 0.00 57.70 58.09 2vja n MET 83 Cb 0.25 -1.50 -0.01 0.00 0.00 0.00 0.00 33.22 31.96 2vja n MET 83 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 175.97 176.88 2vja n TRP 84 N -1.44 0.00 -2.44 3.17 7.02 -0.91 -4.73 117.44 118.12 2vja n TRP 84 Ca 0.02 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.22 2vja n TRP 84 Cb 0.08 0.00 -0.00 0.00 -2.42 0.00 0.00 31.31 28.97 2vja n TRP 84 CO 0.00 0.00 0.00 -0.80 -2.02 0.00 0.00 177.69 174.87 2vja s ASN 85 N -1.68 6.28 0.23 -0.99 0.01 -0.49 -4.69 114.94 113.62 2vja s ASN 85 Ca 0.10 1.09 -0.31 0.00 -0.71 0.00 0.00 52.86 53.03 2vja s ASN 85 Cb 0.10 -2.32 -0.13 0.00 0.41 0.00 0.00 41.25 39.31 2vja s ASN 85 CO 0.34 -0.65 1.43 -2.65 -1.51 0.00 0.00 177.10 174.07 2vja n PRO 86 N -2.32 2.07 -0.27 -0.60 -0.02 -1.26 -4.86 135.00 127.73 2vja n PRO 86 Ca 0.02 0.74 0.07 0.00 -2.02 0.00 0.00 63.50 62.31 2vja n PRO 86 Cb 0.55 -2.41 0.20 0.00 -0.02 0.00 0.00 33.50 31.82 2vja n PRO 86 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2vja n ASN 87 N 2.25 3.29 -4.19 2.55 6.94 -1.26 -4.96 115.26 119.88 2vja n ASN 87 Ca 0.12 -2.27 -0.11 0.00 -0.02 0.00 0.00 54.58 52.30 2vja n ASN 87 Cb 0.31 -0.33 -0.10 0.00 -2.36 0.00 0.00 39.78 37.30 2vja n ASN 87 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 2vja s ARG 88 N -1.49 1.05 0.42 -3.83 1.81 -1.26 -5.11 118.95 110.55 2vja s ARG 88 Ca 0.30 -1.52 -0.26 0.00 -1.72 0.00 0.00 55.73 52.53 2vja s ARG 88 Cb 0.19 0.10 -0.09 0.00 -0.45 0.00 0.00 34.95 34.70 2vja s ARG 88 CO 0.15 -0.26 1.40 -2.00 -0.68 0.00 0.00 175.30 173.91 2vja s GLU 89 N -4.04 3.86 0.20 3.54 2.12 -1.26 -4.50 118.70 118.62 2vja s GLU 89 Ca 0.28 2.37 -0.16 0.00 0.36 0.00 0.00 54.97 57.82 2vja s GLU 89 Cb 0.07 -2.76 -0.08 0.00 0.26 0.00 0.00 34.13 31.63 2vja s GLU 89 CO 0.05 -0.66 0.63 -1.64 -0.54 0.00 0.00 175.26 173.10 2vja s MET 90 N -2.30 4.05 -0.13 4.30 -1.94 -1.26 -1.45 119.30 120.57 2vja s MET 90 Ca 0.58 0.61 -0.30 0.00 -1.71 0.00 0.00 55.69 54.87 2vja s MET 90 Cb -0.43 -2.82 0.11 0.00 2.01 0.00 0.00 34.83 33.70 2vja s MET 90 CO 0.56 0.40 0.89 0.45 -0.01 0.00 0.00 175.02 177.31 2vja s SER 91 N -1.83 -0.46 0.50 3.03 0.15 -0.35 -4.90 113.70 109.84 2vja s SER 91 Ca 0.42 0.51 0.28 0.00 0.70 0.00 0.00 55.95 57.87 2vja s SER 91 Cb -0.15 0.39 1.22 0.00 -1.71 0.00 0.00 66.02 65.77 2vja s SER 91 CO 0.20 -0.43 1.94 -0.33 1.20 0.00 0.00 173.24 175.82 2vja h GLU 92 N 2.72 0.00 -5.29 5.44 5.08 -1.95 -3.27 114.58 117.31 2vja h GLU 92 Ca -0.21 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.45 2vja h GLU 92 Cb 1.16 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.27 2vja h GLU 92 CO 0.33 0.14 1.59 0.34 -1.00 0.00 0.00 179.01 180.41 2vja s ASP 93 N -6.01 6.88 0.00 1.42 2.15 -1.26 -4.35 116.67 115.50 2vja s ASP 93 Ca -0.00 -2.54 0.00 0.00 0.43 0.00 0.00 52.55 50.43 2vja s ASP 93 Cb 0.11 -2.48 0.00 0.00 -0.30 0.00 0.00 42.92 40.25 2vja s ASP 93 CO 0.59 -1.00 0.43 0.00 -0.17 0.00 0.00 175.17 175.02 2vja n LEU 95 N -0.09 4.78 -4.37 0.00 4.77 -1.26 -4.76 117.00 116.07 2vja n LEU 95 Ca 0.00 -3.83 -0.19 0.00 -0.03 0.00 0.00 56.01 51.96 2vja n LEU 95 Cb 0.31 -1.74 -0.10 0.00 -2.33 0.00 0.00 43.42 39.55 2vja n LEU 95 CO 0.00 -0.06 -0.27 -0.31 -1.33 0.00 0.00 177.39 175.42 2vja s TYR 96 N 5.03 1.71 0.05 -1.77 1.51 -1.26 -2.79 117.35 119.82 2vja s TYR 96 Ca 0.56 -1.05 0.00 0.00 -1.01 0.00 0.00 57.07 55.57 2vja s TYR 96 Cb 0.04 -1.05 -0.03 0.00 -0.11 0.00 0.00 41.96 40.80 2vja s TYR 96 CO 0.08 -0.15 -0.05 -0.48 -1.11 0.00 0.00 175.55 173.85 2vja s LEU 97 N -3.38 2.38 0.03 -1.29 0.05 0.79 -3.26 118.68 114.00 2vja s LEU 97 Ca 0.36 -0.78 0.08 0.00 0.05 0.00 0.00 54.13 53.84 2vja s LEU 97 Cb 0.08 0.05 -0.03 0.00 -2.05 0.00 0.00 46.19 44.24 2vja s LEU 97 CO 0.14 -0.42 -0.24 0.20 -0.55 0.00 0.00 176.35 175.48 2vja s ASN 98 N -2.30 3.31 -0.02 1.48 0.01 0.15 -1.25 114.94 116.31 2vja s ASN 98 Ca -0.01 -0.52 0.03 0.00 -0.71 0.00 0.00 52.86 51.64 2vja s ASN 98 Cb -0.01 -0.39 0.00 0.00 0.41 0.00 0.00 41.25 41.26 2vja s ASN 98 CO -0.05 0.27 -0.09 -0.63 -1.51 0.00 0.00 177.10 175.09 2vja s ILE 99 N -0.79 0.80 -0.22 0.60 1.01 0.14 0.08 121.20 122.82 2vja s ILE 99 Ca 0.12 -0.38 -0.00 0.00 0.00 0.00 0.00 60.65 60.38 2vja s ILE 99 Cb -0.10 -0.70 0.02 0.00 0.01 0.00 0.00 42.46 41.69 2vja s ILE 99 CO 0.02 0.24 -0.12 0.26 0.00 0.00 0.00 174.94 175.34 2vja s TRP 100 N 0.09 2.95 -0.11 3.97 0.51 -0.01 0.22 118.94 126.57 2vja s TRP 100 Ca -0.01 -1.60 0.02 0.00 -2.12 0.00 0.00 56.10 52.38 2vja s TRP 100 Cb -0.07 -1.99 -0.01 0.00 -0.81 0.00 0.00 33.47 30.58 2vja s TRP 100 CO 0.00 -0.76 -0.17 0.08 -0.51 0.00 0.00 176.95 175.60 2vja s VAL 101 N 1.30 2.73 0.68 4.03 1.01 -0.50 -1.94 120.40 127.72 2vja s VAL 101 Ca 0.02 -0.79 -0.17 0.00 0.00 0.00 0.00 61.98 61.04 2vja s VAL 101 Cb -0.15 -2.11 0.01 0.00 0.00 0.00 0.00 36.38 34.13 2vja s VAL 101 CO -0.08 0.54 1.26 -2.65 0.00 0.00 0.00 175.10 174.18 2vja n PRO 102 N 3.37 0.93 -4.29 2.72 -0.02 -1.26 -1.37 135.00 135.07 2vja n PRO 102 Ca -0.18 0.38 -0.29 0.00 -2.02 0.00 0.00 63.50 61.39 2vja n PRO 102 Cb 0.53 -2.50 -0.17 0.00 -0.02 0.00 0.00 33.50 31.34 2vja n PRO 102 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2vja s SER 103 N -1.52 2.52 0.63 2.55 0.15 -1.26 -2.63 113.70 114.14 2vja s SER 103 Ca 0.81 -0.44 -0.18 0.00 0.70 0.00 0.00 55.95 56.84 2vja s SER 103 Cb -0.36 -1.11 -0.01 0.00 -1.71 0.00 0.00 66.02 62.82 2vja s SER 103 CO 0.42 -0.01 1.21 -2.16 1.20 0.00 0.00 173.24 173.90 2vja s PRO 104 N 1.18 2.74 -0.05 5.44 0.04 -1.26 -4.94 135.00 138.14 2vja s PRO 104 Ca -0.02 1.80 -0.35 0.00 0.04 0.00 0.00 61.00 62.47 2vja s PRO 104 Cb -0.14 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.37 2vja s PRO 104 CO -0.05 -1.38 1.80 -2.13 0.04 0.00 0.00 177.00 175.28 2vja n ARG 105 N -1.93 2.06 -0.78 4.56 0.63 -1.08 -4.96 116.66 115.16 2vja n ARG 105 Ca 0.14 0.75 -0.29 0.00 -0.92 0.00 0.00 57.85 57.53 2vja n ARG 105 Cb 0.50 -2.57 0.22 0.00 0.45 0.00 0.00 32.46 31.06 2vja n ARG 105 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2vja s PRO 106 N 3.33 -0.23 -0.14 -0.14 0.02 -1.26 -5.01 135.00 131.58 2vja s PRO 106 Ca 0.90 0.82 -0.09 0.00 0.02 0.00 0.00 61.00 62.65 2vja s PRO 106 Cb -0.73 -1.64 -0.05 0.00 0.02 0.00 0.00 34.50 32.10 2vja s PRO 106 CO 0.50 -3.25 -0.03 0.87 -0.33 0.00 0.00 177.00 174.75 2vja h LYS 107 N -2.28 0.00 -1.19 5.54 1.57 -1.94 -3.39 116.57 114.87 2vja h LYS 107 Ca -0.57 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 57.81 2vja h LYS 107 Cb 1.32 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 33.36 2vja h LYS 107 CO 0.52 0.17 -0.81 0.45 -0.57 0.00 0.00 179.45 179.20 2vja n SER 108 N -4.64 -1.34 -4.99 0.86 2.88 -1.16 -4.43 113.62 100.80 2vja n SER 108 Ca -0.08 -2.92 -0.19 0.00 -1.33 0.00 0.00 58.87 54.36 2vja n SER 108 Cb 0.25 0.50 0.04 0.00 -0.75 0.00 0.00 64.21 64.24 2vja n SER 108 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2vja s THR 109 N -0.19 2.64 0.38 2.46 -1.32 -0.21 -4.43 115.64 114.97 2vja s THR 109 Ca 0.33 -0.92 -0.28 0.00 -1.21 0.00 0.00 61.69 59.61 2vja s THR 109 Cb 0.17 -2.72 -0.11 0.00 -1.51 0.00 0.00 72.50 68.33 2vja s THR 109 CO -0.17 0.00 1.46 -0.89 -2.21 0.00 0.00 174.62 172.81 2vja s THR 110 N -2.56 2.13 -0.03 5.08 2.01 -1.26 -0.61 115.64 120.39 2vja s THR 110 Ca 0.58 0.13 0.07 0.00 0.31 0.00 0.00 61.69 62.78 2vja s THR 110 Cb -0.08 -3.08 -0.02 0.00 0.01 0.00 0.00 72.50 69.33 2vja s THR 110 CO 0.36 0.03 -0.25 -0.69 -0.69 0.00 0.00 174.62 173.38 2vja s VAL 111 N -1.13 2.13 -0.08 3.82 1.01 -0.81 -1.14 120.40 124.19 2vja s VAL 111 Ca 0.53 -1.07 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2vja s VAL 111 Cb -0.45 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.19 2vja s VAL 111 CO 0.61 0.58 -0.13 -0.04 0.00 0.00 0.00 175.10 176.12 2vja s MET 112 N -0.49 1.90 -0.18 2.72 -1.94 -0.50 -0.24 119.30 120.57 2vja s MET 112 Ca 0.06 -0.46 -0.03 0.00 -1.71 0.00 0.00 55.69 53.55 2vja s MET 112 Cb -0.11 -1.61 -0.02 0.00 2.01 0.00 0.00 34.83 35.10 2vja s MET 112 CO 0.00 -0.02 -0.05 0.08 -0.01 0.00 0.00 175.02 175.02 2vja s VAL 113 N 0.85 3.50 -0.17 -6.03 1.01 0.83 -0.20 120.40 120.19 2vja s VAL 113 Ca -0.10 -0.47 -0.16 0.00 0.00 0.00 0.00 61.98 61.25 2vja s VAL 113 Cb -0.15 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 2vja s VAL 113 CO 0.01 0.46 0.37 0.86 0.00 0.00 0.00 175.10 176.81 2vja s TRP 114 N 0.93 3.43 -0.45 5.22 -0.11 0.12 -0.69 118.94 127.38 2vja s TRP 114 Ca -0.01 0.66 0.00 0.00 1.22 0.00 0.00 56.10 57.97 2vja s TRP 114 Cb -0.15 -2.47 0.12 0.00 -1.50 0.00 0.00 33.47 29.48 2vja s TRP 114 CO 0.01 0.11 0.22 0.42 -4.62 0.00 0.00 176.95 173.09 2vja s ILE 115 N 0.88 2.98 0.68 5.86 1.01 -0.30 -2.37 121.20 129.95 2vja s ILE 115 Ca 0.19 -2.53 -0.17 0.00 0.00 0.00 0.00 60.65 58.14 2vja s ILE 115 Cb -0.14 -3.06 -0.03 0.00 0.01 0.00 0.00 42.46 39.24 2vja s ILE 115 CO 0.07 -0.72 0.75 0.00 0.00 0.00 0.00 174.94 175.03 2vja n TYR 116 N 4.02 -0.03 -1.91 3.97 0.18 -1.26 -3.93 117.16 118.21 2vja n TYR 116 Ca 0.03 0.39 0.00 0.00 1.88 0.00 0.00 57.90 60.20 2vja n TYR 116 Cb 0.39 -2.01 0.00 0.00 -0.38 0.00 0.00 39.34 37.34 2vja n TYR 116 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2vja n GLY 117 N 1.43 2.10 0.00 -7.48 0.00 -1.21 -3.71 105.19 96.31 2vja n GLY 117 Ca 0.12 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.12 2vja n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vja n GLY 118 N 5.00 0.92 2.95 -0.02 0.00 -1.26 -4.13 105.19 108.65 2vja n GLY 118 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2vja n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vja n GLY 119 N 0.00 0.18 2.51 -0.02 0.00 -1.26 -1.65 105.19 104.95 2vja n GLY 119 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2vja n GLY 119 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vja n PHE 120 N -2.05 0.00 -0.06 1.61 3.72 -1.26 -4.80 117.46 114.61 2vja n PHE 120 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2vja n PHE 120 Cb 0.50 -0.56 0.00 0.00 -0.94 0.00 0.00 39.48 38.48 2vja n PHE 120 CO 0.00 0.00 0.00 2.48 -0.05 0.00 0.00 176.76 179.19 2vja n TYR 121 N -2.56 0.00 -3.83 1.38 0.18 -0.86 0.71 117.16 112.19 2vja n TYR 121 Ca 0.00 0.00 -0.07 0.00 1.88 0.00 0.00 57.90 59.71 2vja n TYR 121 Cb 0.12 0.00 0.01 0.00 -0.38 0.00 0.00 39.34 39.09 2vja n TYR 121 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 2vja s SER 122 N -0.13 -0.07 0.00 9.48 1.04 -0.66 -3.83 113.70 119.54 2vja s SER 122 Ca 0.00 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.57 2vja s SER 122 Cb 0.00 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.84 2vja s SER 122 CO 0.00 -1.39 0.00 0.61 0.98 0.00 0.00 173.24 173.44 2vja n GLY 123 N -0.55 3.86 3.08 7.32 0.00 -1.26 -4.05 105.19 113.60 2vja n GLY 123 Ca -0.06 -1.54 -0.11 0.00 0.00 0.00 0.00 46.02 44.31 2vja n GLY 123 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vja s SER 124 N 0.00 0.06 0.00 1.61 0.01 -1.26 -4.66 113.70 109.46 2vja s SER 124 Ca 0.00 -0.25 0.27 0.00 1.31 0.00 0.00 55.95 57.28 2vja s SER 124 Cb 0.00 0.19 0.85 0.00 0.21 0.00 0.00 66.02 67.27 2vja s SER 124 CO 0.00 -0.35 1.64 -1.54 0.41 0.00 0.00 173.24 173.40 2vja n SER 125 N 1.50 0.47 -1.12 2.44 3.41 -1.26 -4.09 113.62 114.97 2vja n SER 125 Ca -0.23 -0.27 0.11 0.00 -0.26 0.00 0.00 58.87 58.23 2vja n SER 125 Cb 0.55 0.01 0.22 0.00 -0.26 0.00 0.00 64.21 64.73 2vja n SER 125 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2vja n THR 126 N -1.25 0.61 -1.27 6.66 -2.24 -1.26 -4.89 114.28 110.64 2vja n THR 126 Ca 0.09 -0.80 -0.35 0.00 -2.27 0.00 0.00 64.05 60.72 2vja n THR 126 Cb 0.33 0.88 0.11 0.00 -2.10 0.00 0.00 70.33 69.54 2vja n THR 126 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2vja n LEU 127 N 1.41 4.54 -0.07 3.22 4.77 -1.26 -4.90 117.00 124.71 2vja n LEU 127 Ca 0.19 0.65 -0.02 0.00 -0.03 0.00 0.00 56.01 56.80 2vja n LEU 127 Cb 0.58 -1.50 0.24 0.00 -2.33 0.00 0.00 43.42 40.41 2vja n LEU 127 CO 0.15 -1.64 0.95 0.44 -1.33 0.00 0.00 177.39 175.96 2vja h ASP 128 N -0.51 0.63 0.35 -1.43 3.32 -1.95 -2.00 116.42 114.82 2vja h ASP 128 Ca -0.47 -0.12 0.00 0.00 0.02 0.00 0.00 57.03 56.46 2vja h ASP 128 Cb 1.31 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2vja h ASP 128 CO 0.47 0.67 0.00 0.55 -1.72 0.00 0.00 179.24 179.21 2vja n VAL 129 N -4.27 0.85 -0.07 -1.35 3.14 -1.26 -2.08 118.33 113.29 2vja n VAL 129 Ca 0.03 0.21 0.06 0.00 -2.96 0.00 0.00 64.34 61.68 2vja n VAL 129 Cb 0.24 -0.99 0.14 0.00 -1.06 0.00 0.00 33.84 32.17 2vja n VAL 129 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 2vja n TYR 130 N -1.39 0.39 -1.61 1.45 4.01 -0.76 -4.67 117.16 114.60 2vja n TYR 130 Ca 0.05 -0.41 -0.50 0.00 -0.16 0.00 0.00 57.90 56.88 2vja n TYR 130 Cb 0.13 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.08 2vja n TYR 130 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2vja n ASN 131 N 0.56 2.93 -0.33 7.72 2.85 -0.88 -4.82 115.26 123.28 2vja n ASN 131 Ca 0.11 0.73 0.15 0.00 -0.11 0.00 0.00 54.58 55.46 2vja n ASN 131 Cb 0.41 -1.33 0.66 0.00 1.24 0.00 0.00 39.78 40.75 2vja n ASN 131 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2vja n GLY 132 N 5.17 -0.31 0.35 8.20 0.00 -1.26 -4.31 105.19 113.02 2vja n GLY 132 Ca 0.29 -0.37 -0.04 0.00 0.00 0.00 0.00 46.02 45.90 2vja n GLY 132 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2vja h LYS 133 N 1.60 1.20 -0.24 1.61 2.10 -1.92 -2.02 116.57 118.90 2vja h LYS 133 Ca 0.00 -0.18 -0.01 0.00 -2.00 0.00 0.00 60.65 58.46 2vja h LYS 133 Cb 0.34 -0.21 -0.01 0.00 -0.90 0.00 0.00 32.23 31.45 2vja h LYS 133 CO 0.00 0.93 0.09 1.88 -2.00 0.00 0.00 179.45 180.35 2vja h TYR 134 N 1.19 0.37 0.06 0.07 -1.99 -1.80 -1.13 116.97 113.73 2vja h TYR 134 Ca 0.29 -0.03 -0.00 0.00 2.00 0.00 0.00 58.73 60.98 2vja h TYR 134 Cb 0.13 -0.11 0.00 0.00 2.00 0.00 0.00 36.73 38.75 2vja h TYR 134 CO 0.02 0.40 -0.03 1.25 -0.00 0.00 0.00 178.16 179.79 2vja h LEU 135 N 0.24 -0.07 -0.86 3.88 5.85 -1.70 -0.83 115.31 121.82 2vja h LEU 135 Ca 0.08 -0.40 0.09 0.00 0.84 0.00 0.00 57.88 58.49 2vja h LEU 135 Cb 0.18 0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.16 2vja h LEU 135 CO -0.01 0.38 0.51 0.00 -0.34 0.00 0.00 178.44 178.98 2vja h ALA 136 N 0.36 1.22 -0.11 1.25 0.00 -1.40 -0.73 119.26 119.85 2vja h ALA 136 Ca -0.01 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 2vja h ALA 136 Cb 0.46 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2vja h ALA 136 CO 0.01 0.18 -0.13 -0.92 0.00 0.00 0.00 179.25 178.39 2vja h TYR 137 N 0.88 0.34 -0.24 0.00 5.03 -1.19 -0.50 116.97 121.30 2vja h TYR 137 Ca 0.40 -0.11 -0.15 0.00 2.58 0.00 0.00 58.73 61.45 2vja h TYR 137 Cb 0.31 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.51 2vja h TYR 137 CO -0.04 0.72 -0.48 1.15 -1.32 0.00 0.00 178.16 178.19 2vja h THR 138 N -0.14 1.30 -0.29 1.81 2.02 -0.90 -3.22 112.91 113.49 2vja h THR 138 Ca 0.01 -1.68 0.00 0.00 0.77 0.00 0.00 66.41 65.51 2vja h THR 138 Cb 0.68 1.63 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 2vja h THR 138 CO 0.03 0.53 0.00 -0.62 0.37 0.00 0.00 175.52 175.83 2vja n GLU 139 N -4.00 2.22 -3.77 6.66 -0.58 -0.30 -4.99 120.64 115.87 2vja n GLU 139 Ca -0.03 -2.04 -0.24 0.00 -0.42 0.00 0.00 57.16 54.43 2vja n GLU 139 Cb 0.57 -1.43 0.02 0.00 -0.57 0.00 0.00 31.44 30.03 2vja n GLU 139 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2vja n GLU 140 N 1.20 -3.78 -4.48 3.49 1.02 -0.26 -5.00 120.64 112.84 2vja n GLU 140 Ca 0.16 0.53 -0.24 0.00 -0.02 0.00 0.00 57.16 57.59 2vja n GLU 140 Cb 0.53 -4.83 -0.10 0.00 -0.02 0.00 0.00 31.44 27.01 2vja n GLU 140 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 2vja s VAL 141 N -3.73 2.25 -0.37 2.62 -7.23 -0.82 -4.75 120.40 108.35 2vja s VAL 141 Ca 0.08 -2.29 -0.19 0.00 -1.81 0.00 0.00 61.98 57.76 2vja s VAL 141 Cb -0.03 -2.41 0.01 0.00 0.56 0.00 0.00 36.38 34.51 2vja s VAL 141 CO 0.84 -0.34 0.58 -0.69 -0.31 0.00 0.00 175.10 175.18 2vja s VAL 142 N -2.64 4.94 -0.25 1.32 1.01 -0.29 -4.47 120.40 120.02 2vja s VAL 142 Ca 0.30 0.33 -0.08 0.00 0.00 0.00 0.00 61.98 62.53 2vja s VAL 142 Cb -0.01 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.27 2vja s VAL 142 CO 0.14 -0.34 0.11 -0.22 0.00 0.00 0.00 175.10 174.79 2vja s LEU 143 N 2.58 3.67 -0.05 3.92 2.96 -0.82 -1.42 118.68 129.52 2vja s LEU 143 Ca 0.21 -0.10 0.01 0.00 -0.22 0.00 0.00 54.13 54.02 2vja s LEU 143 Cb -0.15 -1.99 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 2vja s LEU 143 CO 0.15 -0.01 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.44 2vja s VAL 144 N 1.48 3.93 -0.22 1.68 1.01 0.72 -0.83 120.40 128.17 2vja s VAL 144 Ca 0.06 -0.47 0.02 0.00 0.00 0.00 0.00 61.98 61.59 2vja s VAL 144 Cb -0.15 -2.66 0.05 0.00 0.00 0.00 0.00 36.38 33.62 2vja s VAL 144 CO 0.05 0.54 -0.12 -0.55 0.00 0.00 0.00 175.10 175.02 2vja s SER 145 N -1.03 3.84 0.57 3.32 0.15 0.11 0.10 113.70 120.76 2vja s SER 145 Ca 0.14 -1.09 0.08 0.00 0.70 0.00 0.00 55.95 55.79 2vja s SER 145 Cb -0.11 -1.41 0.07 0.00 -1.71 0.00 0.00 66.02 62.86 2vja s SER 145 CO 0.04 -0.14 0.67 -1.48 1.20 0.00 0.00 173.24 173.53 2vja s LEU 146 N 1.25 2.95 0.15 3.45 0.05 -1.00 0.29 118.68 125.82 2vja s LEU 146 Ca -0.04 -1.00 -0.05 0.00 0.05 0.00 0.00 54.13 53.10 2vja s LEU 146 Cb -0.17 -1.45 -0.03 0.00 -2.05 0.00 0.00 46.19 42.49 2vja s LEU 146 CO -0.08 -1.29 0.16 -0.94 -0.55 0.00 0.00 176.35 173.66 2vja s SER 147 N -4.55 0.18 -0.07 1.48 1.04 -1.20 -4.54 113.70 106.04 2vja s SER 147 Ca 0.53 -1.07 -0.30 0.00 0.48 0.00 0.00 55.95 55.59 2vja s SER 147 Cb -0.04 0.36 0.08 0.00 0.10 0.00 0.00 66.02 66.52 2vja s SER 147 CO 0.33 -0.81 0.76 -0.72 0.98 0.00 0.00 173.24 173.78 2vja s TYR 148 N -4.02 -0.58 0.33 5.02 1.13 -1.26 -4.48 117.35 113.49 2vja s TYR 148 Ca 0.22 0.96 -0.29 0.00 -1.41 0.00 0.00 57.07 56.54 2vja s TYR 148 Cb 0.06 0.43 -0.11 0.00 -1.10 0.00 0.00 41.96 41.23 2vja s TYR 148 CO 0.01 -0.55 1.53 1.03 -2.51 0.00 0.00 175.55 175.06 2vja s ARG 149 N -1.32 4.13 0.39 -3.49 0.52 -1.26 -4.92 118.95 113.00 2vja s ARG 149 Ca -0.08 2.55 0.07 0.00 -0.52 0.00 0.00 55.73 57.75 2vja s ARG 149 Cb -0.00 -3.01 -0.08 0.00 0.52 0.00 0.00 34.95 32.39 2vja s ARG 149 CO 0.07 -0.56 0.01 0.14 0.02 0.00 0.00 175.30 174.97 2vja s VAL 150 N -0.52 1.94 0.00 3.52 -7.23 -1.26 -4.27 120.40 112.57 2vja s VAL 150 Ca 0.58 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.73 2vja s VAL 150 Cb -0.47 -2.94 0.00 0.00 0.56 0.00 0.00 36.38 33.53 2vja s VAL 150 CO 0.54 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.92 2vja n GLY 151 N -0.92 0.55 0.27 2.32 0.00 0.22 -2.86 105.19 104.77 2vja n GLY 151 Ca -0.05 -0.83 0.02 0.00 0.00 0.00 0.00 46.02 45.16 2vja n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vja h ALA 152 N -0.78 1.01 -0.43 4.61 0.00 -1.89 0.65 119.26 122.44 2vja h ALA 152 Ca 0.00 0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.09 2vja h ALA 152 Cb 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 2vja h ALA 152 CO 0.00 -0.03 0.33 0.74 0.00 0.00 0.00 179.25 180.29 2vja h PHE 153 N 0.63 0.00 -0.00 0.00 0.04 -1.93 -1.51 116.94 114.16 2vja h PHE 153 Ca 0.36 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.13 2vja h PHE 153 Cb 0.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.53 2vja h PHE 153 CO -0.10 0.00 -0.43 0.41 -0.60 0.00 0.00 178.31 177.59 2vja n GLY 154 N -1.59 0.13 0.20 -1.45 0.00 -0.44 -4.04 105.19 97.99 2vja n GLY 154 Ca 0.07 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2vja n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vja n PHE 155 N -1.20 0.00 -1.69 1.61 3.72 0.09 -0.25 117.46 119.75 2vja n PHE 155 Ca 0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.99 2vja n PHE 155 Cb 0.14 0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.66 2vja n PHE 155 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 2vja n LEU 156 N 0.00 3.99 -3.98 4.37 7.94 -0.59 -4.47 117.00 124.26 2vja n LEU 156 Ca 0.00 0.98 -0.29 0.00 -1.11 0.00 0.00 56.01 55.59 2vja n LEU 156 Cb 0.57 -1.53 -0.17 0.00 0.53 0.00 0.00 43.42 42.82 2vja n LEU 156 CO 0.00 0.15 -0.47 0.00 -1.11 0.00 0.00 177.39 175.96 2vja s ALA 157 N 2.89 1.70 -0.56 1.96 0.00 -1.26 -3.39 121.76 123.09 2vja s ALA 157 Ca 0.83 -0.80 0.06 0.00 0.00 0.00 0.00 51.96 52.05 2vja s ALA 157 Cb -0.50 -1.02 0.21 0.00 0.00 0.00 0.00 23.12 21.82 2vja s ALA 157 CO 0.39 -0.40 0.54 1.28 0.00 0.00 0.00 175.76 177.56 2vja n LEU 158 N 4.82 1.86 -4.53 0.00 4.77 -0.48 -2.85 117.00 120.59 2vja n LEU 158 Ca -0.15 -4.99 -0.54 0.00 -0.03 0.00 0.00 56.01 50.30 2vja n LEU 158 Cb 0.50 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.38 2vja n LEU 158 CO 0.20 1.93 0.65 1.57 -1.33 0.00 0.00 177.39 180.41 2vja n HIS 159 N 1.71 0.92 0.00 -1.77 -0.00 -1.26 -1.84 115.22 112.98 2vja n HIS 159 Ca 0.25 0.86 0.00 0.00 0.46 0.00 0.00 57.72 59.29 2vja n HIS 159 Cb 0.43 -2.18 0.00 0.00 -0.12 0.00 0.00 29.99 28.12 2vja n HIS 159 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2vja n GLY 160 N 1.94 3.16 3.81 1.57 0.00 -1.26 -5.07 105.19 109.34 2vja n GLY 160 Ca 0.18 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.85 2vja n GLY 160 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2vja s SER 161 N 0.00 6.08 0.00 1.61 0.15 -0.76 -4.96 113.70 115.82 2vja s SER 161 Ca 0.00 1.79 0.12 0.00 0.70 0.00 0.00 55.95 58.56 2vja s SER 161 Cb 0.00 -2.53 0.17 0.00 -1.71 0.00 0.00 66.02 61.95 2vja s SER 161 CO 0.00 -0.96 1.01 0.00 1.20 0.00 0.00 173.24 174.49 2vja n GLN 162 N -1.69 1.39 -0.04 5.44 1.13 -1.26 -3.71 117.38 118.65 2vja n GLN 162 Ca 0.08 -1.51 -0.13 0.00 -1.94 0.00 0.00 57.00 53.50 2vja n GLN 162 Cb 0.53 -1.25 -0.14 0.00 0.11 0.00 0.00 30.24 29.48 2vja n GLN 162 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2vja n GLU 163 N 0.66 0.68 -3.14 -1.09 -0.58 -1.26 -4.59 120.64 111.32 2vja n GLU 163 Ca 0.09 0.21 -0.20 0.00 -0.42 0.00 0.00 57.16 56.83 2vja n GLU 163 Cb 0.35 -1.69 -0.04 0.00 -0.57 0.00 0.00 31.44 29.49 2vja n GLU 163 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2vja n ALA 164 N -2.79 1.89 0.22 0.62 0.00 -1.26 -2.79 120.51 116.40 2vja n ALA 164 Ca -0.27 -3.17 0.08 0.00 0.00 0.00 0.00 53.44 50.08 2vja n ALA 164 Cb 1.07 -0.90 0.50 0.00 0.00 0.00 0.00 19.45 20.12 2vja n ALA 164 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2vja h PRO 165 N 3.68 0.00 0.00 0.00 0.13 -1.74 -1.28 132.00 132.78 2vja h PRO 165 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 2vja h PRO 165 Cb 0.93 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.06 2vja h PRO 165 CO 0.45 0.25 0.00 0.41 -0.23 0.00 0.00 178.00 178.88 2vja n GLY 166 N -0.23 2.07 2.82 1.56 0.00 -1.22 -4.42 105.19 105.77 2vja n GLY 166 Ca -0.01 -1.93 -0.00 0.00 0.00 0.00 0.00 46.02 44.08 2vja n GLY 166 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vja n ASN 167 N 0.00 -5.47 0.23 1.61 3.02 -1.26 -4.85 115.26 108.55 2vja n ASN 167 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 54.58 54.68 2vja n ASN 167 Cb 0.00 -2.98 0.74 0.00 -0.61 0.00 0.00 39.78 36.92 2vja n ASN 167 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2vja h VAL 168 N 0.00 0.79 -0.65 2.41 -1.51 -1.88 0.70 116.25 116.11 2vja h VAL 168 Ca -0.00 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 65.42 2vja h VAL 168 Cb 0.83 0.95 -0.03 0.00 -2.13 0.00 0.00 31.29 30.91 2vja h VAL 168 CO 0.01 0.00 0.21 1.23 -1.23 0.00 0.00 177.57 177.78 2vja h GLY 169 N 0.00 1.08 1.41 5.19 0.00 -0.84 0.23 103.07 110.14 2vja h GLY 169 Ca 0.04 -0.64 -0.09 0.00 0.00 0.00 0.00 47.33 46.64 2vja h GLY 169 CO -0.00 0.60 -0.15 1.41 0.00 0.00 0.00 176.54 178.39 2vja h LEU 170 N 0.94 0.68 -1.13 3.11 3.38 -1.17 -2.43 115.31 118.69 2vja h LEU 170 Ca 0.21 -0.21 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 2vja h LEU 170 Cb 0.29 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2vja h LEU 170 CO -0.01 0.85 -0.24 -0.07 0.09 0.00 0.00 178.44 179.06 2vja h LEU 171 N 0.62 0.31 -0.82 1.67 3.38 -0.44 -1.74 115.31 118.29 2vja h LEU 171 Ca 0.10 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2vja h LEU 171 Cb 0.61 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 2vja h LEU 171 CO 0.04 0.56 0.40 0.44 0.09 0.00 0.00 178.44 179.97 2vja h ASP 172 N 0.28 1.06 -0.05 -0.43 3.32 -0.10 -1.05 116.42 119.45 2vja h ASP 172 Ca 0.04 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 2vja h ASP 172 Cb 0.59 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 2vja h ASP 172 CO 0.04 0.89 0.02 1.56 -1.72 0.00 0.00 179.24 180.04 2vja h GLN 173 N 1.16 0.07 -0.78 3.56 4.20 -1.12 -2.14 115.11 120.05 2vja h GLN 173 Ca 0.28 -0.01 0.09 0.00 0.06 0.00 0.00 58.65 59.07 2vja h GLN 173 Cb 0.11 -0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.80 2vja h GLN 173 CO -0.04 0.19 0.42 -0.09 -0.67 0.00 0.00 178.83 178.65 2vja h ARG 174 N -0.07 0.70 -0.41 1.46 2.43 -1.03 -0.53 114.38 116.93 2vja h ARG 174 Ca 0.02 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 2vja h ARG 174 Cb 0.15 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 2vja h ARG 174 CO -0.00 0.46 0.05 1.98 -1.51 0.00 0.00 179.97 180.95 2vja h MET 175 N 0.72 0.62 -0.26 0.20 4.05 -0.97 0.22 114.93 119.52 2vja h MET 175 Ca 0.38 -0.13 -0.13 0.00 -0.28 0.00 0.00 59.70 59.54 2vja h MET 175 Cb 0.36 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.05 2vja h MET 175 CO -0.25 0.61 -0.36 0.00 0.23 0.00 0.00 176.91 177.14 2vja h ALA 176 N 1.46 0.89 -0.24 0.39 0.00 -0.52 -0.49 119.26 120.75 2vja h ALA 176 Ca 0.13 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 2vja h ALA 176 Cb 0.30 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2vja h ALA 176 CO 0.00 0.63 -0.44 -0.07 0.00 0.00 0.00 179.25 179.38 2vja h LEU 177 N 0.49 0.63 -0.99 0.00 3.38 -0.06 -1.21 115.31 117.55 2vja h LEU 177 Ca 0.05 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 2vja h LEU 177 Cb 0.85 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2vja h LEU 177 CO 0.07 0.98 0.07 -0.61 0.09 0.00 0.00 178.44 179.05 2vja h GLN 178 N 0.48 0.80 -0.50 1.13 5.75 -0.30 -0.45 115.11 122.02 2vja h GLN 178 Ca 0.03 -0.19 -0.08 0.00 -0.15 0.00 0.00 58.65 58.27 2vja h GLN 178 Cb 0.95 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.38 2vja h GLN 178 CO 0.09 0.76 0.00 2.35 -2.65 0.00 0.00 178.83 179.38 2vja h TRP 179 N 0.76 0.96 -0.70 3.99 7.01 -0.61 -1.51 115.95 125.85 2vja h TRP 179 Ca 0.16 -0.17 -0.07 0.00 2.11 0.00 0.00 58.89 60.93 2vja h TRP 179 Cb 0.36 -0.25 -0.03 0.00 -2.10 0.00 0.00 29.16 27.14 2vja h TRP 179 CO 0.02 0.90 0.16 0.28 -2.79 0.00 0.00 178.44 177.01 2vja h VAL 180 N 0.74 1.26 -0.59 2.65 2.07 -0.83 0.43 116.25 121.98 2vja h VAL 180 Ca 0.14 -0.97 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 2vja h VAL 180 Cb 0.51 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 2vja h VAL 180 CO 0.03 0.37 0.29 -0.74 0.02 0.00 0.00 177.57 177.54 2vja h HIS 181 N 1.06 0.82 0.00 1.57 -0.00 -0.81 0.36 115.15 118.15 2vja h HIS 181 Ca 0.22 -0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.49 2vja h HIS 181 Cb 0.37 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 2vja h HIS 181 CO 0.03 0.60 -1.24 -0.25 -0.00 0.00 0.00 177.93 177.07 2vja n ASP 182 N -4.36 0.80 0.00 3.26 8.00 -0.59 -4.62 116.55 119.04 2vja n ASP 182 Ca 0.05 0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.88 2vja n ASP 182 Cb 0.12 0.42 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 2vja n ASP 182 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2vja n ASN 183 N -2.74 0.09 0.23 -2.24 3.02 0.10 -4.78 115.26 108.95 2vja n ASN 183 Ca -0.05 -0.42 0.07 0.00 -0.03 0.00 0.00 54.58 54.15 2vja n ASN 183 Cb 0.68 0.58 0.56 0.00 -0.61 0.00 0.00 39.78 40.98 2vja n ASN 183 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2vja h ILE 184 N 0.04 1.00 -0.07 2.41 6.09 -1.07 -1.07 117.51 124.84 2vja h ILE 184 Ca 0.00 -0.59 0.02 0.00 -1.37 0.00 0.00 64.86 62.92 2vja h ILE 184 Cb 0.02 1.33 -0.00 0.00 0.47 0.00 0.00 36.82 38.64 2vja h ILE 184 CO 0.00 0.16 0.08 0.06 -3.07 0.00 0.00 178.15 175.38 2vja h GLN 185 N 0.00 0.00 0.00 2.19 3.07 -1.75 0.14 115.11 118.76 2vja h GLN 185 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2vja h GLN 185 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.88 2vja h GLN 185 CO 0.02 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.13 2vja n PHE 186 N -3.92 0.08 -0.10 0.06 3.72 -0.40 -2.72 117.46 114.18 2vja n PHE 186 Ca -0.01 0.03 0.06 0.00 -0.05 0.00 0.00 57.45 57.47 2vja n PHE 186 Cb 0.17 -0.54 0.15 0.00 -0.94 0.00 0.00 39.48 38.32 2vja n PHE 186 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2vja n PHE 187 N -1.57 0.44 -0.21 1.38 3.01 0.40 -4.92 117.46 116.00 2vja n PHE 187 Ca 0.06 -0.43 0.00 0.00 1.01 0.00 0.00 57.45 58.09 2vja n PHE 187 Cb 0.30 -0.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.75 2vja n PHE 187 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vja n GLY 188 N 0.63 0.71 3.92 1.37 0.00 -1.10 -4.74 105.19 105.98 2vja n GLY 188 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 2vja n GLY 188 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vja s GLY 189 N -1.51 2.14 -0.49 -0.02 0.00 -0.76 -1.04 107.32 105.65 2vja s GLY 189 Ca 0.00 -0.84 -0.19 0.00 0.00 0.00 0.00 44.72 43.68 2vja s GLY 189 CO 0.00 -0.82 0.62 -0.35 0.00 0.00 0.00 173.10 172.55 2vja s ASP 190 N -2.58 6.24 0.11 1.64 2.15 0.22 -2.89 116.67 121.56 2vja s ASP 190 Ca 0.35 -0.77 0.08 0.00 0.43 0.00 0.00 52.55 52.64 2vja s ASP 190 Cb -0.13 -2.29 0.42 0.00 -0.30 0.00 0.00 42.92 40.62 2vja s ASP 190 CO 0.28 -0.85 1.24 -0.81 -0.17 0.00 0.00 175.17 174.86 2vja n PRO 191 N 6.17 0.05 0.00 4.34 -0.04 -1.26 -0.54 135.00 143.72 2vja n PRO 191 Ca -0.05 0.54 0.13 0.00 -0.04 0.00 0.00 63.50 64.08 2vja n PRO 191 Cb 0.46 -1.66 0.44 0.00 -0.04 0.00 0.00 33.50 32.70 2vja n PRO 191 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2vja n LYS 192 N -1.77 0.36 -3.16 0.54 5.02 -1.26 -4.28 118.16 113.61 2vja n LYS 192 Ca -0.00 -0.17 -0.23 0.00 -2.02 0.00 0.00 58.31 55.89 2vja n LYS 192 Cb 0.02 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.48 2vja n LYS 192 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2vja n THR 193 N -1.17 0.98 -4.34 -0.18 -1.04 0.30 -4.73 114.28 104.09 2vja n THR 193 Ca 0.10 -4.83 -0.34 0.00 -2.04 0.00 0.00 64.05 56.94 2vja n THR 193 Cb 0.32 -1.24 -0.11 0.00 -1.82 0.00 0.00 70.33 67.48 2vja n THR 193 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2vja s VAL 194 N -2.70 4.07 -0.18 12.58 0.11 -1.26 -1.92 120.40 131.11 2vja s VAL 194 Ca 0.41 -0.30 -0.03 0.00 -2.93 0.00 0.00 61.98 59.13 2vja s VAL 194 Cb 0.26 -2.78 -0.02 0.00 -1.53 0.00 0.00 36.38 32.31 2vja s VAL 194 CO -0.09 0.50 -0.05 -0.89 -3.33 0.00 0.00 175.10 171.24 2vja s THR 195 N 0.20 3.58 -0.18 5.04 2.01 0.67 -0.21 115.64 126.75 2vja s THR 195 Ca -0.01 -0.45 -0.10 0.00 0.31 0.00 0.00 61.69 61.44 2vja s THR 195 Cb -0.13 -2.58 -0.05 0.00 0.01 0.00 0.00 72.50 69.74 2vja s THR 195 CO 0.02 0.47 0.16 0.27 -0.69 0.00 0.00 174.62 174.85 2vja s ILE 196 N 0.78 5.40 0.01 1.82 -4.36 -0.84 -0.12 121.20 123.90 2vja s ILE 196 Ca -0.02 0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.63 2vja s ILE 196 Cb -0.15 -3.49 -0.01 0.00 1.25 0.00 0.00 42.46 40.06 2vja s ILE 196 CO 0.02 0.45 -0.02 0.72 0.24 0.00 0.00 174.94 176.34 2vja s PHE 197 N 0.24 0.22 0.16 1.37 -0.71 0.14 -1.19 117.98 118.20 2vja s PHE 197 Ca 0.10 -0.33 -0.24 0.00 -1.04 0.00 0.00 56.93 55.42 2vja s PHE 197 Cb -0.11 -0.15 0.06 0.00 -1.21 0.00 0.00 43.02 41.61 2vja s PHE 197 CO -0.00 -0.11 0.70 0.20 -1.34 0.00 0.00 175.22 174.66 2vja s GLY 198 N -0.92 -0.46 0.09 1.99 0.00 -1.10 -1.15 107.32 105.77 2vja s GLY 198 Ca -0.09 0.38 0.08 0.00 0.00 0.00 0.00 44.72 45.09 2vja s GLY 198 CO -0.01 0.13 -0.17 1.85 0.00 0.00 0.00 173.10 174.91 2vja s GLU 199 N -3.65 1.93 5.85 2.90 -6.30 -1.25 -1.42 118.70 116.76 2vja s GLU 199 Ca 0.05 -1.09 0.00 0.00 -2.50 0.00 0.00 54.97 51.43 2vja s GLU 199 Cb -0.02 -2.17 0.00 0.00 0.00 0.00 0.00 34.13 31.94 2vja s GLU 199 CO -0.07 0.50 0.00 0.45 0.02 0.00 0.00 175.26 176.16 2vja n SER 200 N 1.01 0.00 0.27 -1.70 2.88 0.29 0.05 113.62 116.41 2vja n SER 200 Ca -0.15 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.49 2vja n SER 200 Cb 0.52 0.00 0.72 0.00 -0.75 0.00 0.00 64.21 64.70 2vja n SER 200 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2vja h ALA 201 N -0.77 1.66 -0.13 -1.46 0.00 -1.88 0.15 119.26 116.83 2vja h ALA 201 Ca 0.00 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 2vja h ALA 201 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2vja h ALA 201 CO 0.00 0.07 -0.60 0.78 0.00 0.00 0.00 179.25 179.50 2vja h GLY 202 N 0.25 0.49 1.58 0.00 0.00 -0.46 -0.44 103.07 104.49 2vja h GLY 202 Ca -0.00 -0.60 -0.16 0.00 0.00 0.00 0.00 47.33 46.57 2vja h GLY 202 CO 0.01 0.54 -0.61 -1.33 0.00 0.00 0.00 176.54 175.15 2vja h GLY 203 N 1.20 0.48 0.98 4.60 0.00 -0.65 -1.60 103.07 108.08 2vja h GLY 203 Ca -0.00 -0.59 -0.10 0.00 0.00 0.00 0.00 47.33 46.64 2vja h GLY 203 CO 0.11 0.53 -0.14 0.00 0.00 0.00 0.00 176.54 177.03 2vja h ALA 204 N 1.02 0.52 -0.11 3.60 0.00 -0.70 -2.73 119.26 120.85 2vja h ALA 204 Ca -0.01 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.61 2vja h ALA 204 Cb 1.15 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 2vja h ALA 204 CO 0.11 0.43 -0.16 0.77 0.00 0.00 0.00 179.25 180.39 2vja h SER 205 N 0.55 -0.49 -0.91 0.00 0.02 -0.87 0.05 113.55 111.90 2vja h SER 205 Ca 0.09 0.09 0.14 0.00 -0.84 0.00 0.00 61.79 61.26 2vja h SER 205 Cb 0.68 0.23 -0.09 0.00 0.14 0.00 0.00 62.40 63.36 2vja h SER 205 CO 0.05 -0.21 0.53 0.58 -1.14 0.00 0.00 176.83 176.64 2vja h VAL 206 N -0.21 0.81 0.00 2.27 2.07 -1.23 0.22 116.25 120.19 2vja h VAL 206 Ca 0.09 -0.27 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 2vja h VAL 206 Cb 0.33 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 2vja h VAL 206 CO -0.23 0.14 -0.40 1.23 0.02 0.00 0.00 177.57 178.33 2vja h GLY 207 N 0.78 0.00 2.00 2.17 0.00 -1.02 -2.32 103.07 104.68 2vja h GLY 207 Ca 0.48 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.68 2vja h GLY 207 CO -0.32 0.00 -0.64 -0.33 0.00 0.00 0.00 176.54 175.25 2vja h MET 208 N 0.00 0.00 -0.00 4.80 2.86 0.13 -2.57 114.93 120.15 2vja h MET 208 Ca -0.00 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.47 2vja h MET 208 Cb 0.81 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.44 2vja h MET 208 CO 0.05 0.64 -0.79 0.45 1.06 0.00 0.00 176.91 178.31 2vja h HIS 209 N 0.00 0.01 -0.02 -0.22 3.86 -0.81 0.43 115.15 118.40 2vja h HIS 209 Ca -0.01 -0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.14 2vja h HIS 209 Cb 1.22 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.68 2vja h HIS 209 CO 0.00 0.80 -0.29 0.82 0.86 0.00 0.00 177.93 180.12 2vja h ILE 210 N 0.00 1.22 0.15 2.45 2.04 -1.19 -3.17 117.51 119.01 2vja h ILE 210 Ca -0.01 -1.02 -0.35 0.00 1.00 0.00 0.00 64.86 64.48 2vja h ILE 210 Cb 1.40 1.53 -0.00 0.00 -0.74 0.00 0.00 36.82 39.01 2vja h ILE 210 CO 0.10 0.29 -1.84 -0.07 0.00 0.00 0.00 178.15 176.64 2vja h LEU 211 N 0.02 0.51 -9.13 1.44 3.38 -1.14 0.74 115.31 111.14 2vja h LEU 211 Ca 0.00 -0.89 -0.56 0.00 0.09 0.00 0.00 57.88 56.51 2vja h LEU 211 Cb 0.53 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 2vja h LEU 211 CO 0.04 1.78 0.97 -0.55 0.09 0.00 0.00 178.44 180.76 2vja s SER 212 N -7.15 6.80 0.59 -0.43 0.15 0.11 -4.70 113.70 109.08 2vja s SER 212 Ca -0.18 1.70 0.29 0.00 0.70 0.00 0.00 55.95 58.46 2vja s SER 212 Cb 0.06 -2.54 1.54 0.00 -1.71 0.00 0.00 66.02 63.37 2vja s SER 212 CO 0.82 -0.89 1.97 -0.65 1.20 0.00 0.00 173.24 175.69 2vja h PRO 213 N 8.85 0.00 0.00 5.44 0.11 -1.86 -0.44 132.00 144.11 2vja h PRO 213 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2vja h PRO 213 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2vja h PRO 213 CO 0.98 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.18 2vja n GLY 214 N -1.46 -1.48 0.03 -0.55 0.00 -1.26 -3.81 105.19 96.65 2vja n GLY 214 Ca 0.06 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2vja n GLY 214 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vja n SER 215 N -1.51 2.48 -0.31 1.61 7.64 -0.20 -4.78 113.62 118.55 2vja n SER 215 Ca 0.07 0.00 0.05 0.00 1.01 0.00 0.00 58.87 60.00 2vja n SER 215 Cb 0.33 1.11 0.13 0.00 -1.01 0.00 0.00 64.21 64.78 2vja n SER 215 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2vja h ARG 216 N 0.00 0.01 0.00 1.43 3.08 -1.55 -0.07 114.38 117.28 2vja h ARG 216 Ca -0.14 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.91 2vja h ARG 216 Cb 1.09 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2vja h ARG 216 CO 0.01 0.01 0.00 -0.25 -1.07 0.00 0.00 179.97 178.66 2vja n ASP 217 N -5.54 0.00 -0.92 7.04 8.00 -1.26 -3.48 116.55 120.39 2vja n ASP 217 Ca 0.14 -1.15 0.11 0.00 0.71 0.00 0.00 54.79 54.60 2vja n ASP 217 Cb 0.47 0.00 0.27 0.00 -0.02 0.00 0.00 41.12 41.84 2vja n ASP 217 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2vja n LEU 218 N -0.88 2.73 -3.47 0.64 4.77 -0.04 -4.94 117.00 115.81 2vja n LEU 218 Ca 0.17 -1.22 -0.12 0.00 -0.03 0.00 0.00 56.01 54.81 2vja n LEU 218 Cb 0.08 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 2vja n LEU 218 CO 0.13 0.61 0.35 0.72 -1.33 0.00 0.00 177.39 177.87 2vja s PHE 219 N -1.54 -0.48 -0.19 -1.77 -0.71 -1.23 -4.87 117.98 107.19 2vja s PHE 219 Ca 0.36 0.29 -0.16 0.00 -1.04 0.00 0.00 56.93 56.38 2vja s PHE 219 Cb 0.20 0.49 -0.12 0.00 -1.21 0.00 0.00 43.02 42.37 2vja s PHE 219 CO 0.28 -0.80 -0.02 -2.13 -1.34 0.00 0.00 175.22 171.22 2vja n ARG 220 N -0.25 0.53 -4.36 1.99 3.00 0.71 -4.94 116.66 113.34 2vja n ARG 220 Ca -0.17 0.51 -0.19 0.00 -0.00 0.00 0.00 57.85 57.99 2vja n ARG 220 Cb 0.64 -1.68 -0.09 0.00 0.00 0.00 0.00 32.46 31.32 2vja n ARG 220 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2vja s ARG 221 N -2.37 1.61 -0.06 -0.14 0.52 -1.02 -4.69 118.95 112.79 2vja s ARG 221 Ca -0.25 -1.92 -0.08 0.00 -0.52 0.00 0.00 55.73 52.96 2vja s ARG 221 Cb 0.05 -0.25 0.02 0.00 0.52 0.00 0.00 34.95 35.29 2vja s ARG 221 CO 0.44 -0.41 0.21 0.00 0.02 0.00 0.00 175.30 175.57 2vja s ALA 222 N -3.56 -0.52 -0.13 2.13 0.00 -1.19 -1.98 121.76 116.51 2vja s ALA 222 Ca 0.35 0.46 0.02 0.00 0.00 0.00 0.00 51.96 52.79 2vja s ALA 222 Cb 0.05 -0.24 0.01 0.00 0.00 0.00 0.00 23.12 22.94 2vja s ALA 222 CO 0.16 -0.13 -0.19 0.42 0.00 0.00 0.00 175.76 176.02 2vja s ILE 223 N -0.26 1.81 -0.21 0.00 1.01 -0.33 -2.27 121.20 120.96 2vja s ILE 223 Ca -0.04 -0.83 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 2vja s ILE 223 Cb -0.03 -1.62 0.02 0.00 0.01 0.00 0.00 42.46 40.83 2vja s ILE 223 CO 0.01 0.50 -0.13 -0.76 0.00 0.00 0.00 174.94 174.56 2vja s LEU 224 N 0.89 2.58 -0.31 2.97 1.02 -0.65 -2.72 118.68 122.46 2vja s LEU 224 Ca -0.07 -0.65 -0.06 0.00 0.02 0.00 0.00 54.13 53.37 2vja s LEU 224 Cb -0.15 -1.58 0.02 0.00 0.02 0.00 0.00 46.19 44.50 2vja s LEU 224 CO -0.02 -0.04 0.07 -1.10 0.02 0.00 0.00 176.35 175.29 2vja s GLN 225 N 1.34 2.88 -1.40 1.70 -0.21 -0.51 -2.17 119.66 121.30 2vja s GLN 225 Ca 0.04 -0.99 -0.04 0.00 0.02 0.00 0.00 55.36 54.39 2vja s GLN 225 Cb -0.14 -3.37 0.03 0.00 1.00 0.00 0.00 33.01 30.53 2vja s GLN 225 CO -0.09 -0.52 0.70 0.43 -2.12 0.00 0.00 175.29 173.69 2vja n SER 226 N 4.82 -1.83 -3.65 5.90 7.64 0.05 -0.55 113.62 126.02 2vja n SER 226 Ca -0.14 -0.87 -0.03 0.00 1.01 0.00 0.00 58.87 58.85 2vja n SER 226 Cb 0.47 -3.72 -0.06 0.00 -1.01 0.00 0.00 64.21 59.89 2vja n SER 226 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2vja s GLY 227 N -4.09 0.26 0.05 0.23 0.00 -1.26 -2.92 107.32 99.59 2vja s GLY 227 Ca 0.18 3.27 -0.12 0.00 0.00 0.00 0.00 44.72 48.06 2vja s GLY 227 CO 0.84 1.65 0.26 -1.35 0.00 0.00 0.00 173.10 174.49 2vja s SER 228 N -0.34 -0.04 0.45 1.64 1.04 -1.26 -4.03 113.70 111.16 2vja s SER 228 Ca 0.08 -0.32 0.16 0.00 0.48 0.00 0.00 55.95 56.35 2vja s SER 228 Cb -0.04 0.34 1.11 0.00 0.10 0.00 0.00 66.02 67.53 2vja s SER 228 CO -0.13 -0.62 1.97 1.55 0.98 0.00 0.00 173.24 176.99 2vja h PRO 229 N 3.20 0.31 -0.06 4.02 0.13 -1.80 -2.41 132.00 135.39 2vja h PRO 229 Ca -0.32 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 2vja h PRO 229 Cb 1.20 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2vja h PRO 229 CO 0.48 0.21 0.00 0.27 -0.23 0.00 0.00 178.00 178.73 2vja n ASN 230 N -4.46 0.70 -4.67 1.44 6.94 -1.26 -4.73 115.26 109.21 2vja n ASN 230 Ca 0.11 -1.51 -0.41 0.00 -0.02 0.00 0.00 54.58 52.74 2vja n ASN 230 Cb 0.45 -0.04 0.01 0.00 -2.36 0.00 0.00 39.78 37.84 2vja n ASN 230 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2vja h PRO 232 N 1.97 0.00 -0.00 0.00 0.13 -1.83 -1.98 132.00 130.29 2vja h PRO 232 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2vja h PRO 232 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2vja h PRO 232 CO 0.59 0.00 -0.71 -2.67 -0.23 0.00 0.00 178.00 174.98 2vja n TRP 233 N -3.87 0.00 1.25 1.56 4.27 -1.26 -4.44 117.44 114.94 2vja n TRP 233 Ca -0.01 0.00 0.14 0.00 -3.89 0.00 0.00 57.50 53.75 2vja n TRP 233 Cb 0.21 -0.09 0.62 0.00 -1.36 0.00 0.00 31.31 30.70 2vja n TRP 233 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2vja n ALA 234 N -1.23 2.62 -3.61 -1.67 0.00 -0.74 -4.65 120.51 111.23 2vja n ALA 234 Ca 0.06 -0.18 -0.09 0.00 0.00 0.00 0.00 53.44 53.22 2vja n ALA 234 Cb 0.35 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.38 2vja n ALA 234 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2vja s SER 235 N -2.72 -0.40 0.12 0.00 1.04 -1.26 -3.74 113.70 106.75 2vja s SER 235 Ca 0.22 -0.25 -0.02 0.00 0.48 0.00 0.00 55.95 56.39 2vja s SER 235 Cb 0.20 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 2vja s SER 235 CO 0.51 -1.04 0.07 0.68 0.98 0.00 0.00 173.24 174.44 2vja s VAL 236 N -3.67 0.12 0.68 5.02 -7.23 -0.66 -4.98 120.40 109.67 2vja s VAL 236 Ca 0.06 -1.84 -0.11 0.00 -1.81 0.00 0.00 61.98 58.29 2vja s VAL 236 Cb -0.03 -1.94 -0.00 0.00 0.56 0.00 0.00 36.38 34.97 2vja s VAL 236 CO -0.04 -0.53 1.05 -0.94 -0.31 0.00 0.00 175.10 174.33 2vja s SER 237 N -3.02 5.58 0.36 4.85 1.04 -1.26 -2.16 113.70 119.08 2vja s SER 237 Ca 0.21 1.58 0.04 0.00 0.48 0.00 0.00 55.95 58.25 2vja s SER 237 Cb 0.07 -2.49 0.68 0.00 0.10 0.00 0.00 66.02 64.38 2vja s SER 237 CO -0.00 -1.31 2.00 -0.37 0.98 0.00 0.00 173.24 174.54 2vja h VAL 238 N -0.59 1.12 -0.23 5.02 -1.51 -1.95 0.49 116.25 118.60 2vja h VAL 238 Ca -0.44 -0.28 -0.02 0.00 -1.23 0.00 0.00 66.70 64.74 2vja h VAL 238 Cb 1.21 0.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.60 2vja h VAL 238 CO 0.58 0.15 0.08 0.00 -1.23 0.00 0.00 177.57 177.15 2vja h ALA 239 N 1.62 0.30 -0.44 5.19 0.00 -1.95 -0.46 119.26 123.52 2vja h ALA 239 Ca 0.25 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 2vja h ALA 239 Cb -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2vja h ALA 239 CO -0.06 -0.08 -0.09 1.49 0.00 0.00 0.00 179.25 180.51 2vja h GLU 240 N 0.22 0.78 -0.77 0.00 4.57 -1.77 -0.45 114.58 117.15 2vja h GLU 240 Ca 0.08 -0.25 -0.04 0.00 -1.18 0.00 0.00 59.36 57.97 2vja h GLU 240 Cb 0.21 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.70 2vja h GLU 240 CO -0.00 0.84 0.32 0.78 -1.18 0.00 0.00 179.01 179.77 2vja h GLY 241 N 0.97 1.22 0.75 1.92 0.00 -0.65 -0.42 103.07 106.86 2vja h GLY 241 Ca 0.12 -0.65 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 2vja h GLY 241 CO 0.03 0.62 -0.09 -0.09 0.00 0.00 0.00 176.54 177.01 2vja h ARG 242 N 1.10 0.32 -0.39 4.80 2.43 -0.83 -0.92 114.38 120.90 2vja h ARG 242 Ca 0.26 -0.15 0.07 0.00 -0.81 0.00 0.00 59.98 59.35 2vja h ARG 242 Cb 0.19 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.67 2vja h ARG 242 CO -0.02 0.66 -0.04 -0.09 -1.51 0.00 0.00 179.97 178.97 2vja h ARG 243 N -0.02 0.06 -0.60 0.20 2.43 -0.84 0.27 114.38 115.88 2vja h ARG 243 Ca 0.03 -0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 2vja h ARG 243 Cb 0.57 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 2vja h ARG 243 CO 0.02 0.04 -0.01 0.00 -1.51 0.00 0.00 179.97 178.51 2vja h ARG 244 N 0.06 1.07 -0.39 0.20 3.08 -1.04 -0.48 114.38 116.88 2vja h ARG 244 Ca 0.19 -0.34 0.01 0.00 0.07 0.00 0.00 59.98 59.90 2vja h ARG 244 Cb 0.28 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2vja h ARG 244 CO -0.35 1.05 0.25 0.00 -1.07 0.00 0.00 179.97 179.84 2vja h ALA 245 N 0.98 0.50 -0.33 0.04 0.00 -0.24 -0.50 119.26 119.71 2vja h ALA 245 Ca 0.17 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 2vja h ALA 245 Cb 0.57 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2vja h ALA 245 CO 0.03 -0.07 -0.11 0.28 0.00 0.00 0.00 179.25 179.38 2vja h VAL 246 N 0.50 1.24 -0.05 0.00 2.07 -0.30 -2.42 116.25 117.29 2vja h VAL 246 Ca 0.15 -1.04 -0.08 0.00 0.82 0.00 0.00 66.70 66.55 2vja h VAL 246 Cb -0.03 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.83 2vja h VAL 246 CO -0.05 0.34 -0.34 -0.08 0.02 0.00 0.00 177.57 177.47 2vja h GLU 247 N 0.52 0.09 -0.32 1.57 4.57 -0.33 -1.41 114.58 119.26 2vja h GLU 247 Ca 0.10 -0.03 -0.13 0.00 -1.18 0.00 0.00 59.36 58.11 2vja h GLU 247 Cb 0.50 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 2vja h GLU 247 CO 0.03 0.42 -0.32 1.25 -1.18 0.00 0.00 179.01 179.21 2vja h LEU 248 N 0.08 0.73 -0.24 1.64 5.85 -0.63 -1.99 115.31 120.76 2vja h LEU 248 Ca 0.01 -0.30 -0.05 0.00 0.84 0.00 0.00 57.88 58.38 2vja h LEU 248 Cb 0.64 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2vja h LEU 248 CO 0.05 1.00 -0.04 1.23 -0.34 0.00 0.00 178.44 180.34 2vja h GLY 249 N 0.97 0.49 1.38 3.75 0.00 -1.15 -2.87 103.07 105.64 2vja h GLY 249 Ca 0.07 -0.39 0.05 0.00 0.00 0.00 0.00 47.33 47.06 2vja h GLY 249 CO 0.07 0.35 0.31 -0.09 0.00 0.00 0.00 176.54 177.18 2vja h ARG 250 N 0.20 0.42 0.00 4.80 2.43 -1.14 0.86 114.38 121.95 2vja h ARG 250 Ca 0.06 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2vja h ARG 250 Cb 0.48 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2vja h ARG 250 CO 0.02 0.28 0.00 -0.91 -1.51 0.00 0.00 179.97 177.85 2vja h ASN 251 N 0.44 0.00 -0.31 -3.80 2.35 -1.15 -2.94 115.58 110.17 2vja h ASN 251 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 2vja h ASN 251 Cb 0.22 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.59 2vja h ASN 251 CO -0.05 0.00 0.00 0.18 -1.65 0.00 0.00 177.43 175.91 2vja n LEU 252 N -2.93 3.08 -3.41 1.61 4.77 0.12 -4.96 117.00 115.27 2vja n LEU 252 Ca 0.01 -2.23 -0.22 0.00 -0.03 0.00 0.00 56.01 53.54 2vja n LEU 252 Cb 0.31 -0.29 0.08 0.00 -2.33 0.00 0.00 43.42 41.19 2vja n LEU 252 CO 0.27 0.71 0.22 0.59 -1.33 0.00 0.00 177.39 177.84 2vja n ASN 253 N 0.22 -5.70 -4.87 -1.43 3.02 -0.77 -4.98 115.26 100.75 2vja n ASN 253 Ca 0.13 -0.52 -0.31 0.00 -0.03 0.00 0.00 54.58 53.86 2vja n ASN 253 Cb 0.52 -4.79 -0.03 0.00 -0.61 0.00 0.00 39.78 34.87 2vja n ASN 253 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vja s ASN 255 N -3.22 6.67 0.00 0.00 3.84 -1.26 -4.71 114.94 116.26 2vja s ASN 255 Ca 0.54 1.48 0.23 0.00 0.21 0.00 0.00 52.86 55.32 2vja s ASN 255 Cb -0.10 -2.54 0.49 0.00 -0.55 0.00 0.00 41.25 38.55 2vja s ASN 255 CO 0.33 -1.04 1.43 0.18 -2.79 0.00 0.00 177.10 175.21 2vja n LEU 256 N 7.55 2.88 0.07 3.21 4.77 -1.26 -3.05 117.00 131.16 2vja n LEU 256 Ca 0.16 -1.17 0.20 0.00 -0.03 0.00 0.00 56.01 55.17 2vja n LEU 256 Cb 0.46 -0.16 0.74 0.00 -2.33 0.00 0.00 43.42 42.13 2vja n LEU 256 CO 0.62 0.59 1.18 0.78 -1.33 0.00 0.00 177.39 179.22 2vja h ASN 257 N 3.91 0.00 -4.90 -1.43 2.35 -1.96 -3.44 115.58 110.10 2vja h ASN 257 Ca 0.00 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.80 2vja h ASN 257 Cb 0.85 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 39.10 2vja h ASN 257 CO 0.00 0.00 0.33 -0.94 -1.65 0.00 0.00 177.43 175.17 2vja s SER 258 N -5.56 -0.43 0.24 5.81 1.04 -1.26 -5.04 113.70 108.49 2vja s SER 258 Ca -0.05 -0.09 -0.07 0.00 0.48 0.00 0.00 55.95 56.22 2vja s SER 258 Cb 0.17 0.53 0.22 0.00 0.10 0.00 0.00 66.02 67.04 2vja s SER 258 CO 0.60 -0.88 1.89 0.44 0.98 0.00 0.00 173.24 176.27 2vja h ASP 259 N 2.00 1.11 -0.61 7.02 3.32 -1.93 0.31 116.42 127.64 2vja h ASP 259 Ca -0.28 -0.06 0.03 0.00 0.02 0.00 0.00 57.03 56.74 2vja h ASP 259 Cb 1.27 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 40.50 2vja h ASP 259 CO 0.33 0.84 0.37 -0.33 -1.72 0.00 0.00 179.24 178.73 2vja h GLU 260 N 1.28 0.71 -0.10 3.56 3.07 -1.97 0.20 114.58 121.33 2vja h GLU 260 Ca 0.33 -0.04 -0.21 0.00 -0.50 0.00 0.00 59.36 58.94 2vja h GLU 260 Cb -0.07 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 27.69 2vja h GLU 260 CO -0.06 0.47 -0.80 0.93 -1.40 0.00 0.00 179.01 178.15 2vja h GLU 261 N 0.73 0.61 0.12 2.33 5.08 -1.76 0.33 114.58 122.03 2vja h GLU 261 Ca 0.24 -0.52 -0.01 0.00 -1.00 0.00 0.00 59.36 58.07 2vja h GLU 261 Cb 0.03 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2vja h GLU 261 CO -0.10 1.14 -0.06 1.25 -1.00 0.00 0.00 179.01 180.24 2vja h LEU 262 N 0.41 -0.14 -0.51 1.33 5.85 -0.64 0.10 115.31 121.70 2vja h LEU 262 Ca -0.05 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 2vja h LEU 262 Cb 1.41 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.45 2vja h LEU 262 CO 0.15 0.08 0.30 0.40 -0.34 0.00 0.00 178.44 179.03 2vja h ILE 263 N -0.36 1.16 -0.84 4.05 2.04 -0.65 -0.33 117.51 122.58 2vja h ILE 263 Ca -0.02 -0.37 0.04 0.00 1.00 0.00 0.00 64.86 65.51 2vja h ILE 263 Cb 0.29 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.80 2vja h ILE 263 CO 0.03 0.17 0.53 -0.74 0.00 0.00 0.00 178.15 178.14 2vja h HIS 264 N 0.68 1.00 -0.43 1.37 2.76 -0.77 0.24 115.15 120.00 2vja h HIS 264 Ca 0.18 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.34 2vja h HIS 264 Cb 0.00 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 28.62 2vja h HIS 264 CO -0.02 0.55 0.10 0.00 -1.30 0.00 0.00 177.93 177.25 2vja h LEU 266 N 0.56 0.00 -0.07 0.00 3.38 -0.37 -2.41 115.31 116.39 2vja h LEU 266 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2vja h LEU 266 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 2vja h LEU 266 CO 0.00 0.22 0.00 0.03 0.09 0.00 0.00 178.44 178.78 2vja h ARG 267 N 0.00 0.00 0.00 1.13 3.08 -0.78 -3.13 114.38 114.69 2vja h ARG 267 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2vja h ARG 267 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2vja h ARG 267 CO 0.03 0.00 -0.49 0.93 -1.07 0.00 0.00 179.97 179.37 2vja h GLU 268 N 0.00 0.00 -7.12 0.04 4.39 -1.26 -3.47 114.58 107.16 2vja h GLU 268 Ca 0.00 0.00 -0.47 0.00 0.34 0.00 0.00 59.36 59.23 2vja h GLU 268 Cb 0.79 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.46 2vja h GLU 268 CO 0.00 0.00 0.37 0.15 -1.16 0.00 0.00 179.01 178.37 2vja s LYS 269 N -3.22 3.87 0.42 2.33 -0.14 -1.18 -5.04 119.74 116.78 2vja s LYS 269 Ca 0.05 1.17 -0.23 0.00 -1.36 0.00 0.00 55.97 55.61 2vja s LYS 269 Cb 0.10 -2.12 -0.09 0.00 -1.68 0.00 0.00 37.83 34.05 2vja s LYS 269 CO 0.71 -0.35 1.03 0.15 -0.76 0.00 0.00 175.35 176.12 2vja s LYS 270 N -3.55 4.10 0.20 1.68 1.02 -1.26 -4.95 119.74 116.97 2vja s LYS 270 Ca 0.63 1.41 -0.20 0.00 0.02 0.00 0.00 55.97 57.83 2vja s LYS 270 Cb -0.13 -2.39 0.15 0.00 -0.52 0.00 0.00 37.83 34.94 2vja s LYS 270 CO 0.23 -0.18 1.58 -1.35 -0.92 0.00 0.00 175.35 174.72 2vja h PRO 271 N 2.21 -0.12 -0.01 -1.68 0.11 -1.96 0.12 132.00 130.67 2vja h PRO 271 Ca -0.49 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2vja h PRO 271 Cb 1.21 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2vja h PRO 271 CO 0.61 -0.08 0.04 0.37 -0.21 0.00 0.00 178.00 178.73 2vja h GLN 272 N -0.13 0.00 -0.19 1.05 5.75 -1.99 -1.15 115.11 118.45 2vja h GLN 272 Ca 0.26 0.00 -0.20 0.00 -0.15 0.00 0.00 58.65 58.55 2vja h GLN 272 Cb 0.56 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.11 2vja h GLN 272 CO -0.74 0.00 -0.68 0.93 -2.65 0.00 0.00 178.83 175.69 2vja h GLU 273 N 0.00 0.76 0.08 1.69 5.08 -1.13 -1.37 114.58 119.68 2vja h GLU 273 Ca 0.01 -0.56 -0.00 0.00 -1.00 0.00 0.00 59.36 57.80 2vja h GLU 273 Cb 0.08 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2vja h GLU 273 CO -0.00 1.18 -0.04 -0.07 -1.00 0.00 0.00 179.01 179.08 2vja h LEU 274 N 0.55 -0.09 -1.27 1.33 4.07 -1.12 -3.18 115.31 115.60 2vja h LEU 274 Ca -0.02 -0.27 0.09 0.00 0.08 0.00 0.00 57.88 57.76 2vja h LEU 274 Cb 1.29 0.02 -0.06 0.00 1.08 0.00 0.00 40.66 42.99 2vja h LEU 274 CO 0.14 0.22 0.54 0.40 -1.08 0.00 0.00 178.44 178.66 2vja h ILE 275 N -0.40 0.99 0.00 1.22 2.04 -1.43 -2.20 117.51 117.73 2vja h ILE 275 Ca -0.01 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 2vja h ILE 275 Cb 0.35 0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2vja h ILE 275 CO 0.02 0.15 -0.05 0.44 0.00 0.00 0.00 178.15 178.71 2vja h ASP 276 N 0.83 0.00 -0.08 1.72 3.32 -1.22 -2.78 116.42 118.20 2vja h ASP 276 Ca 0.38 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.43 2vja h ASP 276 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2vja h ASP 276 CO -0.15 0.05 0.00 1.33 -1.72 0.00 0.00 179.24 178.76 2vja n VAL 277 N -4.08 0.32 -0.30 -1.35 0.24 -0.98 -4.76 118.33 107.43 2vja n VAL 277 Ca -0.03 -0.66 0.05 0.00 -2.04 0.00 0.00 64.34 61.67 2vja n VAL 277 Cb 0.14 0.95 0.15 0.00 -1.47 0.00 0.00 33.84 33.61 2vja n VAL 277 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2vja h GLU 278 N 1.48 0.02 0.00 7.34 4.81 -1.12 0.19 114.58 127.31 2vja h GLU 278 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2vja h GLU 278 Cb 0.43 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.80 2vja h GLU 278 CO 0.00 0.02 0.00 0.91 -0.73 0.00 0.00 179.01 179.21 2vja n TRP 279 N -5.50 0.08 0.25 0.92 7.02 -1.26 -3.40 117.44 115.56 2vja n TRP 279 Ca 0.14 0.03 0.14 0.00 -1.02 0.00 0.00 57.50 56.79 2vja n TRP 279 Cb 0.49 -0.55 0.51 0.00 -2.42 0.00 0.00 31.31 29.34 2vja n TRP 279 CO 0.00 0.00 0.00 -0.91 -2.02 0.00 0.00 177.69 174.76 2vja h ASN 280 N 0.00 0.00 0.64 -0.99 2.35 -1.30 -3.19 115.58 113.08 2vja h ASN 280 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2vja h ASN 280 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 2vja h ASN 280 CO 0.00 0.07 -0.03 1.33 -1.65 0.00 0.00 177.43 177.15 2vja n VAL 281 N -3.17 0.00 -1.94 2.81 0.24 -1.22 -4.89 118.33 110.16 2vja n VAL 281 Ca 0.01 -0.01 -0.39 0.00 -2.04 0.00 0.00 64.34 61.91 2vja n VAL 281 Cb 0.39 -0.43 0.01 0.00 -1.47 0.00 0.00 33.84 32.34 2vja n VAL 281 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2vja s LEU 282 N -2.67 4.13 0.15 1.34 1.43 -1.21 -4.78 118.68 117.07 2vja s LEU 282 Ca 0.25 2.75 -0.17 0.00 -1.03 0.00 0.00 54.13 55.93 2vja s LEU 282 Cb 0.20 -3.97 0.03 0.00 0.03 0.00 0.00 46.19 42.48 2vja s LEU 282 CO 0.49 -1.05 1.76 -0.65 0.23 0.00 0.00 176.35 177.12 2vja h PRO 283 N 2.39 0.28 -4.81 1.29 0.11 -1.93 -3.46 132.00 125.86 2vja h PRO 283 Ca -0.50 -0.02 -0.39 0.00 0.11 0.00 0.00 66.00 65.20 2vja h PRO 283 Cb 1.26 -0.06 -0.14 0.00 0.11 0.00 0.00 31.00 32.17 2vja h PRO 283 CO 0.61 0.19 -0.55 -0.06 -0.21 0.00 0.00 178.00 177.98 2vja s PHE 284 N -6.16 1.53 0.17 0.65 0.08 -1.26 -5.11 117.98 107.88 2vja s PHE 284 Ca -0.13 -1.46 -0.30 0.00 0.12 0.00 0.00 56.93 55.16 2vja s PHE 284 Cb 0.11 -0.74 -0.08 0.00 -0.57 0.00 0.00 43.02 41.74 2vja s PHE 284 CO 0.71 -0.65 1.27 -0.51 -0.10 0.00 0.00 175.22 175.94 2vja s ASP 285 N -3.32 6.97 0.25 1.36 -0.00 -1.26 -4.96 116.67 115.71 2vja s ASP 285 Ca 0.38 2.30 -0.20 0.00 -0.00 0.00 0.00 52.55 55.03 2vja s ASP 285 Cb 0.05 -2.60 0.07 0.00 -0.00 0.00 0.00 42.92 40.43 2vja s ASP 285 CO 0.19 -0.49 0.93 -0.94 -0.00 0.00 0.00 175.17 174.87 2vja s SER 286 N 0.42 -0.03 0.04 0.27 1.04 -1.26 -4.78 113.70 109.40 2vja s SER 286 Ca 0.56 -0.79 0.02 0.00 0.48 0.00 0.00 55.95 56.22 2vja s SER 286 Cb -0.35 0.62 -0.02 0.00 0.10 0.00 0.00 66.02 66.37 2vja s SER 286 CO 0.36 -1.23 -0.08 0.27 0.98 0.00 0.00 173.24 173.54 2vja s ILE 287 N -2.43 0.55 -1.27 -1.02 -4.36 -1.18 -4.80 121.20 106.70 2vja s ILE 287 Ca 0.18 -1.05 -0.08 0.00 -0.26 0.00 0.00 60.65 59.44 2vja s ILE 287 Cb -0.03 -0.61 0.01 0.00 1.25 0.00 0.00 42.46 43.07 2vja s ILE 287 CO 0.07 -0.36 1.03 0.33 0.24 0.00 0.00 174.94 176.25 2vja n PHE 288 N 1.52 -2.56 -4.08 1.37 -0.00 -1.26 -4.82 117.46 107.63 2vja n PHE 288 Ca -0.22 0.88 -0.18 0.00 -0.00 0.00 0.00 57.45 57.93 2vja n PHE 288 Cb 0.55 -4.66 -0.16 0.00 -0.00 0.00 0.00 39.48 35.21 2vja n PHE 288 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 2vja s ARG 289 N -6.14 0.53 0.00 -4.13 1.81 -1.26 -4.66 118.95 105.10 2vja s ARG 289 Ca 0.51 -0.06 0.06 0.00 -1.72 0.00 0.00 55.73 54.52 2vja s ARG 289 Cb -0.23 -0.59 -0.02 0.00 -0.45 0.00 0.00 34.95 33.67 2vja s ARG 289 CO 0.63 -0.05 -0.19 -0.06 -0.68 0.00 0.00 175.30 174.95 2vja s PHE 290 N 0.67 1.70 0.08 -0.53 0.08 -1.26 -5.06 117.98 113.66 2vja s PHE 290 Ca -0.08 -0.33 -0.34 0.00 0.12 0.00 0.00 56.93 56.30 2vja s PHE 290 Cb -0.11 -1.07 -0.18 0.00 -0.57 0.00 0.00 43.02 41.09 2vja s PHE 290 CO -0.01 0.00 1.60 0.77 -0.10 0.00 0.00 175.22 177.49 2vja h SER 291 N 5.44 -1.03 -3.61 1.36 0.02 -1.91 -3.41 113.55 110.40 2vja h SER 291 Ca -0.39 0.06 -0.70 0.00 -0.84 0.00 0.00 61.79 59.92 2vja h SER 291 Cb 1.15 0.30 -0.31 0.00 0.14 0.00 0.00 62.40 63.68 2vja h SER 291 CO 0.47 -0.63 -0.59 -0.36 -1.14 0.00 0.00 176.83 174.58 2vja s PHE 292 N -5.99 3.36 0.30 3.45 0.08 -1.26 -5.00 117.98 112.91 2vja s PHE 292 Ca -0.18 -1.82 0.02 0.00 0.12 0.00 0.00 56.93 55.07 2vja s PHE 292 Cb 0.04 -2.60 -0.05 0.00 -0.57 0.00 0.00 43.02 39.85 2vja s PHE 292 CO 0.62 -0.83 0.12 0.14 -0.10 0.00 0.00 175.22 175.16 2vja s VAL 293 N 1.30 0.56 0.63 -0.44 -7.23 -1.26 -4.39 120.40 109.56 2vja s VAL 293 Ca 0.01 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 58.00 2vja s VAL 293 Cb -0.21 -2.58 -0.07 0.00 0.56 0.00 0.00 36.38 34.07 2vja s VAL 293 CO -0.00 0.00 0.48 -2.65 -0.31 0.00 0.00 175.10 172.62 2vja n PRO 294 N -0.58 0.41 -4.83 4.82 -0.02 -1.25 -4.67 135.00 128.89 2vja n PRO 294 Ca -0.01 0.17 -0.27 0.00 -2.02 0.00 0.00 63.50 61.38 2vja n PRO 294 Cb 0.66 -1.71 -0.15 0.00 -0.02 0.00 0.00 33.50 32.27 2vja n PRO 294 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2vja s VAL 295 N -1.80 1.75 -1.11 -1.45 -7.23 -1.26 -1.66 120.40 107.64 2vja s VAL 295 Ca 0.67 -1.13 -0.22 0.00 -1.81 0.00 0.00 61.98 59.50 2vja s VAL 295 Cb -0.41 -1.49 0.05 0.00 0.56 0.00 0.00 36.38 35.09 2vja s VAL 295 CO 0.56 0.33 1.58 -0.63 -0.31 0.00 0.00 175.10 176.63 2vja s ILE 296 N -0.69 3.95 -0.80 -0.62 -1.09 -0.92 -4.77 121.20 116.25 2vja s ILE 296 Ca 0.08 -1.10 0.25 0.00 -2.23 0.00 0.00 60.65 57.65 2vja s ILE 296 Cb -0.09 -5.04 0.09 0.00 -1.58 0.00 0.00 42.46 35.84 2vja s ILE 296 CO 0.01 -1.90 1.48 -0.90 -1.23 0.00 0.00 174.94 172.41 2vja n ASP 297 N 9.12 0.56 0.00 3.58 5.75 -1.26 -4.30 116.55 130.00 2vja n ASP 297 Ca 0.39 0.12 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 2vja n ASP 297 Cb 0.49 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.57 2vja n ASP 297 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vja n GLY 298 N 1.40 1.11 0.29 6.12 0.00 -0.32 -4.84 105.19 108.94 2vja n GLY 298 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2vja n GLY 298 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2vja n GLU 299 N -2.00 0.00 -0.26 1.61 2.13 -1.26 -4.33 120.64 116.53 2vja n GLU 299 Ca 0.00 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 2vja n GLU 299 Cb 0.00 -0.05 0.28 0.00 0.27 0.00 0.00 31.44 31.94 2vja n GLU 299 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 2vja h PHE 300 N 0.00 0.94 -3.71 4.31 3.04 -1.92 -3.31 116.94 116.29 2vja h PHE 300 Ca 0.00 0.02 -0.67 0.00 3.98 0.00 0.00 57.97 61.30 2vja h PHE 300 Cb 0.00 -0.31 -0.37 0.00 2.56 0.00 0.00 35.95 37.83 2vja h PHE 300 CO 0.00 0.50 -0.70 -0.06 -2.02 0.00 0.00 178.31 176.02 2vja s PHE 301 N -5.82 3.50 0.21 0.41 0.08 -1.26 -4.38 117.98 110.72 2vja s PHE 301 Ca -0.11 -2.47 -0.14 0.00 0.12 0.00 0.00 56.93 54.33 2vja s PHE 301 Cb 0.20 -2.56 0.22 0.00 -0.57 0.00 0.00 43.02 40.31 2vja s PHE 301 CO 0.79 -0.90 1.63 -1.35 -0.10 0.00 0.00 175.22 175.28 2vja h PRO 302 N 7.82 -0.01 0.00 0.24 0.11 -1.75 -0.85 132.00 137.56 2vja h PRO 302 Ca -0.13 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.81 2vja h PRO 302 Cb 1.04 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 2vja h PRO 302 CO 0.54 -0.01 -0.14 0.25 -0.21 0.00 0.00 178.00 178.43 2vja n THR 303 N -5.43 0.00 -1.57 -1.15 -2.24 -1.26 -4.46 114.28 98.17 2vja n THR 303 Ca 0.07 -0.95 -0.40 0.00 -2.27 0.00 0.00 64.05 60.51 2vja n THR 303 Cb 0.32 0.52 0.03 0.00 -2.10 0.00 0.00 70.33 69.10 2vja n THR 303 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2vja n SER 304 N -2.19 0.53 -0.31 3.42 3.41 -1.26 -4.80 113.62 112.43 2vja n SER 304 Ca 0.02 0.91 -0.00 0.00 -0.26 0.00 0.00 58.87 59.54 2vja n SER 304 Cb 0.26 -1.31 0.12 0.00 -0.26 0.00 0.00 64.21 63.03 2vja n SER 304 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2vja h LEU 305 N 0.97 0.86 -0.04 1.04 3.38 -1.98 -2.05 115.31 117.48 2vja h LEU 305 Ca -0.45 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 2vja h LEU 305 Cb 1.36 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.93 2vja h LEU 305 CO 0.53 0.57 0.02 -0.08 0.09 0.00 0.00 178.44 179.57 2vja h GLU 306 N 1.00 0.06 -0.44 1.13 4.57 -1.99 -1.33 114.58 117.58 2vja h GLU 306 Ca 0.36 -0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.54 2vja h GLU 306 Cb 0.10 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.65 2vja h GLU 306 CO -0.15 0.18 0.30 0.66 -1.18 0.00 0.00 179.01 178.81 2vja h SER 307 N -0.07 0.47 0.02 1.04 4.64 -1.86 -0.74 113.55 117.05 2vja h SER 307 Ca 0.01 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 2vja h SER 307 Cb 0.14 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 2vja h SER 307 CO -0.00 0.34 -0.47 0.24 -0.87 0.00 0.00 176.83 176.06 2vja h MET 308 N 0.56 0.53 -0.08 4.77 2.86 -1.03 -2.21 114.93 120.32 2vja h MET 308 Ca 0.17 -0.30 -0.17 0.00 -2.06 0.00 0.00 59.70 57.35 2vja h MET 308 Cb 0.00 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.67 2vja h MET 308 CO -0.04 0.89 -0.68 -0.07 1.06 0.00 0.00 176.91 178.07 2vja h LEU 309 N 0.42 0.40 -0.53 1.22 3.38 -0.33 -0.63 115.31 119.25 2vja h LEU 309 Ca 0.02 -0.25 -0.16 0.00 0.09 0.00 0.00 57.88 57.58 2vja h LEU 309 Cb 0.98 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 2vja h LEU 309 CO 0.09 0.96 -0.66 0.78 0.09 0.00 0.00 178.44 179.70 2vja h ASN 310 N 0.24 0.37 0.23 -0.43 2.35 -1.08 -3.18 115.58 114.08 2vja h ASN 310 Ca -0.02 -0.23 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 2vja h ASN 310 Cb 1.23 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.49 2vja h ASN 310 CO 0.11 0.93 -0.27 -1.54 -1.65 0.00 0.00 177.43 175.00 2vja n SER 311 N -3.85 1.05 -0.44 5.81 3.41 -0.84 -4.93 113.62 113.82 2vja n SER 311 Ca -0.03 -0.90 -0.05 0.00 -0.26 0.00 0.00 58.87 57.63 2vja n SER 311 Cb 0.66 0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 64.75 2vja n SER 311 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vja n GLY 312 N 1.35 0.63 3.57 5.00 0.00 -0.96 -4.94 105.19 109.84 2vja n GLY 312 Ca 0.12 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 2vja n GLY 312 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vja s ASN 313 N -2.90 6.81 -0.14 1.61 2.47 -0.28 -4.84 114.94 117.66 2vja s ASN 313 Ca 0.00 -2.34 -0.34 0.00 0.42 0.00 0.00 52.86 50.60 2vja s ASN 313 Cb 0.00 -2.57 0.14 0.00 -1.45 0.00 0.00 41.25 37.37 2vja s ASN 313 CO 0.00 -1.19 1.28 0.72 -3.72 0.00 0.00 177.10 174.19 2vja s PHE 314 N 4.16 -0.07 0.22 0.43 -0.12 -1.26 -4.76 117.98 116.58 2vja s PHE 314 Ca 0.52 0.02 -0.32 0.00 -0.05 0.00 0.00 56.93 57.10 2vja s PHE 314 Cb 0.03 0.52 -0.12 0.00 -0.63 0.00 0.00 43.02 42.82 2vja s PHE 314 CO 0.05 -0.19 1.63 1.17 -0.05 0.00 0.00 175.22 177.83 2vja n LYS 315 N -0.24 2.55 -3.57 1.99 4.81 0.25 -4.95 118.16 119.00 2vja n LYS 315 Ca -0.03 0.92 -0.41 0.00 -0.87 0.00 0.00 58.31 57.92 2vja n LYS 315 Cb 0.60 -2.71 -0.10 0.00 0.02 0.00 0.00 35.03 32.84 2vja n LYS 315 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2vja s LYS 316 N 0.52 2.78 0.00 1.64 3.01 -1.26 -4.94 119.74 121.50 2vja s LYS 316 Ca 0.72 -1.22 0.00 0.00 -1.01 0.00 0.00 55.97 54.46 2vja s LYS 316 Cb -0.55 -3.81 0.00 0.00 -1.01 0.00 0.00 37.83 32.46 2vja s LYS 316 CO 0.39 -0.82 0.00 -2.37 0.51 0.00 0.00 175.35 173.07 2vja n THR 317 N 5.01 0.00 -3.95 2.17 5.66 -1.26 -4.75 114.28 117.16 2vja n THR 317 Ca -0.11 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.56 2vja n THR 317 Cb 0.45 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.18 2vja n THR 317 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 2vja s GLN 318 N 1.35 3.34 0.02 1.09 1.11 -1.26 -1.00 119.66 124.31 2vja s GLN 318 Ca 0.00 -0.37 0.00 0.00 0.01 0.00 0.00 55.36 55.00 2vja s GLN 318 Cb 0.00 -3.03 -0.02 0.00 -1.01 0.00 0.00 33.01 28.95 2vja s GLN 318 CO 0.00 0.66 -0.03 0.96 0.01 0.00 0.00 175.29 176.89 2vja s ILE 319 N -1.31 0.17 -0.16 1.08 -4.36 0.44 -3.20 121.20 113.86 2vja s ILE 319 Ca 0.27 -0.71 -0.00 0.00 -0.26 0.00 0.00 60.65 59.95 2vja s ILE 319 Cb -0.12 -0.27 0.04 0.00 1.25 0.00 0.00 42.46 43.35 2vja s ILE 319 CO 0.18 -0.34 -0.07 -0.22 0.24 0.00 0.00 174.94 174.74 2vja s LEU 320 N -1.10 1.62 0.19 0.37 0.20 -0.96 -1.45 118.68 117.56 2vja s LEU 320 Ca -0.11 -0.62 -0.01 0.00 0.69 0.00 0.00 54.13 54.08 2vja s LEU 320 Cb -0.07 -0.95 -0.04 0.00 -0.43 0.00 0.00 46.19 44.69 2vja s LEU 320 CO -0.01 -0.16 0.12 -1.48 -0.29 0.00 0.00 176.35 174.53 2vja s LEU 321 N 1.61 1.25 0.00 -0.68 2.34 -0.14 -1.64 118.68 121.42 2vja s LEU 321 Ca 0.01 -1.37 0.00 0.00 0.06 0.00 0.00 54.13 52.84 2vja s LEU 321 Cb -0.15 0.36 0.00 0.00 -0.56 0.00 0.00 46.19 45.84 2vja s LEU 321 CO -0.08 -0.82 0.00 0.61 -1.06 0.00 0.00 176.35 175.00 2vja n GLY 322 N -0.25 -1.33 3.23 -3.48 0.00 -0.92 -0.66 105.19 101.77 2vja n GLY 322 Ca 0.01 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 2vja n GLY 322 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vja s VAL 323 N -2.23 0.04 0.20 1.61 -7.23 -0.98 -0.77 120.40 111.05 2vja s VAL 323 Ca 0.00 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.22 2vja s VAL 323 Cb 0.00 -2.51 -0.04 0.00 0.56 0.00 0.00 36.38 34.40 2vja s VAL 323 CO 0.00 0.00 0.19 0.20 -0.31 0.00 0.00 175.10 175.18 2vja s ASN 324 N -3.21 5.69 0.22 4.85 0.01 -1.26 -0.08 114.94 121.16 2vja s ASN 324 Ca 0.39 -0.11 -0.08 0.00 -0.71 0.00 0.00 52.86 52.35 2vja s ASN 324 Cb 0.06 -1.52 0.29 0.00 0.41 0.00 0.00 41.25 40.48 2vja s ASN 324 CO 0.15 0.02 1.81 0.50 -1.51 0.00 0.00 177.10 178.06 2vja h LYS 325 N 1.96 0.68 -2.28 -0.60 3.64 -1.16 -3.30 116.57 115.51 2vja h LYS 325 Ca -0.48 -0.04 -0.61 0.00 -1.27 0.00 0.00 60.65 58.24 2vja h LYS 325 Cb 1.21 -0.15 -0.41 0.00 -0.41 0.00 0.00 32.23 32.47 2vja h LYS 325 CO 0.63 0.45 -0.49 -0.25 -2.27 0.00 0.00 179.45 177.52 2vja n ASP 326 N -4.78 4.62 -0.10 4.20 8.00 -0.57 -4.91 116.55 123.01 2vja n ASP 326 Ca 0.10 -3.65 0.14 0.00 0.71 0.00 0.00 54.79 52.09 2vja n ASP 326 Cb 0.21 -0.63 0.53 0.00 -0.02 0.00 0.00 41.12 41.21 2vja n ASP 326 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2vja h GLU 327 N 3.28 0.34 0.00 -1.24 4.39 -1.72 -3.20 114.58 116.43 2vja h GLU 327 Ca 0.17 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2vja h GLU 327 Cb 0.51 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 2vja h GLU 327 CO 0.86 0.23 -0.41 0.78 -1.16 0.00 0.00 179.01 179.30 2vja h GLY 328 N 0.35 0.00 0.58 -3.84 0.00 -1.85 -3.40 103.07 94.92 2vja h GLY 328 Ca 0.31 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.71 2vja h GLY 328 CO -0.08 0.00 0.38 1.48 0.00 0.00 0.00 176.54 178.32 2vja h SER 329 N 0.00 0.53 -0.68 0.19 4.64 -1.80 -2.54 113.55 113.90 2vja h SER 329 Ca 0.00 0.04 0.09 0.00 -0.47 0.00 0.00 61.79 61.45 2vja h SER 329 Cb 0.96 -0.06 -0.07 0.00 -0.31 0.00 0.00 62.40 62.93 2vja h SER 329 CO 0.00 0.33 0.33 0.15 -0.87 0.00 0.00 176.83 176.77 2vja h PHE 330 N 0.67 0.60 0.00 4.77 3.04 -1.82 -1.64 116.94 122.56 2vja h PHE 330 Ca 0.33 0.03 -0.09 0.00 3.98 0.00 0.00 57.97 62.22 2vja h PHE 330 Cb 0.27 -0.17 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 2vja h PHE 330 CO -0.09 0.22 -0.42 0.74 -2.02 0.00 0.00 178.31 176.74 2vja h PHE 331 N 0.58 0.00 -0.14 0.41 -1.00 -1.78 -3.17 116.94 111.84 2vja h PHE 331 Ca 0.33 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.89 2vja h PHE 331 Cb 0.34 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.90 2vja h PHE 331 CO -0.11 0.42 -0.78 -0.07 -1.61 0.00 0.00 178.31 176.17 2vja h LEU 332 N 0.00 0.88 -1.18 1.54 3.38 -0.97 -2.60 115.31 116.36 2vja h LEU 332 Ca -0.00 -0.58 0.07 0.00 0.09 0.00 0.00 57.88 57.46 2vja h LEU 332 Cb 1.10 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.53 2vja h LEU 332 CO 0.06 1.37 0.57 0.25 0.09 0.00 0.00 178.44 180.78 2vja h LEU 333 N 0.50 0.85 0.11 1.67 5.85 -1.30 -1.18 115.31 121.81 2vja h LEU 333 Ca -0.05 0.01 -0.29 0.00 0.84 0.00 0.00 57.88 58.39 2vja h LEU 333 Cb 1.40 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 2vja h LEU 333 CO 0.16 0.53 -1.41 1.88 -0.34 0.00 0.00 178.44 179.26 2vja h TYR 334 N 0.96 0.41 0.00 1.25 -1.99 -1.53 -3.42 116.97 112.65 2vja h TYR 334 Ca 0.39 -0.30 0.00 0.00 2.00 0.00 0.00 58.73 60.82 2vja h TYR 334 Cb 0.27 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.98 2vja h TYR 334 CO -0.00 1.30 0.00 0.41 -0.00 0.00 0.00 178.16 179.87 2vja n GLY 335 N 1.60 0.50 3.36 3.88 0.00 -0.98 -5.05 105.19 108.49 2vja n GLY 335 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 2vja n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vja s ALA 336 N -0.48 2.46 0.57 4.61 0.00 -0.45 -4.93 121.76 123.54 2vja s ALA 336 Ca 0.00 -0.97 -0.20 0.00 0.00 0.00 0.00 51.96 50.78 2vja s ALA 336 Cb 0.00 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 22.15 2vja s ALA 336 CO 0.00 0.40 1.31 -1.25 0.00 0.00 0.00 175.76 176.22 2vja s PRO 337 N -0.15 3.00 0.00 0.00 0.04 -1.26 -3.08 135.00 133.54 2vja s PRO 337 Ca -0.02 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.13 2vja s PRO 337 Cb -0.14 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.29 2vja s PRO 337 CO 0.04 -1.26 0.00 0.41 0.04 0.00 0.00 177.00 176.22 2vja n GLY 338 N 0.73 2.92 3.80 0.56 0.00 -1.26 -4.90 105.19 107.04 2vja n GLY 338 Ca 0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.75 2vja n GLY 338 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vja s PHE 339 N -2.18 3.82 -0.07 1.61 0.08 -1.18 -4.57 117.98 115.50 2vja s PHE 339 Ca 0.00 1.36 -0.17 0.00 0.12 0.00 0.00 56.93 58.24 2vja s PHE 339 Cb 0.00 -2.58 0.04 0.00 -0.57 0.00 0.00 43.02 39.91 2vja s PHE 339 CO 0.00 0.54 0.41 0.45 -0.10 0.00 0.00 175.22 176.53 2vja s SER 340 N -1.02 -0.36 0.25 1.36 0.15 -1.26 -4.92 113.70 107.90 2vja s SER 340 Ca 0.31 0.47 0.06 0.00 0.70 0.00 0.00 55.95 57.49 2vja s SER 340 Cb -0.20 0.55 0.28 0.00 -1.71 0.00 0.00 66.02 64.94 2vja s SER 340 CO 0.21 -0.37 1.58 0.50 1.20 0.00 0.00 173.24 176.36 2vja h LYS 341 N 4.31 0.18 -0.91 5.44 3.64 -1.98 -3.24 116.57 124.01 2vja h LYS 341 Ca -0.28 -0.12 -0.55 0.00 -1.27 0.00 0.00 60.65 58.43 2vja h LYS 341 Cb 1.17 0.02 -0.29 0.00 -0.41 0.00 0.00 32.23 32.72 2vja h LYS 341 CO 0.34 0.73 0.56 -0.25 -2.27 0.00 0.00 179.45 178.55 2vja n ASP 342 N -3.86 5.32 -3.78 4.20 8.00 -1.26 -4.40 116.55 120.77 2vja n ASP 342 Ca -0.02 -3.72 -0.09 0.00 0.71 0.00 0.00 54.79 51.67 2vja n ASP 342 Cb 0.61 -0.84 -0.03 0.00 -0.02 0.00 0.00 41.12 40.84 2vja n ASP 342 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2vja s SER 343 N -1.83 -0.26 0.11 -2.24 0.15 -1.23 -5.01 113.70 103.39 2vja s SER 343 Ca 0.58 -0.53 0.22 0.00 0.70 0.00 0.00 55.95 56.92 2vja s SER 343 Cb 0.48 0.62 0.88 0.00 -1.71 0.00 0.00 66.02 66.29 2vja s SER 343 CO 0.04 -1.13 1.69 1.21 1.20 0.00 0.00 173.24 176.25 2vja n GLU 344 N -0.38 0.10 -3.69 5.44 2.13 -1.26 -4.75 120.64 118.23 2vja n GLU 344 Ca -0.08 0.25 -0.21 0.00 0.66 0.00 0.00 57.16 57.77 2vja n GLU 344 Cb 0.62 -1.66 0.03 0.00 0.27 0.00 0.00 31.44 30.70 2vja n GLU 344 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2vja n SER 345 N -1.85 -1.18 -4.68 4.31 7.64 -1.26 -4.89 113.62 111.71 2vja n SER 345 Ca 0.04 -0.81 -0.42 0.00 1.01 0.00 0.00 58.87 58.68 2vja n SER 345 Cb 0.27 -4.09 -0.03 0.00 -1.01 0.00 0.00 64.21 59.35 2vja n SER 345 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2vja s LYS 346 N -5.95 4.31 -0.21 1.43 1.02 -1.26 -4.73 119.74 114.34 2vja s LYS 346 Ca 0.00 1.80 -0.14 0.00 0.02 0.00 0.00 55.97 57.64 2vja s LYS 346 Cb -0.00 -3.59 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 2vja s LYS 346 CO 0.81 -0.53 0.34 0.42 -0.92 0.00 0.00 175.35 175.47 2vja s ILE 347 N 2.44 5.24 1.15 2.17 -1.09 -0.67 -4.97 121.20 125.48 2vja s ILE 347 Ca 0.59 0.57 -0.17 0.00 -2.23 0.00 0.00 60.65 59.42 2vja s ILE 347 Cb -0.27 -3.67 0.26 0.00 -1.58 0.00 0.00 42.46 37.20 2vja s ILE 347 CO 0.23 0.28 1.09 -0.94 -1.23 0.00 0.00 174.94 174.37 2vja s SER 348 N 1.01 1.29 0.18 3.58 1.04 -1.26 -4.26 113.70 115.28 2vja s SER 348 Ca 0.16 0.85 -0.06 0.00 0.48 0.00 0.00 55.95 57.38 2vja s SER 348 Cb -0.14 -1.26 0.08 0.00 0.10 0.00 0.00 66.02 64.80 2vja s SER 348 CO 0.07 -3.92 1.51 -0.09 0.98 0.00 0.00 173.24 171.79 2vja h ARG 349 N -2.44 0.70 -0.21 4.02 9.65 -1.90 -2.21 114.38 121.99 2vja h ARG 349 Ca -0.49 -0.40 -0.00 0.00 -1.10 0.00 0.00 59.98 57.99 2vja h ARG 349 Cb 1.31 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.91 2vja h ARG 349 CO 0.42 1.01 0.12 1.49 2.80 0.00 0.00 179.97 185.82 2vja h GLU 350 N 0.55 0.28 -0.06 0.20 4.81 -1.98 -1.85 114.58 116.54 2vja h GLU 350 Ca 0.03 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 2vja h GLU 350 Cb 1.02 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 2vja h GLU 350 CO 0.10 0.23 -0.42 -0.44 -0.73 0.00 0.00 179.01 177.75 2vja h ASP 351 N 0.25 0.13 0.01 1.04 3.32 -1.90 -2.31 116.42 116.96 2vja h ASP 351 Ca 0.07 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.07 2vja h ASP 351 Cb 0.02 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2vja h ASP 351 CO -0.01 0.54 -0.01 0.15 -1.72 0.00 0.00 179.24 178.19 2vja h PHE 352 N 0.11 -0.01 -0.36 4.55 3.57 -1.04 0.42 116.94 124.18 2vja h PHE 352 Ca 0.01 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.56 2vja h PHE 352 Cb 0.79 0.00 -0.05 0.00 2.79 0.00 0.00 35.95 39.48 2vja h PHE 352 CO 0.01 0.04 0.06 0.52 -2.23 0.00 0.00 178.31 176.71 2vja h MET 353 N -0.06 0.17 -0.61 1.11 2.86 -1.15 -1.18 114.93 116.06 2vja h MET 353 Ca -0.00 -0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.67 2vja h MET 353 Cb 0.06 -0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.63 2vja h MET 353 CO 0.00 0.11 0.35 0.77 1.06 0.00 0.00 176.91 179.21 2vja h SER 354 N 0.18 0.54 -0.28 1.22 0.02 -0.94 -2.33 113.55 111.96 2vja h SER 354 Ca 0.17 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.17 2vja h SER 354 Cb 0.20 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 2vja h SER 354 CO -0.23 0.37 0.07 1.23 -1.14 0.00 0.00 176.83 177.12 2vja h GLY 355 N 0.67 0.33 1.02 -3.77 0.00 0.78 -0.74 103.07 101.35 2vja h GLY 355 Ca 0.26 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.55 2vja h GLY 355 CO -0.14 0.00 0.44 -0.39 0.00 0.00 0.00 176.54 176.45 2vja h VAL 356 N 0.18 1.24 -0.43 4.60 -1.51 -0.94 0.52 116.25 119.91 2vja h VAL 356 Ca 0.13 -0.59 0.03 0.00 -1.23 0.00 0.00 66.70 65.03 2vja h VAL 356 Cb 0.12 0.16 -0.03 0.00 -2.13 0.00 0.00 31.29 29.41 2vja h VAL 356 CO -0.16 0.27 0.23 0.50 -1.23 0.00 0.00 177.57 177.18 2vja h LYS 357 N 1.12 0.45 -0.49 5.19 1.63 -1.07 -0.79 116.57 122.62 2vja h LYS 357 Ca 0.28 -0.03 -0.08 0.00 -0.85 0.00 0.00 60.65 59.97 2vja h LYS 357 Cb 0.03 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.54 2vja h LYS 357 CO -0.05 0.30 -0.03 -0.07 -3.45 0.00 0.00 179.45 176.15 2vja h LEU 358 N 0.47 0.81 -0.41 5.20 4.07 -0.10 -2.96 115.31 122.38 2vja h LEU 358 Ca 0.18 -0.22 -0.18 0.00 0.08 0.00 0.00 57.88 57.74 2vja h LEU 358 Cb 0.06 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.57 2vja h LEU 358 CO -0.11 0.89 -0.75 0.28 -1.08 0.00 0.00 178.44 177.68 2vja h SER 359 N 0.77 0.40 -2.21 -0.43 0.02 0.55 -3.11 113.55 109.53 2vja h SER 359 Ca 0.14 -0.27 -0.59 0.00 -0.84 0.00 0.00 61.79 60.23 2vja h SER 359 Cb 0.51 -0.12 -0.42 0.00 0.14 0.00 0.00 62.40 62.52 2vja h SER 359 CO 0.03 1.01 -0.65 0.52 -1.14 0.00 0.00 176.83 176.59 2vja n VAL 360 N -3.80 2.41 0.13 2.27 0.31 -0.35 -4.87 118.33 114.43 2vja n VAL 360 Ca -0.04 -5.28 0.17 0.00 -0.01 0.00 0.00 64.34 59.18 2vja n VAL 360 Cb 0.72 -1.78 0.74 0.00 -0.91 0.00 0.00 33.84 32.61 2vja n VAL 360 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2vja h PRO 361 N 3.70 0.00 -0.01 5.55 0.13 -1.65 -2.29 132.00 137.43 2vja h PRO 361 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2vja h PRO 361 Cb 0.62 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.75 2vja h PRO 361 CO 0.80 0.00 -0.12 -2.39 -0.23 0.00 0.00 178.00 176.07 2vja n HIS 362 N -4.11 0.00 -2.87 1.56 1.44 -1.26 -4.92 115.22 105.06 2vja n HIS 362 Ca 0.04 0.00 -0.35 0.00 -2.01 0.00 0.00 57.72 55.41 2vja n HIS 362 Cb 0.42 -0.14 -0.07 0.00 0.12 0.00 0.00 29.99 30.33 2vja n HIS 362 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2vja s ALA 363 N -2.39 3.17 0.69 1.59 0.00 -0.86 -5.07 121.76 118.88 2vja s ALA 363 Ca 0.30 0.38 -0.05 0.00 0.00 0.00 0.00 51.96 52.59 2vja s ALA 363 Cb 0.20 -3.08 0.06 0.00 0.00 0.00 0.00 23.12 20.30 2vja s ALA 363 CO 0.46 0.19 0.98 0.54 0.00 0.00 0.00 175.76 177.93 2vja s ASN 364 N -1.93 4.85 0.32 0.00 2.20 -1.26 -4.81 114.94 114.31 2vja s ASN 364 Ca 0.55 0.36 0.08 0.00 -0.94 0.00 0.00 52.86 52.91 2vja s ASN 364 Cb -0.13 -1.03 0.84 0.00 -2.00 0.00 0.00 41.25 38.92 2vja s ASN 364 CO 0.18 -1.55 1.75 -0.78 -2.94 0.00 0.00 177.10 173.76 2vja h ASP 365 N -0.51 0.71 -0.56 3.54 3.58 -1.99 0.12 116.42 121.32 2vja h ASP 365 Ca -0.44 0.12 -0.07 0.00 0.42 0.00 0.00 57.03 57.07 2vja h ASP 365 Cb 1.31 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.34 2vja h ASP 365 CO 0.58 0.17 0.09 0.25 -2.88 0.00 0.00 179.24 177.45 2vja h LEU 366 N 0.65 0.88 -1.09 2.28 5.85 -1.99 -1.26 115.31 120.63 2vja h LEU 366 Ca 0.62 -0.26 -0.06 0.00 0.84 0.00 0.00 57.88 59.02 2vja h LEU 366 Cb 1.11 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 2vja h LEU 366 CO -0.43 0.92 0.04 1.23 -0.34 0.00 0.00 178.44 179.85 2vja h GLY 367 N 0.81 0.73 0.83 3.75 0.00 -1.18 -1.51 103.07 106.50 2vja h GLY 367 Ca 0.17 -0.44 -0.03 0.00 0.00 0.00 0.00 47.33 47.02 2vja h GLY 367 CO 0.01 0.41 0.00 1.41 0.00 0.00 0.00 176.54 178.38 2vja h LEU 368 N 0.65 0.36 -1.03 3.11 3.38 -0.74 -1.33 115.31 119.71 2vja h LEU 368 Ca 0.14 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.82 2vja h LEU 368 Cb 0.35 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 2vja h LEU 368 CO 0.01 0.58 0.65 0.44 0.09 0.00 0.00 178.44 180.21 2vja h ASP 369 N 0.14 1.11 -0.30 -0.43 3.32 -0.99 0.24 116.42 119.51 2vja h ASP 369 Ca 0.06 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 2vja h ASP 369 Cb 0.39 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 2vja h ASP 369 CO 0.01 0.79 0.16 0.00 -1.72 0.00 0.00 179.24 178.48 2vja h ALA 370 N 1.40 0.39 -0.28 3.45 0.00 -1.05 0.90 119.26 124.07 2vja h ALA 370 Ca 0.37 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.19 2vja h ALA 370 Cb -0.10 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2vja h ALA 370 CO -0.09 -0.07 0.13 0.28 0.00 0.00 0.00 179.25 179.50 2vja h VAL 371 N 0.37 1.15 -0.15 0.00 2.07 -0.73 -0.92 116.25 118.04 2vja h VAL 371 Ca 0.11 -0.44 0.02 0.00 0.82 0.00 0.00 66.70 67.21 2vja h VAL 371 Cb 0.07 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 2vja h VAL 371 CO -0.02 0.15 0.04 0.74 0.02 0.00 0.00 177.57 178.51 2vja h THR 372 N 0.32 0.96 -0.62 2.57 2.02 -0.75 -2.11 112.91 115.30 2vja h THR 372 Ca 0.10 -0.04 -0.05 0.00 0.77 0.00 0.00 66.41 67.19 2vja h THR 372 Cb 0.12 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 2vja h THR 372 CO -0.01 0.02 0.19 0.25 0.37 0.00 0.00 175.52 176.34 2vja h LEU 373 N 0.11 0.86 -1.59 2.58 5.85 -0.71 -1.75 115.31 120.66 2vja h LEU 373 Ca 0.06 -0.14 -0.04 0.00 0.84 0.00 0.00 57.88 58.60 2vja h LEU 373 Cb 0.04 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2vja h LEU 373 CO -0.07 0.81 -0.18 -0.61 -0.34 0.00 0.00 178.44 178.05 2vja h GLN 374 N 0.90 0.00 -0.09 1.25 5.75 -0.76 -3.21 115.11 118.96 2vja h GLN 374 Ca 0.20 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.70 2vja h GLN 374 Cb 0.26 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.81 2vja h GLN 374 CO -0.01 0.18 0.00 0.66 -2.65 0.00 0.00 178.83 177.01 2vja n TYR 375 N -3.58 0.24 -4.63 3.99 4.01 -0.83 -5.01 117.16 111.35 2vja n TYR 375 Ca -0.01 -0.82 -0.33 0.00 -0.16 0.00 0.00 57.90 56.58 2vja n TYR 375 Cb 0.32 -0.15 -0.15 0.00 -0.31 0.00 0.00 39.34 39.04 2vja n TYR 375 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2vja s THR 376 N -2.28 2.59 -0.76 -0.72 2.01 -0.70 -4.85 115.64 110.93 2vja s THR 376 Ca 0.26 -0.80 -0.22 0.00 0.31 0.00 0.00 61.69 61.24 2vja s THR 376 Cb 0.22 -2.08 0.08 0.00 0.01 0.00 0.00 72.50 70.73 2vja s THR 376 CO 0.05 0.52 1.06 -0.62 -0.69 0.00 0.00 174.62 174.94 2vja s ASP 377 N 0.73 6.31 0.00 3.53 -1.08 -1.26 -4.89 116.67 120.01 2vja s ASP 377 Ca -0.07 -1.26 0.09 0.00 -0.52 0.00 0.00 52.55 50.79 2vja s ASP 377 Cb -0.16 -2.43 0.52 0.00 -1.46 0.00 0.00 42.92 39.39 2vja s ASP 377 CO 0.01 -1.38 0.95 0.79 0.52 0.00 0.00 175.17 176.06 2vja n TRP 378 N 7.61 0.00 1.13 -5.34 7.02 -1.26 -1.11 117.44 125.49 2vja n TRP 378 Ca 0.06 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.66 2vja n TRP 378 Cb 0.47 0.00 0.19 0.00 -2.42 0.00 0.00 31.31 29.55 2vja n TRP 378 CO 0.00 0.00 0.00 -1.33 -2.02 0.00 0.00 177.69 174.34 2vja n MET 379 N -0.94 1.02 -2.65 -0.99 2.81 -1.26 -4.48 117.12 110.63 2vja n MET 379 Ca 0.07 -0.74 -0.05 0.00 -1.81 0.00 0.00 57.70 55.16 2vja n MET 379 Cb 0.03 -1.48 0.11 0.00 -0.71 0.00 0.00 33.22 31.16 2vja n MET 379 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2vja n ASP 380 N -0.34 -1.65 0.24 7.83 2.03 -0.27 -5.02 116.55 119.38 2vja n ASP 380 Ca 0.11 -2.28 0.17 0.00 0.52 0.00 0.00 54.79 53.31 2vja n ASP 380 Cb 0.41 0.88 0.88 0.00 -0.72 0.00 0.00 41.12 42.57 2vja n ASP 380 CO 0.00 0.00 0.00 -2.24 -1.92 0.00 0.00 177.20 173.04 2vja h ASP 381 N 1.56 0.00 -0.48 1.67 2.03 -1.57 -2.09 116.42 117.53 2vja h ASP 381 Ca -0.35 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.95 2vja h ASP 381 Cb 1.29 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.79 2vja h ASP 381 CO -0.12 0.00 0.00 0.59 -1.03 0.00 0.00 179.24 178.68 2vja n ASN 382 N -3.65 2.92 -4.59 4.15 3.02 -1.26 -4.74 115.26 111.12 2vja n ASN 382 Ca 0.00 -2.11 -0.42 0.00 -0.03 0.00 0.00 54.58 52.03 2vja n ASN 382 Cb 0.28 -0.38 -0.03 0.00 -0.61 0.00 0.00 39.78 39.04 2vja n ASN 382 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2vja s ASN 383 N -0.92 5.97 0.45 6.41 3.84 -0.79 -4.87 114.94 125.03 2vja s ASN 383 Ca 0.34 0.76 0.16 0.00 0.21 0.00 0.00 52.86 54.33 2vja s ASN 383 Cb 0.19 -2.54 1.09 0.00 -0.55 0.00 0.00 41.25 39.45 2vja s ASN 383 CO 0.21 -1.74 1.97 1.23 -2.79 0.00 0.00 177.10 175.98 2vja h GLY 384 N 13.58 0.51 1.19 1.21 0.00 -1.90 -1.31 103.07 116.35 2vja h GLY 384 Ca -0.29 -0.14 -0.28 0.00 0.00 0.00 0.00 47.33 46.62 2vja h GLY 384 CO 1.11 0.08 -1.11 -2.22 0.00 0.00 0.00 176.54 174.40 2vja h ILE 385 N 0.34 1.29 -0.03 2.60 2.04 -1.89 -1.67 117.51 120.19 2vja h ILE 385 Ca 0.29 -2.33 -0.08 0.00 1.00 0.00 0.00 64.86 63.74 2vja h ILE 385 Cb 0.66 2.54 -0.01 0.00 -0.74 0.00 0.00 36.82 39.27 2vja h ILE 385 CO -0.07 0.71 -0.35 0.11 0.00 0.00 0.00 178.15 178.55 2vja h LYS 386 N 0.31 0.06 -0.11 2.37 1.57 -1.83 -1.80 116.57 117.15 2vja h LYS 386 Ca -0.15 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.42 2vja h LYS 386 Cb 1.78 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.08 2vja h LYS 386 CO 0.22 0.41 -0.70 -0.91 -0.57 0.00 0.00 179.45 177.89 2vja h ASN 387 N 0.05 0.57 0.58 0.86 2.35 -1.27 0.39 115.58 119.12 2vja h ASN 387 Ca 0.00 -0.36 -0.03 0.00 -0.55 0.00 0.00 56.30 55.37 2vja h ASN 387 Cb 0.65 -0.17 0.01 0.00 0.05 0.00 0.00 38.32 38.86 2vja h ASN 387 CO 0.05 1.10 -0.28 -0.09 -1.65 0.00 0.00 177.43 176.56 2vja h ARG 388 N 0.34 -0.75 -0.51 0.81 2.43 -1.15 -2.19 114.38 113.35 2vja h ARG 388 Ca -0.03 0.05 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 2vja h ARG 388 Cb 1.28 0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 30.97 2vja h ARG 388 CO 0.13 -0.46 0.34 -0.44 -1.51 0.00 0.00 179.97 178.03 2vja h ASP 389 N -1.14 0.39 -0.17 -3.80 3.32 -1.40 -0.48 116.42 113.14 2vja h ASP 389 Ca -0.08 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 2vja h ASP 389 Cb 0.64 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 2vja h ASP 389 CO 0.13 0.26 0.10 1.23 -1.72 0.00 0.00 179.24 179.24 2vja h GLY 390 N 0.45 0.25 1.03 2.75 0.00 -0.83 -0.14 103.07 106.57 2vja h GLY 390 Ca 0.22 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.42 2vja h GLY 390 CO -0.06 0.10 0.38 -2.00 0.00 0.00 0.00 176.54 174.96 2vja h LEU 391 N 0.20 1.03 -0.65 3.11 5.85 -0.66 -0.27 115.31 123.91 2vja h LEU 391 Ca 0.06 -0.13 0.04 0.00 0.84 0.00 0.00 57.88 58.69 2vja h LEU 391 Cb 0.03 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.75 2vja h LEU 391 CO -0.01 0.87 0.39 -0.78 -0.34 0.00 0.00 178.44 178.57 2vja h ASP 392 N 1.11 0.61 -0.20 1.25 3.58 -0.66 -1.30 116.42 120.81 2vja h ASP 392 Ca 0.27 0.01 -0.15 0.00 0.42 0.00 0.00 57.03 57.58 2vja h ASP 392 Cb 0.11 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2vja h ASP 392 CO -0.03 0.41 -0.41 0.44 -2.88 0.00 0.00 179.24 176.77 2vja h ASP 393 N 0.74 0.80 0.24 2.28 3.32 -0.45 -2.26 116.42 121.10 2vja h ASP 393 Ca 0.28 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.95 2vja h ASP 393 Cb 0.09 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 2vja h ASP 393 CO -0.14 1.11 -0.15 0.40 -1.72 0.00 0.00 179.24 178.75 2vja h ILE 394 N 0.61 0.69 -0.61 0.35 2.04 -0.41 0.16 117.51 120.33 2vja h ILE 394 Ca 0.05 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.91 2vja h ILE 394 Cb 0.96 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 2vja h ILE 394 CO 0.09 0.00 0.41 0.58 0.00 0.00 0.00 178.15 179.23 2vja h VAL 395 N -0.38 1.16 -0.11 1.67 2.07 -1.28 -1.10 116.25 118.28 2vja h VAL 395 Ca -0.02 -0.29 -0.19 0.00 0.82 0.00 0.00 66.70 67.01 2vja h VAL 395 Cb 0.31 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 30.34 2vja h VAL 395 CO 0.03 0.15 -0.73 1.23 0.02 0.00 0.00 177.57 178.27 2vja h GLY 396 N 0.83 0.60 0.72 2.17 0.00 -1.27 -2.00 103.07 104.12 2vja h GLY 396 Ca 0.22 -0.83 -0.07 0.00 0.00 0.00 0.00 47.33 46.66 2vja h GLY 396 CO -0.05 0.74 -0.19 -0.55 0.00 0.00 0.00 176.54 176.49 2vja h ASP 397 N 0.37 0.38 -0.20 0.19 3.32 -0.58 0.89 116.42 120.80 2vja h ASP 397 Ca -0.03 -0.53 -0.04 0.00 0.02 0.00 0.00 57.03 56.45 2vja h ASP 397 Cb 1.32 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.75 2vja h ASP 397 CO 0.13 0.84 -0.02 -0.74 -1.72 0.00 0.00 179.24 177.74 2vja h HIS 398 N -0.07 0.40 0.00 4.55 2.76 -1.28 -0.76 115.15 120.76 2vja h HIS 398 Ca 0.01 -0.08 -0.24 0.00 -2.20 0.00 0.00 60.37 57.87 2vja h HIS 398 Cb 0.76 -0.10 -0.04 0.00 1.55 0.00 0.00 27.41 29.58 2vja h HIS 398 CO 0.10 0.58 -1.38 -0.91 -1.30 0.00 0.00 177.93 175.02 2vja h ASN 399 N 0.11 0.00 0.00 3.26 2.35 -1.46 -3.41 115.58 116.43 2vja h ASN 399 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2vja h ASN 399 Cb 0.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2vja h ASN 399 CO 0.01 0.90 0.00 0.52 -1.65 0.00 0.00 177.43 177.21 2vja n VAL 400 N -3.12 0.62 0.23 2.81 0.31 -0.50 -4.63 118.33 114.05 2vja n VAL 400 Ca -0.10 0.21 -0.15 0.00 -0.01 0.00 0.00 64.34 64.29 2vja n VAL 400 Cb 0.97 -1.11 -0.08 0.00 -0.91 0.00 0.00 33.84 32.71 2vja n VAL 400 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2vja h ILE 401 N 0.00 0.39 -0.48 2.52 2.04 -0.98 -1.68 117.51 119.32 2vja h ILE 401 Ca 0.00 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.75 2vja h ILE 401 Cb 0.00 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 2vja h ILE 401 CO 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 178.15 178.02 2vja h PRO 403 N 0.79 1.14 -0.43 0.00 0.11 -1.70 0.30 132.00 132.21 2vja h PRO 403 Ca 0.12 -0.13 -0.14 0.00 0.11 0.00 0.00 66.00 65.96 2vja h PRO 403 Cb 0.65 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.53 2vja h PRO 403 CO 0.05 0.83 -0.29 1.25 -0.21 0.00 0.00 178.00 179.63 2vja h LEU 404 N 1.15 0.98 -1.00 2.35 6.46 -0.92 -1.44 115.31 122.89 2vja h LEU 404 Ca 0.29 -0.40 -0.05 0.00 -0.12 0.00 0.00 57.88 57.59 2vja h LEU 404 Cb 0.03 -0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 39.66 2vja h LEU 404 CO -0.05 1.19 0.11 0.24 -0.62 0.00 0.00 178.44 179.32 2vja h MET 405 N 0.80 0.84 0.13 1.25 2.86 -0.46 0.17 114.93 120.51 2vja h MET 405 Ca 0.09 -0.18 -0.00 0.00 -2.06 0.00 0.00 59.70 57.54 2vja h MET 405 Cb 0.87 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 2vja h MET 405 CO 0.08 0.77 -0.08 1.25 1.06 0.00 0.00 176.91 179.99 2vja h HIS 406 N 0.80 -0.20 -0.05 -0.22 -0.00 -0.71 -1.83 115.15 112.94 2vja h HIS 406 Ca 0.17 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.57 2vja h HIS 406 Cb 0.32 0.07 -0.04 0.00 -0.00 0.00 0.00 27.41 27.76 2vja h HIS 406 CO 0.02 -0.12 -0.15 0.35 -0.00 0.00 0.00 177.93 178.03 2vja h PHE 407 N -0.20 -0.39 -0.97 5.26 3.57 -0.48 -1.81 116.94 121.92 2vja h PHE 407 Ca -0.01 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.55 2vja h PHE 407 Cb 0.16 0.18 -0.06 0.00 2.79 0.00 0.00 35.95 39.03 2vja h PHE 407 CO -0.08 -0.22 0.63 -0.24 -2.23 0.00 0.00 178.31 176.16 2vja h VAL 408 N -0.23 1.14 -0.34 1.41 3.04 -0.56 0.03 116.25 120.74 2vja h VAL 408 Ca 0.07 -0.41 -0.13 0.00 -1.01 0.00 0.00 66.70 65.22 2vja h VAL 408 Cb 0.32 -0.16 -0.01 0.00 -2.01 0.00 0.00 31.29 29.43 2vja h VAL 408 CO -0.18 0.22 -0.32 0.78 -1.01 0.00 0.00 177.57 177.06 2vja h ASN 409 N 1.19 0.77 -0.08 3.17 2.35 -1.03 -1.56 115.58 120.39 2vja h ASN 409 Ca 0.39 -0.31 -0.15 0.00 -0.55 0.00 0.00 56.30 55.68 2vja h ASN 409 Cb 0.05 -0.21 0.01 0.00 0.05 0.00 0.00 38.32 38.22 2vja h ASN 409 CO -0.14 1.02 -0.53 0.11 -1.65 0.00 0.00 177.43 176.25 2vja h LYS 410 N 0.62 0.50 -0.07 0.81 1.79 -0.90 -3.29 116.57 116.03 2vja h LYS 410 Ca 0.07 -0.43 -0.00 0.00 -2.18 0.00 0.00 60.65 58.11 2vja h LYS 410 Cb 0.84 0.10 -0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2vja h LYS 410 CO 0.07 1.06 0.04 -0.92 -1.08 0.00 0.00 179.45 178.62 2vja h TYR 411 N 0.07 0.10 -0.35 -1.35 3.20 -1.01 -2.87 116.97 114.75 2vja h TYR 411 Ca -0.04 -0.00 0.10 0.00 3.14 0.00 0.00 58.73 61.93 2vja h TYR 411 Cb 1.19 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 2vja h TYR 411 CO 0.12 0.15 0.45 1.15 -1.64 0.00 0.00 178.16 178.39 2vja h THR 412 N 0.02 0.30 0.00 1.81 2.02 -1.38 0.28 112.91 115.96 2vja h THR 412 Ca 0.02 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.19 2vja h THR 412 Cb 0.08 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.12 2vja h THR 412 CO -0.00 0.00 -0.09 0.11 0.37 0.00 0.00 175.52 175.91 2vja h LYS 413 N 0.00 0.00 0.00 6.66 1.79 -1.58 -3.31 116.57 120.13 2vja h LYS 413 Ca 0.17 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.64 2vja h LYS 413 Cb 1.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 2vja h LYS 413 CO -0.00 0.09 -0.89 1.19 -1.08 0.00 0.00 179.45 178.76 2vja n PHE 414 N -3.31 0.00 -0.34 -1.35 3.72 0.18 -5.09 117.46 111.27 2vja n PHE 414 Ca -0.01 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.09 2vja n PHE 414 Cb 0.29 0.00 0.29 0.00 -0.94 0.00 0.00 39.48 39.12 2vja n PHE 414 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 2vja s GLY 415 N -2.27 1.40 -0.09 1.37 0.00 0.74 -4.87 107.32 103.60 2vja s GLY 415 Ca 0.00 -0.81 0.13 0.00 0.00 0.00 0.00 44.72 44.03 2vja s GLY 415 CO 0.00 0.21 1.17 -2.01 0.00 0.00 0.00 173.10 172.47 2vja n ASN 416 N -5.69 2.60 0.00 1.64 4.05 -0.17 -4.89 115.26 112.80 2vja n ASN 416 Ca 0.13 -2.68 0.00 0.00 0.45 0.00 0.00 54.58 52.47 2vja n ASN 416 Cb 0.60 -0.32 0.00 0.00 1.23 0.00 0.00 39.78 41.29 2vja n ASN 416 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2vja n GLY 417 N -0.83 2.32 3.13 8.20 0.00 -1.22 -4.68 105.19 112.12 2vja n GLY 417 Ca 0.12 0.27 -0.29 0.00 0.00 0.00 0.00 46.02 46.12 2vja n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vja s THR 418 N 0.00 1.64 -0.13 2.61 2.01 -1.26 -0.42 115.64 120.09 2vja s THR 418 Ca 0.00 -0.77 0.00 0.00 0.31 0.00 0.00 61.69 61.23 2vja s THR 418 Cb 0.00 -1.44 0.02 0.00 0.01 0.00 0.00 72.50 71.09 2vja s THR 418 CO 0.00 0.47 -0.12 -0.31 -0.69 0.00 0.00 174.62 173.97 2vja s TYR 419 N 0.51 1.89 -0.05 4.92 1.51 -0.53 0.41 117.35 126.00 2vja s TYR 419 Ca -0.17 -1.00 0.03 0.00 -1.01 0.00 0.00 57.07 54.92 2vja s TYR 419 Cb -0.17 -1.44 -0.03 0.00 -0.11 0.00 0.00 41.96 40.22 2vja s TYR 419 CO 0.06 -0.59 -0.12 -1.17 -1.11 0.00 0.00 175.55 172.63 2vja s LEU 420 N 1.50 2.90 0.15 -1.29 2.96 -1.26 -0.97 118.68 122.67 2vja s LEU 420 Ca 0.03 -0.13 0.05 0.00 -0.22 0.00 0.00 54.13 53.86 2vja s LEU 420 Cb -0.13 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.91 2vja s LEU 420 CO -0.09 0.35 -0.11 -0.72 -1.32 0.00 0.00 176.35 174.46 2vja s TYR 421 N -0.77 1.33 -0.30 5.38 -0.85 0.16 -2.76 117.35 119.55 2vja s TYR 421 Ca 0.12 -0.72 -0.01 0.00 -0.52 0.00 0.00 57.07 55.94 2vja s TYR 421 Cb -0.11 -0.67 0.10 0.00 0.38 0.00 0.00 41.96 41.66 2vja s TYR 421 CO 0.01 0.13 0.09 0.12 -1.52 0.00 0.00 175.55 174.38 2vja s PHE 422 N -3.18 1.63 -0.40 -3.49 5.36 -0.57 -2.31 117.98 115.02 2vja s PHE 422 Ca 0.17 -1.67 -0.27 0.00 -0.96 0.00 0.00 56.93 54.20 2vja s PHE 422 Cb 0.01 -1.65 0.02 0.00 -0.34 0.00 0.00 43.02 41.06 2vja s PHE 422 CO 0.02 -0.86 1.02 0.12 -1.46 0.00 0.00 175.22 174.05 2vja s PHE 423 N 1.64 2.99 -0.27 10.12 5.36 0.89 -1.03 117.98 137.68 2vja s PHE 423 Ca 0.09 0.78 0.16 0.00 -0.96 0.00 0.00 56.93 57.00 2vja s PHE 423 Cb -0.17 -3.94 0.49 0.00 -0.34 0.00 0.00 43.02 39.06 2vja s PHE 423 CO -0.25 -0.99 1.14 0.27 -1.46 0.00 0.00 175.22 173.94 2vja n ASN 424 N 7.17 3.00 -4.52 6.13 6.94 -1.19 -0.89 115.26 131.90 2vja n ASN 424 Ca 0.09 -2.76 -0.35 0.00 -0.02 0.00 0.00 54.58 51.54 2vja n ASN 424 Cb 0.48 -0.42 -0.11 0.00 -2.36 0.00 0.00 39.78 37.37 2vja n ASN 424 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2vja s HIS 425 N -3.71 3.13 -0.43 -2.53 2.46 -1.26 -4.97 115.29 107.98 2vja s HIS 425 Ca 0.37 -0.22 -0.21 0.00 0.47 0.00 0.00 55.06 55.48 2vja s HIS 425 Cb 0.36 -2.15 0.02 0.00 -0.13 0.00 0.00 32.58 30.69 2vja s HIS 425 CO -0.01 -0.13 0.65 0.50 -2.47 0.00 0.00 174.74 173.28 2vja s ARG 426 N 1.00 3.32 0.31 2.88 6.06 -1.26 -4.83 118.95 126.43 2vja s ARG 426 Ca 0.04 -0.33 -0.29 0.00 -2.50 0.00 0.00 55.73 52.64 2vja s ARG 426 Cb -0.14 -3.94 -0.12 0.00 0.06 0.00 0.00 34.95 30.81 2vja s ARG 426 CO 0.03 -0.99 1.46 0.00 -2.50 0.00 0.00 175.30 173.30 2vja n ALA 427 N 6.26 1.89 0.30 6.12 0.00 -1.26 -4.88 120.51 128.94 2vja n ALA 427 Ca -0.01 0.37 0.18 0.00 0.00 0.00 0.00 53.44 53.98 2vja n ALA 427 Cb 0.48 -2.36 0.96 0.00 0.00 0.00 0.00 19.45 18.52 2vja n ALA 427 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2vja h SER 428 N 3.79 0.00 -0.41 0.00 4.64 -1.95 -2.76 113.55 116.87 2vja h SER 428 Ca -0.47 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.70 2vja h SER 428 Cb 1.25 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.25 2vja h SER 428 CO 0.72 0.03 0.04 -0.46 -0.87 0.00 0.00 176.83 176.29 2vja n ASN 429 N -3.41 3.27 -4.74 4.97 0.23 -1.26 -5.02 115.26 109.29 2vja n ASN 429 Ca -0.02 -3.45 -0.41 0.00 -0.53 0.00 0.00 54.58 50.16 2vja n ASN 429 Cb 0.15 -0.63 -0.03 0.00 -2.08 0.00 0.00 39.78 37.19 2vja n ASN 429 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2vja s LEU 430 N -3.09 4.39 0.05 -4.53 2.96 -1.04 -4.91 118.68 112.52 2vja s LEU 430 Ca 0.46 2.57 0.25 0.00 -0.22 0.00 0.00 54.13 57.19 2vja s LEU 430 Cb 0.39 -3.62 0.45 0.00 0.50 0.00 0.00 46.19 43.92 2vja s LEU 430 CO 0.05 -0.66 1.38 1.33 -1.32 0.00 0.00 176.35 177.13 2vja n VAL 431 N 2.64 0.16 -2.55 1.68 0.24 -1.26 -4.89 118.33 114.35 2vja n VAL 431 Ca 0.07 -0.13 -0.30 0.00 -2.04 0.00 0.00 64.34 61.94 2vja n VAL 431 Cb 0.41 0.05 -0.02 0.00 -1.47 0.00 0.00 33.84 32.81 2vja n VAL 431 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 2vja s TRP 432 N -3.08 3.51 0.57 6.34 0.52 -1.26 -4.97 118.94 120.57 2vja s TRP 432 Ca 0.09 1.13 -0.21 0.00 0.02 0.00 0.00 56.10 57.13 2vja s TRP 432 Cb 0.16 -2.54 -0.04 0.00 -1.15 0.00 0.00 33.47 29.90 2vja s TRP 432 CO 0.71 -0.29 1.34 -1.25 0.02 0.00 0.00 176.95 177.47 2vja s PRO 433 N -4.29 3.00 0.39 4.98 0.04 -1.26 -4.92 135.00 132.95 2vja s PRO 433 Ca 0.53 2.18 0.15 0.00 0.04 0.00 0.00 61.00 63.90 2vja s PRO 433 Cb -0.10 -2.15 1.02 0.00 0.04 0.00 0.00 34.50 33.30 2vja s PRO 433 CO 0.38 -1.28 1.83 1.49 0.04 0.00 0.00 177.00 179.45 2vja h GLU 434 N 1.24 0.47 0.00 4.56 4.57 -1.94 -1.91 114.58 121.57 2vja h GLU 434 Ca -0.51 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.63 2vja h GLU 434 Cb 1.31 -0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2vja h GLU 434 CO 0.56 0.31 -0.04 0.11 -1.18 0.00 0.00 179.01 178.77 2vja h TRP 435 N 0.48 0.00 0.00 0.92 5.08 -1.90 -2.37 115.95 118.16 2vja h TRP 435 Ca 0.51 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.48 2vja h TRP 435 Cb 1.17 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.33 2vja h TRP 435 CO -0.00 0.04 -0.03 0.52 -1.28 0.00 0.00 178.44 177.69 2vja h MET 436 N 0.00 0.00 0.00 0.12 2.86 -1.71 -3.49 114.93 112.72 2vja h MET 436 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2vja h MET 436 Cb 0.22 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.88 2vja h MET 436 CO 0.01 0.03 0.00 0.41 1.06 0.00 0.00 176.91 178.41 2vja n GLY 437 N 0.42 2.43 3.46 8.32 0.00 -0.90 -4.17 105.19 114.75 2vja n GLY 437 Ca 0.02 -0.44 -0.44 0.00 0.00 0.00 0.00 46.02 45.17 2vja n GLY 437 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vja s VAL 438 N 0.00 4.62 0.46 1.61 1.01 -1.26 -4.89 120.40 121.95 2vja s VAL 438 Ca 0.00 -1.33 -0.24 0.00 0.00 0.00 0.00 61.98 60.41 2vja s VAL 438 Cb 0.00 -4.77 -0.07 0.00 0.00 0.00 0.00 36.38 31.53 2vja s VAL 438 CO 0.00 -1.52 1.24 -0.63 0.00 0.00 0.00 175.10 174.19 2vja s ILE 439 N 3.03 2.79 -0.08 2.22 1.01 -1.26 -1.52 121.20 127.39 2vja s ILE 439 Ca 0.31 0.62 -0.35 0.00 0.00 0.00 0.00 60.65 61.24 2vja s ILE 439 Cb -0.07 -3.33 -0.12 0.00 0.01 0.00 0.00 42.46 38.95 2vja s ILE 439 CO -0.06 0.02 1.84 1.57 0.00 0.00 0.00 174.94 178.30 2vja n HIS 440 N -0.42 2.29 -0.10 3.97 -0.00 -1.25 -1.27 115.22 118.43 2vja n HIS 440 Ca 0.07 0.08 0.00 0.00 -0.00 0.00 0.00 57.72 57.86 2vja n HIS 440 Cb 0.46 -2.63 0.00 0.00 -0.00 0.00 0.00 29.99 27.82 2vja n HIS 440 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2vja n GLY 441 N 4.28 0.73 1.16 1.57 0.00 -1.26 -4.96 105.19 106.70 2vja n GLY 441 Ca 0.22 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.29 2vja n GLY 441 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2vja n TYR 442 N -2.00 1.02 0.34 1.61 4.02 -0.40 -3.09 117.16 118.66 2vja n TYR 442 Ca 0.00 -0.38 0.11 0.00 -0.01 0.00 0.00 57.90 57.62 2vja n TYR 442 Cb 0.00 -0.24 -0.12 0.00 -0.02 0.00 0.00 39.34 38.96 2vja n TYR 442 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 2vja n GLU 443 N 0.47 0.43 -0.19 -0.72 0.00 -1.26 -4.38 120.64 114.99 2vja n GLU 443 Ca 0.15 -0.10 -0.04 0.00 0.00 0.00 0.00 57.16 57.17 2vja n GLU 443 Cb 0.67 -1.54 0.06 0.00 0.00 0.00 0.00 31.44 30.63 2vja n GLU 443 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.13 177.95 2vja h ILE 444 N 0.00 1.00 0.00 3.84 2.04 -1.95 -1.06 117.51 121.37 2vja h ILE 444 Ca 0.00 -0.21 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 2vja h ILE 444 Cb 0.83 0.34 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 2vja h ILE 444 CO 0.00 0.11 -0.01 1.05 0.00 0.00 0.00 178.15 179.30 2vja h GLU 445 N 0.60 0.00 0.08 2.37 4.11 -1.80 -0.31 114.58 119.63 2vja h GLU 445 Ca 0.24 0.00 -0.25 0.00 0.07 0.00 0.00 59.36 59.42 2vja h GLU 445 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2vja h GLU 445 CO -0.14 0.01 -1.11 0.74 0.07 0.00 0.00 179.01 178.58 2vja h PHE 446 N 0.00 0.53 -0.28 2.06 -1.00 -1.55 -0.49 116.94 116.20 2vja h PHE 446 Ca -0.00 -0.34 -0.08 0.00 2.81 0.00 0.00 57.97 60.36 2vja h PHE 446 Cb 0.01 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.52 2vja h PHE 446 CO 0.00 1.21 -0.18 0.28 -1.61 0.00 0.00 178.31 178.02 2vja h VAL 447 N 0.13 1.25 -0.59 -0.55 2.07 0.02 -2.85 116.25 115.73 2vja h VAL 447 Ca -0.11 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 66.29 2vja h VAL 447 Cb 1.80 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 2vja h VAL 447 CO 0.18 0.36 0.00 0.49 0.02 0.00 0.00 177.57 178.63 2vja n PHE 448 N -4.17 0.78 -1.29 1.57 3.01 -0.26 -4.68 117.46 112.43 2vja n PHE 448 Ca 0.00 -0.39 -0.10 0.00 1.01 0.00 0.00 57.45 57.97 2vja n PHE 448 Cb 0.36 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.79 2vja n PHE 448 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vja n GLY 449 N 1.45 1.12 0.39 1.37 0.00 -1.05 -4.10 105.19 104.37 2vja n GLY 449 Ca 0.20 -0.47 0.19 0.00 0.00 0.00 0.00 46.02 45.93 2vja n GLY 449 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vja h LEU 450 N 0.00 0.30 0.00 0.99 -0.00 -1.37 0.16 115.31 115.38 2vja h LEU 450 Ca -0.20 0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.70 2vja h LEU 450 Cb 0.69 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 41.32 2vja h LEU 450 CO 0.29 0.14 0.00 -2.65 -0.00 0.00 0.00 178.44 176.22 2vja n PRO 451 N -4.45 0.01 0.06 1.13 -0.02 -1.26 -1.95 135.00 128.52 2vja n PRO 451 Ca 0.15 0.41 0.13 0.00 -2.02 0.00 0.00 63.50 62.18 2vja n PRO 451 Cb 0.63 -1.50 0.45 0.00 -0.02 0.00 0.00 33.50 33.06 2vja n PRO 451 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2vja n LEU 452 N -1.48 0.51 -4.50 2.45 4.32 0.55 -4.49 117.00 114.36 2vja n LEU 452 Ca 0.01 0.48 -0.42 0.00 -0.02 0.00 0.00 56.01 56.06 2vja n LEU 452 Cb 0.05 -0.36 -0.09 0.00 -1.62 0.00 0.00 43.42 41.39 2vja n LEU 452 CO 0.04 -0.09 0.07 0.54 -1.22 0.00 0.00 177.39 176.73 2vja s VAL 453 N -3.07 5.13 0.23 4.08 0.11 -0.82 -4.99 120.40 121.07 2vja s VAL 453 Ca 0.11 -0.28 -0.15 0.00 -2.93 0.00 0.00 61.98 58.73 2vja s VAL 453 Cb 0.15 -3.97 0.28 0.00 -1.53 0.00 0.00 36.38 31.31 2vja s VAL 453 CO 0.59 -0.33 1.57 0.11 -3.33 0.00 0.00 175.10 173.71 2vja h LYS 454 N 8.65 -0.03 0.00 1.54 1.79 -1.88 -1.19 116.57 125.45 2vja h LYS 454 Ca -0.27 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.20 2vja h LYS 454 Cb 1.12 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 2vja h LYS 454 CO 0.76 -0.02 0.00 -0.85 -1.08 0.00 0.00 179.45 178.26 2vja n GLU 455 N -5.51 0.08 0.00 3.15 0.00 -1.26 -1.04 120.64 116.06 2vja n GLU 455 Ca 0.10 0.21 0.14 0.00 0.00 0.00 0.00 57.16 57.61 2vja n GLU 455 Cb 0.41 -1.50 0.52 0.00 0.00 0.00 0.00 31.44 30.88 2vja n GLU 455 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2vja n LEU 456 N -1.24 0.32 -3.00 -1.84 4.77 -0.45 -4.96 117.00 110.59 2vja n LEU 456 Ca 0.02 0.17 -0.21 0.00 -0.03 0.00 0.00 56.01 55.96 2vja n LEU 456 Cb 0.03 -0.30 0.05 0.00 -2.33 0.00 0.00 43.42 40.87 2vja n LEU 456 CO 0.03 0.07 0.07 0.59 -1.33 0.00 0.00 177.39 176.82 2vja n ASN 457 N -1.28 -5.94 -4.89 -1.43 5.03 -0.21 -5.01 115.26 101.54 2vja n ASN 457 Ca 0.10 -0.34 -0.29 0.00 0.87 0.00 0.00 54.58 54.91 2vja n ASN 457 Cb 0.31 -4.70 0.02 0.00 -1.02 0.00 0.00 39.78 34.39 2vja n ASN 457 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2vja s TYR 458 N -3.19 3.49 0.71 3.10 1.51 -1.26 -4.78 117.35 116.93 2vja s TYR 458 Ca 0.37 1.02 -0.11 0.00 -1.01 0.00 0.00 57.07 57.33 2vja s TYR 458 Cb -0.16 -2.69 0.02 0.00 -0.11 0.00 0.00 41.96 39.02 2vja s TYR 458 CO 0.45 -0.71 1.09 0.95 -1.11 0.00 0.00 175.55 176.22 2vja s THR 459 N -3.08 3.60 0.35 -0.71 -4.23 -1.26 -4.89 115.64 105.42 2vja s THR 459 Ca 0.54 0.52 0.02 0.00 -1.18 0.00 0.00 61.69 61.59 2vja s THR 459 Cb -0.11 -3.46 0.26 0.00 1.34 0.00 0.00 72.50 70.53 2vja s THR 459 CO 0.50 -0.68 2.00 0.00 -0.54 0.00 0.00 174.62 175.91 2vja h ALA 460 N -0.68 1.54 0.00 3.99 0.00 -1.96 -0.80 119.26 121.34 2vja h ALA 460 Ca -0.45 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 2vja h ALA 460 Cb 1.25 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2vja h ALA 460 CO 0.63 0.43 -0.19 1.05 0.00 0.00 0.00 179.25 181.16 2vja h GLU 461 N 0.86 0.00 0.00 0.00 9.09 -1.98 -2.38 114.58 120.17 2vja h GLU 461 Ca 0.23 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 59.43 2vja h GLU 461 Cb -0.08 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 26.99 2vja h GLU 461 CO -0.05 0.19 -0.99 0.93 0.05 0.00 0.00 179.01 179.14 2vja h GLU 462 N 0.00 0.01 -0.40 1.06 5.08 -1.55 -1.45 114.58 117.33 2vja h GLU 462 Ca -0.00 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 2vja h GLU 462 Cb 0.83 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.08 2vja h GLU 462 CO 0.03 0.99 -0.25 1.49 -1.00 0.00 0.00 179.01 180.26 2vja h GLU 463 N 0.00 0.87 -0.61 2.33 4.81 -1.08 -0.85 114.58 120.05 2vja h GLU 463 Ca -0.01 -0.41 -0.09 0.00 -0.13 0.00 0.00 59.36 58.72 2vja h GLU 463 Cb 1.75 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 31.09 2vja h GLU 463 CO 0.13 1.05 0.04 0.00 -0.73 0.00 0.00 179.01 179.51 2vja h ALA 464 N 0.80 0.81 -0.48 2.92 0.00 -1.40 -1.15 119.26 120.76 2vja h ALA 464 Ca 0.08 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 2vja h ALA 464 Cb 0.83 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2vja h ALA 464 CO 0.07 0.62 0.25 1.25 0.00 0.00 0.00 179.25 181.44 2vja h LEU 465 N 0.94 0.61 -0.34 0.00 5.85 -1.07 -1.80 115.31 119.50 2vja h LEU 465 Ca 0.18 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.81 2vja h LEU 465 Cb 0.50 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2vja h LEU 465 CO 0.02 0.54 0.20 -1.28 -0.34 0.00 0.00 178.44 177.58 2vja h SER 466 N 0.63 0.32 -0.75 1.25 0.87 -0.87 -1.22 113.55 113.78 2vja h SER 466 Ca 0.17 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2vja h SER 466 Cb 0.08 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 61.93 2vja h SER 466 CO -0.02 0.24 0.46 0.03 -0.53 0.00 0.00 176.83 177.00 2vja h ARG 467 N 0.41 1.02 -0.01 2.24 3.08 -0.93 -0.37 114.38 119.83 2vja h ARG 467 Ca 0.13 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 59.93 2vja h ARG 467 Cb -0.00 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 29.81 2vja h ARG 467 CO -0.06 0.72 -0.78 0.07 -1.07 0.00 0.00 179.97 178.85 2vja h ARG 468 N 1.04 0.08 -0.22 0.04 0.11 -0.93 -1.69 114.38 112.82 2vja h ARG 468 Ca 0.27 -0.08 -0.12 0.00 0.10 0.00 0.00 59.98 60.15 2vja h ARG 468 Cb -0.05 0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.05 2vja h ARG 468 CO -0.05 0.81 -0.35 0.82 0.10 0.00 0.00 179.97 181.30 2vja h ILE 469 N 0.05 1.32 -0.65 0.08 2.04 -0.72 -0.32 117.51 119.30 2vja h ILE 469 Ca -0.02 -1.56 -0.02 0.00 1.00 0.00 0.00 64.86 64.26 2vja h ILE 469 Cb 1.36 1.80 -0.03 0.00 -0.74 0.00 0.00 36.82 39.21 2vja h ILE 469 CO 0.11 0.49 0.33 0.24 0.00 0.00 0.00 178.15 179.31 2vja h MET 470 N 0.31 0.93 -0.25 2.37 2.86 -1.07 0.14 114.93 120.22 2vja h MET 470 Ca 0.02 -0.13 -0.09 0.00 -2.06 0.00 0.00 59.70 57.44 2vja h MET 470 Cb 0.94 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.42 2vja h MET 470 CO 0.08 0.73 -0.23 1.25 1.06 0.00 0.00 176.91 179.80 2vja h HIS 471 N 0.90 0.51 -0.10 -0.22 -0.00 -1.22 0.17 115.15 115.19 2vja h HIS 471 Ca 0.23 -0.10 -0.01 0.00 -0.00 0.00 0.00 60.37 60.48 2vja h HIS 471 Cb 0.10 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.41 27.38 2vja h HIS 471 CO 0.00 0.66 0.02 1.88 -0.00 0.00 0.00 177.93 180.49 2vja h TYR 472 N 0.41 0.18 0.08 5.26 0.05 -0.49 0.23 116.97 122.70 2vja h TYR 472 Ca 0.06 -0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 2vja h TYR 472 Cb 0.63 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.32 2vja h TYR 472 CO 0.02 0.37 -0.04 -1.49 -1.05 0.00 0.00 178.16 175.97 2vja h TRP 473 N -0.06 -0.10 0.06 4.88 -0.00 -0.70 -0.62 115.95 119.40 2vja h TRP 473 Ca 0.03 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 58.92 2vja h TRP 473 Cb 0.28 0.03 0.00 0.00 -0.00 0.00 0.00 29.16 29.48 2vja h TRP 473 CO 0.02 -0.02 -0.03 0.00 -0.00 0.00 0.00 178.44 178.41 2vja h ALA 474 N 0.75 -0.08 -1.00 1.49 0.00 -0.68 0.09 119.26 119.83 2vja h ALA 474 Ca -0.01 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.85 2vja h ALA 474 Cb 0.14 0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 2vja h ALA 474 CO 0.02 -0.44 0.65 1.15 0.00 0.00 0.00 179.25 180.62 2vja h THR 475 N -0.28 1.10 -0.46 0.00 2.02 -0.96 0.08 112.91 114.40 2vja h THR 475 Ca -0.01 -0.41 -0.03 0.00 0.77 0.00 0.00 66.41 66.73 2vja h THR 475 Cb 0.25 -0.19 -0.02 0.00 -1.74 0.00 0.00 68.15 66.45 2vja h THR 475 CO 0.01 0.22 0.16 0.15 0.37 0.00 0.00 175.52 176.43 2vja h PHE 476 N 1.18 0.73 -0.63 3.16 3.57 -0.85 -1.22 116.94 122.89 2vja h PHE 476 Ca 0.43 -0.07 0.05 0.00 3.53 0.00 0.00 57.97 61.90 2vja h PHE 476 Cb 0.15 -0.21 -0.05 0.00 2.79 0.00 0.00 35.95 38.62 2vja h PHE 476 CO -0.00 0.65 0.35 0.00 -2.23 0.00 0.00 178.31 177.08 2vja h ALA 477 N 1.01 0.83 -0.17 2.41 0.00 0.50 0.61 119.26 124.44 2vja h ALA 477 Ca 0.15 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.88 2vja h ALA 477 Cb 0.25 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2vja h ALA 477 CO -0.01 0.05 -0.66 0.87 0.00 0.00 0.00 179.25 179.50 2vja h LYS 478 N 0.67 0.64 0.00 0.00 1.57 -0.81 -3.40 116.57 115.24 2vja h LYS 478 Ca 0.27 -0.47 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 2vja h LYS 478 Cb 0.13 0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.52 2vja h LYS 478 CO -0.16 1.09 -0.64 0.25 -0.57 0.00 0.00 179.45 179.42 2vja n THR 479 N -3.93 0.00 -0.43 -0.16 -2.24 -0.48 -5.02 114.28 102.03 2vja n THR 479 Ca -0.05 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2vja n THR 479 Cb 0.67 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 2vja n THR 479 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vja n GLY 480 N 1.84 0.78 3.01 3.38 0.00 0.21 -5.04 105.19 109.38 2vja n GLY 480 Ca 0.00 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 2vja n GLY 480 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vja s ASN 481 N -2.09 0.35 0.44 1.61 3.84 -1.25 -4.92 114.94 112.92 2vja s ASN 481 Ca 0.00 0.59 0.30 0.00 0.21 0.00 0.00 52.86 53.96 2vja s ASN 481 Cb 0.00 0.73 1.49 0.00 -0.55 0.00 0.00 41.25 42.92 2vja s ASN 481 CO 0.00 -0.24 1.92 1.55 -2.79 0.00 0.00 177.10 177.54 2vja h PRO 482 N 8.28 0.00 -6.27 0.43 0.13 -1.82 -3.25 132.00 129.50 2vja h PRO 482 Ca -0.14 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.42 2vja h PRO 482 Cb 1.11 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.20 2vja h PRO 482 CO 0.14 0.00 -0.13 -0.80 -0.23 0.00 0.00 178.00 176.98 2vja s ASN 483 N -4.69 6.76 -0.30 1.44 0.01 -1.26 -4.51 114.94 112.39 2vja s ASN 483 Ca -0.01 0.99 -0.17 0.00 -0.71 0.00 0.00 52.86 52.96 2vja s ASN 483 Cb 0.09 -2.25 -0.02 0.00 0.41 0.00 0.00 41.25 39.48 2vja s ASN 483 CO 0.37 0.11 0.47 -1.61 -1.51 0.00 0.00 177.10 174.92 2vja s GLU 484 N -2.00 3.88 0.88 -0.60 2.02 -1.26 -4.99 118.70 116.63 2vja s GLU 484 Ca 0.37 0.04 -0.16 0.00 0.02 0.00 0.00 54.97 55.25 2vja s GLU 484 Cb -0.14 -3.71 -0.07 0.00 0.10 0.00 0.00 34.13 30.30 2vja s GLU 484 CO 0.19 -0.44 -0.09 -0.35 0.02 0.00 0.00 175.26 174.59 2vja n PRO 485 N 5.54 -0.04 -3.31 0.39 -0.04 -1.26 -2.46 135.00 133.82 2vja n PRO 485 Ca -0.06 0.01 -0.22 0.00 -0.04 0.00 0.00 63.50 63.20 2vja n PRO 485 Cb 0.50 -1.44 -0.05 0.00 -0.04 0.00 0.00 33.50 32.47 2vja n PRO 485 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 2vja n HIS 486 N -2.74 -0.67 -3.09 0.54 1.44 -1.26 -4.90 115.22 104.55 2vja n HIS 486 Ca 0.04 0.37 -0.19 0.00 -2.01 0.00 0.00 57.72 55.94 2vja n HIS 486 Cb 0.53 -1.21 0.03 0.00 0.12 0.00 0.00 29.99 29.46 2vja n HIS 486 CO 0.00 0.00 0.00 -1.54 -2.81 0.00 0.00 176.34 171.99 2vja s SER 487 N -2.75 5.36 -0.16 4.39 1.04 -1.03 -5.07 113.70 115.49 2vja s SER 487 Ca 0.32 -0.64 -0.17 0.00 0.48 0.00 0.00 55.95 55.94 2vja s SER 487 Cb -0.19 -0.23 -0.23 0.00 0.10 0.00 0.00 66.02 65.47 2vja s SER 487 CO 0.57 -1.00 0.37 1.56 0.98 0.00 0.00 173.24 175.72 2vja h GLN 488 N 0.48 0.13 -6.50 4.02 7.50 -1.90 -3.49 115.11 115.35 2vja h GLN 488 Ca -0.36 -0.21 -0.56 0.00 0.50 0.00 0.00 58.65 58.02 2vja h GLN 488 Cb 1.28 0.08 0.20 0.00 0.05 0.00 0.00 27.48 29.09 2vja h GLN 488 CO 0.45 1.10 -0.70 0.39 -1.50 0.00 0.00 178.83 178.57 2vja n GLU 489 N -4.09 0.15 -1.59 1.46 4.71 -1.26 -4.88 120.64 115.14 2vja n GLU 489 Ca -0.29 0.08 -0.40 0.00 -0.01 0.00 0.00 57.16 56.54 2vja n GLU 489 Cb 0.81 -1.62 0.03 0.00 -1.01 0.00 0.00 31.44 29.65 2vja n GLU 489 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 2vja n SER 490 N 0.42 0.83 -4.77 1.62 3.41 -1.26 -4.96 113.62 108.91 2vja n SER 490 Ca 0.08 0.94 -0.36 0.00 -0.26 0.00 0.00 58.87 59.26 2vja n SER 490 Cb 0.51 -1.34 -0.07 0.00 -0.26 0.00 0.00 64.21 63.05 2vja n SER 490 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2vja s LYS 491 N -2.21 4.04 -0.42 4.33 -0.14 -1.26 -5.05 119.74 119.02 2vja s LYS 491 Ca 0.67 0.00 -0.29 0.00 -1.36 0.00 0.00 55.97 55.00 2vja s LYS 491 Cb -0.51 -3.35 0.03 0.00 -1.68 0.00 0.00 37.83 32.31 2vja s LYS 491 CO 0.54 0.41 1.10 -0.46 -0.76 0.00 0.00 175.35 176.18 2vja s TRP 492 N -0.03 2.94 0.56 3.18 -0.11 -1.26 -5.01 118.94 119.20 2vja s TRP 492 Ca 0.15 0.85 -0.17 0.00 1.22 0.00 0.00 56.10 58.15 2vja s TRP 492 Cb -0.13 -4.15 -0.06 0.00 -1.50 0.00 0.00 33.47 27.64 2vja s TRP 492 CO 0.03 -1.09 1.03 -1.25 -4.62 0.00 0.00 176.95 171.06 2vja s PRO 493 N 4.13 3.58 0.41 5.86 0.04 -1.26 -4.87 135.00 142.89 2vja s PRO 493 Ca 0.46 1.14 -0.25 0.00 0.04 0.00 0.00 61.00 62.39 2vja s PRO 493 Cb -0.09 -2.07 -0.08 0.00 0.04 0.00 0.00 34.50 32.29 2vja s PRO 493 CO 0.26 -0.59 1.19 -0.51 0.04 0.00 0.00 177.00 177.39 2vja s LEU 494 N -4.24 4.17 -0.18 -3.56 1.43 -1.26 -4.73 118.68 110.30 2vja s LEU 494 Ca 0.62 2.40 -0.25 0.00 -1.03 0.00 0.00 54.13 55.87 2vja s LEU 494 Cb -0.14 -4.03 -0.01 0.00 0.03 0.00 0.00 46.19 42.03 2vja s LEU 494 CO 0.33 -0.75 0.82 0.12 0.23 0.00 0.00 176.35 177.10 2vja s PHE 495 N -1.40 3.40 0.13 0.29 2.19 0.16 -4.42 117.98 118.33 2vja s PHE 495 Ca 0.58 1.21 0.10 0.00 0.33 0.00 0.00 56.93 59.15 2vja s PHE 495 Cb -0.32 -3.01 -0.04 0.00 -1.31 0.00 0.00 43.02 38.35 2vja s PHE 495 CO 0.40 -0.26 -0.20 0.95 1.83 0.00 0.00 175.22 177.93 2vja s THR 496 N 2.26 2.68 0.55 0.12 -4.23 -1.26 -4.45 115.64 111.31 2vja s THR 496 Ca 0.37 -1.62 0.26 0.00 -1.18 0.00 0.00 61.69 59.51 2vja s THR 496 Cb -0.16 -2.23 0.37 0.00 1.34 0.00 0.00 72.50 71.82 2vja s THR 496 CO 0.11 0.07 2.04 0.00 -0.54 0.00 0.00 174.62 176.30 2vja h THR 497 N 3.56 0.65 0.00 3.99 1.03 -1.95 0.53 112.91 120.71 2vja h THR 497 Ca -0.50 0.00 -0.13 0.00 -0.01 0.00 0.00 66.41 65.77 2vja h THR 497 Cb 1.17 0.80 -0.02 0.00 -1.07 0.00 0.00 68.15 69.03 2vja h THR 497 CO 0.45 0.00 -0.71 0.50 -0.01 0.00 0.00 175.52 175.74 2vja h LYS 498 N 0.00 0.00 0.00 0.00 3.64 -2.01 -3.40 116.57 114.80 2vja h LYS 498 Ca 0.16 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2vja h LYS 498 Cb 0.71 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 2vja h LYS 498 CO -0.00 1.00 -1.33 0.39 -2.27 0.00 0.00 179.45 177.24 2vja n GLU 499 N -4.50 0.51 -4.15 1.90 1.02 -1.16 -5.00 120.64 109.25 2vja n GLU 499 Ca -0.22 -0.02 -0.38 0.00 -0.02 0.00 0.00 57.16 56.51 2vja n GLU 499 Cb 0.60 -1.65 -0.03 0.00 -0.02 0.00 0.00 31.44 30.34 2vja n GLU 499 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2vja n GLN 500 N -2.29 -0.79 -2.61 3.49 6.02 0.18 -4.43 117.38 116.94 2vja n GLN 500 Ca -0.01 0.12 -0.32 0.00 -0.01 0.00 0.00 57.00 56.78 2vja n GLN 500 Cb 0.52 -3.17 -0.05 0.00 1.02 0.00 0.00 30.24 28.55 2vja n GLN 500 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2vja s LYS 501 N -7.30 4.04 0.09 -1.09 1.02 -1.26 -2.07 119.74 113.18 2vja s LYS 501 Ca 0.25 0.97 -0.21 0.00 0.02 0.00 0.00 55.97 57.00 2vja s LYS 501 Cb -0.14 -2.18 0.05 0.00 -0.52 0.00 0.00 37.83 35.05 2vja s LYS 501 CO 0.97 -0.15 0.52 -0.59 -0.92 0.00 0.00 175.35 175.18 2vja s PHE 502 N -2.42 -0.41 0.21 3.18 -0.12 -1.02 -4.25 117.98 113.14 2vja s PHE 502 Ca 0.59 0.32 0.10 0.00 -0.05 0.00 0.00 56.93 57.90 2vja s PHE 502 Cb -0.10 0.38 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 2vja s PHE 502 CO 0.24 -0.71 -0.14 0.96 -0.05 0.00 0.00 175.22 175.52 2vja s ILE 503 N -3.07 2.88 0.46 -4.49 -4.36 -1.11 -0.51 121.20 111.00 2vja s ILE 503 Ca -0.02 -1.91 -0.11 0.00 -0.26 0.00 0.00 60.65 58.35 2vja s ILE 503 Cb -0.00 -2.44 -0.06 0.00 1.25 0.00 0.00 42.46 41.21 2vja s ILE 503 CO -0.07 -0.19 0.85 -1.81 0.24 0.00 0.00 174.94 173.97 2vja s ASP 504 N -2.98 6.48 -0.34 4.36 1.01 -1.15 -1.51 116.67 122.55 2vja s ASP 504 Ca 0.25 1.24 0.02 0.00 0.71 0.00 0.00 52.55 54.78 2vja s ASP 504 Cb -0.08 -2.37 0.10 0.00 1.01 0.00 0.00 42.92 41.58 2vja s ASP 504 CO 0.14 -0.52 0.08 -0.22 0.21 0.00 0.00 175.17 174.86 2vja s LEU 505 N -4.15 3.80 0.00 1.23 2.96 -0.20 -4.68 118.68 117.65 2vja s LEU 505 Ca 0.53 -2.02 0.00 0.00 -0.22 0.00 0.00 54.13 52.42 2vja s LEU 505 Cb -0.10 -1.34 0.00 0.00 0.50 0.00 0.00 46.19 45.24 2vja s LEU 505 CO 0.35 -0.38 0.00 -0.46 -1.32 0.00 0.00 176.35 174.54 2vja n ASN 506 N 4.40 0.00 -0.02 3.68 0.23 -1.26 -3.16 115.26 119.13 2vja n ASN 506 Ca 0.02 -0.94 0.15 0.00 -0.53 0.00 0.00 54.58 53.28 2vja n ASN 506 Cb 0.41 0.00 0.74 0.00 -2.08 0.00 0.00 39.78 38.86 2vja n ASN 506 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2vja n THR 507 N 0.00 0.00 -2.66 5.53 -2.24 -1.26 -4.86 114.28 108.79 2vja n THR 507 Ca 0.00 -0.01 -0.23 0.00 -2.27 0.00 0.00 64.05 61.54 2vja n THR 507 Cb 0.00 -0.42 0.03 0.00 -2.10 0.00 0.00 70.33 67.84 2vja n THR 507 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2vja s GLU 508 N -2.51 2.67 0.77 -0.78 2.02 -1.26 -5.04 118.70 114.57 2vja s GLU 508 Ca 0.30 -0.57 -0.15 0.00 0.02 0.00 0.00 54.97 54.57 2vja s GLU 508 Cb 0.20 -2.45 0.04 0.00 0.10 0.00 0.00 34.13 32.02 2vja s GLU 508 CO 0.46 -0.66 1.03 -2.30 0.02 0.00 0.00 175.26 173.81 2vja n PRO 509 N -2.36 0.36 -1.73 0.39 -0.02 -1.26 -4.90 135.00 125.48 2vja n PRO 509 Ca 0.06 0.19 -0.38 0.00 -2.02 0.00 0.00 63.50 61.34 2vja n PRO 509 Cb 0.59 -2.29 0.05 0.00 -0.02 0.00 0.00 33.50 31.83 2vja n PRO 509 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 2vja n MET 510 N -2.39 1.53 -4.15 -0.52 1.56 -1.26 -5.01 117.12 106.89 2vja n MET 510 Ca 0.13 0.57 -0.18 0.00 -0.27 0.00 0.00 57.70 57.95 2vja n MET 510 Cb 0.50 -2.54 -0.15 0.00 2.15 0.00 0.00 33.22 33.18 2vja n MET 510 CO 0.00 0.00 0.00 0.15 -0.73 0.00 0.00 175.97 175.39 2vja s LYS 511 N -2.97 0.57 -0.17 2.12 1.02 -1.26 -5.06 119.74 113.99 2vja s LYS 511 Ca 0.74 -0.13 -0.07 0.00 0.02 0.00 0.00 55.97 56.53 2vja s LYS 511 Cb -0.41 -0.59 -0.04 0.00 -0.52 0.00 0.00 37.83 36.27 2vja s LYS 511 CO 0.47 0.02 0.07 0.08 -0.92 0.00 0.00 175.35 175.07 2vja s VAL 512 N 0.38 4.85 0.32 3.17 1.01 -1.26 -2.91 120.40 125.96 2vja s VAL 512 Ca -0.04 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 61.92 2vja s VAL 512 Cb -0.08 -3.17 -0.00 0.00 0.00 0.00 0.00 36.38 33.13 2vja s VAL 512 CO -0.00 0.48 0.02 1.41 0.00 0.00 0.00 175.10 177.01 2vja n HIS 513 N 3.33 0.63 -3.77 5.22 8.25 0.33 -4.98 115.22 124.24 2vja n HIS 513 Ca -0.17 -1.66 -0.13 0.00 -0.26 0.00 0.00 57.72 55.50 2vja n HIS 513 Cb 0.52 -0.18 -0.10 0.00 1.12 0.00 0.00 29.99 31.35 2vja n HIS 513 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2vja s GLN 514 N -3.17 0.43 -1.04 -0.41 -0.21 -1.26 -2.43 119.66 111.56 2vja s GLN 514 Ca 0.03 0.30 -0.06 0.00 0.02 0.00 0.00 55.36 55.65 2vja s GLN 514 Cb 0.00 0.20 -0.06 0.00 1.00 0.00 0.00 33.01 34.15 2vja s GLN 514 CO 0.02 -0.07 0.91 0.54 -2.12 0.00 0.00 175.29 174.57 2vja n ARG 515 N 2.56 -2.49 -1.48 2.91 1.74 -0.88 -4.83 116.66 114.20 2vja n ARG 515 Ca -0.15 0.86 -0.57 0.00 -0.77 0.00 0.00 57.85 57.22 2vja n ARG 515 Cb 0.57 -5.78 -0.09 0.00 -1.02 0.00 0.00 32.46 26.15 2vja n ARG 515 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2vja n LEU 516 N -3.26 1.67 -4.30 0.55 7.94 -1.26 -1.90 117.00 116.43 2vja n LEU 516 Ca -0.08 0.74 -0.33 0.00 -1.11 0.00 0.00 56.01 55.22 2vja n LEU 516 Cb 0.62 -1.08 -0.08 0.00 0.53 0.00 0.00 43.42 43.41 2vja n LEU 516 CO 0.58 -0.68 -0.34 0.54 -1.11 0.00 0.00 177.39 176.39 2vja n ARG 517 N 6.87 -1.45 -0.28 1.96 1.74 -1.26 -4.87 116.66 119.37 2vja n ARG 517 Ca 0.41 0.17 -0.01 0.00 -0.77 0.00 0.00 57.85 57.65 2vja n ARG 517 Cb 0.09 -4.10 0.11 0.00 -1.02 0.00 0.00 32.46 27.54 2vja n ARG 517 CO 0.00 0.00 0.00 -0.39 -1.52 0.00 0.00 177.63 175.72 2vja h VAL 518 N -1.58 1.08 0.34 1.55 -1.51 -1.75 -1.68 116.25 112.70 2vja h VAL 518 Ca -0.64 -0.32 -0.01 0.00 -1.23 0.00 0.00 66.70 64.50 2vja h VAL 518 Cb 1.39 0.06 -0.03 0.00 -2.13 0.00 0.00 31.29 30.58 2vja h VAL 518 CO 0.74 0.17 -0.45 -0.61 -1.23 0.00 0.00 177.57 176.19 2vja h GLN 519 N 0.94 -0.79 -0.47 5.19 5.75 -1.89 0.30 115.11 124.14 2vja h GLN 519 Ca 0.33 0.05 -0.02 0.00 -0.15 0.00 0.00 58.65 58.86 2vja h GLN 519 Cb 0.07 0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.78 2vja h GLN 519 CO -0.13 -0.53 0.23 0.52 -2.65 0.00 0.00 178.83 176.27 2vja h MET 520 N -0.82 0.68 0.00 1.69 2.86 -1.95 -2.71 114.93 114.68 2vja h MET 520 Ca -0.04 -0.10 -0.03 0.00 -2.06 0.00 0.00 59.70 57.47 2vja h MET 520 Cb 0.74 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.27 2vja h MET 520 CO -0.12 0.58 -0.15 0.00 1.06 0.00 0.00 176.91 178.28 2vja h VAL 522 N 0.00 1.26 -0.02 0.00 2.07 -0.08 0.22 116.25 119.70 2vja h VAL 522 Ca -0.00 -1.16 -0.00 0.00 0.82 0.00 0.00 66.70 66.36 2vja h VAL 522 Cb 0.31 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 2vja h VAL 522 CO 0.02 0.41 0.01 0.15 0.02 0.00 0.00 177.57 178.18 2vja h PHE 523 N 0.87 0.02 -0.24 1.57 3.57 -0.69 0.79 116.94 122.84 2vja h PHE 523 Ca 0.15 -0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.47 2vja h PHE 523 Cb 0.57 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 2vja h PHE 523 CO 0.04 0.09 -0.57 -1.49 -2.23 0.00 0.00 178.31 174.15 2vja h TRP 524 N -0.06 0.93 0.00 0.41 4.06 -0.95 0.83 115.95 121.18 2vja h TRP 524 Ca 0.01 -0.34 -0.15 0.00 2.06 0.00 0.00 58.89 60.46 2vja h TRP 524 Cb 0.08 -0.17 -0.03 0.00 -1.00 0.00 0.00 29.16 28.04 2vja h TRP 524 CO -0.05 1.13 -1.25 -0.91 -3.56 0.00 0.00 178.44 173.80 2vja h ASN 525 N 0.56 0.00 0.00 -3.49 2.35 -0.58 -3.39 115.58 111.03 2vja h ASN 525 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2vja h ASN 525 Cb 1.16 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.53 2vja h ASN 525 CO 0.12 0.56 -0.29 0.00 -1.65 0.00 0.00 177.43 176.17 2vja n GLN 526 N -2.94 0.15 0.16 0.81 6.02 0.24 -4.78 117.38 117.04 2vja n GLN 526 Ca -0.07 0.06 -0.13 0.00 -0.01 0.00 0.00 57.00 56.84 2vja n GLN 526 Cb 0.82 -0.73 -0.08 0.00 1.02 0.00 0.00 30.24 31.27 2vja n GLN 526 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2vja h PHE 527 N -0.29 -0.38 -0.31 1.08 3.57 -1.41 -3.16 116.94 116.04 2vja h PHE 527 Ca 0.00 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.54 2vja h PHE 527 Cb 0.29 0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.11 2vja h PHE 527 CO -0.12 -0.06 0.02 1.25 -2.23 0.00 0.00 178.31 177.16 2vja h LEU 528 N -0.72 -0.09 -0.78 0.59 5.85 -1.07 -1.62 115.31 117.48 2vja h LEU 528 Ca -0.04 0.06 0.09 0.00 0.84 0.00 0.00 57.88 58.84 2vja h LEU 528 Cb 0.49 0.11 -0.07 0.00 0.37 0.00 0.00 40.66 41.56 2vja h LEU 528 CO 0.07 -0.01 0.43 -0.65 -0.34 0.00 0.00 178.44 177.94 2vja h PRO 529 N 0.11 0.70 -0.82 5.25 0.11 -1.76 -0.59 132.00 134.99 2vja h PRO 529 Ca 0.15 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.19 2vja h PRO 529 Cb 0.19 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.10 2vja h PRO 529 CO -0.23 0.46 0.43 0.87 -0.21 0.00 0.00 178.00 179.32 2vja h LYS 530 N 0.72 1.16 -0.34 1.05 1.57 -1.38 -0.75 116.57 118.60 2vja h LYS 530 Ca 0.38 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.96 2vja h LYS 530 Cb 0.36 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 2vja h LYS 530 CO -0.25 0.87 0.03 1.25 -0.57 0.00 0.00 179.45 180.77 2vja h LEU 531 N 1.16 0.57 -1.20 2.94 6.46 -0.30 -2.85 115.31 122.08 2vja h LEU 531 Ca 0.29 -0.28 -0.05 0.00 -0.12 0.00 0.00 57.88 57.71 2vja h LEU 531 Cb 0.06 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 39.83 2vja h LEU 531 CO -0.04 0.71 -0.25 -0.07 -0.62 0.00 0.00 178.44 178.17 2vja h LEU 532 N 0.41 0.00 0.00 2.25 3.38 -0.91 -2.74 115.31 117.70 2vja h LEU 532 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2vja h LEU 532 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2vja h LEU 532 CO 0.01 0.25 0.00 -3.20 0.09 0.00 0.00 178.44 175.60 2vja n ASN 533 N -3.50 0.00 -4.77 -0.43 5.15 -0.31 -4.83 115.26 106.58 2vja n ASN 533 Ca -0.00 0.44 -0.25 0.00 -0.60 0.00 0.00 54.58 54.17 2vja n ASN 533 Cb 0.42 -0.48 0.09 0.00 -0.53 0.00 0.00 39.78 39.28 2vja n ASN 533 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vja s ALA 534 N -2.96 3.27 0.00 5.20 0.00 -1.03 -5.08 121.76 121.16 2vja s ALA 534 Ca 0.14 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.90 2vja s ALA 534 Cb 0.18 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.89 2vja s ALA 534 CO 0.49 -1.40 0.00 -2.37 0.00 0.00 0.00 175.76 172.47