#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vvj s HIS 0 N 0.00 1.15 -0.09 4.41 0.00 -1.26 -5.13 115.29 114.37 2vvj s HIS 0 Ca 0.00 -1.32 -0.30 0.00 -3.00 0.00 0.00 55.06 50.44 2vvj s HIS 0 Cb 0.00 -0.33 -0.03 0.00 -4.00 0.00 0.00 32.58 28.22 2vvj s HIS 0 CO 0.00 -0.91 1.29 -1.64 -1.00 0.00 0.00 174.74 172.48 2vvj s MET 1 N -3.62 4.29 0.42 -0.38 1.00 -1.26 -4.93 119.30 114.81 2vvj s MET 1 Ca 0.34 1.75 0.23 0.00 0.00 0.00 0.00 55.69 58.01 2vvj s MET 1 Cb 0.02 -3.66 0.45 0.00 0.00 0.00 0.00 34.83 31.64 2vvj s MET 1 CO 0.18 -0.59 1.64 0.66 0.00 0.00 0.00 175.02 176.91 2vvj h SER 2 N 7.92 0.00 -0.26 3.03 4.64 -1.86 -3.42 113.55 123.61 2vvj h SER 2 Ca -0.32 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.89 2vvj h SER 2 Cb 1.14 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 2vvj h SER 2 CO 0.92 0.13 -0.10 0.00 -0.87 0.00 0.00 176.83 176.91 2vvj n ALA 3 N -2.14 -0.08 -2.61 5.18 0.00 -1.26 -3.05 120.51 116.54 2vvj n ALA 3 Ca 0.03 0.09 -0.42 0.00 0.00 0.00 0.00 53.44 53.14 2vvj n ALA 3 Cb 0.54 -1.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.74 2vvj n ALA 3 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2vvj s ILE 4 N -1.80 4.80 0.55 0.00 1.01 -1.26 -4.97 121.20 119.53 2vvj s ILE 4 Ca 0.00 1.20 -0.13 0.00 0.00 0.00 0.00 60.65 61.72 2vvj s ILE 4 Cb 0.00 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 38.27 2vvj s ILE 4 CO 0.00 -0.24 0.98 -0.54 0.00 0.00 0.00 174.94 175.14 2vvj s LYS 5 N 2.95 3.75 0.55 2.79 1.02 -1.26 -4.98 119.74 124.56 2vvj s LYS 5 Ca 0.32 0.78 0.27 0.00 0.02 0.00 0.00 55.97 57.37 2vvj s LYS 5 Cb -0.14 -2.14 1.58 0.00 -0.52 0.00 0.00 37.83 36.61 2vvj s LYS 5 CO 0.12 -0.39 2.15 -1.35 -0.92 0.00 0.00 175.35 174.96 2vvj h PRO 6 N 0.32 0.00 -4.66 -1.68 0.11 -1.97 -3.40 132.00 120.73 2vvj h PRO 6 Ca -0.46 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.03 2vvj h PRO 6 Cb 1.19 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 31.93 2vvj h PRO 6 CO 0.62 0.07 -0.82 -0.51 -0.21 0.00 0.00 178.00 177.15 2vvj s ASP 7 N -6.25 3.23 0.11 -2.05 1.01 -1.26 -4.06 116.67 107.40 2vvj s ASP 7 Ca -0.04 -0.78 0.10 0.00 0.71 0.00 0.00 52.55 52.53 2vvj s ASP 7 Cb 0.14 -1.26 -0.04 0.00 1.01 0.00 0.00 42.92 42.78 2vvj s ASP 7 CO 0.58 -0.11 -0.24 -0.04 0.21 0.00 0.00 175.17 175.57 2vvj s MET 8 N 1.40 1.29 0.30 8.23 -1.94 -0.32 -4.99 119.30 123.27 2vvj s MET 8 Ca 0.01 -1.24 -0.04 0.00 -1.71 0.00 0.00 55.69 52.71 2vvj s MET 8 Cb -0.15 -1.66 -0.05 0.00 2.01 0.00 0.00 34.83 34.98 2vvj s MET 8 CO -0.09 0.39 0.54 0.15 -0.01 0.00 0.00 175.02 176.01 2vvj s LYS 9 N -1.92 3.60 -0.09 2.03 1.02 0.92 -0.55 119.74 124.75 2vvj s LYS 9 Ca 0.10 -0.07 -0.00 0.00 0.02 0.00 0.00 55.97 56.02 2vvj s LYS 9 Cb -0.10 -2.66 0.02 0.00 -0.52 0.00 0.00 37.83 34.58 2vvj s LYS 9 CO 0.05 0.21 -0.05 0.42 -0.92 0.00 0.00 175.35 175.05 2vvj s ILE 10 N -2.12 0.78 -0.05 2.17 1.01 0.15 -1.21 121.20 121.93 2vvj s ILE 10 Ca 0.43 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.94 2vvj s ILE 10 Cb -0.11 -0.83 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 2vvj s ILE 10 CO 0.31 0.32 -0.08 0.21 0.00 0.00 0.00 174.94 175.70 2vvj s ASN 11 N 1.59 4.56 -0.15 3.58 3.84 0.31 -0.83 114.94 127.83 2vvj s ASN 11 Ca 0.01 -0.07 -0.13 0.00 0.21 0.00 0.00 52.86 52.88 2vvj s ASN 11 Cb -0.13 -1.10 0.04 0.00 -0.55 0.00 0.00 41.25 39.51 2vvj s ASN 11 CO -0.05 0.34 0.40 -0.22 -2.79 0.00 0.00 177.10 174.78 2vvj s LEU 12 N -0.92 0.40 -0.09 3.21 0.20 -0.41 -1.26 118.68 119.81 2vvj s LEU 12 Ca 0.13 0.82 0.01 0.00 0.69 0.00 0.00 54.13 55.77 2vvj s LEU 12 Cb -0.11 1.37 0.02 0.00 -0.43 0.00 0.00 46.19 47.04 2vvj s LEU 12 CO 0.02 -0.15 -0.08 -0.60 -0.29 0.00 0.00 176.35 175.26 2vvj s ARG 13 N 0.35 1.41 -0.14 1.98 3.52 -0.67 0.22 118.95 125.62 2vvj s ARG 13 Ca -0.01 -0.25 -0.02 0.00 -0.13 0.00 0.00 55.73 55.31 2vvj s ARG 13 Cb -0.03 -1.38 -0.02 0.00 -1.56 0.00 0.00 34.95 31.95 2vvj s ARG 13 CO -0.01 -0.15 -0.08 1.41 -0.81 0.00 0.00 175.30 175.66 2vvj s MET 14 N 1.30 3.54 -0.04 5.12 -2.45 0.14 -1.06 119.30 125.84 2vvj s MET 14 Ca -0.03 -0.59 0.07 0.00 -1.25 0.00 0.00 55.69 53.89 2vvj s MET 14 Cb -0.14 -2.79 -0.02 0.00 1.25 0.00 0.00 34.83 33.13 2vvj s MET 14 CO -0.03 0.24 -0.24 -1.21 1.05 0.00 0.00 175.02 174.83 2vvj s GLU 15 N 0.32 2.33 0.32 4.11 2.02 -0.56 0.06 118.70 127.30 2vvj s GLU 15 Ca -0.06 -0.89 -0.18 0.00 0.02 0.00 0.00 54.97 53.85 2vvj s GLU 15 Cb -0.15 -2.13 0.06 0.00 0.10 0.00 0.00 34.13 32.02 2vvj s GLU 15 CO 0.04 0.50 0.88 0.20 0.02 0.00 0.00 175.26 176.90 2vvj s GLY 16 N -0.45 0.30 -0.15 -1.39 0.00 -0.38 -2.10 107.32 103.15 2vvj s GLY 16 Ca 0.05 -0.63 -0.05 0.00 0.00 0.00 0.00 44.72 44.09 2vvj s GLY 16 CO 0.01 0.74 0.29 0.21 0.00 0.00 0.00 173.10 174.35 2vvj s ASN 17 N -3.21 0.32 -0.13 1.64 3.84 -0.28 -1.04 114.94 116.07 2vvj s ASN 17 Ca 0.18 0.59 0.03 0.00 0.21 0.00 0.00 52.86 53.87 2vvj s ASN 17 Cb -0.04 0.80 0.01 0.00 -0.55 0.00 0.00 41.25 41.46 2vvj s ASN 17 CO 0.09 -0.25 -0.22 -0.69 -2.79 0.00 0.00 177.10 173.25 2vvj s VAL 18 N 2.45 2.06 -1.45 -5.21 1.01 -0.63 -1.10 120.40 117.53 2vvj s VAL 18 Ca 0.02 -0.98 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 2vvj s VAL 18 Cb -0.12 -1.82 0.09 0.00 0.00 0.00 0.00 36.38 34.53 2vvj s VAL 18 CO -0.10 0.55 0.68 0.59 0.00 0.00 0.00 175.10 176.83 2vvj n ASN 19 N 4.00 -4.00 0.00 3.32 4.13 -0.47 -0.97 115.26 121.27 2vvj n ASN 19 Ca -0.20 -0.62 0.00 0.00 1.68 0.00 0.00 54.58 55.44 2vvj n ASN 19 Cb 0.52 -3.26 0.00 0.00 -1.54 0.00 0.00 39.78 35.49 2vvj n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2vvj n GLY 20 N -1.36 1.34 3.53 7.41 0.00 -1.26 -5.03 105.19 109.82 2vvj n GLY 20 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2vvj n GLY 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2vvj s HIS 21 N -2.70 3.20 0.30 1.61 5.04 -0.14 -5.06 115.29 117.54 2vvj s HIS 21 Ca 0.00 -0.10 -0.26 0.00 -1.54 0.00 0.00 55.06 53.16 2vvj s HIS 21 Cb 0.00 -2.70 -0.10 0.00 0.04 0.00 0.00 32.58 29.82 2vvj s HIS 21 CO 0.00 -0.48 0.92 -1.58 -2.34 0.00 0.00 174.74 171.26 2vvj s HIS 22 N 2.02 3.72 -0.00 3.88 2.46 -1.26 -1.61 115.29 124.50 2vvj s HIS 22 Ca 0.11 1.76 -0.14 0.00 0.47 0.00 0.00 55.06 57.27 2vvj s HIS 22 Cb -0.17 -2.90 0.02 0.00 -0.13 0.00 0.00 32.58 29.40 2vvj s HIS 22 CO 0.12 0.25 0.29 -0.59 -2.47 0.00 0.00 174.74 172.34 2vvj s PHE 23 N -1.56 -0.14 -0.08 3.88 -0.12 -0.21 -4.12 117.98 115.63 2vvj s PHE 23 Ca 0.48 0.17 0.02 0.00 -0.05 0.00 0.00 56.93 57.55 2vvj s PHE 23 Cb -0.19 0.08 0.01 0.00 -0.63 0.00 0.00 43.02 42.29 2vvj s PHE 23 CO 0.24 -0.40 -0.15 0.08 -0.05 0.00 0.00 175.22 174.94 2vvj s VAL 24 N -1.55 1.40 -0.09 -2.49 1.01 -0.76 -1.25 120.40 116.66 2vvj s VAL 24 Ca -0.12 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.25 2vvj s VAL 24 Cb -0.05 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 35.09 2vvj s VAL 24 CO 0.03 0.42 -0.11 -0.63 0.00 0.00 0.00 175.10 174.80 2vvj s ILE 25 N 0.68 1.16 0.10 2.22 1.01 0.11 -0.01 121.20 126.47 2vvj s ILE 25 Ca -0.14 -0.43 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 2vvj s ILE 25 Cb -0.16 -1.11 -0.05 0.00 0.01 0.00 0.00 42.46 41.16 2vvj s ILE 25 CO 0.04 0.38 0.28 -1.81 0.00 0.00 0.00 174.94 173.82 2vvj s ASP 26 N 1.16 6.40 -0.01 3.58 1.01 -0.33 0.24 116.67 128.72 2vvj s ASP 26 Ca -0.05 0.38 -0.01 0.00 0.71 0.00 0.00 52.55 53.58 2vvj s ASP 26 Cb -0.14 -2.00 -0.00 0.00 1.01 0.00 0.00 42.92 41.78 2vvj s ASP 26 CO -0.03 0.11 0.03 -0.83 0.21 0.00 0.00 175.17 174.67 2vvj s GLY 27 N -2.56 0.02 -0.09 0.21 0.00 0.13 -1.16 107.32 103.88 2vvj s GLY 27 Ca 0.37 -0.02 -0.04 0.00 0.00 0.00 0.00 44.72 45.04 2vvj s GLY 27 CO 0.27 -0.05 0.18 -0.35 0.00 0.00 0.00 173.10 173.15 2vvj s ASP 28 N -0.30 0.42 0.04 1.64 2.15 -0.81 -1.29 116.67 118.53 2vvj s ASP 28 Ca -0.03 0.39 -0.01 0.00 0.43 0.00 0.00 52.55 53.32 2vvj s ASP 28 Cb -0.02 0.35 0.00 0.00 -0.30 0.00 0.00 42.92 42.95 2vvj s ASP 28 CO -0.00 -0.22 0.08 0.61 -0.17 0.00 0.00 175.17 175.47 2vvj n GLY 29 N 5.02 2.24 3.07 2.66 0.00 -0.01 -0.72 105.19 117.45 2vvj n GLY 29 Ca -0.11 -1.15 -0.08 0.00 0.00 0.00 0.00 46.02 44.68 2vvj n GLY 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vvj s THR 30 N -2.77 0.21 0.27 2.61 -4.23 -0.55 0.34 115.64 111.52 2vvj s THR 30 Ca 0.02 -1.61 -0.18 0.00 -1.18 0.00 0.00 61.69 58.74 2vvj s THR 30 Cb -0.00 -1.24 0.01 0.00 1.34 0.00 0.00 72.50 72.61 2vvj s THR 30 CO 0.02 -0.88 0.64 -0.83 -0.54 0.00 0.00 174.62 173.03 2vvj s GLY 31 N -2.59 0.12 -0.47 3.99 0.00 0.28 -1.22 107.32 107.44 2vvj s GLY 31 Ca 0.02 -0.50 0.03 0.00 0.00 0.00 0.00 44.72 44.27 2vvj s GLY 31 CO -0.08 -0.27 0.24 0.54 0.00 0.00 0.00 173.10 173.53 2vvj s LYS 32 N -3.93 1.64 0.29 2.90 1.02 0.13 -1.17 119.74 120.62 2vvj s LYS 32 Ca 0.15 -2.30 0.03 0.00 0.02 0.00 0.00 55.97 53.87 2vvj s LYS 32 Cb -0.04 -2.88 0.64 0.00 -0.52 0.00 0.00 37.83 35.03 2vvj s LYS 32 CO 0.08 -1.12 1.78 -1.35 -0.92 0.00 0.00 175.35 173.81 2vvj h PRO 33 N 6.68 0.71 0.00 -1.68 0.11 -1.78 0.66 132.00 136.71 2vvj h PRO 33 Ca -0.05 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.02 2vvj h PRO 33 Cb 0.91 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.86 2vvj h PRO 33 CO 0.59 0.47 0.00 0.74 -0.21 0.00 0.00 178.00 179.59 2vvj h PHE 34 N 0.73 0.00 0.00 0.65 -1.00 -1.84 -2.89 116.94 112.60 2vvj h PHE 34 Ca 0.53 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.31 2vvj h PHE 34 Cb 0.77 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.33 2vvj h PHE 34 CO -0.04 0.00 -0.85 0.39 -1.61 0.00 0.00 178.31 176.20 2vvj n GLU 35 N -2.85 0.05 -2.89 1.51 1.02 -0.42 -4.55 120.64 112.52 2vvj n GLU 35 Ca 0.04 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.07 2vvj n GLU 35 Cb 0.48 -1.51 0.03 0.00 -0.02 0.00 0.00 31.44 30.42 2vvj n GLU 35 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vvj n GLY 36 N 1.48 0.21 3.04 0.62 0.00 0.09 -4.51 105.19 106.12 2vvj n GLY 36 Ca 0.04 -0.28 -0.19 0.00 0.00 0.00 0.00 46.02 45.59 2vvj n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vvj s LYS 37 N -5.44 0.77 0.00 1.61 1.02 -1.07 -0.99 119.74 115.64 2vvj s LYS 37 Ca 0.23 -0.38 -0.17 0.00 0.02 0.00 0.00 55.97 55.67 2vvj s LYS 37 Cb -0.10 -0.74 0.03 0.00 -0.52 0.00 0.00 37.83 36.50 2vvj s LYS 37 CO 0.29 0.20 0.38 1.14 -0.92 0.00 0.00 175.35 176.44 2vvj s GLN 38 N -0.32 0.79 0.03 1.68 -2.07 -0.87 0.19 119.66 119.09 2vvj s GLN 38 Ca 0.03 -0.21 -0.00 0.00 -1.82 0.00 0.00 55.36 53.36 2vvj s GLN 38 Cb -0.04 0.35 -0.03 0.00 -1.09 0.00 0.00 33.01 32.21 2vvj s GLN 38 CO -0.00 -0.24 -0.03 -1.54 -1.32 0.00 0.00 175.29 172.15 2vvj s SER 39 N -1.55 0.36 -0.13 12.60 1.04 -0.36 -1.32 113.70 124.35 2vvj s SER 39 Ca -0.10 -0.65 -0.12 0.00 0.48 0.00 0.00 55.95 55.56 2vvj s SER 39 Cb -0.03 0.12 0.03 0.00 0.10 0.00 0.00 66.02 66.25 2vvj s SER 39 CO 0.03 -0.38 0.34 -0.32 0.98 0.00 0.00 173.24 173.89 2vvj s MET 40 N -2.20 0.40 -0.30 4.02 0.00 -0.24 -1.49 119.30 119.49 2vvj s MET 40 Ca -0.09 0.48 -0.16 0.00 0.00 0.00 0.00 55.69 55.93 2vvj s MET 40 Cb -0.05 0.19 -0.03 0.00 0.00 0.00 0.00 34.83 34.95 2vvj s MET 40 CO -0.04 -0.05 0.40 -0.51 0.00 0.00 0.00 175.02 174.83 2vvj s ASP 41 N 0.21 6.26 -0.11 1.11 1.01 0.11 -0.90 116.67 124.36 2vvj s ASP 41 Ca -0.00 0.14 -0.03 0.00 0.71 0.00 0.00 52.55 53.38 2vvj s ASP 41 Cb -0.03 -2.22 -0.03 0.00 1.01 0.00 0.00 42.92 41.65 2vvj s ASP 41 CO 0.00 -0.27 -0.00 -0.76 0.21 0.00 0.00 175.17 174.35 2vvj s LEU 42 N 2.13 3.53 -0.08 1.23 1.43 0.97 -1.92 118.68 125.98 2vvj s LEU 42 Ca 0.15 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 2vvj s LEU 42 Cb -0.16 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.26 2vvj s LEU 42 CO 0.11 0.32 -0.07 -0.70 0.23 0.00 0.00 176.35 176.24 2vvj s GLU 43 N -0.54 1.28 -0.33 1.70 2.12 -0.31 -1.40 118.70 121.22 2vvj s GLU 43 Ca 0.09 -0.21 -0.29 0.00 0.36 0.00 0.00 54.97 54.93 2vvj s GLU 43 Cb -0.12 -1.29 0.00 0.00 0.26 0.00 0.00 34.13 32.98 2vvj s GLU 43 CO 0.02 -0.16 1.36 0.08 -0.54 0.00 0.00 175.26 176.02 2vvj s VAL 44 N 1.32 4.03 -0.10 3.70 1.01 0.32 -1.19 120.40 129.51 2vvj s VAL 44 Ca -0.03 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.11 2vvj s VAL 44 Cb -0.14 -4.13 -0.24 0.00 0.00 0.00 0.00 36.38 31.86 2vvj s VAL 44 CO -0.03 -0.55 0.46 0.29 0.00 0.00 0.00 175.10 175.27 2vvj n LYS 45 N 7.57 0.70 -4.08 2.72 4.76 0.98 -4.82 118.16 125.98 2vvj n LYS 45 Ca 0.16 0.26 -0.14 0.00 -2.87 0.00 0.00 58.31 55.72 2vvj n LYS 45 Cb 0.47 -1.73 -0.12 0.00 -1.84 0.00 0.00 35.03 31.81 2vvj n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2vvj s GLU 46 N -2.57 0.48 0.00 1.97 2.02 -0.97 -4.86 118.70 114.77 2vvj s GLU 46 Ca -0.15 -0.58 0.00 0.00 0.02 0.00 0.00 54.97 54.26 2vvj s GLU 46 Cb 0.07 -0.30 0.00 0.00 0.10 0.00 0.00 34.13 34.00 2vvj s GLU 46 CO 0.79 0.06 0.00 0.41 0.02 0.00 0.00 175.26 176.54 2vvj n GLY 47 N 1.90 0.59 3.81 -1.39 0.00 -1.26 -1.84 105.19 107.01 2vvj n GLY 47 Ca -0.20 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 2vvj n GLY 47 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vvj s GLY 48 N -1.99 2.55 0.31 -0.02 0.00 -1.26 -3.68 107.32 103.23 2vvj s GLY 48 Ca 0.00 0.34 -0.28 0.00 0.00 0.00 0.00 44.72 44.78 2vvj s GLY 48 CO 0.00 0.67 1.01 2.56 0.00 0.00 0.00 173.10 177.34 2vvj s PRO 49 N -2.58 4.58 0.16 2.90 0.04 -1.26 -5.11 135.00 133.73 2vvj s PRO 49 Ca 0.54 1.55 -0.31 0.00 0.04 0.00 0.00 61.00 62.81 2vvj s PRO 49 Cb -0.14 -2.98 -0.10 0.00 0.04 0.00 0.00 34.50 31.33 2vvj s PRO 49 CO 0.19 0.23 1.52 -0.51 0.04 0.00 0.00 177.00 178.46 2vvj s LEU 50 N -1.78 4.37 0.00 -3.56 1.43 -1.24 -4.91 118.68 112.99 2vvj s LEU 50 Ca 0.48 2.55 0.19 0.00 -1.03 0.00 0.00 54.13 56.32 2vvj s LEU 50 Cb -0.25 -3.59 1.03 0.00 0.03 0.00 0.00 46.19 43.40 2vvj s LEU 50 CO 0.32 -0.78 1.67 -0.81 0.23 0.00 0.00 176.35 176.99 2vvj n PRO 51 N 3.84 1.11 -4.35 1.29 -0.04 -1.26 -4.86 135.00 130.74 2vvj n PRO 51 Ca 0.13 -0.17 -0.18 0.00 -0.04 0.00 0.00 63.50 63.24 2vvj n PRO 51 Cb 0.39 -1.30 -0.10 0.00 -0.04 0.00 0.00 33.50 32.45 2vvj n PRO 51 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2vvj s PHE 52 N -1.97 1.65 0.04 0.54 -0.12 -1.26 -4.67 117.98 112.19 2vvj s PHE 52 Ca 0.28 -0.78 -0.30 0.00 -0.05 0.00 0.00 56.93 56.08 2vvj s PHE 52 Cb 0.13 -0.90 -0.09 0.00 -0.63 0.00 0.00 43.02 41.53 2vvj s PHE 52 CO 0.22 0.13 1.97 0.00 -0.05 0.00 0.00 175.22 177.49 2vvj n ALA 53 N -0.42 1.62 0.14 1.99 0.00 0.28 -4.88 120.51 119.24 2vvj n ALA 53 Ca -0.06 0.22 0.10 0.00 0.00 0.00 0.00 53.44 53.70 2vvj n ALA 53 Cb 0.63 -2.68 0.61 0.00 0.00 0.00 0.00 19.45 18.01 2vvj n ALA 53 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2vvj h PHE 54 N 10.43 0.10 -0.90 0.00 3.57 -1.94 -2.91 116.94 125.28 2vvj h PHE 54 Ca -0.50 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.23 2vvj h PHE 54 Cb 1.24 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 39.89 2vvj h PHE 54 CO 0.94 0.06 0.61 -0.44 -2.23 0.00 0.00 178.31 177.25 2vvj h ASP 55 N 0.10 0.24 0.59 0.41 3.32 -1.96 -1.51 116.42 117.62 2vvj h ASP 55 Ca 0.10 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2vvj h ASP 55 Cb 0.25 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 2vvj h ASP 55 CO -0.01 0.09 -0.03 0.16 -1.72 0.00 0.00 179.24 177.73 2vvj h ILE 56 N 0.24 0.10 0.00 0.35 3.07 -1.92 -2.66 117.51 116.69 2vvj h ILE 56 Ca 0.46 -0.37 -0.00 0.00 1.55 0.00 0.00 64.86 66.49 2vvj h ILE 56 Cb 1.40 1.33 -0.00 0.00 -0.27 0.00 0.00 36.82 39.28 2vvj h ILE 56 CO -0.12 0.03 -0.84 -0.07 -1.05 0.00 0.00 178.15 176.10 2vvj h LEU 57 N 0.00 0.00 -0.98 0.16 3.38 -1.49 -3.43 115.31 112.95 2vvj h LEU 57 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2vvj h LEU 57 Cb 0.33 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2vvj h LEU 57 CO 0.00 0.00 0.17 0.71 0.09 0.00 0.00 178.44 179.42 2vvj h THR 58 N 0.00 1.23 0.00 0.22 1.35 -1.54 -1.05 112.91 113.12 2vvj h THR 58 Ca -0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 65.05 2vvj h THR 58 Cb 1.00 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 68.01 2vvj h THR 58 CO 0.00 0.31 0.00 0.35 -0.25 0.00 0.00 175.52 175.93 2vvj n THR 59 N -4.28 0.75 -2.99 6.82 -2.24 -1.26 -5.10 114.28 105.98 2vvj n THR 59 Ca 0.05 0.14 -0.44 0.00 -2.27 0.00 0.00 64.05 61.53 2vvj n THR 59 Cb 0.22 -0.93 -0.01 0.00 -2.10 0.00 0.00 70.33 67.51 2vvj n THR 59 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vvj s ALA 60 N -3.12 3.94 -0.30 6.98 0.00 -0.40 -5.13 121.76 123.73 2vvj s ALA 60 Ca 0.08 -3.28 -0.11 0.00 0.00 0.00 0.00 51.96 48.64 2vvj s ALA 60 Cb 0.11 -4.04 0.18 0.00 0.00 0.00 0.00 23.12 19.38 2vvj s ALA 60 CO 0.38 -2.75 1.03 1.21 0.00 0.00 0.00 175.76 175.64 2vvj s ASN 65 N 2.83 -0.46 0.00 0.00 3.84 -1.26 -4.97 114.94 114.93 2vvj s ASN 65 Ca 0.39 0.08 0.17 0.00 0.21 0.00 0.00 52.86 53.71 2vvj s ASN 65 Cb -0.04 1.30 1.01 0.00 -0.55 0.00 0.00 41.25 42.97 2vvj s ASN 65 CO -0.03 -0.08 1.44 -1.14 -2.79 0.00 0.00 177.10 174.49 2vvj n ARG 66 N 5.17 0.64 0.24 0.43 3.00 -1.26 -1.65 116.66 123.24 2vvj n ARG 66 Ca 0.07 0.00 0.09 0.00 -0.00 0.00 0.00 57.85 58.01 2vvj n ARG 66 Cb 0.57 -1.41 0.62 0.00 0.00 0.00 0.00 32.46 32.24 2vvj n ARG 66 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.63 177.39 2vvj h VAL 67 N 0.00 0.87 -1.42 5.15 3.04 -1.95 -3.22 116.25 118.72 2vvj h VAL 67 Ca 0.00 -0.54 -0.76 0.00 -1.01 0.00 0.00 66.70 64.39 2vvj h VAL 67 Cb 0.00 1.31 -0.15 0.00 -2.01 0.00 0.00 31.29 30.44 2vvj h VAL 67 CO 0.00 0.14 2.06 0.49 -1.01 0.00 0.00 177.57 179.25 2vvj n PHE 68 N -4.03 2.76 -3.81 3.17 3.01 -0.66 -4.68 117.46 113.23 2vvj n PHE 68 Ca -0.02 -2.78 -0.13 0.00 1.01 0.00 0.00 57.45 55.53 2vvj n PHE 68 Cb 0.23 -1.85 -0.13 0.00 -0.01 0.00 0.00 39.48 37.72 2vvj n PHE 68 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2vvj s ALA 69 N -0.44 -0.26 -0.48 4.37 0.00 -1.22 -4.29 121.76 119.45 2vvj s ALA 69 Ca 0.44 0.42 -0.29 0.00 0.00 0.00 0.00 51.96 52.53 2vvj s ALA 69 Cb 0.12 -0.27 0.03 0.00 0.00 0.00 0.00 23.12 23.01 2vvj s ALA 69 CO -0.02 -0.09 1.17 -2.00 0.00 0.00 0.00 175.76 174.82 2vvj s GLU 70 N 0.43 3.69 -0.24 0.00 2.12 -0.33 -4.49 118.70 119.89 2vvj s GLU 70 Ca -0.03 0.57 -0.10 0.00 0.36 0.00 0.00 54.97 55.77 2vvj s GLU 70 Cb -0.04 -3.93 -0.05 0.00 0.26 0.00 0.00 34.13 30.37 2vvj s GLU 70 CO -0.02 -1.43 0.14 0.71 -0.54 0.00 0.00 175.26 174.12 2vvj s TYR 71 N 4.60 3.27 0.71 5.30 1.51 -1.26 -0.91 117.35 130.58 2vvj s TYR 71 Ca 0.49 0.12 -0.11 0.00 -1.01 0.00 0.00 57.07 56.56 2vvj s TYR 71 Cb -0.08 -2.25 0.02 0.00 -0.11 0.00 0.00 41.96 39.55 2vvj s TYR 71 CO 0.32 0.01 1.07 -1.25 -1.11 0.00 0.00 175.55 174.58 2vvj s PRO 72 N 1.08 2.80 0.56 -1.71 0.04 -1.26 -4.95 135.00 131.57 2vvj s PRO 72 Ca 0.07 0.92 0.25 0.00 0.04 0.00 0.00 61.00 62.28 2vvj s PRO 72 Cb -0.14 -1.98 1.57 0.00 0.04 0.00 0.00 34.50 34.00 2vvj s PRO 72 CO 0.04 -1.19 2.15 -0.44 0.04 0.00 0.00 177.00 177.60 2vvj h ASP 73 N -0.78 0.00 0.24 6.66 5.19 -1.99 -2.31 116.42 123.42 2vvj h ASP 73 Ca -0.44 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.97 2vvj h ASP 73 Cb 1.22 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.73 2vvj h ASP 73 CO 0.57 0.00 -0.13 0.00 -3.12 0.00 0.00 179.24 176.56 2vvj n HIS 74 N -4.08 0.00 -4.85 4.55 1.44 -1.26 -4.76 115.22 106.25 2vvj n HIS 74 Ca -0.00 0.00 -0.33 0.00 -2.01 0.00 0.00 57.72 55.38 2vvj n HIS 74 Cb 0.23 -0.12 -0.15 0.00 0.12 0.00 0.00 29.99 30.06 2vvj n HIS 74 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 2vvj s ILE 75 N -2.37 2.63 0.13 0.61 1.01 -0.87 -5.07 121.20 117.27 2vvj s ILE 75 Ca 0.30 -0.81 -0.31 0.00 0.00 0.00 0.00 60.65 59.83 2vvj s ILE 75 Cb 0.20 -2.08 -0.10 0.00 0.01 0.00 0.00 42.46 40.50 2vvj s ILE 75 CO 0.46 0.53 1.64 -1.58 0.00 0.00 0.00 174.94 175.99 2vvj s GLN 76 N 0.47 4.19 -0.82 2.79 2.00 -1.26 -4.66 119.66 122.37 2vvj s GLN 76 Ca -0.12 2.40 -0.16 0.00 -2.00 0.00 0.00 55.36 55.49 2vvj s GLN 76 Cb -0.16 -3.33 0.18 0.00 0.80 0.00 0.00 33.01 30.50 2vvj s GLN 76 CO 0.05 -0.69 0.83 0.34 -0.50 0.00 0.00 175.29 175.32 2vvj s ASP 77 N 1.72 6.65 0.47 6.67 -1.08 -1.26 -4.70 116.67 125.14 2vvj s ASP 77 Ca 0.73 -2.39 0.15 0.00 -0.52 0.00 0.00 52.55 50.52 2vvj s ASP 77 Cb -0.43 -2.26 1.10 0.00 -1.46 0.00 0.00 42.92 39.87 2vvj s ASP 77 CO 0.32 -0.75 2.05 0.22 0.52 0.00 0.00 175.17 177.54 2vvj h TYR 78 N 8.20 0.00 0.07 -5.34 3.20 -1.93 -2.78 116.97 118.40 2vvj h TYR 78 Ca 0.06 0.00 -0.12 0.00 3.14 0.00 0.00 58.73 61.81 2vvj h TYR 78 Cb 1.04 0.00 0.01 0.00 1.54 0.00 0.00 36.73 39.32 2vvj h TYR 78 CO 1.03 0.11 -0.58 0.74 -1.64 0.00 0.00 178.16 177.83 2vvj h PHE 79 N 0.00 0.28 -0.12 -3.82 -1.00 -1.90 -2.72 116.94 107.67 2vvj h PHE 79 Ca -0.00 -0.21 -0.09 0.00 2.81 0.00 0.00 57.97 60.49 2vvj h PHE 79 Cb 0.20 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 2vvj h PHE 79 CO 0.00 1.22 -0.32 0.87 -1.61 0.00 0.00 178.31 178.47 2vvj h LYS 80 N -0.66 0.23 0.00 1.51 1.57 -1.89 -2.58 116.57 114.75 2vvj h LYS 80 Ca -0.12 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2vvj h LYS 80 Cb 1.38 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.67 2vvj h LYS 80 CO 0.06 0.53 0.00 1.04 -0.57 0.00 0.00 179.45 180.51 2vvj n GLN 81 N -4.10 0.21 0.16 3.15 1.13 -1.05 -2.85 117.38 114.03 2vvj n GLN 81 Ca -0.01 0.33 0.13 0.00 -1.94 0.00 0.00 57.00 55.51 2vvj n GLN 81 Cb 0.41 -1.82 0.44 0.00 0.11 0.00 0.00 30.24 29.38 2vvj n GLN 81 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 2vvj h SER 82 N 0.00 0.00 -2.83 1.08 0.02 -1.12 -3.45 113.55 107.25 2vvj h SER 82 Ca 0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 2vvj h SER 82 Cb 0.50 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2vvj h SER 82 CO 0.00 0.00 -0.28 -0.36 -1.14 0.00 0.00 176.83 175.05 2vvj s PHE 83 N -3.28 3.48 0.09 3.45 0.40 -1.13 0.04 117.98 121.02 2vvj s PHE 83 Ca 0.06 0.35 0.30 0.00 -0.60 0.00 0.00 56.93 57.05 2vvj s PHE 83 Cb 0.10 -1.87 1.19 0.00 0.51 0.00 0.00 43.02 42.94 2vvj s PHE 83 CO 0.54 0.29 1.92 -1.00 0.70 0.00 0.00 175.22 177.67 2vvj h PRO 84 N 1.57 0.00 -0.36 0.24 0.13 -1.79 -3.41 132.00 128.39 2vvj h PRO 84 Ca -0.49 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.58 2vvj h PRO 84 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2vvj h PRO 84 CO 0.65 0.07 -0.03 -0.22 -0.23 0.00 0.00 178.00 178.24 2vvj h LYS 85 N 0.00 0.65 0.00 0.86 3.64 -1.90 -3.37 116.57 116.45 2vvj h LYS 85 Ca -0.00 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 2vvj h LYS 85 Cb 0.60 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2vvj h LYS 85 CO 0.01 0.78 0.00 0.41 -2.27 0.00 0.00 179.45 178.38 2vvj n GLY 86 N -0.29 -0.77 3.72 5.01 0.00 0.11 -4.61 105.19 108.35 2vvj n GLY 86 Ca -0.02 -2.18 -0.09 0.00 0.00 0.00 0.00 46.02 43.74 2vvj n GLY 86 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2vvj s TYR 87 N 0.00 0.17 0.10 1.61 1.13 -0.99 -1.25 117.35 118.11 2vvj s TYR 87 Ca 0.00 -0.60 0.04 0.00 -1.41 0.00 0.00 57.07 55.10 2vvj s TYR 87 Cb 0.00 0.47 -0.03 0.00 -1.10 0.00 0.00 41.96 41.30 2vvj s TYR 87 CO 0.00 -1.19 -0.12 -1.12 -2.51 0.00 0.00 175.55 170.61 2vvj s SER 88 N -3.01 1.62 0.08 -0.18 0.01 -0.34 -0.74 113.70 111.14 2vvj s SER 88 Ca 0.18 -0.77 0.04 0.00 1.31 0.00 0.00 55.95 56.70 2vvj s SER 88 Cb -0.03 -0.02 -0.03 0.00 0.21 0.00 0.00 66.02 66.14 2vvj s SER 88 CO 0.10 -0.20 -0.11 -1.66 0.41 0.00 0.00 173.24 171.77 2vvj s TRP 89 N -2.14 1.06 0.03 2.43 1.48 -0.19 -0.97 118.94 120.65 2vvj s TRP 89 Ca 0.05 -0.55 0.07 0.00 -1.06 0.00 0.00 56.10 54.60 2vvj s TRP 89 Cb -0.05 -0.59 -0.02 0.00 -1.16 0.00 0.00 33.47 31.65 2vvj s TRP 89 CO 0.01 0.01 -0.20 -1.21 -4.06 0.00 0.00 176.95 171.51 2vvj s GLU 90 N -2.19 1.39 -0.02 3.25 2.02 -0.82 -1.47 118.70 120.86 2vvj s GLU 90 Ca 0.00 -0.88 -0.05 0.00 0.02 0.00 0.00 54.97 54.06 2vvj s GLU 90 Cb -0.07 -1.47 0.00 0.00 0.10 0.00 0.00 34.13 32.70 2vvj s GLU 90 CO 0.01 0.38 0.11 0.50 0.02 0.00 0.00 175.26 176.28 2vvj s ARG 91 N -1.04 0.32 0.01 1.61 3.52 0.51 -1.01 118.95 122.88 2vvj s ARG 91 Ca 0.07 -0.18 0.08 0.00 -0.13 0.00 0.00 55.73 55.57 2vvj s ARG 91 Cb -0.08 0.14 -0.02 0.00 -1.56 0.00 0.00 34.95 33.42 2vvj s ARG 91 CO 0.01 -0.07 -0.26 -1.54 -0.81 0.00 0.00 175.30 172.64 2vvj s SER 92 N -0.79 3.17 -0.19 -2.12 1.04 -0.54 -1.12 113.70 113.14 2vvj s SER 92 Ca -0.09 -0.52 0.01 0.00 0.48 0.00 0.00 55.95 55.84 2vvj s SER 92 Cb -0.05 -0.34 0.03 0.00 0.10 0.00 0.00 66.02 65.76 2vvj s SER 92 CO 0.01 0.29 -0.15 -0.76 0.98 0.00 0.00 173.24 173.61 2vvj s LEU 93 N -0.94 2.30 -0.36 2.42 1.43 0.40 -2.10 118.68 121.83 2vvj s LEU 93 Ca 0.11 -0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 52.35 2vvj s LEU 93 Cb -0.10 -1.36 0.07 0.00 0.03 0.00 0.00 46.19 44.83 2vvj s LEU 93 CO 0.01 -0.09 0.12 -0.89 0.23 0.00 0.00 176.35 175.73 2vvj s THR 94 N 1.33 3.48 0.35 5.49 2.01 0.12 -0.55 115.64 127.86 2vvj s THR 94 Ca 0.01 -1.48 -0.13 0.00 0.31 0.00 0.00 61.69 60.39 2vvj s THR 94 Cb -0.15 -3.10 -0.08 0.00 0.01 0.00 0.00 72.50 69.17 2vvj s THR 94 CO -0.10 -0.33 0.74 -0.36 -0.69 0.00 0.00 174.62 173.88 2vvj s PHE 95 N 1.29 3.40 0.01 4.92 0.40 0.39 -1.22 117.98 127.18 2vvj s PHE 95 Ca 0.00 1.15 0.30 0.00 -0.60 0.00 0.00 56.93 57.79 2vvj s PHE 95 Cb -0.21 -2.50 1.49 0.00 0.51 0.00 0.00 43.02 42.31 2vvj s PHE 95 CO -0.00 0.04 1.92 1.05 0.70 0.00 0.00 175.22 178.92 2vvj h GLU 96 N 1.94 0.00 -0.60 0.44 4.11 -1.48 -1.97 114.58 117.02 2vvj h GLU 96 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.95 2vvj h GLU 96 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2vvj h GLU 96 CO 0.65 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.33 2vvj n ASP 97 N -2.62 4.57 0.00 3.06 5.75 -1.26 -4.94 116.55 121.10 2vvj n ASP 97 Ca -0.01 -2.45 0.00 0.00 -0.01 0.00 0.00 54.79 52.32 2vvj n ASP 97 Cb 0.14 -0.55 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 2vvj n ASP 97 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vvj n GLY 98 N 0.97 1.14 3.73 6.12 0.00 -0.74 -4.73 105.19 111.68 2vvj n GLY 98 Ca 0.24 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 2vvj n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvj n GLY 99 N -2.00 1.50 2.89 -0.02 0.00 -1.21 -4.72 105.19 101.62 2vvj n GLY 99 Ca 0.00 0.58 -0.19 0.00 0.00 0.00 0.00 46.02 46.41 2vvj n GLY 99 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vvj s ILE 100 N 0.85 0.47 0.10 -0.61 1.01 -0.72 -0.46 121.20 121.83 2vvj s ILE 100 Ca 0.72 -0.10 0.10 0.00 0.00 0.00 0.00 60.65 61.37 2vvj s ILE 100 Cb -0.50 -0.49 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 2vvj s ILE 100 CO 0.37 0.20 -0.27 0.00 0.00 0.00 0.00 174.94 175.24 2vvj s ILE 102 N -0.97 1.99 -0.02 0.00 -5.25 0.78 -0.45 121.20 117.28 2vvj s ILE 102 Ca 0.13 -1.56 -0.08 0.00 -0.99 0.00 0.00 60.65 58.15 2vvj s ILE 102 Cb -0.10 -1.76 0.01 0.00 2.95 0.00 0.00 42.46 43.56 2vvj s ILE 102 CO 0.05 0.10 0.17 0.00 -1.79 0.00 0.00 174.94 173.47 2vvj s ALA 103 N -1.02 -0.41 0.03 2.27 0.00 -0.27 -0.69 121.76 121.67 2vvj s ALA 103 Ca 0.10 0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.18 2vvj s ALA 103 Cb -0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.00 2vvj s ALA 103 CO 0.04 -0.18 -0.10 1.03 0.00 0.00 0.00 175.76 176.55 2vvj s ARG 104 N -0.99 0.66 -0.04 0.00 0.52 -0.37 -0.36 118.95 118.38 2vvj s ARG 104 Ca -0.11 -0.61 -0.01 0.00 -0.52 0.00 0.00 55.73 54.48 2vvj s ARG 104 Cb -0.06 -0.58 0.03 0.00 0.52 0.00 0.00 34.95 34.87 2vvj s ARG 104 CO 0.01 0.14 0.07 1.21 0.02 0.00 0.00 175.30 176.76 2vvj s ASN 105 N -1.03 0.28 -0.34 0.23 2.47 -0.54 -1.02 114.94 114.99 2vvj s ASN 105 Ca -0.02 0.13 -0.10 0.00 0.42 0.00 0.00 52.86 53.29 2vvj s ASN 105 Cb -0.07 0.01 0.01 0.00 -1.45 0.00 0.00 41.25 39.75 2vvj s ASN 105 CO 0.01 -0.17 0.17 -0.62 -3.72 0.00 0.00 177.10 172.77 2vvj s ASP 106 N 1.40 5.59 -0.23 -4.21 2.15 -0.84 -1.02 116.67 119.51 2vvj s ASP 106 Ca -0.06 -0.80 -0.07 0.00 0.43 0.00 0.00 52.55 52.06 2vvj s ASP 106 Cb -0.12 -1.99 -0.03 0.00 -0.30 0.00 0.00 42.92 40.47 2vvj s ASP 106 CO -0.04 -0.29 0.05 -0.63 -0.17 0.00 0.00 175.17 174.08 2vvj s ILE 107 N 1.56 4.26 0.40 4.11 1.01 0.08 -2.21 121.20 130.41 2vvj s ILE 107 Ca 0.03 -0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.52 2vvj s ILE 107 Cb -0.18 -2.96 -0.05 0.00 0.01 0.00 0.00 42.46 39.27 2vvj s ILE 107 CO 0.06 0.38 0.04 0.42 0.00 0.00 0.00 174.94 175.84 2vvj s THR 108 N 1.27 1.33 -0.02 2.92 -4.23 -0.59 -2.35 115.64 113.98 2vvj s THR 108 Ca 0.04 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.55 2vvj s THR 108 Cb -0.15 -2.66 0.02 0.00 1.34 0.00 0.00 72.50 71.05 2vvj s THR 108 CO 0.03 0.00 0.03 -0.32 -0.54 0.00 0.00 174.62 173.81 2vvj s MET 109 N -3.81 -0.03 -0.17 3.99 1.75 -1.26 -0.48 119.30 119.30 2vvj s MET 109 Ca 0.28 0.15 -0.02 0.00 -1.25 0.00 0.00 55.69 54.85 2vvj s MET 109 Cb 0.07 -0.19 0.05 0.00 2.84 0.00 0.00 34.83 37.60 2vvj s MET 109 CO 0.14 -0.13 0.00 -1.21 -0.65 0.00 0.00 175.02 173.17 2vvj s GLU 110 N 0.83 0.89 7.95 4.11 2.02 -0.47 -4.97 118.70 129.06 2vvj s GLU 110 Ca -0.07 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 54.51 2vvj s GLU 110 Cb -0.10 -1.96 0.00 0.00 0.10 0.00 0.00 34.13 32.17 2vvj s GLU 110 CO -0.02 -0.54 0.00 0.41 0.02 0.00 0.00 175.26 175.12 2vvj n GLY 111 N 5.00 3.77 1.81 -1.39 0.00 -1.26 -2.24 105.19 110.87 2vvj n GLY 111 Ca -0.09 -0.02 0.08 0.00 0.00 0.00 0.00 46.02 45.98 2vvj n GLY 111 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vvj n ASP 112 N 8.62 5.45 -4.07 1.61 5.75 -1.26 -4.93 116.55 127.71 2vvj n ASP 112 Ca 0.00 -2.78 -0.26 0.00 -0.01 0.00 0.00 54.79 51.74 2vvj n ASP 112 Cb 0.00 -0.66 -0.17 0.00 -1.03 0.00 0.00 41.12 39.27 2vvj n ASP 112 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 2vvj s THR 113 N -2.48 1.35 0.11 2.12 2.01 -0.95 -0.05 115.64 117.74 2vvj s THR 113 Ca 0.54 -0.61 -0.23 0.00 0.31 0.00 0.00 61.69 61.70 2vvj s THR 113 Cb 0.39 -1.21 -0.07 0.00 0.01 0.00 0.00 72.50 71.62 2vvj s THR 113 CO 0.19 0.40 0.68 -0.36 -0.69 0.00 0.00 174.62 174.84 2vvj s PHE 114 N 0.55 3.84 -0.08 4.92 0.08 -0.35 -1.37 117.98 125.56 2vvj s PHE 114 Ca -0.15 1.45 0.02 0.00 0.12 0.00 0.00 56.93 58.38 2vvj s PHE 114 Cb -0.16 -2.66 -0.02 0.00 -0.57 0.00 0.00 43.02 39.61 2vvj s PHE 114 CO 0.05 0.51 -0.15 0.71 -0.10 0.00 0.00 175.22 176.24 2vvj s TYR 115 N -0.95 2.72 -0.20 0.36 1.51 0.37 -0.53 117.35 120.64 2vvj s TYR 115 Ca 0.33 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.99 2vvj s TYR 115 Cb -0.21 -1.71 0.04 0.00 -0.11 0.00 0.00 41.96 39.96 2vvj s TYR 115 CO 0.23 -0.01 -0.12 -0.80 -1.11 0.00 0.00 175.55 173.74 2vvj s ASN 116 N -0.24 3.39 -0.50 2.29 0.01 -0.38 -1.54 114.94 117.96 2vvj s ASN 116 Ca 0.01 -0.87 -0.16 0.00 -0.71 0.00 0.00 52.86 51.14 2vvj s ASN 116 Cb -0.13 -1.28 0.10 0.00 0.41 0.00 0.00 41.25 40.35 2vvj s ASN 116 CO 0.03 -0.13 0.44 -0.75 -1.51 0.00 0.00 177.10 175.18 2vvj s LYS 117 N 1.37 2.97 -0.09 -0.60 2.20 -0.94 -1.66 119.74 122.99 2vvj s LYS 117 Ca -0.01 -1.52 -0.01 0.00 -0.36 0.00 0.00 55.97 54.07 2vvj s LYS 117 Cb -0.16 -4.20 -0.03 0.00 -1.51 0.00 0.00 37.83 31.93 2vvj s LYS 117 CO -0.09 -1.17 -0.03 0.08 -0.36 0.00 0.00 175.35 173.79 2vvj s VAL 118 N 1.61 4.01 0.02 4.02 1.01 -0.22 -1.99 120.40 128.86 2vvj s VAL 118 Ca 0.04 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.73 2vvj s VAL 118 Cb -0.27 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 2vvj s VAL 118 CO 0.05 0.58 -0.21 -0.13 0.00 0.00 0.00 175.10 175.39 2vvj s ARG 119 N -0.61 1.49 -0.10 2.72 1.81 -0.18 -1.50 118.95 122.57 2vvj s ARG 119 Ca 0.10 -0.86 -0.04 0.00 -1.72 0.00 0.00 55.73 53.21 2vvj s ARG 119 Cb -0.12 -1.54 0.05 0.00 -0.45 0.00 0.00 34.95 32.89 2vvj s ARG 119 CO 0.02 0.40 0.22 0.12 -0.68 0.00 0.00 175.30 175.39 2vvj s PHE 120 N -0.67 -0.31 -0.04 -0.53 2.19 -0.89 -1.24 117.98 116.49 2vvj s PHE 120 Ca 0.08 0.77 0.01 0.00 0.33 0.00 0.00 56.93 58.11 2vvj s PHE 120 Cb -0.08 -0.05 0.02 0.00 -1.31 0.00 0.00 43.02 41.60 2vvj s PHE 120 CO 0.01 -0.27 -0.03 -1.01 1.83 0.00 0.00 175.22 175.75 2vvj s HIS 121 N 1.78 0.61 -0.02 10.12 3.76 0.14 -1.12 115.29 130.56 2vvj s HIS 121 Ca -0.04 -0.14 0.03 0.00 -0.15 0.00 0.00 55.06 54.76 2vvj s HIS 121 Cb -0.11 -0.57 -0.00 0.00 1.11 0.00 0.00 32.58 33.00 2vvj s HIS 121 CO -0.08 -0.16 -0.09 0.20 -0.85 0.00 0.00 174.74 173.76 2vvj s GLY 122 N 0.86 0.49 0.19 -2.22 0.00 -0.26 -0.15 107.32 106.22 2vvj s GLY 122 Ca -0.11 -0.38 0.02 0.00 0.00 0.00 0.00 44.72 44.26 2vvj s GLY 122 CO -0.00 -0.23 0.02 -1.34 0.00 0.00 0.00 173.10 171.54 2vvj s VAL 123 N -0.04 0.68 -1.88 1.40 -7.23 -0.18 -1.37 120.40 111.77 2vvj s VAL 123 Ca 0.01 -1.99 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 2vvj s VAL 123 Cb -0.06 -2.22 0.00 0.00 0.56 0.00 0.00 36.38 34.66 2vvj s VAL 123 CO -0.00 -0.39 0.00 0.59 -0.31 0.00 0.00 175.10 174.99 2vvj n ASN 124 N -0.29 -5.38 -4.66 4.85 3.02 -1.26 -1.76 115.26 109.78 2vvj n ASN 124 Ca -0.05 0.29 -0.43 0.00 -0.03 0.00 0.00 54.58 54.36 2vvj n ASN 124 Cb 0.64 -4.51 -0.02 0.00 -0.61 0.00 0.00 39.78 35.27 2vvj n ASN 124 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2vvj s PHE 125 N -2.80 2.77 0.47 3.10 0.08 -1.26 -3.33 117.98 117.01 2vvj s PHE 125 Ca 0.00 0.95 -0.24 0.00 0.12 0.00 0.00 56.93 57.76 2vvj s PHE 125 Cb 0.00 -3.59 -0.07 0.00 -0.57 0.00 0.00 43.02 38.79 2vvj s PHE 125 CO 0.00 -1.81 1.29 -1.25 -0.10 0.00 0.00 175.22 173.35 2vvj s PRO 126 N 3.64 3.59 0.40 0.24 0.04 -1.26 -4.91 135.00 136.74 2vvj s PRO 126 Ca 0.56 2.10 0.09 0.00 0.04 0.00 0.00 61.00 63.79 2vvj s PRO 126 Cb -0.21 -2.47 0.88 0.00 0.04 0.00 0.00 34.50 32.73 2vvj s PRO 126 CO 0.17 -0.78 1.99 0.00 0.04 0.00 0.00 177.00 178.41 2vvj h ALA 127 N 2.04 1.83 -0.51 8.56 0.00 -1.98 -1.61 119.26 127.58 2vvj h ALA 127 Ca -0.50 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.39 2vvj h ALA 127 Cb 1.27 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2vvj h ALA 127 CO 0.60 0.07 0.00 0.09 0.00 0.00 0.00 179.25 180.01 2vvj n ASN 128 N -4.48 4.59 -4.87 0.00 3.02 -1.26 -4.35 115.26 107.91 2vvj n ASN 128 Ca 0.09 -2.63 -0.30 0.00 -0.03 0.00 0.00 54.58 51.71 2vvj n ASN 128 Cb 0.25 -0.56 0.07 0.00 -0.61 0.00 0.00 39.78 38.93 2vvj n ASN 128 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2vvj s GLY 129 N -1.12 1.61 0.59 7.41 0.00 -0.61 -4.88 107.32 110.32 2vvj s GLY 129 Ca 0.47 -0.43 0.33 0.00 0.00 0.00 0.00 44.72 45.09 2vvj s GLY 129 CO 0.18 -0.01 2.21 -0.56 0.00 0.00 0.00 173.10 174.93 2vvj h PRO 130 N -0.86 0.00 0.08 2.90 0.13 -1.94 -1.74 132.00 130.58 2vvj h PRO 130 Ca -0.46 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2vvj h PRO 130 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2vvj h PRO 130 CO 0.64 0.04 -0.04 0.28 -0.23 0.00 0.00 178.00 178.69 2vvj h VAL 131 N 0.00 1.02 0.00 1.56 2.07 -1.93 0.11 116.25 119.07 2vvj h VAL 131 Ca -0.00 -1.45 -0.02 0.00 0.82 0.00 0.00 66.70 66.05 2vvj h VAL 131 Cb 0.13 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 31.70 2vvj h VAL 131 CO 0.00 0.30 -0.08 0.24 0.02 0.00 0.00 177.57 178.06 2vvj h MET 132 N -0.90 0.00 -0.02 1.57 2.86 -1.77 0.88 114.93 117.54 2vvj h MET 132 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2vvj h MET 132 Cb 0.57 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.23 2vvj h MET 132 CO 0.02 0.08 -0.06 1.04 1.06 0.00 0.00 176.91 179.04 2vvj n GLN 133 N -3.19 1.82 -3.70 1.72 1.13 -0.66 -4.71 117.38 109.79 2vvj n GLN 133 Ca 0.01 -1.32 -0.27 0.00 -1.94 0.00 0.00 57.00 53.47 2vvj n GLN 133 Cb 0.38 -1.47 0.03 0.00 0.11 0.00 0.00 30.24 29.28 2vvj n GLN 133 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2vvj n LYS 134 N 0.56 -2.35 -0.34 -1.09 5.02 -0.77 -4.92 118.16 114.28 2vvj n LYS 134 Ca 0.16 0.50 0.07 0.00 -2.02 0.00 0.00 58.31 57.02 2vvj n LYS 134 Cb 0.46 -4.51 0.22 0.00 -0.02 0.00 0.00 35.03 31.19 2vvj n LYS 134 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2vvj n LYS 135 N -4.17 3.00 -3.10 1.97 4.76 0.31 -4.99 118.16 115.93 2vvj n LYS 135 Ca -0.17 -2.47 -0.34 0.00 -2.87 0.00 0.00 58.31 52.46 2vvj n LYS 135 Cb 0.63 -1.57 -0.06 0.00 -1.84 0.00 0.00 35.03 32.18 2vvj n LYS 135 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2vvj s THR 136 N -1.84 4.62 -0.14 -0.18 -4.23 -1.26 -1.09 115.64 111.53 2vvj s THR 136 Ca 0.34 1.11 -0.05 0.00 -1.18 0.00 0.00 61.69 61.90 2vvj s THR 136 Cb 0.23 -3.71 -0.06 0.00 1.34 0.00 0.00 72.50 70.30 2vvj s THR 136 CO 0.14 -0.05 -0.17 0.18 -0.54 0.00 0.00 174.62 174.19 2vvj n LEU 137 N 0.02 1.34 -3.53 4.79 4.77 0.12 -4.83 117.00 119.70 2vvj n LEU 137 Ca 0.02 0.12 -0.09 0.00 -0.03 0.00 0.00 56.01 56.03 2vvj n LEU 137 Cb 0.52 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 41.17 2vvj n LEU 137 CO 0.42 0.37 0.73 -1.59 -1.33 0.00 0.00 177.39 175.98 2vvj s LYS 138 N -2.25 0.73 0.17 3.23 -2.85 -1.21 -4.99 119.74 112.57 2vvj s LYS 138 Ca -0.19 -0.15 -0.30 0.00 -1.00 0.00 0.00 55.97 54.33 2vvj s LYS 138 Cb 0.07 0.34 -0.08 0.00 -2.06 0.00 0.00 37.83 36.10 2vvj s LYS 138 CO 0.25 -0.29 1.20 -1.58 0.10 0.00 0.00 175.35 175.03 2vvj s TRP 139 N -2.45 3.43 0.56 1.78 0.52 -1.26 -0.05 118.94 121.47 2vvj s TRP 139 Ca 0.03 1.41 -0.16 0.00 0.02 0.00 0.00 56.10 57.39 2vvj s TRP 139 Cb -0.01 -3.43 -0.06 0.00 -1.15 0.00 0.00 33.47 28.83 2vvj s TRP 139 CO -0.05 -1.21 1.03 -1.21 0.02 0.00 0.00 176.95 175.53 2vvj s GLU 140 N -0.06 3.58 0.45 4.98 0.41 -0.13 -4.73 118.70 123.20 2vvj s GLU 140 Ca 0.54 1.13 -0.25 0.00 -0.41 0.00 0.00 54.97 55.98 2vvj s GLU 140 Cb -0.32 -2.07 -0.09 0.00 -1.78 0.00 0.00 34.13 29.87 2vvj s GLU 140 CO 0.35 -0.59 1.31 -0.35 -0.49 0.00 0.00 175.26 175.49 2vvj n PRO 141 N -1.78 1.94 -4.42 0.39 -0.04 -1.26 -4.74 135.00 125.09 2vvj n PRO 141 Ca 0.08 0.69 -0.22 0.00 -0.04 0.00 0.00 63.50 64.01 2vvj n PRO 141 Cb 0.53 -2.46 -0.08 0.00 -0.04 0.00 0.00 33.50 31.44 2vvj n PRO 141 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2vvj s SER 142 N -0.60 2.20 -0.14 3.54 1.04 -0.46 -4.95 113.70 114.33 2vvj s SER 142 Ca 0.63 -1.65 -0.03 0.00 0.48 0.00 0.00 55.95 55.38 2vvj s SER 142 Cb -0.48 0.47 0.05 0.00 0.10 0.00 0.00 66.02 66.16 2vvj s SER 142 CO 0.56 -0.94 0.04 -0.89 0.98 0.00 0.00 173.24 173.00 2vvj s THR 143 N -3.37 0.26 0.03 2.02 2.01 -1.26 -0.59 115.64 114.73 2vvj s THR 143 Ca 0.31 -0.19 -0.27 0.00 0.31 0.00 0.00 61.69 61.85 2vvj s THR 143 Cb 0.03 -0.70 -0.05 0.00 0.01 0.00 0.00 72.50 71.79 2vvj s THR 143 CO 0.18 -0.08 0.84 -0.70 -0.69 0.00 0.00 174.62 174.17 2vvj s GLU 144 N 1.99 4.54 -0.35 4.92 2.12 0.57 -4.54 118.70 127.95 2vvj s GLU 144 Ca 0.02 1.19 -0.13 0.00 0.36 0.00 0.00 54.97 56.41 2vvj s GLU 144 Cb -0.15 -3.40 -0.01 0.00 0.26 0.00 0.00 34.13 30.82 2vvj s GLU 144 CO -0.07 0.15 0.25 0.15 -0.54 0.00 0.00 175.26 175.20 2vvj s LYS 145 N 0.36 3.41 -0.24 4.30 -0.14 -0.00 -0.81 119.74 126.62 2vvj s LYS 145 Ca 0.43 -0.70 -0.08 0.00 -1.36 0.00 0.00 55.97 54.26 2vvj s LYS 145 Cb -0.21 -3.84 -0.04 0.00 -1.68 0.00 0.00 37.83 32.07 2vvj s LYS 145 CO 0.25 -0.50 0.09 -1.64 -0.76 0.00 0.00 175.35 172.79 2vvj s MET 146 N 1.72 3.81 0.15 1.68 -1.94 0.14 -1.46 119.30 123.40 2vvj s MET 146 Ca 0.06 -0.41 -0.17 0.00 -1.71 0.00 0.00 55.69 53.46 2vvj s MET 146 Cb -0.18 -3.36 0.04 0.00 2.01 0.00 0.00 34.83 33.34 2vvj s MET 146 CO 0.10 -0.05 0.46 1.52 -0.01 0.00 0.00 175.02 177.04 2vvj s TYR 147 N 1.28 -0.21 -0.23 -0.03 -0.85 -0.05 -1.57 117.35 115.68 2vvj s TYR 147 Ca 0.05 -0.10 -0.23 0.00 -0.52 0.00 0.00 57.07 56.27 2vvj s TYR 147 Cb -0.15 0.33 -0.01 0.00 0.38 0.00 0.00 41.96 42.51 2vvj s TYR 147 CO 0.04 -0.78 0.77 0.08 -1.52 0.00 0.00 175.55 174.14 2vvj s VAL 148 N -3.82 4.89 -0.10 -3.49 1.01 -1.26 -0.09 120.40 117.54 2vvj s VAL 148 Ca 0.05 1.45 0.01 0.00 0.00 0.00 0.00 61.98 63.48 2vvj s VAL 148 Cb 0.01 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.34 2vvj s VAL 148 CO -0.09 -0.02 -0.12 -0.60 0.00 0.00 0.00 175.10 174.27 2vvj s ARG 149 N 2.59 1.83 -1.62 2.72 3.52 0.25 -4.75 118.95 123.51 2vvj s ARG 149 Ca 0.33 -0.41 -0.15 0.00 -0.13 0.00 0.00 55.73 55.37 2vvj s ARG 149 Cb -0.16 -1.66 0.12 0.00 -1.56 0.00 0.00 34.95 31.69 2vvj s ARG 149 CO 0.08 -0.13 0.83 -0.25 -0.81 0.00 0.00 175.30 175.03 2vvj n ASP 150 N 4.40 -3.57 0.00 -2.12 8.00 -1.26 -1.13 116.55 120.86 2vvj n ASP 150 Ca -0.18 -0.93 0.00 0.00 0.71 0.00 0.00 54.79 54.40 2vvj n ASP 150 Cb 0.51 -3.20 0.00 0.00 -0.02 0.00 0.00 41.12 38.41 2vvj n ASP 150 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vvj n GLY 151 N -1.55 0.60 3.18 0.44 0.00 -1.26 -5.02 105.19 101.58 2vvj n GLY 151 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2vvj n GLY 151 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vvj s VAL 152 N -2.53 1.70 0.08 1.61 1.01 -0.29 -5.09 120.40 116.88 2vvj s VAL 152 Ca 0.00 -0.85 -0.31 0.00 0.00 0.00 0.00 61.98 60.83 2vvj s VAL 152 Cb 0.00 -1.46 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 2vvj s VAL 152 CO 0.00 0.48 1.82 -0.22 0.00 0.00 0.00 175.10 177.18 2vvj s LEU 153 N 0.10 4.40 0.02 3.92 2.96 -1.25 -0.58 118.68 128.25 2vvj s LEU 153 Ca -0.08 2.64 0.05 0.00 -0.22 0.00 0.00 54.13 56.53 2vvj s LEU 153 Cb -0.14 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 42.98 2vvj s LEU 153 CO 0.04 -0.99 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.04 2vvj s THR 154 N 3.29 1.20 -0.12 3.68 2.01 0.87 -0.38 115.64 126.20 2vvj s THR 154 Ca 0.81 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.93 2vvj s THR 154 Cb -0.43 -1.05 0.02 0.00 0.01 0.00 0.00 72.50 71.05 2vvj s THR 154 CO 0.36 0.15 -0.14 -0.83 -0.69 0.00 0.00 174.62 173.47 2vvj s GLY 155 N -0.86 1.03 -0.09 4.40 0.00 0.61 -0.87 107.32 111.53 2vvj s GLY 155 Ca 0.04 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 44.02 2vvj s GLY 155 CO 0.01 0.34 -0.08 0.99 0.00 0.00 0.00 173.10 174.35 2vvj s ASP 156 N 1.14 4.50 -0.04 1.64 1.01 -0.53 -0.72 116.67 123.66 2vvj s ASP 156 Ca -0.04 -0.11 0.01 0.00 0.71 0.00 0.00 52.55 53.12 2vvj s ASP 156 Cb -0.14 -1.33 0.02 0.00 1.01 0.00 0.00 42.92 42.48 2vvj s ASP 156 CO -0.04 0.29 -0.04 -0.63 0.21 0.00 0.00 175.17 174.96 2vvj s ILE 157 N -0.37 0.50 -0.58 0.77 1.01 -0.34 -0.82 121.20 121.36 2vvj s ILE 157 Ca 0.05 -0.10 -0.26 0.00 0.00 0.00 0.00 60.65 60.34 2vvj s ILE 157 Cb -0.12 -0.53 0.04 0.00 0.01 0.00 0.00 42.46 41.85 2vvj s ILE 157 CO 0.02 0.22 1.07 -0.89 0.00 0.00 0.00 174.94 175.36 2vvj s THR 158 N 0.92 4.18 0.16 2.92 2.01 -1.26 -1.60 115.64 122.96 2vvj s THR 158 Ca -0.11 0.52 0.07 0.00 0.31 0.00 0.00 61.69 62.48 2vvj s THR 158 Cb -0.14 -4.65 -0.04 0.00 0.01 0.00 0.00 72.50 67.67 2vvj s THR 158 CO -0.00 -1.28 -0.01 -0.04 -0.69 0.00 0.00 174.62 172.60 2vvj s MET 159 N 4.51 2.40 -0.05 4.92 -1.94 0.15 -4.70 119.30 124.60 2vvj s MET 159 Ca 0.36 -1.07 -0.02 0.00 -1.71 0.00 0.00 55.69 53.25 2vvj s MET 159 Cb -0.10 -2.38 0.04 0.00 2.01 0.00 0.00 34.83 34.40 2vvj s MET 159 CO 0.21 0.47 0.09 0.00 -0.01 0.00 0.00 175.02 175.78 2vvj s ALA 160 N -1.64 -0.07 -0.15 3.03 0.00 -1.26 -1.34 121.76 120.34 2vvj s ALA 160 Ca 0.27 0.47 -0.16 0.00 0.00 0.00 0.00 51.96 52.54 2vvj s ALA 160 Cb -0.10 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 2vvj s ALA 160 CO 0.18 -0.20 0.41 -0.51 0.00 0.00 0.00 175.76 175.64 2vvj s LEU 161 N 1.32 4.24 0.11 0.00 1.43 -0.24 -0.95 118.68 124.58 2vvj s LEU 161 Ca -0.07 0.66 -0.30 0.00 -1.03 0.00 0.00 54.13 53.39 2vvj s LEU 161 Cb -0.12 -2.57 -0.06 0.00 0.03 0.00 0.00 46.19 43.47 2vvj s LEU 161 CO -0.04 0.01 1.18 -0.22 0.23 0.00 0.00 176.35 177.50 2vvj s LEU 162 N 0.74 4.41 0.31 1.79 2.96 0.93 -0.76 118.68 129.06 2vvj s LEU 162 Ca 0.22 2.07 0.08 0.00 -0.22 0.00 0.00 54.13 56.27 2vvj s LEU 162 Cb -0.14 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 42.93 2vvj s LEU 162 CO 0.08 -0.40 0.23 -0.76 -1.32 0.00 0.00 176.35 174.18 2vvj s LEU 163 N 0.52 3.60 0.25 -0.68 1.43 0.47 0.16 118.68 124.43 2vvj s LEU 163 Ca 0.56 -0.46 -0.31 0.00 -1.03 0.00 0.00 54.13 52.88 2vvj s LEU 163 Cb -0.30 -2.17 -0.12 0.00 0.03 0.00 0.00 46.19 43.63 2vvj s LEU 163 CO 0.32 -0.24 1.67 -1.61 0.23 0.00 0.00 176.35 176.72 2vvj s GLU 164 N -3.92 4.12 0.00 1.70 2.02 -0.25 -2.23 118.70 120.14 2vvj s GLU 164 Ca 0.38 2.60 0.00 0.00 0.02 0.00 0.00 54.97 57.97 2vvj s GLU 164 Cb -0.06 -3.05 0.00 0.00 0.10 0.00 0.00 34.13 31.12 2vvj s GLU 164 CO 0.25 -0.70 0.00 0.41 0.02 0.00 0.00 175.26 175.24 2vvj n GLY 165 N 3.18 0.84 2.64 -1.39 0.00 -1.26 -4.48 105.19 104.72 2vvj n GLY 165 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2vvj n GLY 165 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2vvj n ASN 166 N 0.00 -4.42 -4.91 1.61 5.15 -0.95 -5.00 115.26 106.74 2vvj n ASN 166 Ca 0.00 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 53.70 2vvj n ASN 166 Cb 0.00 -2.17 0.04 0.00 -0.53 0.00 0.00 39.78 37.12 2vvj n ASN 166 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2vvj s ALA 167 N -1.48 3.14 0.14 5.20 0.00 -1.25 -4.85 121.76 122.66 2vvj s ALA 167 Ca 0.00 -0.62 0.11 0.00 0.00 0.00 0.00 51.96 51.44 2vvj s ALA 167 Cb 0.00 -2.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 2vvj s ALA 167 CO 0.00 -0.99 -0.24 -1.01 0.00 0.00 0.00 175.76 173.51 2vvj s HIS 168 N -3.15 2.36 -0.21 0.00 3.76 -1.26 -0.39 115.29 116.39 2vvj s HIS 168 Ca 0.56 -0.35 0.00 0.00 -0.15 0.00 0.00 55.06 55.13 2vvj s HIS 168 Cb -0.11 -1.25 0.05 0.00 1.11 0.00 0.00 32.58 32.38 2vvj s HIS 168 CO 0.47 0.38 -0.06 -0.47 -0.85 0.00 0.00 174.74 174.21 2vvj s TYR 169 N -1.19 2.22 0.20 1.40 5.04 0.06 -4.95 117.35 120.13 2vvj s TYR 169 Ca 0.16 -1.55 -0.23 0.00 -2.44 0.00 0.00 57.07 53.00 2vvj s TYR 169 Cb -0.10 -1.52 -0.08 0.00 0.35 0.00 0.00 41.96 40.61 2vvj s TYR 169 CO 0.08 -0.73 0.78 1.03 -1.34 0.00 0.00 175.55 175.36 2vvj s ARG 170 N 1.46 4.46 -0.04 4.97 1.81 -1.26 -1.08 118.95 129.27 2vvj s ARG 170 Ca -0.03 1.08 -0.01 0.00 -1.72 0.00 0.00 55.73 55.04 2vvj s ARG 170 Cb -0.17 -3.07 0.03 0.00 -0.45 0.00 0.00 34.95 31.29 2vvj s ARG 170 CO -0.07 0.47 0.08 0.00 -0.68 0.00 0.00 175.30 175.11 2vvj s ASP 172 N 1.19 6.22 -0.06 0.00 1.01 -0.36 -0.68 116.67 124.00 2vvj s ASP 172 Ca -0.08 0.24 0.05 0.00 0.71 0.00 0.00 52.55 53.47 2vvj s ASP 172 Cb -0.12 -2.09 -0.02 0.00 1.01 0.00 0.00 42.92 41.70 2vvj s ASP 172 CO -0.04 0.19 -0.21 -0.55 0.21 0.00 0.00 175.17 174.76 2vvj s SER 173 N 0.31 3.39 -0.10 0.27 0.15 -0.63 -0.70 113.70 116.39 2vvj s SER 173 Ca 0.08 -0.41 0.00 0.00 0.70 0.00 0.00 55.95 56.32 2vvj s SER 173 Cb -0.11 -0.83 0.02 0.00 -1.71 0.00 0.00 66.02 63.39 2vvj s SER 173 CO -0.02 0.27 -0.08 -0.60 1.20 0.00 0.00 173.24 174.02 2vvj s ARG 174 N -0.32 1.47 -0.06 5.44 3.52 -0.89 -1.20 118.95 126.91 2vvj s ARG 174 Ca 0.02 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.41 2vvj s ARG 174 Cb -0.13 -1.48 -0.02 0.00 -1.56 0.00 0.00 34.95 31.77 2vvj s ARG 174 CO 0.02 -0.20 -0.21 0.99 -0.81 0.00 0.00 175.30 175.09 2vvj s THR 175 N 1.49 2.47 -0.10 4.11 2.01 0.10 -1.47 115.64 124.25 2vvj s THR 175 Ca 0.00 -0.93 -0.00 0.00 0.31 0.00 0.00 61.69 61.07 2vvj s THR 175 Cb -0.13 -1.93 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 2vvj s THR 175 CO -0.05 0.57 -0.08 0.42 -0.69 0.00 0.00 174.62 174.79 2vvj s THR 176 N -0.36 3.61 -0.13 -0.82 -4.23 -0.18 -0.29 115.64 113.25 2vvj s THR 176 Ca 0.03 -0.49 0.02 0.00 -1.18 0.00 0.00 61.69 60.07 2vvj s THR 176 Cb -0.12 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2vvj s THR 176 CO 0.02 0.56 -0.20 -0.31 -0.54 0.00 0.00 174.62 174.15 2vvj s TYR 177 N -0.30 2.68 -0.15 3.99 2.02 0.49 -1.95 117.35 124.13 2vvj s TYR 177 Ca 0.04 -1.08 -0.01 0.00 -0.37 0.00 0.00 57.07 55.65 2vvj s TYR 177 Cb -0.13 -1.80 0.04 0.00 -0.40 0.00 0.00 41.96 39.68 2vvj s TYR 177 CO 0.02 -0.46 -0.02 0.15 -1.57 0.00 0.00 175.55 173.67 2vvj s LYS 178 N 0.59 1.09 0.46 -0.62 1.02 -0.14 -3.92 119.74 118.22 2vvj s LYS 178 Ca -0.11 -0.37 -0.24 0.00 0.02 0.00 0.00 55.97 55.26 2vvj s LYS 178 Cb -0.16 -1.83 -0.07 0.00 -0.52 0.00 0.00 37.83 35.24 2vvj s LYS 178 CO 0.03 -0.46 1.30 0.00 -0.92 0.00 0.00 175.35 175.31 2vvj s ALA 179 N 1.75 3.09 0.18 5.17 0.00 -1.26 -1.20 121.76 129.49 2vvj s ALA 179 Ca 0.01 1.22 0.02 0.00 0.00 0.00 0.00 51.96 53.21 2vvj s ALA 179 Cb -0.15 -3.50 0.06 0.00 0.00 0.00 0.00 23.12 19.53 2vvj s ALA 179 CO -0.07 -0.97 1.43 0.87 0.00 0.00 0.00 175.76 177.02 2vvj h LYS 180 N 2.20 0.25 -6.15 0.00 1.57 -1.47 -3.47 116.57 109.51 2vvj h LYS 180 Ca -0.50 -0.24 -0.54 0.00 -1.87 0.00 0.00 60.65 57.50 2vvj h LYS 180 Cb 1.26 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.55 2vvj h LYS 180 CO 0.61 0.92 -0.57 -1.83 -0.57 0.00 0.00 179.45 178.00 2vvj s GLU 181 N -3.41 2.44 0.79 3.15 -1.05 -1.26 -5.06 118.70 114.30 2vvj s GLU 181 Ca -0.04 -1.42 -0.11 0.00 -0.15 0.00 0.00 54.97 53.26 2vvj s GLU 181 Cb 0.11 -2.24 0.07 0.00 -0.44 0.00 0.00 34.13 31.62 2vvj s GLU 181 CO 0.82 0.24 1.09 -1.59 0.95 0.00 0.00 175.26 176.78 2vvj s LYS 182 N -3.79 2.11 0.00 -4.83 0.00 -1.26 -4.32 119.74 107.65 2vvj s LYS 182 Ca 0.35 1.06 0.00 0.00 0.00 0.00 0.00 55.97 57.38 2vvj s LYS 182 Cb -0.05 -1.89 0.00 0.00 0.00 0.00 0.00 37.83 35.89 2vvj s LYS 182 CO 0.22 -1.71 0.00 0.41 0.00 0.00 0.00 175.35 174.27 2vvj n GLY 183 N -1.29 0.76 3.64 0.59 0.00 -1.26 -5.02 105.19 102.61 2vvj n GLY 183 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2vvj n GLY 183 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vvj s VAL 184 N -2.69 4.60 0.30 1.61 1.01 -1.26 -4.91 120.40 119.07 2vvj s VAL 184 Ca 0.00 1.75 -0.29 0.00 0.00 0.00 0.00 61.98 63.44 2vvj s VAL 184 Cb 0.00 -4.34 -0.10 0.00 0.00 0.00 0.00 36.38 31.93 2vvj s VAL 184 CO 0.00 -0.35 1.38 -0.75 0.00 0.00 0.00 175.10 175.38 2vvj s LYS 185 N 3.41 4.29 0.01 2.72 2.20 -1.26 -5.00 119.74 126.10 2vvj s LYS 185 Ca 0.43 2.30 -0.21 0.00 -0.36 0.00 0.00 55.97 58.13 2vvj s LYS 185 Cb -0.13 -3.07 -0.06 0.00 -1.51 0.00 0.00 37.83 33.06 2vvj s LYS 185 CO 0.12 -0.33 0.60 -0.51 -0.36 0.00 0.00 175.35 174.87 2vvj s LEU 186 N -1.26 4.43 0.61 5.43 1.43 -1.26 -4.68 118.68 123.38 2vvj s LEU 186 Ca 0.54 1.19 -0.12 0.00 -1.03 0.00 0.00 54.13 54.71 2vvj s LEU 186 Cb -0.41 -2.94 -0.04 0.00 0.03 0.00 0.00 46.19 42.82 2vvj s LEU 186 CO 0.50 0.12 1.03 -2.16 0.23 0.00 0.00 176.35 176.07 2vvj s PRO 187 N -0.30 3.63 0.89 1.29 0.04 -1.26 -5.00 135.00 134.29 2vvj s PRO 187 Ca 0.31 0.77 -0.13 0.00 0.04 0.00 0.00 61.00 61.99 2vvj s PRO 187 Cb -0.18 -2.09 0.13 0.00 0.04 0.00 0.00 34.50 32.40 2vvj s PRO 187 CO 0.18 -0.54 1.16 0.20 0.04 0.00 0.00 177.00 178.04 2vvj s GLY 188 N -4.07 1.59 0.07 0.56 0.00 -1.26 -4.64 107.32 99.57 2vvj s GLY 188 Ca 0.55 -0.62 -0.37 0.00 0.00 0.00 0.00 44.72 44.28 2vvj s GLY 188 CO 0.52 -0.06 1.36 2.98 0.00 0.00 0.00 173.10 177.89 2vvj n TYR 189 N -3.64 1.54 -4.05 1.90 9.36 -1.26 -4.83 117.16 116.18 2vvj n TYR 189 Ca 0.08 0.63 -0.12 0.00 3.32 0.00 0.00 57.90 61.81 2vvj n TYR 189 Cb 0.60 -2.34 -0.05 0.00 -0.63 0.00 0.00 39.34 36.92 2vvj n TYR 189 CO 0.00 0.00 0.00 -3.38 0.22 0.00 0.00 176.86 173.70 2vvj s HIS 190 N 0.62 0.74 0.12 2.98 -3.43 -0.61 -4.99 115.29 110.72 2vvj s HIS 190 Ca 0.85 -1.05 0.11 0.00 -0.80 0.00 0.00 55.06 54.16 2vvj s HIS 190 Cb -0.96 0.03 -0.04 0.00 -1.43 0.00 0.00 32.58 30.19 2vvj s HIS 190 CO 0.47 -1.06 -0.26 -0.51 -2.00 0.00 0.00 174.74 171.39 2vvj s LEU 191 N -3.13 2.36 -0.20 5.38 1.02 -0.34 -0.68 118.68 123.08 2vvj s LEU 191 Ca 0.27 -0.71 -0.01 0.00 0.02 0.00 0.00 54.13 53.70 2vvj s LEU 191 Cb -0.00 -1.27 0.06 0.00 0.02 0.00 0.00 46.19 45.00 2vvj s LEU 191 CO 0.15 0.19 -0.00 -0.69 0.02 0.00 0.00 176.35 176.01 2vvj s VAL 192 N -1.05 0.88 0.25 -1.59 1.01 0.01 -0.70 120.40 119.22 2vvj s VAL 192 Ca 0.14 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 61.08 2vvj s VAL 192 Cb -0.10 -1.28 -0.09 0.00 0.00 0.00 0.00 36.38 34.91 2vvj s VAL 192 CO 0.06 -0.13 1.17 -1.81 0.00 0.00 0.00 175.10 174.39 2vvj s ASP 193 N 1.70 7.13 0.05 3.32 1.01 -0.29 -0.32 116.67 129.26 2vvj s ASP 193 Ca -0.02 2.32 0.05 0.00 0.71 0.00 0.00 52.55 55.61 2vvj s ASP 193 Cb -0.17 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.11 2vvj s ASP 193 CO -0.07 -0.28 -0.15 -1.00 0.21 0.00 0.00 175.17 173.87 2vvj s HIS 194 N -0.76 1.32 -0.05 4.23 3.76 0.24 -1.83 115.29 122.21 2vvj s HIS 194 Ca 0.48 -0.37 -0.02 0.00 -0.15 0.00 0.00 55.06 55.00 2vvj s HIS 194 Cb -0.33 -0.78 0.04 0.00 1.11 0.00 0.00 32.58 32.62 2vvj s HIS 194 CO 0.41 0.05 0.10 0.00 -0.85 0.00 0.00 174.74 174.45 2vvj s ILE 196 N 1.58 1.45 -0.13 0.00 2.07 -1.26 -1.40 121.20 123.51 2vvj s ILE 196 Ca -0.04 -0.80 -0.08 0.00 -1.41 0.00 0.00 60.65 58.32 2vvj s ILE 196 Cb -0.12 -1.21 0.05 0.00 0.13 0.00 0.00 42.46 41.30 2vvj s ILE 196 CO -0.04 0.40 0.31 -0.70 -1.91 0.00 0.00 174.94 173.00 2vvj s GLU 197 N -0.46 0.30 -0.48 3.50 2.12 -0.14 -4.58 118.70 118.96 2vvj s GLU 197 Ca 0.07 0.58 -0.28 0.00 0.36 0.00 0.00 54.97 55.70 2vvj s GLU 197 Cb -0.07 -0.01 0.03 0.00 0.26 0.00 0.00 34.13 34.34 2vvj s GLU 197 CO -0.01 -0.13 1.07 0.42 -0.54 0.00 0.00 175.26 176.07 2vvj s ILE 198 N 0.99 4.29 0.07 -3.70 1.01 -1.26 -0.71 121.20 121.88 2vvj s ILE 198 Ca -0.07 1.03 -0.16 0.00 0.00 0.00 0.00 60.65 61.45 2vvj s ILE 198 Cb -0.07 -4.55 -0.16 0.00 0.01 0.00 0.00 42.46 37.68 2vvj s ILE 198 CO -0.07 -0.97 1.28 -0.07 0.00 0.00 0.00 174.94 175.10 2vvj h LEU 199 N 11.04 0.74 -7.49 2.97 3.38 -0.88 -3.47 115.31 121.59 2vvj h LEU 199 Ca -0.23 -0.61 -0.04 0.00 0.09 0.00 0.00 57.88 57.08 2vvj h LEU 199 Cb 1.07 -0.22 -0.12 0.00 0.09 0.00 0.00 40.66 41.48 2vvj h LEU 199 CO 1.10 1.23 -0.04 -0.94 0.09 0.00 0.00 178.44 179.87 2vvj s SER 200 N -6.79 -0.24 0.11 -0.43 1.04 -1.22 -5.01 113.70 101.17 2vvj s SER 200 Ca -0.12 -0.37 -0.22 0.00 0.48 0.00 0.00 55.95 55.71 2vvj s SER 200 Cb 0.07 0.51 0.06 0.00 0.10 0.00 0.00 66.02 66.76 2vvj s SER 200 CO 0.85 -0.92 0.56 -1.38 0.98 0.00 0.00 173.24 173.33 2vvj s HIS 201 N -3.83 -0.47 0.85 5.02 -3.43 -1.26 -0.59 115.29 111.59 2vvj s HIS 201 Ca 0.05 0.35 -0.12 0.00 -0.80 0.00 0.00 55.06 54.55 2vvj s HIS 201 Cb 0.01 0.45 0.14 0.00 -1.43 0.00 0.00 32.58 31.75 2vvj s HIS 201 CO -0.09 -0.76 1.20 0.16 -2.00 0.00 0.00 174.74 173.25 2vvj s ASP 202 N -2.47 3.90 0.22 7.38 -4.77 -0.70 -4.97 116.67 115.26 2vvj s ASP 202 Ca -0.01 0.37 -0.08 0.00 -3.30 0.00 0.00 52.55 49.53 2vvj s ASP 202 Cb -0.00 -0.67 0.33 0.00 -1.09 0.00 0.00 42.92 41.49 2vvj s ASP 202 CO -0.09 -2.23 1.73 0.50 0.70 0.00 0.00 175.17 175.78 2vvj h LYS 203 N -1.20 0.39 -0.24 2.11 3.64 -2.02 -2.28 116.57 116.97 2vvj h LYS 203 Ca -0.44 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 2vvj h LYS 203 Cb 1.28 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 2vvj h LYS 203 CO 0.49 0.26 0.00 -0.25 -2.27 0.00 0.00 179.45 177.68 2vvj n ASP 204 N -5.02 2.33 -2.37 4.20 8.00 -1.26 -4.92 116.55 117.51 2vvj n ASP 204 Ca 0.10 -1.82 -0.21 0.00 0.71 0.00 0.00 54.79 53.57 2vvj n ASP 204 Cb 0.32 -0.15 -0.01 0.00 -0.02 0.00 0.00 41.12 41.25 2vvj n ASP 204 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2vvj n TYR 205 N 0.76 -0.97 0.19 1.24 4.02 -0.86 -4.34 117.16 117.20 2vvj n TYR 205 Ca 0.17 0.00 0.06 0.00 -0.01 0.00 0.00 57.90 58.13 2vvj n TYR 205 Cb 0.43 -3.93 0.30 0.00 -0.02 0.00 0.00 39.34 36.12 2vvj n TYR 205 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 2vvj h ASN 206 N 0.00 0.00 -3.43 7.72 2.35 -1.91 -3.43 115.58 116.87 2vvj h ASN 206 Ca -0.49 0.00 -0.45 0.00 -0.55 0.00 0.00 56.30 54.81 2vvj h ASN 206 Cb 1.36 0.00 -0.34 0.00 0.05 0.00 0.00 38.32 39.40 2vvj h ASN 206 CO 0.58 0.35 -0.79 -0.54 -1.65 0.00 0.00 177.43 175.38 2vvj s LYS 207 N -3.47 1.16 -0.02 0.81 1.02 -1.26 -0.52 119.74 117.47 2vvj s LYS 207 Ca 0.01 -0.22 -0.01 0.00 0.02 0.00 0.00 55.97 55.77 2vvj s LYS 207 Cb 0.10 -1.07 0.01 0.00 -0.52 0.00 0.00 37.83 36.35 2vvj s LYS 207 CO 0.68 -0.05 0.04 0.08 -0.92 0.00 0.00 175.35 175.18 2vvj s VAL 208 N 0.87 -0.02 -0.27 3.17 1.01 -0.49 -1.72 120.40 122.96 2vvj s VAL 208 Ca -0.12 0.06 -0.08 0.00 0.00 0.00 0.00 61.98 61.85 2vvj s VAL 208 Cb -0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 36.38 36.13 2vvj s VAL 208 CO 0.01 0.02 0.09 -0.75 0.00 0.00 0.00 175.10 174.47 2vvj s LYS 209 N 0.32 3.54 0.03 2.72 2.20 0.25 -0.02 119.74 128.78 2vvj s LYS 209 Ca -0.03 -0.56 0.04 0.00 -0.36 0.00 0.00 55.97 55.06 2vvj s LYS 209 Cb -0.04 -3.38 -0.04 0.00 -1.51 0.00 0.00 37.83 32.87 2vvj s LYS 209 CO -0.01 -0.26 -0.05 -1.17 -0.36 0.00 0.00 175.35 173.50 2vvj s LEU 210 N 1.61 3.23 -0.00 5.43 2.96 -0.08 -0.13 118.68 131.69 2vvj s LEU 210 Ca 0.06 -0.17 0.01 0.00 -0.22 0.00 0.00 54.13 53.81 2vvj s LEU 210 Cb -0.16 -1.90 0.00 0.00 0.50 0.00 0.00 46.19 44.64 2vvj s LEU 210 CO 0.04 0.25 -0.02 -0.47 -1.32 0.00 0.00 176.35 174.83 2vvj s TYR 211 N -1.08 0.20 0.02 5.38 5.04 0.11 -1.08 117.35 125.94 2vvj s TYR 211 Ca 0.19 -0.03 0.02 0.00 -2.44 0.00 0.00 57.07 54.81 2vvj s TYR 211 Cb -0.11 -0.14 -0.02 0.00 0.35 0.00 0.00 41.96 42.04 2vvj s TYR 211 CO 0.10 -0.01 -0.08 -2.00 -1.34 0.00 0.00 175.55 172.22 2vvj s GLU 212 N 0.02 0.55 -0.05 4.97 2.12 -0.43 -0.97 118.70 124.90 2vvj s GLU 212 Ca 0.00 -0.52 0.01 0.00 0.36 0.00 0.00 54.97 54.81 2vvj s GLU 212 Cb -0.02 -0.43 0.02 0.00 0.26 0.00 0.00 34.13 33.96 2vvj s GLU 212 CO -0.00 0.10 -0.04 -1.58 -0.54 0.00 0.00 175.26 173.20 2vvj s HIS 213 N -0.79 0.73 -0.01 5.30 5.65 -0.50 -2.06 115.29 123.63 2vvj s HIS 213 Ca -0.03 -0.21 0.01 0.00 0.25 0.00 0.00 55.06 55.08 2vvj s HIS 213 Cb -0.06 -0.69 0.01 0.00 -1.18 0.00 0.00 32.58 30.65 2vvj s HIS 213 CO 0.00 -0.22 -0.02 0.00 -0.65 0.00 0.00 174.74 173.86 2vvj s ALA 214 N 1.10 0.24 -0.06 1.58 0.00 -0.16 -1.33 121.76 123.14 2vvj s ALA 214 Ca -0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.84 2vvj s ALA 214 Cb -0.14 -0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.88 2vvj s ALA 214 CO -0.01 0.02 0.00 0.08 0.00 0.00 0.00 175.76 175.85 2vvj s VAL 215 N 0.23 0.32 0.25 0.00 1.01 -0.76 -1.18 120.40 120.28 2vvj s VAL 215 Ca -0.02 0.12 -0.26 0.00 0.00 0.00 0.00 61.98 61.82 2vvj s VAL 215 Cb -0.05 -0.46 -0.09 0.00 0.00 0.00 0.00 36.38 35.78 2vvj s VAL 215 CO -0.01 0.23 0.87 0.00 0.00 0.00 0.00 175.10 176.20 2vvj s ALA 216 N 1.73 3.33 0.32 5.51 0.00 -0.08 -1.14 121.76 131.42 2vvj s ALA 216 Ca 0.01 0.45 -0.12 0.00 0.00 0.00 0.00 51.96 52.30 2vvj s ALA 216 Cb -0.13 -3.08 0.02 0.00 0.00 0.00 0.00 23.12 19.93 2vvj s ALA 216 CO -0.04 0.23 0.61 -3.38 0.00 0.00 0.00 175.76 173.18 2vvj s HIS 217 N -1.40 0.43 -2.62 0.00 -3.43 0.12 -4.43 115.29 103.96 2vvj s HIS 217 Ca 0.44 -0.86 0.23 0.00 -0.80 0.00 0.00 55.06 54.06 2vvj s HIS 217 Cb -0.21 0.38 0.29 0.00 -1.43 0.00 0.00 32.58 31.61 2vvj s HIS 217 CO 0.26 -1.25 1.30 0.43 -2.00 0.00 0.00 174.74 173.48 2vvj n SER 218 N -1.03 3.16 -0.27 7.38 7.64 -1.26 -1.20 113.62 128.05 2vvj n SER 218 Ca -0.03 -1.97 0.02 0.00 1.01 0.00 0.00 58.87 57.91 2vvj n SER 218 Cb 0.61 -0.12 -0.01 0.00 -1.01 0.00 0.00 64.21 63.68 2vvj n SER 218 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vvj n GLY 219 N 1.36 -2.04 3.75 0.23 0.00 -1.26 -4.87 105.19 102.36 2vvj n GLY 219 Ca 0.16 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 2vvj n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vvj s LEU 220 N 0.00 3.52 0.54 0.99 1.43 -1.26 -2.21 118.68 121.69 2vvj s LEU 220 Ca 0.00 2.25 0.32 0.00 -1.03 0.00 0.00 54.13 55.67 2vvj s LEU 220 Cb 0.00 -4.58 1.27 0.00 0.03 0.00 0.00 46.19 42.91 2vvj s LEU 220 CO 0.00 -1.71 1.95 1.55 0.23 0.00 0.00 176.35 178.36 2vvj h PRO 221 N 0.42 0.00 0.00 1.29 0.13 -2.07 -3.55 132.00 128.22 2vvj h PRO 221 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2vvj h PRO 221 Cb 1.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.41 2vvj h PRO 221 CO 0.54 0.02 0.00 -3.47 -0.23 0.00 0.00 178.00 174.85