#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vgr s LYS 3 N 0.00 4.21 0.31 -2.82 1.02 -1.26 -4.60 119.74 116.60 1vgr s LYS 3 Ca 0.00 0.33 0.09 0.00 0.02 0.00 0.00 55.97 56.41 1vgr s LYS 3 Cb 0.00 -3.53 0.87 0.00 -0.52 0.00 0.00 37.83 34.65 1vgr s LYS 3 CO 0.00 -0.05 1.71 -1.35 -0.92 0.00 0.00 175.35 174.74 1vgr h PRO 4 N 7.29 0.48 -0.27 -1.68 0.11 -1.92 -2.33 132.00 133.68 1vgr h PRO 4 Ca -0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1vgr h PRO 4 Cb 1.16 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1vgr h PRO 4 CO 0.73 0.32 0.00 1.28 -0.21 0.00 0.00 178.00 180.12 1vgr n LEU 5 N -4.96 3.68 -4.59 2.35 4.77 -0.09 -5.00 117.00 113.16 1vgr n LEU 5 Ca 0.26 -2.84 -0.59 0.00 -0.03 0.00 0.00 56.01 52.81 1vgr n LEU 5 Cb 0.76 -0.49 -0.08 0.00 -2.33 0.00 0.00 43.42 41.28 1vgr n LEU 5 CO 0.14 0.68 0.84 0.47 -1.33 0.00 0.00 177.39 178.20 1vgr n ASP 6 N -0.36 0.87 0.00 -1.43 8.00 -0.88 -1.65 116.55 121.09 1vgr n ASP 6 Ca 0.19 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.84 1vgr n ASP 6 Cb 0.80 -1.00 0.00 0.00 -0.02 0.00 0.00 41.12 40.91 1vgr n ASP 6 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vgr n GLY 7 N 2.52 1.36 3.62 0.44 0.00 -1.26 -4.99 105.19 106.89 1vgr n GLY 7 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 1vgr n GLY 7 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vgr s ILE 8 N -2.92 4.95 -0.29 -0.61 -1.09 -0.66 -4.97 121.20 115.61 1vgr s ILE 8 Ca 0.00 1.16 -0.17 0.00 -2.23 0.00 0.00 60.65 59.42 1vgr s ILE 8 Cb 0.00 -3.97 -0.02 0.00 -1.58 0.00 0.00 42.46 36.88 1vgr s ILE 8 CO 0.00 -0.02 0.46 0.20 -1.23 0.00 0.00 174.94 174.35 1vgr s ASN 9 N 1.48 6.33 -0.21 3.58 0.01 -1.26 -1.00 114.94 123.86 1vgr s ASN 9 Ca 0.27 0.28 -0.04 0.00 -0.71 0.00 0.00 52.86 52.66 1vgr s ASN 9 Cb -0.15 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.24 1vgr s ASN 9 CO 0.09 -0.30 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.66 1vgr s VAL 10 N 2.23 3.56 -0.51 1.60 1.01 0.63 -0.84 120.40 128.09 1vgr s VAL 10 Ca 0.18 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.54 1vgr s VAL 10 Cb -0.16 -2.62 0.07 0.00 0.00 0.00 0.00 36.38 33.67 1vgr s VAL 10 CO 0.10 0.43 0.60 -0.22 0.00 0.00 0.00 175.10 176.01 1vgr s LEU 11 N 1.29 5.10 -0.53 3.92 2.96 0.09 -0.90 118.68 130.61 1vgr s LEU 11 Ca 0.04 -1.02 -0.09 0.00 -0.22 0.00 0.00 54.13 52.83 1vgr s LEU 11 Cb -0.14 -2.40 0.14 0.00 0.50 0.00 0.00 46.19 44.28 1vgr s LEU 11 CO -0.01 -0.88 0.41 -0.62 -1.32 0.00 0.00 176.35 173.93 1vgr s ASP 12 N 2.78 5.76 -0.04 3.68 2.15 0.10 -0.97 116.67 130.14 1vgr s ASP 12 Ca 0.13 -2.12 0.08 0.00 0.43 0.00 0.00 52.55 51.08 1vgr s ASP 12 Cb -0.20 -2.02 0.30 0.00 -0.30 0.00 0.00 42.92 40.70 1vgr s ASP 12 CO 0.11 -0.64 1.15 0.49 -0.17 0.00 0.00 175.17 176.10 1vgr n PHE 13 N 4.63 0.59 -2.40 -5.34 3.01 0.68 -0.86 117.46 117.77 1vgr n PHE 13 Ca -0.04 -0.24 -0.26 0.00 1.01 0.00 0.00 57.45 57.92 1vgr n PHE 13 Cb 0.41 -0.10 0.04 0.00 -0.01 0.00 0.00 39.48 39.81 1vgr n PHE 13 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1vgr s THR 14 N -1.64 3.43 0.25 4.37 -4.23 -1.24 -4.51 115.64 112.07 1vgr s THR 14 Ca 0.21 -0.08 -0.12 0.00 -1.18 0.00 0.00 61.69 60.52 1vgr s THR 14 Cb 0.13 -3.37 -0.00 0.00 1.34 0.00 0.00 72.50 70.60 1vgr s THR 14 CO 0.11 -0.38 0.47 -1.38 -0.54 0.00 0.00 174.62 172.91 1vgr s HIS 15 N -3.00 0.39 0.00 3.99 -3.43 -1.26 -4.80 115.29 107.17 1vgr s HIS 15 Ca 0.55 -0.75 0.00 0.00 -0.80 0.00 0.00 55.06 54.06 1vgr s HIS 15 Cb -0.11 0.18 0.00 0.00 -1.43 0.00 0.00 32.58 31.22 1vgr s HIS 15 CO 0.45 -0.99 0.00 0.28 -2.00 0.00 0.00 174.74 172.47 1vgr n VAL 16 N -0.38 0.00 0.02 -5.38 0.31 -1.26 -4.41 118.33 107.23 1vgr n VAL 16 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1vgr n VAL 16 Cb 0.62 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.55 1vgr n VAL 16 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1vgr n GLN 17 N 7.57 0.00 0.23 5.55 7.27 -1.26 -4.59 117.38 132.15 1vgr n GLN 17 Ca 0.00 0.00 -0.17 0.00 0.07 0.00 0.00 57.00 56.90 1vgr n GLN 17 Cb 0.00 -0.30 -0.09 0.00 2.41 0.00 0.00 30.24 32.27 1vgr n GLN 17 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1vgr h ALA 18 N 0.00 -0.96 0.53 1.69 0.00 -1.79 0.12 119.26 118.85 1vgr h ALA 18 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1vgr h ALA 18 Cb 0.44 0.68 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1vgr h ALA 18 CO 0.00 -1.08 -0.26 0.78 0.00 0.00 0.00 179.25 178.68 1vgr h GLY 19 N -0.85 -0.76 1.02 0.00 0.00 -1.87 -2.85 103.07 97.76 1vgr h GLY 19 Ca -0.03 0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.62 1vgr h GLY 19 CO -0.12 -0.28 0.58 -2.55 0.00 0.00 0.00 176.54 174.18 1vgr h PRO 20 N -0.72 1.08 -0.90 4.80 0.11 -1.75 -1.98 132.00 132.64 1vgr h PRO 20 Ca -0.07 -0.07 0.07 0.00 0.11 0.00 0.00 66.00 66.04 1vgr h PRO 20 Cb 0.56 -0.24 -0.07 0.00 0.11 0.00 0.00 31.00 31.36 1vgr h PRO 20 CO 0.11 0.72 0.56 0.00 -0.21 0.00 0.00 178.00 179.18 1vgr h ALA 21 N 1.48 1.25 0.19 -0.75 0.00 -0.73 -0.05 119.26 120.64 1vgr h ALA 21 Ca 0.35 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.24 1vgr h ALA 21 Cb 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1vgr h ALA 21 CO -0.10 0.30 -0.09 0.00 0.00 0.00 0.00 179.25 179.36 1vgr h THR 23 N -0.45 1.47 -0.53 0.00 1.35 -1.30 -1.66 112.91 111.79 1vgr h THR 23 Ca -0.03 -2.28 -0.01 0.00 -0.55 0.00 0.00 66.41 63.54 1vgr h THR 23 Cb 0.35 2.22 -0.02 0.00 -1.73 0.00 0.00 68.15 68.97 1vgr h THR 23 CO 0.04 0.65 0.28 -0.61 -0.25 0.00 0.00 175.52 175.64 1vgr h GLN 24 N 0.02 0.75 -0.15 4.72 4.15 -1.04 0.76 115.11 124.32 1vgr h GLN 24 Ca -0.01 -0.09 -0.14 0.00 0.77 0.00 0.00 58.65 59.18 1vgr h GLN 24 Cb 1.19 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.73 1vgr h GLN 24 CO 0.09 0.59 -0.51 1.98 -1.93 0.00 0.00 178.83 179.05 1vgr h MET 25 N 0.71 0.40 -0.62 1.69 4.05 -1.20 -0.29 114.93 119.67 1vgr h MET 25 Ca 0.18 -0.23 -0.07 0.00 -0.28 0.00 0.00 59.70 59.30 1vgr h MET 25 Cb 0.07 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.86 1vgr h MET 25 CO -0.03 0.81 0.11 0.52 0.23 0.00 0.00 176.91 178.56 1vgr h MET 26 N 0.31 0.99 -0.63 0.39 2.86 -1.03 -2.00 114.93 115.82 1vgr h MET 26 Ca 0.01 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 1vgr h MET 26 Cb 1.00 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.50 1vgr h MET 26 CO 0.09 0.90 0.32 0.78 1.06 0.00 0.00 176.91 180.06 1vgr h GLY 27 N 1.03 0.97 2.00 8.32 0.00 -0.26 0.07 103.07 115.20 1vgr h GLY 27 Ca 0.19 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1vgr h GLY 27 CO 0.01 0.45 -0.05 0.74 0.00 0.00 0.00 176.54 177.68 1vgr h PHE 28 N 0.87 0.00 -0.59 5.60 -1.00 -0.69 -0.96 116.94 120.18 1vgr h PHE 28 Ca 0.22 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.00 1vgr h PHE 28 Cb 0.10 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.66 1vgr h PHE 28 CO -0.00 0.05 0.00 1.28 -1.61 0.00 0.00 178.31 178.03 1vgr n LEU 29 N -3.86 3.14 0.00 1.54 4.77 -0.78 -4.47 117.00 117.33 1vgr n LEU 29 Ca -0.03 -1.57 0.00 0.00 -0.03 0.00 0.00 56.01 54.39 1vgr n LEU 29 Cb 0.14 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 1vgr n LEU 29 CO 0.29 0.78 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 1vgr n GLY 30 N 1.43 0.63 3.76 -0.72 0.00 -0.36 -0.91 105.19 109.02 1vgr n GLY 30 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1vgr n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgr n ALA 31 N -1.25 1.99 -2.76 4.61 0.00 -0.04 -3.66 120.51 119.41 1vgr n ALA 31 Ca 0.00 0.22 -0.42 0.00 0.00 0.00 0.00 53.44 53.24 1vgr n ALA 31 Cb 0.00 -2.39 -0.04 0.00 0.00 0.00 0.00 19.45 17.02 1vgr n ALA 31 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1vgr s ASN 32 N -0.55 6.17 -0.25 0.00 3.04 -0.17 -4.37 114.94 118.81 1vgr s ASN 32 Ca 0.63 -0.80 -0.09 0.00 0.04 0.00 0.00 52.86 52.64 1vgr s ASN 32 Cb -0.44 -2.46 -0.04 0.00 -1.54 0.00 0.00 41.25 36.77 1vgr s ASN 32 CO 0.56 -1.56 0.12 -0.69 -3.04 0.00 0.00 177.10 172.49 1vgr s VAL 33 N 4.58 4.90 -0.37 -5.21 1.01 -1.26 -0.27 120.40 123.78 1vgr s VAL 33 Ca 0.26 0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.21 1vgr s VAL 33 Cb -0.14 -3.29 0.07 0.00 0.00 0.00 0.00 36.38 33.02 1vgr s VAL 33 CO 0.12 0.33 0.16 -0.63 0.00 0.00 0.00 175.10 175.08 1vgr s ILE 34 N 1.36 3.67 -0.32 2.22 1.01 -0.08 -2.04 121.20 127.01 1vgr s ILE 34 Ca 0.06 -1.49 -0.28 0.00 0.00 0.00 0.00 60.65 58.94 1vgr s ILE 34 Cb -0.15 -3.24 0.02 0.00 0.01 0.00 0.00 42.46 39.10 1vgr s ILE 34 CO 0.06 -0.40 1.03 -0.75 0.00 0.00 0.00 174.94 174.88 1vgr s LYS 35 N 1.32 4.04 -0.09 2.79 2.20 0.85 -0.72 119.74 130.12 1vgr s LYS 35 Ca 0.02 0.98 -0.20 0.00 -0.36 0.00 0.00 55.97 56.41 1vgr s LYS 35 Cb -0.21 -3.74 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 1vgr s LYS 35 CO 0.00 -0.88 0.55 0.42 -0.36 0.00 0.00 175.35 175.08 1vgr s ILE 36 N 3.57 5.12 0.09 5.43 1.01 -0.04 -1.14 121.20 135.24 1vgr s ILE 36 Ca 0.43 1.12 0.02 0.00 0.00 0.00 0.00 60.65 62.23 1vgr s ILE 36 Cb -0.12 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 1vgr s ILE 36 CO 0.15 0.32 -0.08 -1.61 0.00 0.00 0.00 174.94 173.72 1vgr s GLU 37 N 0.57 0.80 0.35 2.79 2.02 -0.58 -4.64 118.70 120.02 1vgr s GLU 37 Ca 0.30 -1.22 -0.28 0.00 0.02 0.00 0.00 54.97 53.78 1vgr s GLU 37 Cb -0.16 -0.30 -0.11 0.00 0.10 0.00 0.00 34.13 33.66 1vgr s GLU 37 CO 0.13 0.02 1.40 1.03 0.02 0.00 0.00 175.26 177.86 1vgr s ARG 38 N -3.29 4.23 0.45 1.61 0.52 -1.26 -0.95 118.95 120.26 1vgr s ARG 38 Ca 0.08 2.40 -0.25 0.00 -0.52 0.00 0.00 55.73 57.43 1vgr s ARG 38 Cb 0.01 -3.02 -0.08 0.00 0.52 0.00 0.00 34.95 32.38 1vgr s ARG 38 CO -0.03 -0.37 1.43 1.03 0.02 0.00 0.00 175.30 177.38 1vgr s ARG 39 N -1.93 3.68 0.00 3.54 0.52 -1.26 -0.83 118.95 122.66 1vgr s ARG 39 Ca 0.51 2.42 0.00 0.00 -0.52 0.00 0.00 55.73 58.14 1vgr s ARG 39 Cb -0.43 -2.65 0.00 0.00 0.52 0.00 0.00 34.95 32.39 1vgr s ARG 39 CO 0.58 -0.82 0.00 0.41 0.02 0.00 0.00 175.30 175.49 1vgr n GLY 40 N 0.58 2.06 0.01 -3.53 0.00 -1.26 -4.31 105.19 98.73 1vgr n GLY 40 Ca 0.05 -0.22 0.08 0.00 0.00 0.00 0.00 46.02 45.93 1vgr n GLY 40 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vgr n SER 41 N 3.92 1.31 -0.07 1.61 3.41 -1.25 -5.10 113.62 117.46 1vgr n SER 41 Ca 0.00 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 1vgr n SER 41 Cb 0.00 1.55 0.00 0.00 -0.26 0.00 0.00 64.21 65.50 1vgr n SER 41 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vgr n GLY 42 N 1.57 0.75 3.61 5.00 0.00 -0.01 -4.60 105.19 111.51 1vgr n GLY 42 Ca -0.02 -0.84 -0.54 0.00 0.00 0.00 0.00 46.02 44.63 1vgr n GLY 42 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vgr n ASP 43 N -3.16 1.73 0.32 1.61 -0.08 -1.26 -4.47 116.55 111.24 1vgr n ASP 43 Ca 0.00 1.11 0.17 0.00 -1.51 0.00 0.00 54.79 54.57 1vgr n ASP 43 Cb 0.00 -1.16 0.93 0.00 2.34 0.00 0.00 41.12 43.22 1vgr n ASP 43 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1vgr h MET 44 N 5.08 0.00 0.00 -0.67 -0.00 -1.97 -1.15 114.93 116.22 1vgr h MET 44 Ca -0.48 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.18 1vgr h MET 44 Cb 1.34 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.93 1vgr h MET 44 CO 0.81 0.00 -0.21 1.79 -0.00 0.00 0.00 176.91 179.31 1vgr h THR 45 N 0.00 0.82 -0.58 -0.10 1.35 -1.91 -3.19 112.91 109.30 1vgr h THR 45 Ca 0.00 -0.82 0.10 0.00 -0.55 0.00 0.00 66.41 65.15 1vgr h THR 45 Cb 0.41 1.49 -0.08 0.00 -1.73 0.00 0.00 68.15 68.24 1vgr h THR 45 CO 0.00 0.20 0.15 0.03 -0.25 0.00 0.00 175.52 175.66 1vgr h ARG 46 N 0.00 0.29 -0.63 4.72 3.08 -1.51 -2.19 114.38 118.14 1vgr h ARG 46 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1vgr h ARG 46 Cb 0.47 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1vgr h ARG 46 CO 0.03 0.19 0.00 0.41 -1.07 0.00 0.00 179.97 179.53 1vgr n GLY 47 N -1.30 1.98 3.46 0.04 0.00 -1.21 -1.58 105.19 106.58 1vgr n GLY 47 Ca 0.08 -0.68 -0.43 0.00 0.00 0.00 0.00 46.02 44.98 1vgr n GLY 47 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1vgr s TRP 48 N -1.24 3.20 -1.28 1.61 -0.11 -0.82 -4.36 118.94 115.93 1vgr s TRP 48 Ca 0.42 -0.53 -0.02 0.00 1.22 0.00 0.00 56.10 57.19 1vgr s TRP 48 Cb 0.23 -2.87 -0.00 0.00 -1.50 0.00 0.00 33.47 29.32 1vgr s TRP 48 CO 0.28 -0.70 0.72 1.28 -4.62 0.00 0.00 176.95 173.91 1vgr n LEU 49 N 5.44 -3.24 -4.78 5.86 4.77 -1.26 -4.63 117.00 119.16 1vgr n LEU 49 Ca -0.09 -0.82 -0.41 0.00 -0.03 0.00 0.00 56.01 54.66 1vgr n LEU 49 Cb 0.47 -2.69 -0.00 0.00 -2.33 0.00 0.00 43.42 38.87 1vgr n LEU 49 CO 0.45 0.40 1.12 -1.10 -1.33 0.00 0.00 177.39 176.93 1vgr s GLN 50 N -5.88 4.09 0.06 3.23 -0.21 -1.26 -4.68 119.66 115.01 1vgr s GLN 50 Ca 0.05 2.54 0.23 0.00 0.02 0.00 0.00 55.36 58.20 1vgr s GLN 50 Cb -0.01 -2.95 0.09 0.00 1.00 0.00 0.00 33.01 31.14 1vgr s GLN 50 CO 0.81 -0.53 1.07 -0.40 -2.12 0.00 0.00 175.29 174.11 1vgr n ASP 51 N 0.42 0.62 -3.90 5.90 5.68 -1.26 -4.86 116.55 119.16 1vgr n ASP 51 Ca 0.01 -0.13 -0.16 0.00 -0.50 0.00 0.00 54.79 54.01 1vgr n ASP 51 Cb 0.40 0.70 -0.15 0.00 -1.14 0.00 0.00 41.12 40.92 1vgr n ASP 51 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1vgr s LYS 52 N -3.20 0.40 0.42 0.11 1.02 -1.26 -5.13 119.74 112.09 1vgr s LYS 52 Ca 0.04 -0.08 -0.27 0.00 0.02 0.00 0.00 55.97 55.68 1vgr s LYS 52 Cb 0.14 -0.44 -0.10 0.00 -0.52 0.00 0.00 37.83 36.92 1vgr s LYS 52 CO 0.79 0.01 1.47 -1.25 -0.92 0.00 0.00 175.35 175.45 1vgr s PRO 53 N 0.34 3.88 -1.88 -1.68 0.04 -1.26 -2.44 135.00 131.99 1vgr s PRO 53 Ca -0.03 2.53 0.00 0.00 0.04 0.00 0.00 61.00 63.53 1vgr s PRO 53 Cb -0.07 -2.81 0.00 0.00 0.04 0.00 0.00 34.50 31.67 1vgr s PRO 53 CO -0.01 -0.70 0.00 0.09 0.04 0.00 0.00 177.00 176.42 1vgr n ASN 54 N 0.11 -5.58 -4.24 6.66 3.02 -1.26 -4.97 115.26 109.01 1vgr n ASN 54 Ca 0.03 0.44 -0.30 0.00 -0.03 0.00 0.00 54.58 54.72 1vgr n ASN 54 Cb 0.40 -4.65 -0.16 0.00 -0.61 0.00 0.00 39.78 34.76 1vgr n ASN 54 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1vgr s VAL 55 N -2.50 1.88 0.27 2.41 1.01 -1.02 -5.10 120.40 117.36 1vgr s VAL 55 Ca 0.00 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 60.71 1vgr s VAL 55 Cb 0.00 -1.59 -0.14 0.00 0.00 0.00 0.00 36.38 34.65 1vgr s VAL 55 CO 0.00 0.53 1.17 0.47 0.00 0.00 0.00 175.10 177.27 1vgr n ASP 56 N 2.91 1.88 -4.76 3.32 8.00 -1.26 -4.69 116.55 121.96 1vgr n ASP 56 Ca -0.17 1.17 -0.29 0.00 0.71 0.00 0.00 54.79 56.21 1vgr n ASP 56 Cb 0.52 -1.34 0.13 0.00 -0.02 0.00 0.00 41.12 40.41 1vgr n ASP 56 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1vgr s SER 57 N -0.25 3.62 0.34 -2.24 1.04 -0.62 -4.84 113.70 110.74 1vgr s SER 57 Ca 0.62 1.19 0.16 0.00 0.48 0.00 0.00 55.95 58.40 1vgr s SER 57 Cb -0.69 -1.84 0.55 0.00 0.10 0.00 0.00 66.02 64.13 1vgr s SER 57 CO 0.57 -2.51 1.68 -0.07 0.98 0.00 0.00 173.24 173.89 1vgr h LEU 58 N -1.46 0.00 -0.33 2.42 3.38 -1.86 -1.39 115.31 116.07 1vgr h LEU 58 Ca -0.50 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.50 1vgr h LEU 58 Cb 1.31 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 1vgr h LEU 58 CO 0.59 0.45 0.13 0.22 0.09 0.00 0.00 178.44 179.93 1vgr h TYR 59 N 0.00 0.24 -0.16 1.13 -0.00 -1.83 -1.74 116.97 114.61 1vgr h TYR 59 Ca -0.00 0.02 -0.04 0.00 -0.00 0.00 0.00 58.73 58.70 1vgr h TYR 59 Cb 0.99 -0.06 -0.00 0.00 -0.00 0.00 0.00 36.73 37.66 1vgr h TYR 59 CO 0.00 0.12 -0.05 0.35 -0.00 0.00 0.00 178.16 178.58 1vgr h PHE 60 N 0.29 0.36 -0.24 -3.82 3.04 -1.58 -3.21 116.94 111.78 1vgr h PHE 60 Ca 0.14 -0.08 -0.15 0.00 3.98 0.00 0.00 57.97 61.86 1vgr h PHE 60 Cb 0.09 -0.09 -0.01 0.00 2.56 0.00 0.00 35.95 38.51 1vgr h PHE 60 CO -0.12 0.60 -0.48 1.79 -2.02 0.00 0.00 178.31 178.08 1vgr h THR 61 N 0.01 1.30 0.00 4.41 1.35 -1.16 -1.72 112.91 117.10 1vgr h THR 61 Ca 0.04 -1.68 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 1vgr h THR 61 Cb 0.49 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 1vgr h THR 61 CO 0.02 0.53 0.00 0.23 -0.25 0.00 0.00 175.52 176.05 1vgr n MET 62 N -4.00 0.14 -0.04 4.72 2.81 -0.66 -2.87 117.12 117.22 1vgr n MET 62 Ca -0.03 0.30 0.02 0.00 -1.81 0.00 0.00 57.70 56.19 1vgr n MET 62 Cb 0.57 -1.73 0.04 0.00 -0.71 0.00 0.00 33.22 31.39 1vgr n MET 62 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1vgr n PHE 63 N -1.99 0.09 -2.03 2.03 3.01 -1.08 -4.78 117.46 112.72 1vgr n PHE 63 Ca 0.04 -0.23 0.02 0.00 1.01 0.00 0.00 57.45 58.29 1vgr n PHE 63 Cb 0.26 -0.02 0.03 0.00 -0.01 0.00 0.00 39.48 39.74 1vgr n PHE 63 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1vgr n ASN 64 N 0.11 0.59 -4.74 4.37 3.02 -0.67 -4.35 115.26 113.59 1vgr n ASN 64 Ca 0.04 -2.20 -0.32 0.00 -0.03 0.00 0.00 54.58 52.07 1vgr n ASN 64 Cb 0.22 -0.27 0.10 0.00 -0.61 0.00 0.00 39.78 39.22 1vgr n ASN 64 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vgr n ASN 66 N -3.42 -4.51 -3.93 0.00 4.13 -0.46 -4.74 115.26 102.33 1vgr n ASN 66 Ca 0.10 -0.67 -0.10 0.00 1.68 0.00 0.00 54.58 55.59 1vgr n ASN 66 Cb 0.52 -4.53 -0.10 0.00 -1.54 0.00 0.00 39.78 34.13 1vgr n ASN 66 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1vgr s LYS 67 N -6.23 0.39 0.15 3.52 1.02 -1.25 -4.46 119.74 112.88 1vgr s LYS 67 Ca 0.45 -0.52 0.04 0.00 0.02 0.00 0.00 55.97 55.95 1vgr s LYS 67 Cb -0.21 0.15 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 1vgr s LYS 67 CO 0.77 -0.08 0.17 1.03 -0.92 0.00 0.00 175.35 176.32 1vgr s ARG 68 N -1.46 3.04 -0.08 1.68 0.52 -0.87 -3.91 118.95 117.87 1vgr s ARG 68 Ca -0.15 -0.77 0.03 0.00 -0.52 0.00 0.00 55.73 54.32 1vgr s ARG 68 Cb -0.09 -2.74 -0.01 0.00 0.52 0.00 0.00 34.95 32.63 1vgr s ARG 68 CO 0.00 0.51 -0.19 0.45 0.02 0.00 0.00 175.30 176.09 1vgr s SER 69 N -3.03 3.58 -0.00 0.23 0.15 -1.26 -0.11 113.70 113.27 1vgr s SER 69 Ca 0.32 -0.38 0.05 0.00 0.70 0.00 0.00 55.95 56.64 1vgr s SER 69 Cb -0.11 -1.12 -0.01 0.00 -1.71 0.00 0.00 66.02 63.07 1vgr s SER 69 CO 0.25 0.24 -0.17 -0.51 1.20 0.00 0.00 173.24 174.24 1vgr s ILE 70 N -0.10 1.34 0.17 6.45 2.07 -0.29 -1.18 121.20 129.65 1vgr s ILE 70 Ca -0.04 -0.79 -0.14 0.00 -1.41 0.00 0.00 60.65 58.27 1vgr s ILE 70 Cb -0.14 -1.13 -0.07 0.00 0.13 0.00 0.00 42.46 41.25 1vgr s ILE 70 CO 0.04 0.32 0.57 -1.61 -1.91 0.00 0.00 174.94 172.36 1vgr s GLU 71 N -0.54 3.99 -0.28 3.50 2.02 -1.26 -1.52 118.70 124.61 1vgr s GLU 71 Ca 0.06 0.51 -0.11 0.00 0.02 0.00 0.00 54.97 55.45 1vgr s GLU 71 Cb -0.07 -2.87 0.11 0.00 0.10 0.00 0.00 34.13 31.40 1vgr s GLU 71 CO -0.00 0.44 0.62 -1.17 0.02 0.00 0.00 175.26 175.17 1vgr s LEU 72 N -2.10 -1.03 -0.77 1.80 2.96 -0.13 -4.53 118.68 114.90 1vgr s LEU 72 Ca 0.40 1.48 -0.25 0.00 -0.22 0.00 0.00 54.13 55.54 1vgr s LEU 72 Cb -0.15 2.19 0.04 0.00 0.50 0.00 0.00 46.19 48.77 1vgr s LEU 72 CO 0.19 -0.22 1.24 -0.62 -1.32 0.00 0.00 176.35 175.62 1vgr s ASP 73 N 2.61 6.22 0.00 3.68 -1.08 0.17 -4.37 116.67 123.89 1vgr s ASP 73 Ca -0.06 -0.73 0.27 0.00 -0.52 0.00 0.00 52.55 51.50 1vgr s ASP 73 Cb -0.11 -2.53 1.18 0.00 -1.46 0.00 0.00 42.92 40.00 1vgr s ASP 73 CO -0.18 -1.70 1.87 0.23 0.52 0.00 0.00 175.17 175.91 1vgr n MET 74 N 8.91 0.05 -0.81 4.34 2.81 -1.26 -3.42 117.12 127.73 1vgr n MET 74 Ca 0.06 0.03 -0.11 0.00 -1.81 0.00 0.00 57.70 55.88 1vgr n MET 74 Cb 0.49 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.50 1vgr n MET 74 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1vgr n LYS 75 N -1.48 1.57 -3.78 0.03 5.02 -1.26 -4.44 118.16 113.83 1vgr n LYS 75 Ca 0.07 -1.01 -0.13 0.00 -2.02 0.00 0.00 58.31 55.23 1vgr n LYS 75 Cb 0.30 -1.46 -0.11 0.00 -0.02 0.00 0.00 35.03 33.75 1vgr n LYS 75 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1vgr s THR 76 N -1.19 0.01 0.16 -0.18 -1.32 -1.22 -5.07 115.64 106.84 1vgr s THR 76 Ca 0.25 -0.11 -0.15 0.00 -1.21 0.00 0.00 61.69 60.47 1vgr s THR 76 Cb 0.17 -0.43 0.04 0.00 -1.51 0.00 0.00 72.50 70.77 1vgr s THR 76 CO -0.02 -0.06 1.77 -0.65 -2.21 0.00 0.00 174.62 173.45 1vgr h PRO 77 N 5.36 0.37 0.00 7.08 0.11 -1.89 -2.33 132.00 140.70 1vgr h PRO 77 Ca -0.27 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 1vgr h PRO 77 Cb 1.19 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1vgr h PRO 77 CO 0.34 0.24 -0.24 0.93 -0.21 0.00 0.00 178.00 179.06 1vgr h GLU 78 N 0.38 0.00 0.14 1.05 3.07 -1.97 -2.10 114.58 115.15 1vgr h GLU 78 Ca 0.18 0.00 -0.24 0.00 -0.50 0.00 0.00 59.36 58.81 1vgr h GLU 78 Cb 0.12 0.00 0.03 0.00 -0.84 0.00 0.00 28.75 28.05 1vgr h GLU 78 CO -0.15 0.24 -1.01 0.78 -1.40 0.00 0.00 179.01 177.47 1vgr h GLY 79 N 2.13 0.49 0.55 -3.84 0.00 -1.67 -1.94 103.07 98.79 1vgr h GLY 79 Ca -0.00 -1.14 0.08 0.00 0.00 0.00 0.00 47.33 46.26 1vgr h GLY 79 CO 0.03 1.00 0.32 0.50 0.00 0.00 0.00 176.54 178.40 1vgr h LYS 80 N -0.09 0.56 -0.35 4.80 1.57 -1.33 -1.96 116.57 119.77 1vgr h LYS 80 Ca -0.17 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.62 1vgr h LYS 80 Cb 1.77 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.91 1vgr h LYS 80 CO 0.19 0.37 0.13 0.93 -0.57 0.00 0.00 179.45 180.51 1vgr h GLU 81 N 0.58 0.28 -0.66 3.15 5.08 -1.29 -2.16 114.58 119.56 1vgr h GLU 81 Ca 0.31 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.61 1vgr h GLU 81 Cb 0.29 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 1vgr h GLU 81 CO -0.24 0.19 0.26 -0.07 -1.00 0.00 0.00 179.01 178.15 1vgr h LEU 82 N 0.29 0.92 -0.73 1.33 3.38 -0.99 -2.50 115.31 117.01 1vgr h LEU 82 Ca 0.16 -0.18 0.06 0.00 0.09 0.00 0.00 57.88 58.01 1vgr h LEU 82 Cb 0.12 -0.24 -0.06 0.00 0.09 0.00 0.00 40.66 40.57 1vgr h LEU 82 CO -0.15 0.85 0.42 0.25 0.09 0.00 0.00 178.44 179.91 1vgr h LEU 83 N 0.94 0.64 -0.60 1.67 5.85 -1.04 -0.63 115.31 122.14 1vgr h LEU 83 Ca 0.22 0.03 0.05 0.00 0.84 0.00 0.00 57.88 59.02 1vgr h LEU 83 Cb 0.22 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.10 1vgr h LEU 83 CO -0.02 0.41 0.33 -0.33 -0.34 0.00 0.00 178.44 178.49 1vgr h GLU 84 N 0.77 0.60 -0.73 1.25 5.08 -0.95 0.14 114.58 120.74 1vgr h GLU 84 Ca 0.33 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.61 1vgr h GLU 84 Cb 0.20 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1vgr h GLU 84 CO -0.18 0.40 0.30 1.96 -1.00 0.00 0.00 179.01 180.49 1vgr h GLN 85 N 0.62 1.09 -0.29 2.33 4.20 -1.16 -2.20 115.11 119.70 1vgr h GLN 85 Ca 0.26 -0.19 -0.13 0.00 0.06 0.00 0.00 58.65 58.65 1vgr h GLN 85 Cb 0.15 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 1vgr h GLN 85 CO -0.16 0.89 -0.36 0.52 -0.67 0.00 0.00 178.83 179.05 1vgr h MET 86 N 1.05 0.66 -0.24 1.46 2.86 -0.57 -2.74 114.93 117.41 1vgr h MET 86 Ca 0.25 -0.32 -0.05 0.00 -2.06 0.00 0.00 59.70 57.52 1vgr h MET 86 Cb 0.20 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1vgr h MET 86 CO -0.02 0.92 -0.09 0.82 1.06 0.00 0.00 176.91 179.60 1vgr h ILE 87 N 0.55 1.19 0.00 -1.22 2.04 -0.45 -2.20 117.51 117.42 1vgr h ILE 87 Ca 0.05 -0.83 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 1vgr h ILE 87 Cb 0.87 1.11 -0.00 0.00 -0.74 0.00 0.00 36.82 38.06 1vgr h ILE 87 CO 0.08 0.27 -0.03 0.11 0.00 0.00 0.00 178.15 178.58 1vgr h LYS 88 N 0.36 0.00 -0.00 2.37 1.57 -1.09 -2.97 116.57 116.80 1vgr h LYS 88 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1vgr h LYS 88 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1vgr h LYS 88 CO 0.02 0.03 -0.84 1.63 -0.57 0.00 0.00 179.45 179.72 1vgr n LYS 89 N -3.15 0.32 -3.40 3.15 5.02 -0.86 -5.00 118.16 114.23 1vgr n LYS 89 Ca -0.00 -0.26 -0.34 0.00 -2.02 0.00 0.00 58.31 55.69 1vgr n LYS 89 Cb 0.28 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1vgr n LYS 89 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vgr s ALA 90 N -2.86 3.59 -0.13 7.82 0.00 -1.02 -4.78 121.76 124.38 1vgr s ALA 90 Ca 0.11 -0.21 -0.10 0.00 0.00 0.00 0.00 51.96 51.76 1vgr s ALA 90 Cb 0.17 -2.46 -0.26 0.00 0.00 0.00 0.00 23.12 20.57 1vgr s ALA 90 CO 0.78 0.49 0.39 -0.44 0.00 0.00 0.00 175.76 176.98 1vgr h ASP 91 N 3.19 0.37 -3.94 0.00 3.32 -1.31 -3.41 116.42 114.65 1vgr h ASP 91 Ca -0.48 -0.87 -0.31 0.00 0.02 0.00 0.00 57.03 55.39 1vgr h ASP 91 Cb 1.18 -0.12 -0.28 0.00 0.22 0.00 0.00 39.33 40.34 1vgr h ASP 91 CO 0.67 1.77 -0.75 0.54 -1.72 0.00 0.00 179.24 179.76 1vgr s VAL 92 N -2.52 0.38 -0.13 -1.35 0.11 -0.98 -0.92 120.40 114.99 1vgr s VAL 92 Ca -0.23 -0.24 -0.01 0.00 -2.93 0.00 0.00 61.98 58.57 1vgr s VAL 92 Cb 0.06 -0.33 -0.02 0.00 -1.53 0.00 0.00 36.38 34.56 1vgr s VAL 92 CO 0.75 0.08 -0.11 -0.32 -3.33 0.00 0.00 175.10 172.17 1vgr s MET 93 N -0.19 3.35 -0.06 1.54 1.75 0.75 -0.73 119.30 125.71 1vgr s MET 93 Ca 0.01 -0.64 0.06 0.00 -1.25 0.00 0.00 55.69 53.87 1vgr s MET 93 Cb -0.02 -2.67 -0.01 0.00 2.84 0.00 0.00 34.83 34.97 1vgr s MET 93 CO -0.00 0.28 -0.24 0.08 -0.65 0.00 0.00 175.02 174.49 1vgr s VAL 94 N 0.20 1.98 -0.01 10.11 1.01 -0.14 -1.12 120.40 132.43 1vgr s VAL 94 Ca -0.06 -1.02 -0.05 0.00 0.00 0.00 0.00 61.98 60.84 1vgr s VAL 94 Cb -0.15 -1.69 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1vgr s VAL 94 CO 0.04 0.55 0.12 -1.83 0.00 0.00 0.00 175.10 173.98 1vgr s GLU 95 N -0.08 0.35 -0.29 2.72 4.04 -0.70 -0.23 118.70 124.50 1vgr s GLU 95 Ca -0.06 -0.22 0.19 0.00 0.04 0.00 0.00 54.97 54.93 1vgr s GLU 95 Cb -0.14 0.15 0.47 0.00 0.02 0.00 0.00 34.13 34.63 1vgr s GLU 95 CO 0.04 -0.07 1.18 0.27 -1.84 0.00 0.00 175.26 174.84 1vgr n ASN 96 N 2.01 0.77 -4.16 0.83 6.94 -1.26 -2.11 115.26 118.28 1vgr n ASN 96 Ca -0.19 -2.21 -0.29 0.00 -0.02 0.00 0.00 54.58 51.87 1vgr n ASN 96 Cb 0.57 -0.18 0.18 0.00 -2.36 0.00 0.00 39.78 37.99 1vgr n ASN 96 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 1vgr s PHE 97 N -2.70 1.44 0.75 -2.53 2.99 -1.26 -4.77 117.98 111.90 1vgr s PHE 97 Ca 0.23 0.15 -0.13 0.00 0.00 0.00 0.00 56.93 57.19 1vgr s PHE 97 Cb 0.38 -3.96 0.05 0.00 0.00 0.00 0.00 43.02 39.49 1vgr s PHE 97 CO -0.04 -2.56 1.14 0.20 -0.00 0.00 0.00 175.22 173.95 1vgr s GLY 98 N -4.90 2.02 0.08 4.36 0.00 -1.26 -4.86 107.32 102.76 1vgr s GLY 98 Ca 0.74 0.60 -0.37 0.00 0.00 0.00 0.00 44.72 45.69 1vgr s GLY 98 CO 0.52 0.98 1.37 -1.05 0.00 0.00 0.00 173.10 174.92 1vgr n PRO 99 N -3.09 1.21 -0.48 2.90 -0.02 -1.26 -1.76 135.00 132.50 1vgr n PRO 99 Ca 0.11 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1vgr n PRO 99 Cb 0.52 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1vgr n PRO 99 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vgr n GLY 100 N 2.64 1.81 0.05 -1.23 0.00 -1.26 -4.92 105.19 102.28 1vgr n GLY 100 Ca 0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.08 1vgr n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgr h ALA 101 N 0.00 0.01 -0.48 4.61 0.00 -1.68 -0.20 119.26 121.51 1vgr h ALA 101 Ca 0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.75 1vgr h ALA 101 Cb 0.00 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1vgr h ALA 101 CO 0.00 -0.43 -0.08 1.25 0.00 0.00 0.00 179.25 179.99 1vgr h LEU 102 N -0.13 0.84 -0.56 0.00 6.46 -1.90 -2.52 115.31 117.51 1vgr h LEU 102 Ca 0.00 -0.25 0.02 0.00 -0.12 0.00 0.00 57.88 57.54 1vgr h LEU 102 Cb 0.14 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 39.80 1vgr h LEU 102 CO -0.00 0.95 0.34 0.44 -0.62 0.00 0.00 178.44 179.55 1vgr h ASP 103 N 0.78 0.55 -0.21 1.25 3.32 -1.66 -1.61 116.42 118.84 1vgr h ASP 103 Ca 0.13 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 1vgr h ASP 103 Cb 0.58 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1vgr h ASP 103 CO 0.04 0.39 0.07 0.03 -1.72 0.00 0.00 179.24 178.05 1vgr h ARG 104 N 0.67 0.39 0.00 3.56 3.08 -0.62 0.20 114.38 121.67 1vgr h ARG 104 Ca 0.22 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1vgr h ARG 104 Cb 0.02 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1vgr h ARG 104 CO -0.09 0.36 0.00 -1.33 -1.07 0.00 0.00 179.97 177.84 1vgr n MET 105 N -4.39 0.01 0.00 0.04 2.81 -1.04 -4.87 117.12 109.69 1vgr n MET 105 Ca 0.01 0.26 0.00 0.00 -1.81 0.00 0.00 57.70 56.16 1vgr n MET 105 Cb 0.16 -1.52 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 1vgr n MET 105 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vgr n GLY 106 N 0.00 0.43 2.62 3.03 0.00 0.70 -5.00 105.19 106.98 1vgr n GLY 106 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 1vgr n GLY 106 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vgr n PHE 107 N -1.78 2.71 -1.35 1.61 3.01 -0.63 -4.82 117.46 116.21 1vgr n PHE 107 Ca 0.00 -2.62 -0.34 0.00 1.01 0.00 0.00 57.45 55.50 1vgr n PHE 107 Cb 0.00 -1.35 0.10 0.00 -0.01 0.00 0.00 39.48 38.22 1vgr n PHE 107 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 1vgr s THR 108 N -3.53 2.21 0.21 4.37 -4.23 -1.26 -4.09 115.64 109.31 1vgr s THR 108 Ca 0.42 0.10 -0.10 0.00 -1.18 0.00 0.00 61.69 60.93 1vgr s THR 108 Cb 0.18 -2.65 0.15 0.00 1.34 0.00 0.00 72.50 71.53 1vgr s THR 108 CO -0.11 -0.06 1.72 -0.25 -0.54 0.00 0.00 174.62 175.38 1vgr h TRP 109 N -0.44 0.25 -0.57 3.99 -0.00 -1.97 -0.71 115.95 116.49 1vgr h TRP 109 Ca -0.47 0.03 0.08 0.00 -0.00 0.00 0.00 58.89 58.53 1vgr h TRP 109 Cb 1.30 -0.02 -0.06 0.00 -0.00 0.00 0.00 29.16 30.37 1vgr h TRP 109 CO 0.47 0.00 0.22 0.93 -0.00 0.00 0.00 178.44 180.06 1vgr h GLU 110 N 0.29 0.40 -0.53 2.65 5.08 -1.98 -0.81 114.58 119.69 1vgr h GLU 110 Ca 0.31 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.54 1vgr h GLU 110 Cb 0.44 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1vgr h GLU 110 CO -0.37 0.27 -0.06 -0.92 -1.00 0.00 0.00 179.01 176.92 1vgr h TYR 111 N 0.42 1.08 -0.59 4.33 3.20 -1.71 -2.99 116.97 120.71 1vgr h TYR 111 Ca 0.28 -0.21 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 1vgr h TYR 111 Cb 0.31 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 1vgr h TYR 111 CO -0.16 1.00 0.35 0.82 -1.64 0.00 0.00 178.16 178.54 1vgr h ILE 112 N 0.85 1.18 -0.85 1.81 2.04 -0.45 -1.74 117.51 120.35 1vgr h ILE 112 Ca 0.14 -0.42 0.13 0.00 1.00 0.00 0.00 64.86 65.72 1vgr h ILE 112 Cb 0.62 0.38 -0.09 0.00 -0.74 0.00 0.00 36.82 36.99 1vgr h ILE 112 CO 0.04 0.19 0.46 1.56 0.00 0.00 0.00 178.15 180.40 1vgr h GLN 113 N 0.80 0.66 -0.48 2.37 4.20 -1.15 -1.37 115.11 120.14 1vgr h GLN 113 Ca 0.21 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 1vgr h GLN 113 Cb -0.00 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 1vgr h GLN 113 CO -0.04 0.44 0.21 1.49 -0.67 0.00 0.00 178.83 180.26 1vgr h GLU 114 N 0.68 0.71 -0.69 1.46 4.81 -1.26 -2.56 114.58 117.72 1vgr h GLU 114 Ca 0.45 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.52 1vgr h GLU 114 Cb 0.58 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 1vgr h GLU 114 CO -0.33 0.62 0.27 -0.07 -0.73 0.00 0.00 179.01 178.77 1vgr h LEU 115 N 0.63 0.94 -6.04 1.64 3.38 -0.46 -3.42 115.31 111.98 1vgr h LEU 115 Ca 0.16 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 58.02 1vgr h LEU 115 Cb 0.17 -0.24 -0.22 0.00 0.09 0.00 0.00 40.66 40.45 1vgr h LEU 115 CO -0.02 0.84 -0.35 0.21 0.09 0.00 0.00 178.44 179.22 1vgr s ASN 116 N -6.45 -1.31 0.34 -0.43 3.84 -0.60 -4.69 114.94 105.64 1vgr s ASN 116 Ca -0.11 0.42 0.25 0.00 0.21 0.00 0.00 52.86 53.63 1vgr s ASN 116 Cb 0.16 1.98 1.22 0.00 -0.55 0.00 0.00 41.25 44.06 1vgr s ASN 116 CO 0.82 -0.29 1.76 -0.65 -2.79 0.00 0.00 177.10 175.95 1vgr h PRO 117 N 8.02 0.00 0.00 0.43 0.11 -1.71 -2.88 132.00 135.96 1vgr h PRO 117 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1vgr h PRO 117 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1vgr h PRO 117 CO 0.21 0.00 -0.82 0.54 -0.21 0.00 0.00 178.00 177.72 1vgr n ARG 118 N -2.38 0.29 -2.60 1.05 1.74 -1.26 -1.52 116.66 111.98 1vgr n ARG 118 Ca -0.00 0.04 -0.38 0.00 -0.77 0.00 0.00 57.85 56.74 1vgr n ARG 118 Cb 0.13 -1.64 -0.05 0.00 -1.02 0.00 0.00 32.46 29.88 1vgr n ARG 118 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1vgr s VAL 119 N -3.18 3.81 -0.21 1.55 0.11 -1.09 -3.65 120.40 117.74 1vgr s VAL 119 Ca 0.05 1.57 -0.09 0.00 -2.93 0.00 0.00 61.98 60.58 1vgr s VAL 119 Cb 0.14 -3.90 -0.04 0.00 -1.53 0.00 0.00 36.38 31.05 1vgr s VAL 119 CO 0.76 0.18 0.11 -0.63 -3.33 0.00 0.00 175.10 172.19 1vgr s ILE 120 N -1.47 5.07 -0.18 7.04 1.01 -0.10 -3.93 121.20 128.63 1vgr s ILE 120 Ca 0.51 0.07 -0.10 0.00 0.00 0.00 0.00 60.65 61.13 1vgr s ILE 120 Cb -0.24 -3.33 -0.05 0.00 0.01 0.00 0.00 42.46 38.85 1vgr s ILE 120 CO 0.31 0.40 0.16 -0.22 0.00 0.00 0.00 174.94 175.59 1vgr s LEU 121 N 0.73 4.23 -0.07 2.97 2.96 -0.70 -0.18 118.68 128.63 1vgr s LEU 121 Ca 0.06 0.31 0.02 0.00 -0.22 0.00 0.00 54.13 54.29 1vgr s LEU 121 Cb -0.13 -2.14 0.01 0.00 0.50 0.00 0.00 46.19 44.44 1vgr s LEU 121 CO 0.02 0.19 -0.12 0.00 -1.32 0.00 0.00 176.35 175.11 1vgr s ALA 122 N 0.23 1.29 0.03 5.97 0.00 -0.28 -0.34 121.76 128.66 1vgr s ALA 122 Ca 0.10 -0.44 0.02 0.00 0.00 0.00 0.00 51.96 51.64 1vgr s ALA 122 Cb -0.11 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.39 1vgr s ALA 122 CO -0.00 0.08 -0.07 -1.54 0.00 0.00 0.00 175.76 174.23 1vgr s SER 123 N 0.73 0.73 -0.12 0.00 1.04 -0.44 -1.72 113.70 113.91 1vgr s SER 123 Ca -0.13 -0.44 -0.02 0.00 0.48 0.00 0.00 55.95 55.84 1vgr s SER 123 Cb -0.16 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 65.96 1vgr s SER 123 CO 0.03 -0.16 -0.05 -0.69 0.98 0.00 0.00 173.24 173.36 1vgr s VAL 124 N -1.11 3.86 0.30 5.02 1.01 -0.90 -1.57 120.40 127.01 1vgr s VAL 124 Ca -0.08 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.53 1vgr s VAL 124 Cb -0.08 -2.64 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 1vgr s VAL 124 CO 0.00 0.55 0.10 -0.54 0.00 0.00 0.00 175.10 175.21 1vgr s LYS 125 N -0.21 1.54 0.06 2.72 -0.14 -0.82 -4.51 119.74 118.39 1vgr s LYS 125 Ca 0.03 -1.86 -0.19 0.00 -1.36 0.00 0.00 55.97 52.60 1vgr s LYS 125 Cb -0.13 -0.41 -0.11 0.00 -1.68 0.00 0.00 37.83 35.49 1vgr s LYS 125 CO 0.02 -0.31 1.40 0.78 -0.76 0.00 0.00 175.35 176.49 1vgr h GLY 126 N 2.24 0.50 -3.26 -3.33 0.00 -1.87 0.20 103.07 97.55 1vgr h GLY 126 Ca -0.38 -0.48 -0.46 0.00 0.00 0.00 0.00 47.33 46.01 1vgr h GLY 126 CO 0.61 0.43 -0.76 -0.19 0.00 0.00 0.00 176.54 176.63 1vgr s TYR 127 N -4.47 1.63 0.64 5.60 1.51 -1.26 -2.23 117.35 118.77 1vgr s TYR 127 Ca -0.14 -0.53 -0.16 0.00 -1.01 0.00 0.00 57.07 55.24 1vgr s TYR 127 Cb 0.07 -0.81 -0.01 0.00 -0.11 0.00 0.00 41.96 41.09 1vgr s TYR 127 CO 0.77 0.26 1.12 0.00 -1.11 0.00 0.00 175.55 176.58 1vgr s ALA 128 N -2.29 2.49 0.17 3.71 0.00 -1.26 -4.77 121.76 119.81 1vgr s ALA 128 Ca 0.14 0.59 -0.31 0.00 0.00 0.00 0.00 51.96 52.39 1vgr s ALA 128 Cb -0.04 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.66 1vgr s ALA 128 CO 0.05 -1.22 1.46 -2.00 0.00 0.00 0.00 175.76 174.05 1vgr s GLU 129 N -3.98 4.28 0.00 0.00 2.12 -1.26 -1.88 118.70 117.98 1vgr s GLU 129 Ca 0.68 2.23 0.00 0.00 0.36 0.00 0.00 54.97 58.24 1vgr s GLU 129 Cb -0.21 -3.18 0.00 0.00 0.26 0.00 0.00 34.13 31.00 1vgr s GLU 129 CO 0.40 -0.48 0.00 0.41 -0.54 0.00 0.00 175.26 175.04 1vgr n GLY 130 N 3.22 1.41 3.77 -1.50 0.00 -1.26 -5.08 105.19 105.75 1vgr n GLY 130 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1vgr n GLY 130 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1vgr s HIS 131 N -2.35 2.75 0.42 1.61 5.04 -0.79 -4.93 115.29 117.05 1vgr s HIS 131 Ca 0.00 1.53 0.16 0.00 -1.54 0.00 0.00 55.06 55.21 1vgr s HIS 131 Cb 0.00 -3.36 1.04 0.00 0.04 0.00 0.00 32.58 30.30 1vgr s HIS 131 CO 0.00 -1.61 1.91 0.00 -2.34 0.00 0.00 174.74 172.70 1vgr h ALA 132 N 1.63 2.11 -0.55 1.58 0.00 -1.98 -2.19 119.26 119.87 1vgr h ALA 132 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1vgr h ALA 132 Cb 1.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1vgr h ALA 132 CO 0.59 -0.33 0.00 0.09 0.00 0.00 0.00 179.25 179.60 1vgr n ASN 133 N -4.49 5.23 -0.26 0.00 3.02 -1.26 -4.68 115.26 112.82 1vgr n ASN 133 Ca 0.15 -2.78 0.12 0.00 -0.03 0.00 0.00 54.58 52.04 1vgr n ASN 133 Cb 0.55 -0.65 0.24 0.00 -0.61 0.00 0.00 39.78 39.30 1vgr n ASN 133 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 1vgr n GLU 134 N 0.66 -0.06 -0.09 3.52 2.13 -0.82 -1.80 120.64 124.18 1vgr n GLU 134 Ca 0.25 1.11 0.11 0.00 0.66 0.00 0.00 57.16 59.29 1vgr n GLU 134 Cb 1.08 -1.78 0.34 0.00 0.27 0.00 0.00 31.44 31.35 1vgr n GLU 134 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1vgr n HIS 135 N -5.01 0.25 -2.98 4.31 8.25 -1.26 -4.65 115.22 114.13 1vgr n HIS 135 Ca 0.18 -0.12 -0.35 0.00 -0.26 0.00 0.00 57.72 57.17 1vgr n HIS 135 Cb 0.60 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.65 1vgr n HIS 135 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1vgr s LEU 136 N -1.58 4.20 -0.02 2.41 1.43 -0.74 -4.73 118.68 119.64 1vgr s LEU 136 Ca 0.33 1.54 -0.23 0.00 -1.03 0.00 0.00 54.13 54.75 1vgr s LEU 136 Cb 0.19 -4.00 -0.05 0.00 0.03 0.00 0.00 46.19 42.36 1vgr s LEU 136 CO 0.27 -0.13 0.68 -0.54 0.23 0.00 0.00 176.35 176.87 1vgr s LYS 137 N -2.47 4.41 -0.05 1.70 1.02 -1.26 -4.47 119.74 118.62 1vgr s LYS 137 Ca 0.51 0.87 0.01 0.00 0.02 0.00 0.00 55.97 57.38 1vgr s LYS 137 Cb -0.14 -3.39 0.02 0.00 -0.52 0.00 0.00 37.83 33.80 1vgr s LYS 137 CO 0.19 0.22 -0.05 0.08 -0.92 0.00 0.00 175.35 174.87 1vgr s VAL 138 N 0.25 0.60 0.28 3.17 1.01 -1.26 -5.05 120.40 119.40 1vgr s VAL 138 Ca 0.35 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.26 1vgr s VAL 138 Cb -0.19 -0.63 -0.03 0.00 0.00 0.00 0.00 36.38 35.54 1vgr s VAL 138 CO 0.19 0.25 0.20 -0.31 0.00 0.00 0.00 175.10 175.43 1vgr s TYR 139 N 1.00 3.02 0.00 5.22 1.51 -1.26 -4.85 117.35 121.99 1vgr s TYR 139 Ca -0.10 -0.17 0.00 0.00 -1.01 0.00 0.00 57.07 55.79 1vgr s TYR 139 Cb -0.14 -1.49 0.00 0.00 -0.11 0.00 0.00 41.96 40.22 1vgr s TYR 139 CO -0.00 0.44 0.00 -1.91 -1.11 0.00 0.00 175.55 172.97 1vgr n GLU 140 N -1.21 0.00 0.18 -0.62 4.07 -1.26 -1.45 120.64 120.35 1vgr n GLU 140 Ca -0.06 0.00 0.06 0.00 -0.06 0.00 0.00 57.16 57.10 1vgr n GLU 140 Cb 0.58 0.00 0.19 0.00 -0.06 0.00 0.00 31.44 32.16 1vgr n GLU 140 CO 0.00 0.00 0.00 -0.91 -0.06 0.00 0.00 177.13 176.16 1vgr h ASN 141 N 0.00 0.00 -0.91 4.31 2.35 -1.97 -1.59 115.58 117.76 1vgr h ASN 141 Ca 0.00 0.00 0.09 0.00 -0.55 0.00 0.00 56.30 55.84 1vgr h ASN 141 Cb 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.30 1vgr h ASN 141 CO 0.00 0.35 0.55 0.58 -1.65 0.00 0.00 177.43 177.26 1vgr h VAL 142 N 0.00 0.97 -0.05 2.81 2.07 -1.66 -1.32 116.25 119.07 1vgr h VAL 142 Ca -0.00 -0.33 -0.20 0.00 0.82 0.00 0.00 66.70 66.99 1vgr h VAL 142 Cb 1.12 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1vgr h VAL 142 CO 0.05 0.17 -0.83 0.00 0.02 0.00 0.00 177.57 176.98 1vgr h ALA 143 N 1.46 0.48 -0.97 1.67 0.00 -1.16 -1.23 119.26 119.52 1vgr h ALA 143 Ca 0.42 -0.65 0.06 0.00 0.00 0.00 0.00 54.91 54.74 1vgr h ALA 143 Cb 0.32 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 1vgr h ALA 143 CO -0.22 0.78 0.63 1.96 0.00 0.00 0.00 179.25 182.40 1vgr h GLN 144 N 0.27 1.11 -0.12 0.00 4.20 -1.13 -1.08 115.11 118.35 1vgr h GLN 144 Ca -0.05 -0.07 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 1vgr h GLN 144 Cb 1.43 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1vgr h GLN 144 CO 0.14 0.73 -0.29 0.00 -0.67 0.00 0.00 178.83 178.74 1vgr h SER 146 N -0.02 0.00 -0.30 0.00 4.64 -0.96 -3.15 113.55 113.76 1vgr h SER 146 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1vgr h SER 146 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1vgr h SER 146 CO 0.06 0.11 0.00 0.61 -0.87 0.00 0.00 176.83 176.74 1vgr n GLY 147 N -0.60 1.51 0.34 -0.77 0.00 -0.43 -4.97 105.19 100.27 1vgr n GLY 147 Ca -0.02 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1vgr n GLY 147 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgr n GLY 148 N 1.36 0.35 0.11 -0.02 0.00 -1.19 -3.78 105.19 102.02 1vgr n GLY 148 Ca 0.17 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1vgr n GLY 148 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgr h ALA 149 N 0.00 0.15 -0.74 4.61 0.00 -1.71 -3.12 119.26 118.46 1vgr h ALA 149 Ca 0.00 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.62 1vgr h ALA 149 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1vgr h ALA 149 CO 0.00 0.01 0.47 0.00 0.00 0.00 0.00 179.25 179.73 1vgr h ALA 150 N 0.57 0.96 -0.28 0.00 0.00 -1.64 -2.22 119.26 116.64 1vgr h ALA 150 Ca 0.01 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1vgr h ALA 150 Cb 0.65 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1vgr h ALA 150 CO 0.03 0.26 0.19 0.00 0.00 0.00 0.00 179.25 179.73 1vgr h ALA 151 N 1.31 1.88 -0.42 0.00 0.00 -1.84 -2.42 119.26 117.77 1vgr h ALA 151 Ca 0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1vgr h ALA 151 Cb 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vgr h ALA 151 CO -0.11 0.09 0.00 0.25 0.00 0.00 0.00 179.25 179.48 1vgr n THR 152 N -4.49 1.59 -4.78 0.00 -2.24 -0.96 -4.17 114.28 99.23 1vgr n THR 152 Ca 0.02 -1.31 -0.27 0.00 -2.27 0.00 0.00 64.05 60.22 1vgr n THR 152 Cb 0.13 0.19 -0.17 0.00 -2.10 0.00 0.00 70.33 68.37 1vgr n THR 152 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1vgr s THR 153 N -1.75 1.42 0.00 4.28 2.01 -0.88 -4.59 115.64 116.13 1vgr s THR 153 Ca 0.37 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.73 1vgr s THR 153 Cb 0.24 -1.26 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1vgr s THR 153 CO 0.17 0.42 0.00 0.61 -0.69 0.00 0.00 174.62 175.12 1vgr n GLY 154 N 3.72 -0.07 3.73 4.40 0.00 -1.26 -1.82 105.19 113.89 1vgr n GLY 154 Ca -0.22 -2.22 -0.26 0.00 0.00 0.00 0.00 46.02 43.32 1vgr n GLY 154 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1vgr s PHE 155 N 0.00 2.98 0.50 1.61 0.08 -1.26 -0.98 117.98 120.91 1vgr s PHE 155 Ca 0.00 -0.10 0.28 0.00 0.12 0.00 0.00 56.93 57.23 1vgr s PHE 155 Cb 0.00 -1.42 1.61 0.00 -0.57 0.00 0.00 43.02 42.64 1vgr s PHE 155 CO 0.00 0.53 2.16 0.11 -0.10 0.00 0.00 175.22 177.92 1vgr h TRP 156 N 2.40 0.00 -0.33 0.36 0.09 -1.94 -1.96 115.95 114.57 1vgr h TRP 156 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.51 1vgr h TRP 156 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.45 1vgr h TRP 156 CO 0.60 0.06 0.00 -0.40 0.09 0.00 0.00 178.44 178.80 1vgr n ASP 157 N -3.78 4.28 -3.05 0.11 5.75 -1.26 -4.95 116.55 113.64 1vgr n ASP 157 Ca -0.02 -3.00 -0.16 0.00 -0.01 0.00 0.00 54.79 51.59 1vgr n ASP 157 Cb 0.16 -0.57 -0.04 0.00 -1.03 0.00 0.00 41.12 39.63 1vgr n ASP 157 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1vgr n GLY 158 N -0.26 3.58 3.84 6.12 0.00 -0.74 -4.96 105.19 112.78 1vgr n GLY 158 Ca 0.23 -2.07 -0.30 0.00 0.00 0.00 0.00 46.02 43.88 1vgr n GLY 158 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vgr s PRO 159 N -2.99 2.48 0.28 1.61 0.04 -1.26 -4.75 135.00 130.40 1vgr s PRO 159 Ca 0.12 0.58 -0.28 0.00 0.04 0.00 0.00 61.00 61.45 1vgr s PRO 159 Cb 0.01 -1.97 -0.14 0.00 0.04 0.00 0.00 34.50 32.44 1vgr s PRO 159 CO 0.08 -1.33 1.02 -2.30 0.04 0.00 0.00 177.00 174.51 1vgr n PRO 160 N -3.23 1.33 -4.55 0.56 -0.02 -1.26 -4.56 135.00 123.28 1vgr n PRO 160 Ca 0.07 0.47 -0.23 0.00 -2.02 0.00 0.00 63.50 61.79 1vgr n PRO 160 Cb 0.57 -1.85 -0.16 0.00 -0.02 0.00 0.00 33.50 32.04 1vgr n PRO 160 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1vgr s THR 161 N -0.98 1.03 0.43 3.45 2.01 -0.76 -4.98 115.64 115.84 1vgr s THR 161 Ca 0.60 -0.47 -0.17 0.00 0.31 0.00 0.00 61.69 61.95 1vgr s THR 161 Cb -0.71 -0.92 -0.09 0.00 0.01 0.00 0.00 72.50 70.79 1vgr s THR 161 CO 0.59 0.32 0.90 0.68 -0.69 0.00 0.00 174.62 176.41 1vgr s VAL 162 N 0.30 4.53 0.25 3.82 -7.23 -1.26 -4.20 120.40 116.60 1vgr s VAL 162 Ca -0.06 1.21 -0.20 0.00 -1.81 0.00 0.00 61.98 61.12 1vgr s VAL 162 Cb -0.11 -3.65 -0.09 0.00 0.56 0.00 0.00 36.38 33.09 1vgr s VAL 162 CO 0.02 -0.41 0.76 -0.55 -0.31 0.00 0.00 175.10 174.61 1vgr s SER 163 N -2.54 7.08 0.45 4.85 0.15 -1.26 -4.96 113.70 117.46 1vgr s SER 163 Ca 0.58 1.48 0.23 0.00 0.70 0.00 0.00 55.95 58.94 1vgr s SER 163 Cb -0.10 -2.44 1.00 0.00 -1.71 0.00 0.00 66.02 62.77 1vgr s SER 163 CO 0.21 -0.01 1.87 1.23 1.20 0.00 0.00 173.24 177.74 1vgr h GLY 164 N 3.27 0.00 -2.73 9.45 0.00 -2.06 -3.43 103.07 107.57 1vgr h GLY 164 Ca -0.48 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.35 1vgr h GLY 164 CO 0.65 0.00 0.47 0.00 0.00 0.00 0.00 176.54 177.66 1vgr s ALA 165 N -3.81 2.99 -1.42 3.60 0.00 -1.26 -4.91 121.76 116.95 1vgr s ALA 165 Ca -0.01 0.89 -0.10 0.00 0.00 0.00 0.00 51.96 52.74 1vgr s ALA 165 Cb 0.11 -3.36 0.06 0.00 0.00 0.00 0.00 23.12 19.94 1vgr s ALA 165 CO 0.64 -0.57 2.34 0.00 0.00 0.00 0.00 175.76 178.17 1vgr n ALA 166 N -0.41 6.29 -0.10 0.00 0.00 -1.26 -4.69 120.51 120.34 1vgr n ALA 166 Ca 0.07 -3.97 0.12 0.00 0.00 0.00 0.00 53.44 49.66 1vgr n ALA 166 Cb 0.48 -3.16 0.49 0.00 0.00 0.00 0.00 19.45 17.27 1vgr n ALA 166 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1vgr h LEU 167 N 7.61 0.39 0.14 0.00 3.38 -1.91 -0.99 115.31 123.93 1vgr h LEU 167 Ca 0.63 0.01 -0.25 0.00 0.09 0.00 0.00 57.88 58.35 1vgr h LEU 167 Cb 0.47 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1vgr h LEU 167 CO 1.69 0.23 -1.23 1.23 0.09 0.00 0.00 178.44 180.45 1vgr h GLY 168 N 0.43 0.34 0.00 0.83 0.00 -1.84 -3.37 103.07 99.45 1vgr h GLY 168 Ca 0.29 -0.86 0.00 0.00 0.00 0.00 0.00 47.33 46.76 1vgr h GLY 168 CO -0.08 0.75 0.00 1.18 0.00 0.00 0.00 176.54 178.39 1vgr n GLU 169 N -3.96 0.00 -0.26 4.80 -0.58 -1.10 -3.88 120.64 115.66 1vgr n GLU 169 Ca -0.21 0.00 0.04 0.00 -0.42 0.00 0.00 57.16 56.58 1vgr n GLU 169 Cb 0.90 -0.12 0.27 0.00 -0.57 0.00 0.00 31.44 31.92 1vgr n GLU 169 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 1vgr h SER 170 N 0.00 0.83 -0.98 1.62 0.02 -1.75 -1.32 113.55 111.98 1vgr h SER 170 Ca 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.97 1vgr h SER 170 Cb 0.00 -0.18 -0.05 0.00 0.14 0.00 0.00 62.40 62.31 1vgr h SER 170 CO 0.00 0.54 0.65 -1.13 -1.14 0.00 0.00 176.83 175.75 1vgr h ASN 171 N 0.95 1.12 -0.69 3.07 -1.24 -1.38 0.10 115.58 117.51 1vgr h ASN 171 Ca 0.36 -0.03 -0.06 0.00 0.71 0.00 0.00 56.30 57.28 1vgr h ASN 171 Cb 0.19 -0.28 -0.03 0.00 0.73 0.00 0.00 38.32 38.93 1vgr h ASN 171 CO -0.13 0.81 0.18 0.28 -1.29 0.00 0.00 177.43 177.28 1vgr h SER 172 N 1.32 1.04 -0.68 1.15 0.02 -1.38 -1.32 113.55 113.71 1vgr h SER 172 Ca 0.36 -0.23 -0.06 0.00 -0.84 0.00 0.00 61.79 61.03 1vgr h SER 172 Cb -0.14 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.10 1vgr h SER 172 CO -0.08 0.99 0.20 1.23 -1.14 0.00 0.00 176.83 178.03 1vgr h GLY 173 N 1.03 1.14 1.04 -3.77 0.00 -0.58 0.78 103.07 102.72 1vgr h GLY 173 Ca 0.22 -0.68 -0.07 0.00 0.00 0.00 0.00 47.33 46.79 1vgr h GLY 173 CO -0.00 0.64 0.10 -0.33 0.00 0.00 0.00 176.54 176.94 1vgr h MET 174 N 0.99 1.01 -0.56 4.80 2.07 -0.68 -1.37 114.93 121.20 1vgr h MET 174 Ca 0.22 -0.27 -0.06 0.00 -2.07 0.00 0.00 59.70 57.51 1vgr h MET 174 Cb 0.31 -0.12 -0.02 0.00 -1.87 0.00 0.00 31.60 29.90 1vgr h MET 174 CO -0.01 0.95 0.10 0.45 1.07 0.00 0.00 176.91 179.47 1vgr h HIS 175 N 0.92 0.93 -0.37 -0.22 3.86 -0.90 -1.97 115.15 117.40 1vgr h HIS 175 Ca 0.19 -0.11 -0.02 0.00 -1.16 0.00 0.00 60.37 59.26 1vgr h HIS 175 Cb 0.43 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.62 1vgr h HIS 175 CO 0.03 0.80 0.13 1.25 0.86 0.00 0.00 177.93 180.99 1vgr h LEU 176 N 0.85 0.48 -0.54 2.43 5.85 -0.49 -2.00 115.31 121.89 1vgr h LEU 176 Ca 0.18 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.79 1vgr h LEU 176 Cb 0.36 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1vgr h LEU 176 CO 0.01 0.46 0.11 -0.03 -0.34 0.00 0.00 178.44 178.65 1vgr h MET 177 N 0.53 0.88 -0.48 1.25 4.05 -0.50 0.63 114.93 121.28 1vgr h MET 177 Ca 0.13 -0.22 0.07 0.00 -0.28 0.00 0.00 59.70 59.40 1vgr h MET 177 Cb 0.15 -0.11 -0.06 0.00 -0.80 0.00 0.00 31.60 30.78 1vgr h MET 177 CO -0.01 0.84 0.13 0.82 0.23 0.00 0.00 176.91 178.92 1vgr h ILE 178 N 0.77 0.78 -0.53 1.77 2.04 -1.07 -1.11 117.51 120.16 1vgr h ILE 178 Ca 0.17 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 1vgr h ILE 178 Cb 0.37 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 1vgr h ILE 178 CO 0.01 0.05 0.25 1.23 0.00 0.00 0.00 178.15 179.69 1vgr h GLY 179 N 0.28 0.82 0.89 5.37 0.00 -0.65 0.11 103.07 109.90 1vgr h GLY 179 Ca 0.24 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 1vgr h GLY 179 CO -0.28 0.39 0.08 -2.22 0.00 0.00 0.00 176.54 174.51 1vgr h ILE 180 N 0.71 1.21 -0.62 2.60 2.04 -0.72 -0.42 117.51 122.31 1vgr h ILE 180 Ca 0.18 -0.68 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 1vgr h ILE 180 Cb 0.13 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1vgr h ILE 180 CO -0.02 0.22 0.22 -0.07 0.00 0.00 0.00 178.15 178.50 1vgr h LEU 181 N 0.30 0.88 -1.03 1.44 3.38 -1.03 0.28 115.31 119.53 1vgr h LEU 181 Ca 0.09 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1vgr h LEU 181 Cb 0.26 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 1vgr h LEU 181 CO -0.00 0.83 0.64 0.00 0.09 0.00 0.00 178.44 180.01 1vgr h ALA 182 N 1.08 1.41 -0.31 1.53 0.00 -0.65 -1.93 119.26 120.39 1vgr h ALA 182 Ca 0.20 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 1vgr h ALA 182 Cb 0.25 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1vgr h ALA 182 CO -0.01 0.45 -0.40 0.00 0.00 0.00 0.00 179.25 179.29 1vgr h ALA 183 N 1.46 0.70 -0.55 0.00 0.00 -0.38 -0.36 119.26 120.13 1vgr h ALA 183 Ca 0.42 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1vgr h ALA 183 Cb 0.15 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1vgr h ALA 183 CO -0.16 0.66 0.29 -0.07 0.00 0.00 0.00 179.25 179.97 1vgr h LEU 184 N 0.62 0.67 -0.38 0.00 3.38 -0.66 -0.13 115.31 118.81 1vgr h LEU 184 Ca 0.05 -0.05 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1vgr h LEU 184 Cb 0.95 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.53 1vgr h LEU 184 CO 0.09 0.55 -0.57 -0.08 0.09 0.00 0.00 178.44 178.52 1vgr h GLU 185 N 0.76 0.74 -0.80 1.13 4.57 -1.02 -2.23 114.58 117.73 1vgr h GLU 185 Ca 0.19 -0.48 0.09 0.00 -1.18 0.00 0.00 59.36 57.99 1vgr h GLU 185 Cb 0.03 0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.61 1vgr h GLU 185 CO -0.03 1.10 0.45 0.82 -1.18 0.00 0.00 179.01 180.17 1vgr h ILE 186 N 0.56 0.91 -0.05 2.32 2.04 -0.46 -2.96 117.51 119.87 1vgr h ILE 186 Ca 0.01 -0.26 -0.14 0.00 1.00 0.00 0.00 64.86 65.47 1vgr h ILE 186 Cb 1.15 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1vgr h ILE 186 CO 0.12 0.14 -0.60 -0.09 0.00 0.00 0.00 178.15 177.72 1vgr h ARG 187 N 0.76 0.16 -0.69 2.37 2.43 -0.81 -1.56 114.38 117.06 1vgr h ARG 187 Ca 0.38 -0.11 0.11 0.00 -0.81 0.00 0.00 59.98 59.56 1vgr h ARG 187 Cb 0.35 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.87 1vgr h ARG 187 CO -0.24 0.71 0.46 0.45 -1.51 0.00 0.00 179.97 179.84 1vgr h HIS 188 N 0.12 0.52 0.14 2.20 3.86 -1.23 0.65 115.15 121.40 1vgr h HIS 188 Ca -0.01 0.01 -0.24 0.00 -1.16 0.00 0.00 60.37 58.98 1vgr h HIS 188 Cb 1.09 -0.17 0.01 0.00 1.06 0.00 0.00 27.41 29.40 1vgr h HIS 188 CO 0.01 0.23 -1.16 -0.22 0.86 0.00 0.00 177.93 177.66 1vgr h LYS 189 N 0.48 0.29 0.00 2.45 3.64 -1.42 -3.40 116.57 118.60 1vgr h LYS 189 Ca 0.32 -0.49 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1vgr h LYS 189 Cb 0.61 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1vgr h LYS 189 CO -0.10 1.24 -1.52 0.25 -2.27 0.00 0.00 179.45 177.04 1vgr n THR 190 N -4.00 0.00 -1.13 1.00 -2.24 -0.65 -4.98 114.28 102.28 1vgr n THR 190 Ca -0.20 -0.27 -0.05 0.00 -2.27 0.00 0.00 64.05 61.27 1vgr n THR 190 Cb 0.88 0.46 -0.02 0.00 -2.10 0.00 0.00 70.33 69.55 1vgr n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vgr n GLY 191 N 1.38 0.63 3.20 3.38 0.00 0.21 -5.00 105.19 108.99 1vgr n GLY 191 Ca -0.00 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.63 1vgr n GLY 191 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vgr s ARG 192 N -1.86 0.99 0.65 1.61 1.81 -1.26 -4.56 118.95 116.34 1vgr s ARG 192 Ca 0.00 -0.96 -0.09 0.00 -1.72 0.00 0.00 55.73 52.96 1vgr s ARG 192 Cb 0.00 -1.08 0.01 0.00 -0.45 0.00 0.00 34.95 33.43 1vgr s ARG 192 CO 0.00 0.25 1.01 0.20 -0.68 0.00 0.00 175.30 176.08 1vgr s GLY 193 N -1.57 1.62 0.22 -3.53 0.00 -0.57 -4.16 107.32 99.32 1vgr s GLY 193 Ca 0.02 -0.47 0.02 0.00 0.00 0.00 0.00 44.72 44.30 1vgr s GLY 193 CO 0.02 -0.15 0.03 1.20 0.00 0.00 0.00 173.10 174.21 1vgr s GLN 194 N -5.18 1.28 -0.06 2.90 -0.21 -1.25 -4.92 119.66 112.21 1vgr s GLN 194 Ca 0.56 -1.65 -0.18 0.00 0.02 0.00 0.00 55.36 54.10 1vgr s GLN 194 Cb -0.11 -0.37 -0.05 0.00 1.00 0.00 0.00 33.01 33.48 1vgr s GLN 194 CO 0.49 -0.18 0.50 0.21 -2.12 0.00 0.00 175.29 174.20 1vgr s LYS 195 N -3.94 4.26 0.03 2.91 2.20 -1.26 -1.71 119.74 122.23 1vgr s LYS 195 Ca 0.30 0.54 0.08 0.00 -0.36 0.00 0.00 55.97 56.53 1vgr s LYS 195 Cb 0.07 -3.37 -0.02 0.00 -1.51 0.00 0.00 37.83 32.99 1vgr s LYS 195 CO 0.09 0.32 -0.24 0.08 -0.36 0.00 0.00 175.35 175.23 1vgr s VAL 196 N 0.07 1.93 0.01 4.02 1.01 0.54 -4.96 120.40 123.02 1vgr s VAL 196 Ca 0.27 -1.22 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 1vgr s VAL 196 Cb -0.16 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 1vgr s VAL 196 CO 0.13 0.37 -0.02 0.00 0.00 0.00 0.00 175.10 175.58 1vgr s ALA 197 N -0.73 0.07 -0.10 5.51 0.00 -1.26 -1.33 121.76 123.92 1vgr s ALA 197 Ca 0.10 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.66 1vgr s ALA 197 Cb -0.09 0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.15 1vgr s ALA 197 CO 0.01 -0.12 -0.11 0.08 0.00 0.00 0.00 175.76 175.62 1vgr s VAL 198 N -1.04 1.18 0.06 0.00 1.01 -0.61 -4.96 120.40 116.04 1vgr s VAL 198 Ca -0.11 -0.45 -0.23 0.00 0.00 0.00 0.00 61.98 61.19 1vgr s VAL 198 Cb -0.07 -1.12 -0.06 0.00 0.00 0.00 0.00 36.38 35.12 1vgr s VAL 198 CO -0.01 0.38 0.71 0.00 0.00 0.00 0.00 175.10 176.18 1vgr s ALA 199 N 1.16 3.43 0.29 5.51 0.00 -1.26 -1.94 121.76 128.95 1vgr s ALA 199 Ca -0.05 0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1vgr s ALA 199 Cb -0.14 -2.90 0.51 0.00 0.00 0.00 0.00 23.12 20.59 1vgr s ALA 199 CO -0.03 0.16 1.90 0.52 0.00 0.00 0.00 175.76 178.31 1vgr h MET 200 N 5.32 1.03 -0.87 0.00 2.86 -0.48 -0.33 114.93 122.45 1vgr h MET 200 Ca -0.45 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.14 1vgr h MET 200 Cb 1.21 -0.23 -0.04 0.00 0.06 0.00 0.00 31.60 32.59 1vgr h MET 200 CO 0.69 0.68 0.57 0.37 1.06 0.00 0.00 176.91 180.28 1vgr h GLN 201 N 1.06 1.13 -0.30 1.72 4.15 -1.71 -1.98 115.11 119.18 1vgr h GLN 201 Ca 0.41 -0.07 -0.17 0.00 0.77 0.00 0.00 58.65 59.59 1vgr h GLN 201 Cb 0.23 -0.26 -0.00 0.00 0.21 0.00 0.00 27.48 27.66 1vgr h GLN 201 CO -0.17 0.75 -0.50 -0.44 -1.93 0.00 0.00 178.83 176.54 1vgr h ASP 202 N 1.17 0.91 -0.64 -0.69 5.19 -1.40 -1.22 116.42 119.74 1vgr h ASP 202 Ca 0.32 -0.47 -0.07 0.00 -0.62 0.00 0.00 57.03 56.20 1vgr h ASP 202 Cb -0.12 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.10 1vgr h ASP 202 CO -0.07 1.25 0.14 0.00 -3.12 0.00 0.00 179.24 177.43 1vgr h ALA 203 N 0.78 0.84 -0.12 3.45 0.00 -1.04 -1.60 119.26 121.58 1vgr h ALA 203 Ca 0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 1vgr h ALA 203 Cb 1.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1vgr h ALA 203 CO 0.11 0.57 0.07 0.28 0.00 0.00 0.00 179.25 180.28 1vgr h VAL 204 N 0.95 1.07 -0.50 0.00 2.07 -1.28 -3.10 116.25 115.46 1vgr h VAL 204 Ca 0.20 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.54 1vgr h VAL 204 Cb 0.39 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 1vgr h VAL 204 CO 0.01 0.06 0.33 0.25 0.02 0.00 0.00 177.57 178.24 1vgr h LEU 205 N 0.12 0.57 -1.31 2.57 6.46 -1.02 -1.14 115.31 121.55 1vgr h LEU 205 Ca 0.04 -0.01 -0.05 0.00 -0.12 0.00 0.00 57.88 57.74 1vgr h LEU 205 Cb 0.04 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 39.82 1vgr h LEU 205 CO -0.01 0.41 -0.03 -1.13 -0.62 0.00 0.00 178.44 177.06 1vgr h ASN 206 N 0.67 0.40 1.24 1.25 -0.00 -1.23 -1.06 115.58 116.85 1vgr h ASN 206 Ca 0.18 -0.07 0.00 0.00 -0.00 0.00 0.00 56.30 56.41 1vgr h ASN 206 Cb -0.07 -0.11 0.00 0.00 -0.00 0.00 0.00 38.32 38.14 1vgr h ASN 206 CO -0.04 0.49 -0.12 0.18 -0.00 0.00 0.00 177.43 177.94 1vgr n LEU 207 N -4.29 0.62 -1.57 0.34 4.77 -0.50 -3.26 117.00 113.12 1vgr n LEU 207 Ca 0.01 0.48 0.08 0.00 -0.03 0.00 0.00 56.01 56.55 1vgr n LEU 207 Cb 0.24 -0.33 0.36 0.00 -2.33 0.00 0.00 43.42 41.36 1vgr n LEU 207 CO 0.38 -0.11 0.82 0.52 -1.33 0.00 0.00 177.39 177.67 1vgr n VAL 208 N -2.05 2.29 -0.28 4.08 0.31 -0.46 -4.60 118.33 117.61 1vgr n VAL 208 Ca 0.05 -1.40 0.08 0.00 -0.01 0.00 0.00 64.34 63.07 1vgr n VAL 208 Cb 0.41 -0.10 0.23 0.00 -0.91 0.00 0.00 33.84 33.48 1vgr n VAL 208 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1vgr h ARG 209 N 3.59 0.46 -0.08 5.55 2.43 -1.38 -0.53 114.38 124.42 1vgr h ARG 209 Ca 0.00 -0.03 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1vgr h ARG 209 Cb 1.66 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 31.10 1vgr h ARG 209 CO 0.34 0.30 0.05 -0.84 -1.51 0.00 0.00 179.97 178.31 1vgr h ILE 210 N 0.47 0.97 0.00 1.20 -2.65 -1.88 -1.33 117.51 114.29 1vgr h ILE 210 Ca 0.47 -0.01 -0.09 0.00 1.03 0.00 0.00 64.86 66.27 1vgr h ILE 210 Cb 0.77 0.95 -0.01 0.00 -2.05 0.00 0.00 36.82 36.48 1vgr h ILE 210 CO -0.44 0.00 -0.41 0.11 0.03 0.00 0.00 178.15 177.44 1vgr h LYS 211 N 0.02 0.00 -0.01 0.16 1.79 -1.46 -1.59 116.57 115.48 1vgr h LYS 211 Ca 0.03 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.34 1vgr h LYS 211 Cb 0.11 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 1vgr h LYS 211 CO -0.00 0.41 -0.74 1.25 -1.08 0.00 0.00 179.45 179.29 1vgr h LEU 212 N 0.00 0.12 -0.06 2.94 5.85 -1.02 -1.11 115.31 122.04 1vgr h LEU 212 Ca -0.00 -0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.66 1vgr h LEU 212 Cb 1.31 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 1vgr h LEU 212 CO 0.05 0.82 -0.11 -0.09 -0.34 0.00 0.00 178.44 178.77 1vgr h ARG 213 N 0.06 -0.15 -0.92 1.25 2.43 -1.18 -2.62 114.38 113.25 1vgr h ARG 213 Ca -0.02 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1vgr h ARG 213 Cb 1.31 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.85 1vgr h ARG 213 CO 0.10 -0.10 0.61 -0.44 -1.51 0.00 0.00 179.97 178.63 1vgr h ASP 214 N -0.16 1.05 -0.66 -3.80 3.32 -1.14 -1.35 116.42 113.70 1vgr h ASP 214 Ca 0.06 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1vgr h ASP 214 Cb 0.24 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1vgr h ASP 214 CO -0.15 0.76 0.27 -0.61 -1.72 0.00 0.00 179.24 177.80 1vgr h GLN 215 N 1.25 0.99 -0.30 3.56 5.75 -1.08 0.01 115.11 125.29 1vgr h GLN 215 Ca 0.34 -0.17 -0.12 0.00 -0.15 0.00 0.00 58.65 58.54 1vgr h GLN 215 Cb -0.15 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.24 1vgr h GLN 215 CO -0.07 0.82 -0.29 1.96 -2.65 0.00 0.00 178.83 178.60 1vgr h GLN 216 N 0.93 0.72 -0.70 1.69 4.20 -1.18 -1.05 115.11 119.73 1vgr h GLN 216 Ca 0.22 -0.38 0.07 0.00 0.06 0.00 0.00 58.65 58.63 1vgr h GLN 216 Cb 0.19 0.01 -0.06 0.00 0.30 0.00 0.00 27.48 27.92 1vgr h GLN 216 CO -0.02 0.99 0.38 0.00 -0.67 0.00 0.00 178.83 179.51 1vgr h ARG 217 N 0.47 0.65 -0.38 1.46 3.08 -1.03 0.03 114.38 118.66 1vgr h ARG 217 Ca 0.05 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.01 1vgr h ARG 217 Cb 0.86 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.75 1vgr h ARG 217 CO 0.07 0.43 0.06 1.25 -1.07 0.00 0.00 179.97 180.71 1vgr h LEU 218 N 0.67 0.61 -1.02 3.04 5.85 -0.88 -1.04 115.31 122.55 1vgr h LEU 218 Ca 0.32 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1vgr h LEU 218 Cb 0.26 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1vgr h LEU 218 CO -0.22 0.72 0.46 -0.33 -0.34 0.00 0.00 178.44 178.74 1vgr h GLU 219 N 0.48 1.15 0.00 1.25 5.08 -0.56 0.06 114.58 122.03 1vgr h GLU 219 Ca 0.12 -0.12 -0.16 0.00 -1.00 0.00 0.00 59.36 58.19 1vgr h GLU 219 Cb 0.37 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 1vgr h GLU 219 CO 0.01 0.83 -0.91 0.00 -1.00 0.00 0.00 179.01 177.94 1vgr h ARG 220 N 1.16 0.00 0.00 2.33 3.08 -0.77 -3.40 114.38 116.78 1vgr h ARG 220 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1vgr h ARG 220 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.06 1vgr h ARG 220 CO -0.05 0.62 -0.55 0.25 -1.07 0.00 0.00 179.97 179.17 1vgr n THR 221 N -3.19 0.00 -0.99 2.04 -2.24 -0.41 -5.02 114.28 104.46 1vgr n THR 221 Ca -0.02 -0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1vgr n THR 221 Cb 0.84 0.57 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 1vgr n THR 221 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vgr n GLY 222 N 1.62 0.93 3.28 3.38 0.00 0.00 -5.00 105.19 109.40 1vgr n GLY 222 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1vgr n GLY 222 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1vgr s ILE 223 N -3.70 0.04 -0.34 -0.61 2.07 -1.26 -4.71 121.20 112.69 1vgr s ILE 223 Ca 0.00 -0.36 0.02 0.00 -1.41 0.00 0.00 60.65 58.90 1vgr s ILE 223 Cb 0.00 -0.66 0.10 0.00 0.13 0.00 0.00 42.46 42.03 1vgr s ILE 223 CO 0.00 -0.20 0.08 -0.76 -1.91 0.00 0.00 174.94 172.15 1vgr s LEU 224 N -1.16 3.89 0.46 8.50 1.43 -1.26 -4.42 118.68 126.12 1vgr s LEU 224 Ca -0.12 -2.03 0.22 0.00 -1.03 0.00 0.00 54.13 51.17 1vgr s LEU 224 Cb -0.04 -1.37 1.11 0.00 0.03 0.00 0.00 46.19 45.92 1vgr s LEU 224 CO 0.05 -0.38 1.94 0.00 0.23 0.00 0.00 176.35 178.19 1vgr h ALA 225 N 7.71 1.27 -0.00 4.21 0.00 -1.99 -1.55 119.26 128.90 1vgr h ALA 225 Ca -0.07 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1vgr h ALA 225 Cb 1.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1vgr h ALA 225 CO 0.51 0.27 -0.29 -0.85 0.00 0.00 0.00 179.25 178.89 1vgr n GLU 226 N -3.74 0.04 -2.89 0.00 0.00 -1.26 -4.79 120.64 107.99 1vgr n GLU 226 Ca -0.01 -0.02 -0.36 0.00 0.00 0.00 0.00 57.16 56.77 1vgr n GLU 226 Cb 0.33 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.20 1vgr n GLU 226 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1vgr s TYR 227 N -2.97 3.60 0.33 -1.84 1.51 -0.58 -4.90 117.35 112.49 1vgr s TYR 227 Ca 0.13 1.61 0.10 0.00 -1.01 0.00 0.00 57.07 57.91 1vgr s TYR 227 Cb 0.18 -2.81 0.90 0.00 -0.11 0.00 0.00 41.96 40.13 1vgr s TYR 227 CO 0.63 0.18 1.74 -1.35 -1.11 0.00 0.00 175.55 175.64 1vgr h PRO 228 N 2.96 0.56 -0.00 -1.71 0.11 -1.87 -0.76 132.00 131.30 1vgr h PRO 228 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1vgr h PRO 228 Cb 1.19 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 1vgr h PRO 228 CO 0.64 0.37 0.00 1.96 -0.21 0.00 0.00 178.00 180.77 1vgr h GLN 229 N 0.58 0.00 -0.01 1.05 7.50 -1.91 -1.56 115.11 120.76 1vgr h GLN 229 Ca 0.63 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.78 1vgr h GLN 229 Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.76 1vgr h GLN 229 CO -0.44 0.00 -0.03 0.00 -1.50 0.00 0.00 178.83 176.87 1vgr n ALA 230 N -2.19 2.63 -2.61 3.87 0.00 -0.29 -3.80 120.51 118.12 1vgr n ALA 230 Ca -0.03 -0.43 -0.38 0.00 0.00 0.00 0.00 53.44 52.60 1vgr n ALA 230 Cb 0.08 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.29 1vgr n ALA 230 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1vgr s GLN 231 N -2.06 4.21 0.07 0.00 -1.52 -0.59 -4.91 119.66 114.87 1vgr s GLN 231 Ca 0.37 0.48 -0.36 0.00 -1.95 0.00 0.00 55.36 53.90 1vgr s GLN 231 Cb 0.21 -3.35 -0.15 0.00 -0.22 0.00 0.00 33.01 29.49 1vgr s GLN 231 CO 0.36 0.36 1.50 -2.30 -0.25 0.00 0.00 175.29 174.95 1vgr n PRO 232 N 2.94 1.58 -3.71 2.91 -0.02 -1.26 -3.45 135.00 133.99 1vgr n PRO 232 Ca -0.09 0.57 -0.20 0.00 -2.02 0.00 0.00 63.50 61.76 1vgr n PRO 232 Cb 0.52 -2.28 -0.01 0.00 -0.02 0.00 0.00 33.50 31.71 1vgr n PRO 232 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1vgr n ASN 233 N 3.37 -1.09 0.00 2.55 5.03 -1.26 -4.80 115.26 119.06 1vgr n ASN 233 Ca 0.19 -0.61 -0.01 0.00 0.87 0.00 0.00 54.58 55.02 1vgr n ASN 233 Cb 0.23 -0.73 -0.00 0.00 -1.02 0.00 0.00 39.78 38.25 1vgr n ASN 233 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 1vgr n PHE 234 N -2.80 0.00 -2.30 3.10 7.35 -1.22 -5.02 117.46 116.57 1vgr n PHE 234 Ca -0.09 0.00 -0.37 0.00 -0.76 0.00 0.00 57.45 56.23 1vgr n PHE 234 Cb 0.28 -0.07 -0.01 0.00 0.35 0.00 0.00 39.48 40.02 1vgr n PHE 234 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1vgr s ALA 235 N -2.34 2.99 0.00 3.13 0.00 -1.26 -4.99 121.76 119.29 1vgr s ALA 235 Ca -0.04 0.90 0.01 0.00 0.00 0.00 0.00 51.96 52.82 1vgr s ALA 235 Cb 0.01 -3.37 -0.01 0.00 0.00 0.00 0.00 23.12 19.75 1vgr s ALA 235 CO 0.06 -0.59 -0.03 -0.06 0.00 0.00 0.00 175.76 175.14 1vgr s PHE 236 N -1.57 0.27 0.00 0.00 0.40 -1.26 -1.89 117.98 113.94 1vgr s PHE 236 Ca 0.63 -0.14 0.00 0.00 -0.60 0.00 0.00 56.93 56.82 1vgr s PHE 236 Cb -0.27 -0.18 0.00 0.00 0.51 0.00 0.00 43.02 43.08 1vgr s PHE 236 CO 0.33 -0.03 0.00 -0.40 0.70 0.00 0.00 175.22 175.82 1vgr n ASP 237 N 2.73 -0.06 -0.02 1.36 5.68 -0.78 -4.68 116.55 120.77 1vgr n ASP 237 Ca -0.15 -0.17 -0.13 0.00 -0.50 0.00 0.00 54.79 53.85 1vgr n ASP 237 Cb 0.58 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.47 1vgr n ASP 237 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1vgr h ARG 238 N 0.00 0.07 -6.50 0.11 3.08 -1.92 -3.42 114.38 105.79 1vgr h ARG 238 Ca 0.00 -0.03 -0.52 0.00 0.07 0.00 0.00 59.98 59.49 1vgr h ARG 238 Cb 0.00 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 1vgr h ARG 238 CO 0.00 0.49 0.29 -0.51 -1.07 0.00 0.00 179.97 179.17 1vgr s ASP 239 N -5.72 7.42 0.00 7.04 1.11 -1.26 -4.84 116.67 120.42 1vgr s ASP 239 Ca -0.15 1.70 -0.01 0.00 0.18 0.00 0.00 52.55 54.27 1vgr s ASP 239 Cb 0.03 -2.55 -0.01 0.00 1.07 0.00 0.00 42.92 41.46 1vgr s ASP 239 CO 0.69 -0.00 0.28 0.61 1.18 0.00 0.00 175.17 177.93 1vgr n GLY 240 N 2.17 0.30 3.29 0.21 0.00 -1.26 -4.78 105.19 105.11 1vgr n GLY 240 Ca -0.00 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 1vgr n GLY 240 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vgr s ASN 241 N 2.12 2.59 0.21 1.61 -0.87 -1.26 -5.03 114.94 114.31 1vgr s ASN 241 Ca 0.02 -0.65 -0.31 0.00 -1.57 0.00 0.00 52.86 50.35 1vgr s ASN 241 Cb 0.00 -0.16 -0.11 0.00 -0.02 0.00 0.00 41.25 40.96 1vgr s ASN 241 CO 0.01 0.10 1.58 -2.84 -2.57 0.00 0.00 177.10 173.38 1vgr s PRO 242 N -1.73 4.19 0.38 -0.60 0.02 -1.26 -1.87 135.00 134.12 1vgr s PRO 242 Ca 0.07 2.44 -0.05 0.00 0.02 0.00 0.00 61.00 63.49 1vgr s PRO 242 Cb -0.10 -3.10 -0.05 0.00 0.02 0.00 0.00 34.50 31.27 1vgr s PRO 242 CO 0.04 -0.61 0.66 -0.51 -0.33 0.00 0.00 177.00 176.24 1vgr s LEU 243 N 0.57 3.89 0.32 -5.54 1.43 -0.79 -4.77 118.68 113.79 1vgr s LEU 243 Ca 0.68 0.79 -0.17 0.00 -1.03 0.00 0.00 54.13 54.40 1vgr s LEU 243 Cb -0.45 -3.67 0.03 0.00 0.03 0.00 0.00 46.19 42.13 1vgr s LEU 243 CO 0.37 -0.36 0.71 -0.94 0.23 0.00 0.00 176.35 176.36 1vgr s SER 244 N -3.61 -0.09 0.00 2.29 1.04 -1.25 -4.76 113.70 107.32 1vgr s SER 244 Ca 0.45 -0.88 0.31 0.00 0.48 0.00 0.00 55.95 56.32 1vgr s SER 244 Cb -0.10 0.76 1.73 0.00 0.10 0.00 0.00 66.02 68.50 1vgr s SER 244 CO 0.36 -1.45 2.15 0.49 0.98 0.00 0.00 173.24 175.76 1vgr n PHE 245 N -0.48 0.00 -1.77 5.02 3.01 -1.26 -4.52 117.46 117.45 1vgr n PHE 245 Ca -0.05 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.99 1vgr n PHE 245 Cb 0.60 -0.13 -0.03 0.00 -0.01 0.00 0.00 39.48 39.91 1vgr n PHE 245 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1vgr s ASP 246 N -2.26 6.48 -0.18 4.37 1.11 -1.26 -2.46 116.67 122.47 1vgr s ASP 246 Ca 0.39 2.67 0.00 0.00 0.18 0.00 0.00 52.55 55.79 1vgr s ASP 246 Cb 0.21 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.64 1vgr s ASP 246 CO 0.41 -0.97 0.00 -0.46 1.18 0.00 0.00 175.17 175.32 1vgr n ASN 247 N 5.80 -3.44 -4.18 0.27 6.94 -1.26 -5.02 115.26 114.37 1vgr n ASN 247 Ca 0.17 0.04 -0.34 0.00 -0.02 0.00 0.00 54.58 54.43 1vgr n ASN 247 Cb 0.39 -1.08 -0.15 0.00 -2.36 0.00 0.00 39.78 36.58 1vgr n ASN 247 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1vgr s ILE 248 N -1.98 2.71 -0.55 1.53 1.01 -1.03 -4.97 121.20 117.92 1vgr s ILE 248 Ca 0.00 -1.03 0.07 0.00 0.00 0.00 0.00 60.65 59.69 1vgr s ILE 248 Cb 0.00 -2.35 -0.02 0.00 0.01 0.00 0.00 42.46 40.10 1vgr s ILE 248 CO 0.00 0.25 0.46 0.35 0.00 0.00 0.00 174.94 175.99 1vgr n THR 249 N 4.65 0.00 -4.82 2.92 -2.24 -1.26 -4.96 114.28 108.57 1vgr n THR 249 Ca -0.17 -0.40 -0.25 0.00 -2.27 0.00 0.00 64.05 60.96 1vgr n THR 249 Cb 0.47 1.06 -0.15 0.00 -2.10 0.00 0.00 70.33 69.61 1vgr n THR 249 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1vgr s SER 250 N -1.26 2.03 -0.19 3.42 0.15 -1.26 -4.84 113.70 111.75 1vgr s SER 250 Ca 0.05 -0.31 -0.40 0.00 0.70 0.00 0.00 55.95 55.98 1vgr s SER 250 Cb 0.06 -0.26 -0.17 0.00 -1.71 0.00 0.00 66.02 63.94 1vgr s SER 250 CO 0.21 0.20 1.58 0.52 1.20 0.00 0.00 173.24 176.95 1vgr n VAL 251 N 2.71 0.17 -2.60 4.45 0.31 -1.26 -4.92 118.33 117.18 1vgr n VAL 251 Ca -0.15 -0.03 -0.22 0.00 -0.01 0.00 0.00 64.34 63.93 1vgr n VAL 251 Cb 0.54 -0.95 0.05 0.00 -0.91 0.00 0.00 33.84 32.57 1vgr n VAL 251 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1vgr s PRO 252 N 2.44 2.43 0.20 5.55 0.04 -1.26 -4.73 135.00 139.68 1vgr s PRO 252 Ca 0.95 -0.78 -0.30 0.00 0.04 0.00 0.00 61.00 60.91 1vgr s PRO 252 Cb -1.11 -2.45 -0.08 0.00 0.04 0.00 0.00 34.50 30.90 1vgr s PRO 252 CO 0.62 -0.82 1.07 1.03 0.04 0.00 0.00 177.00 178.94 1vgr s ARG 253 N -4.83 4.64 -0.19 4.56 0.52 -1.26 -4.81 118.95 117.57 1vgr s ARG 253 Ca 0.58 1.69 0.13 0.00 -0.52 0.00 0.00 55.73 57.61 1vgr s ARG 253 Cb -0.10 -3.27 0.39 0.00 0.52 0.00 0.00 34.95 32.50 1vgr s ARG 253 CO 0.39 0.16 1.23 0.41 0.02 0.00 0.00 175.30 177.51 1vgr n GLY 254 N 1.83 5.03 7.00 -3.53 0.00 -1.24 -3.70 105.19 110.58 1vgr n GLY 254 Ca 0.01 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.78 1vgr n GLY 254 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgr n GLY 255 N -1.19 2.87 1.65 -0.02 0.00 -0.15 -2.34 105.19 106.00 1vgr n GLY 255 Ca 0.19 0.31 -0.13 0.00 0.00 0.00 0.00 46.02 46.39 1vgr n GLY 255 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vgr n ASN 256 N 6.17 3.05 -4.71 1.61 3.02 -1.26 -4.64 115.26 118.50 1vgr n ASN 256 Ca 0.00 -3.71 -0.29 0.00 -0.03 0.00 0.00 54.58 50.56 1vgr n ASN 256 Cb 0.00 -0.73 0.15 0.00 -0.61 0.00 0.00 39.78 38.59 1vgr n ASN 256 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vgr s ALA 257 N -3.27 1.63 0.53 5.41 0.00 -0.99 -4.10 121.76 120.98 1vgr s ALA 257 Ca 0.50 -0.55 0.26 0.00 0.00 0.00 0.00 51.96 52.18 1vgr s ALA 257 Cb 0.44 -3.03 1.41 0.00 0.00 0.00 0.00 23.12 21.94 1vgr s ALA 257 CO 0.05 -2.42 1.98 0.78 0.00 0.00 0.00 175.76 176.15 1vgr h GLY 258 N -1.60 0.00 0.00 0.00 0.00 -1.74 -3.46 103.07 96.27 1vgr h GLY 258 Ca -0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.82 1vgr h GLY 258 CO 0.60 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.75 1vgr n GLY 259 N -1.65 3.62 0.56 4.60 0.00 -1.26 -1.91 105.19 109.16 1vgr n GLY 259 Ca 0.11 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.17 1vgr n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgr n GLY 260 N 0.00 0.28 0.75 -0.02 0.00 -1.26 -4.77 105.19 100.17 1vgr n GLY 260 Ca 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 1vgr n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vgr n GLY 261 N 1.15 1.01 3.82 -0.02 0.00 -0.80 -5.12 105.19 105.24 1vgr n GLY 261 Ca 0.17 -2.01 -0.31 0.00 0.00 0.00 0.00 46.02 43.87 1vgr n GLY 261 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vgr s GLN 262 N -2.82 2.71 0.25 1.61 -1.52 -1.26 -4.79 119.66 113.84 1vgr s GLN 262 Ca 0.13 0.85 -0.30 0.00 -1.95 0.00 0.00 55.36 54.09 1vgr s GLN 262 Cb -0.01 -1.97 -0.14 0.00 -0.22 0.00 0.00 33.01 30.67 1vgr s GLN 262 CO 0.08 -1.24 1.13 -0.35 -0.25 0.00 0.00 175.29 174.67 1vgr n PRO 263 N -3.21 1.45 -2.89 2.91 -0.04 -1.26 -4.27 135.00 127.69 1vgr n PRO 263 Ca 0.07 0.51 -0.05 0.00 -0.04 0.00 0.00 63.50 64.00 1vgr n PRO 263 Cb 0.54 -1.97 0.02 0.00 -0.04 0.00 0.00 33.50 32.05 1vgr n PRO 263 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vgr n GLY 264 N 1.57 1.17 3.36 0.55 0.00 -1.26 -0.78 105.19 109.80 1vgr n GLY 264 Ca 0.11 -1.14 -0.10 0.00 0.00 0.00 0.00 46.02 44.89 1vgr n GLY 264 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1vgr s TRP 265 N -4.16 0.59 -0.30 1.61 -0.11 -1.13 -4.10 118.94 111.34 1vgr s TRP 265 Ca 0.12 -0.92 -0.11 0.00 1.22 0.00 0.00 56.10 56.41 1vgr s TRP 265 Cb -0.03 -0.13 -0.03 0.00 -1.50 0.00 0.00 33.47 31.78 1vgr s TRP 265 CO 0.06 -0.77 0.18 1.41 -4.62 0.00 0.00 176.95 173.22 1vgr s MET 266 N -4.03 3.69 -0.08 5.86 -2.45 -1.26 -1.80 119.30 119.23 1vgr s MET 266 Ca 0.24 -0.49 0.04 0.00 -1.25 0.00 0.00 55.69 54.23 1vgr s MET 266 Cb 0.03 -3.63 -0.01 0.00 1.25 0.00 0.00 34.83 32.47 1vgr s MET 266 CO 0.05 -0.29 -0.20 -0.51 1.05 0.00 0.00 175.02 175.13 1vgr s LEU 267 N 1.70 2.36 0.70 4.11 1.43 0.24 -4.96 118.68 124.26 1vgr s LEU 267 Ca 0.06 -0.41 -0.16 0.00 -1.03 0.00 0.00 54.13 52.59 1vgr s LEU 267 Cb -0.16 -1.47 0.02 0.00 0.03 0.00 0.00 46.19 44.60 1vgr s LEU 267 CO 0.09 0.23 1.23 -0.54 0.23 0.00 0.00 176.35 177.59 1vgr s LYS 268 N -0.07 2.30 0.30 1.70 1.02 -1.26 -1.53 119.74 122.20 1vgr s LYS 268 Ca -0.05 1.85 0.04 0.00 0.02 0.00 0.00 55.97 57.83 1vgr s LYS 268 Cb -0.14 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.29 1vgr s LYS 268 CO 0.04 -1.73 0.20 0.00 -0.92 0.00 0.00 175.35 172.94 1vgr n LYS 270 N -0.57 1.93 -0.90 0.00 4.81 -0.52 -2.38 118.16 120.53 1vgr n LYS 270 Ca 0.03 0.69 0.00 0.00 -0.87 0.00 0.00 58.31 58.16 1vgr n LYS 270 Cb 0.64 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.36 1vgr n LYS 270 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1vgr n GLY 271 N 2.14 0.51 0.31 3.14 0.00 -1.26 -4.76 105.19 105.27 1vgr n GLY 271 Ca 0.12 -0.37 0.16 0.00 0.00 0.00 0.00 46.02 45.93 1vgr n GLY 271 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1vgr h TRP 272 N 0.00 0.00 -0.37 1.61 5.08 -1.66 0.26 115.95 120.88 1vgr h TRP 272 Ca 0.00 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.85 1vgr h TRP 272 Cb 0.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.15 1vgr h TRP 272 CO 0.00 0.00 -0.25 0.93 -1.28 0.00 0.00 178.44 177.84 1vgr h GLU 273 N 0.00 0.81 -0.01 0.12 3.07 -1.92 -3.20 114.58 113.46 1vgr h GLU 273 Ca 0.02 -0.39 0.00 0.00 -0.50 0.00 0.00 59.36 58.49 1vgr h GLU 273 Cb 0.12 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.03 1vgr h GLU 273 CO -0.00 1.02 -0.80 0.25 -1.40 0.00 0.00 179.01 178.07 1vgr n THR 274 N -4.22 0.00 -3.88 1.13 -2.24 -1.06 -4.80 114.28 99.21 1vgr n THR 274 Ca -0.02 -0.09 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 1vgr n THR 274 Cb 0.46 1.08 -0.15 0.00 -2.10 0.00 0.00 70.33 69.62 1vgr n THR 274 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1vgr s ASP 275 N -2.81 4.38 0.54 3.42 -1.08 0.05 -4.99 116.67 116.18 1vgr s ASP 275 Ca 0.12 -2.05 0.33 0.00 -0.52 0.00 0.00 52.55 50.43 1vgr s ASP 275 Cb 0.17 -1.30 1.80 0.00 -1.46 0.00 0.00 42.92 42.13 1vgr s ASP 275 CO 0.76 -0.38 2.00 0.00 0.52 0.00 0.00 175.17 178.08 1vgr h ALA 276 N 7.65 1.07 -0.26 3.66 0.00 -1.85 -2.35 119.26 127.19 1vgr h ALA 276 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1vgr h ALA 276 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1vgr h ALA 276 CO 0.51 -0.07 0.00 -0.25 0.00 0.00 0.00 179.25 179.44 1vgr n ASP 277 N -2.72 3.30 -4.43 0.00 8.00 -1.26 -4.86 116.55 114.57 1vgr n ASP 277 Ca -0.02 -2.57 -0.44 0.00 0.71 0.00 0.00 54.79 52.46 1vgr n ASP 277 Cb 0.13 -0.38 -0.01 0.00 -0.02 0.00 0.00 41.12 40.84 1vgr n ASP 277 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1vgr s SER 278 N -1.58 6.95 0.04 -2.24 1.04 -0.88 -4.53 113.70 112.49 1vgr s SER 278 Ca 0.32 -2.78 -0.13 0.00 0.48 0.00 0.00 55.95 53.84 1vgr s SER 278 Cb 0.23 -2.36 0.02 0.00 0.10 0.00 0.00 66.02 64.01 1vgr s SER 278 CO 0.10 -0.76 0.28 -0.31 0.98 0.00 0.00 173.24 173.53 1vgr s TYR 279 N 1.37 -0.07 0.20 5.02 1.51 -1.26 -1.81 117.35 122.31 1vgr s TYR 279 Ca 0.36 -0.08 0.10 0.00 -1.01 0.00 0.00 57.07 56.44 1vgr s TYR 279 Cb -0.05 0.06 -0.04 0.00 -0.11 0.00 0.00 41.96 41.82 1vgr s TYR 279 CO -0.05 -0.48 -0.20 0.14 -1.11 0.00 0.00 175.55 173.85 1vgr s VAL 280 N -2.48 2.12 -0.04 0.71 -7.23 -0.58 -1.28 120.40 111.61 1vgr s VAL 280 Ca -0.06 -2.07 -0.02 0.00 -1.81 0.00 0.00 61.98 58.03 1vgr s VAL 280 Cb -0.01 -2.04 -0.04 0.00 0.56 0.00 0.00 36.38 34.85 1vgr s VAL 280 CO -0.03 -0.28 0.09 -0.47 -0.31 0.00 0.00 175.10 174.10 1vgr s TYR 281 N -2.06 3.35 -0.29 2.82 6.14 0.11 -0.60 117.35 126.82 1vgr s TYR 281 Ca 0.20 0.28 -0.00 0.00 0.64 0.00 0.00 57.07 58.19 1vgr s TYR 281 Cb -0.06 -1.79 0.09 0.00 0.42 0.00 0.00 41.96 40.62 1vgr s TYR 281 CO 0.09 0.58 0.06 0.12 0.64 0.00 0.00 175.55 177.05 1vgr s PHE 282 N -1.13 1.97 -0.34 4.97 2.19 -0.75 -2.27 117.98 122.63 1vgr s PHE 282 Ca 0.20 -1.79 -0.23 0.00 0.33 0.00 0.00 56.93 55.45 1vgr s PHE 282 Cb -0.12 -1.76 0.00 0.00 -1.31 0.00 0.00 43.02 39.83 1vgr s PHE 282 CO 0.11 -0.84 0.76 0.99 1.83 0.00 0.00 175.22 178.07 1vgr s THR 283 N 1.53 4.78 -0.74 0.12 2.01 -1.15 -2.82 115.64 119.37 1vgr s THR 283 Ca 0.06 0.95 -0.10 0.00 0.31 0.00 0.00 61.69 62.91 1vgr s THR 283 Cb -0.18 -4.16 0.19 0.00 0.01 0.00 0.00 72.50 68.37 1vgr s THR 283 CO -0.18 -0.34 0.63 -0.63 -0.69 0.00 0.00 174.62 173.41 1vgr s ILE 284 N 2.98 4.90 0.80 1.82 1.01 0.04 -4.68 121.20 128.07 1vgr s ILE 284 Ca 0.30 -2.59 -0.04 0.00 0.00 0.00 0.00 60.65 58.33 1vgr s ILE 284 Cb -0.14 -4.08 0.16 0.00 0.01 0.00 0.00 42.46 38.41 1vgr s ILE 284 CO 0.15 -0.96 1.09 0.00 0.00 0.00 0.00 174.94 175.22 1vgr s ALA 285 N 0.17 3.42 -0.06 9.38 0.00 -1.26 -4.38 121.76 129.02 1vgr s ALA 285 Ca 0.17 -1.75 -0.19 0.00 0.00 0.00 0.00 51.96 50.19 1vgr s ALA 285 Cb -0.15 -2.10 -0.30 0.00 0.00 0.00 0.00 23.12 20.57 1vgr s ALA 285 CO -0.06 -1.78 0.78 0.00 0.00 0.00 0.00 175.76 174.70 1vgr h ALA 286 N -0.84 -0.00 0.00 0.00 0.00 -1.97 -3.33 119.26 113.11 1vgr h ALA 286 Ca -0.36 -0.85 -0.01 0.00 0.00 0.00 0.00 54.91 53.68 1vgr h ALA 286 Cb 1.25 0.24 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 1vgr h ALA 286 CO 0.36 0.57 -0.06 -0.91 0.00 0.00 0.00 179.25 179.21 1vgr h ASN 287 N -0.30 0.00 0.00 0.00 2.35 -2.01 -3.28 115.58 112.34 1vgr h ASN 287 Ca -0.21 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.46 1vgr h ASN 287 Cb 1.74 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 39.93 1vgr h ASN 287 CO 0.13 0.06 -0.72 0.23 -1.65 0.00 0.00 177.43 175.48 1vgr n MET 288 N -3.56 0.76 -0.20 0.81 2.81 -1.26 -4.86 117.12 111.62 1vgr n MET 288 Ca -0.02 -2.55 -0.08 0.00 -1.81 0.00 0.00 57.70 53.24 1vgr n MET 288 Cb 0.17 -0.81 0.04 0.00 -0.71 0.00 0.00 33.22 31.91 1vgr n MET 288 CO 0.00 0.00 0.00 2.35 1.51 0.00 0.00 175.97 179.83 1vgr h TRP 289 N 0.89 1.14 -0.54 2.03 2.91 -1.67 -2.91 115.95 117.80 1vgr h TRP 289 Ca -0.10 -0.19 0.03 0.00 1.13 0.00 0.00 58.89 59.76 1vgr h TRP 289 Cb 1.43 -0.30 -0.04 0.00 -0.51 0.00 0.00 29.16 29.74 1vgr h TRP 289 CO 0.42 1.00 0.31 -1.35 -1.03 0.00 0.00 178.44 177.79 1vgr h PRO 290 N 0.96 0.59 0.00 2.65 0.11 -1.90 -2.73 132.00 131.69 1vgr h PRO 290 Ca 0.17 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.22 1vgr h PRO 290 Cb 0.55 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.52 1vgr h PRO 290 CO 0.03 0.39 -0.12 1.96 -0.21 0.00 0.00 178.00 180.05 1vgr h GLN 291 N 0.61 0.00 -0.02 1.05 7.50 -1.89 -2.93 115.11 119.44 1vgr h GLN 291 Ca 0.23 0.00 -0.17 0.00 0.50 0.00 0.00 58.65 59.20 1vgr h GLN 291 Cb 0.07 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.58 1vgr h GLN 291 CO -0.12 0.12 -0.76 0.82 -1.50 0.00 0.00 178.83 177.39 1vgr h ILE 292 N 0.00 1.46 0.00 2.54 2.04 -1.29 -3.29 117.51 118.97 1vgr h ILE 292 Ca -0.00 -2.38 0.00 0.00 1.00 0.00 0.00 64.86 63.48 1vgr h ILE 292 Cb 0.43 2.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1vgr h ILE 292 CO 0.02 0.69 0.00 0.00 0.00 0.00 0.00 178.15 178.86 1vgr h ASP 294 N 0.00 0.39 0.84 0.00 3.32 -1.73 -3.25 116.42 116.00 1vgr h ASP 294 Ca 0.00 -0.87 -0.06 0.00 0.02 0.00 0.00 57.03 56.13 1vgr h ASP 294 Cb 0.00 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1vgr h ASP 294 CO 0.00 1.72 -0.27 -0.03 -1.72 0.00 0.00 179.24 178.94 1vgr h MET 295 N -0.18 0.00 -0.07 3.56 4.05 -1.80 -2.70 114.93 117.80 1vgr h MET 295 Ca -0.36 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.06 1vgr h MET 295 Cb 1.86 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.66 1vgr h MET 295 CO 0.06 0.27 0.00 -0.89 0.23 0.00 0.00 176.91 176.58 1vgr n ILE 296 N -3.47 0.09 -3.80 1.77 2.08 -1.26 -4.89 119.36 109.88 1vgr n ILE 296 Ca -0.00 -0.10 -0.32 0.00 0.56 0.00 0.00 62.75 62.88 1vgr n ILE 296 Cb 0.44 -0.04 -0.06 0.00 -0.75 0.00 0.00 39.64 39.24 1vgr n ILE 296 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 1vgr n ASP 297 N -0.38 -1.32 -3.73 4.38 5.75 -1.02 -4.88 116.55 115.36 1vgr n ASP 297 Ca 0.09 -0.94 -0.29 0.00 -0.01 0.00 0.00 54.79 53.64 1vgr n ASP 297 Cb 0.11 -1.20 -0.13 0.00 -1.03 0.00 0.00 41.12 38.87 1vgr n ASP 297 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1vgr s LYS 298 N -5.72 1.46 0.00 0.11 1.02 -1.23 -4.96 119.74 110.42 1vgr s LYS 298 Ca 0.61 -2.23 0.20 0.00 0.02 0.00 0.00 55.97 54.57 1vgr s LYS 298 Cb -0.36 -2.48 1.12 0.00 -0.52 0.00 0.00 37.83 35.60 1vgr s LYS 298 CO 0.77 -1.19 1.73 -2.30 -0.92 0.00 0.00 175.35 173.44 1vgr n PRO 299 N 3.26 1.06 0.27 -1.68 -0.02 -1.26 -3.97 135.00 132.65 1vgr n PRO 299 Ca 0.11 -0.09 0.16 0.00 -2.02 0.00 0.00 63.50 61.66 1vgr n PRO 299 Cb 0.36 -1.31 0.67 0.00 -0.02 0.00 0.00 33.50 33.20 1vgr n PRO 299 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1vgr h GLU 300 N 0.19 0.00 -0.00 -0.52 3.07 -1.93 -3.14 114.58 112.24 1vgr h GLU 300 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1vgr h GLU 300 Cb 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 1vgr h GLU 300 CO 0.00 0.06 -0.07 0.91 -1.40 0.00 0.00 179.01 178.51 1vgr n TRP 301 N -3.20 0.00 0.10 4.33 8.01 -1.26 -3.78 117.44 121.64 1vgr n TRP 301 Ca 0.00 0.00 -0.07 0.00 -1.31 0.00 0.00 57.50 56.12 1vgr n TRP 301 Cb 0.31 -0.16 -0.04 0.00 -2.01 0.00 0.00 31.31 29.41 1vgr n TRP 301 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.69 177.55 1vgr h LYS 302 N 0.52 -0.32 -0.01 -0.99 1.57 -1.85 -3.35 116.57 112.14 1vgr h LYS 302 Ca 0.00 0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.72 1vgr h LYS 302 Cb 0.30 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1vgr h LYS 302 CO 0.00 -0.10 -0.40 -0.44 -0.57 0.00 0.00 179.45 177.94 1vgr h ASP 303 N -1.04 0.02 -2.50 0.86 5.19 -1.80 -3.44 116.42 113.71 1vgr h ASP 303 Ca -0.03 -0.01 -0.54 0.00 -0.62 0.00 0.00 57.03 55.83 1vgr h ASP 303 Cb 0.37 -0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.88 1vgr h ASP 303 CO 0.06 0.42 1.15 -0.62 -3.12 0.00 0.00 179.24 177.13 1vgr s ASP 304 N -6.92 6.57 0.44 6.45 -1.08 -1.25 -4.89 116.67 115.99 1vgr s ASP 304 Ca -0.03 2.43 0.24 0.00 -0.52 0.00 0.00 52.55 54.67 1vgr s ASP 304 Cb 0.14 -2.53 0.98 0.00 -1.46 0.00 0.00 42.92 40.05 1vgr s ASP 304 CO 0.73 -0.99 1.86 -0.65 0.52 0.00 0.00 175.17 176.65 1vgr h PRO 305 N 10.02 0.00 -0.31 4.34 0.11 -1.90 -2.98 132.00 141.29 1vgr h PRO 305 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1vgr h PRO 305 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1vgr h PRO 305 CO 0.95 0.23 0.00 0.00 -0.21 0.00 0.00 178.00 178.97 1vgr n ALA 306 N -2.25 2.53 0.00 -0.75 0.00 -1.26 -4.02 120.51 114.76 1vgr n ALA 306 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1vgr n ALA 306 Cb 0.41 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1vgr n ALA 306 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1vgr n TYR 307 N 0.12 0.00 1.26 0.00 0.53 -0.90 -4.03 117.16 114.14 1vgr n TYR 307 Ca 0.07 0.00 0.10 0.00 -1.02 0.00 0.00 57.90 57.05 1vgr n TYR 307 Cb 0.23 0.01 0.36 0.00 -1.03 0.00 0.00 39.34 38.91 1vgr n TYR 307 CO 0.00 0.00 0.00 0.27 -1.02 0.00 0.00 176.86 176.11 1vgr n ASN 308 N -2.29 1.54 -4.67 7.72 6.94 -1.13 -4.61 115.26 118.75 1vgr n ASN 308 Ca 0.00 -1.72 -0.23 0.00 -0.02 0.00 0.00 54.58 52.61 1vgr n ASN 308 Cb 0.37 -0.11 -0.07 0.00 -2.36 0.00 0.00 39.78 37.61 1vgr n ASN 308 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1vgr s THR 309 N -1.78 3.55 0.03 5.53 2.01 -1.24 -5.05 115.64 118.69 1vgr s THR 309 Ca 0.31 -1.85 -0.26 0.00 0.31 0.00 0.00 61.69 60.20 1vgr s THR 309 Cb 0.16 -2.91 -0.17 0.00 0.01 0.00 0.00 72.50 69.59 1vgr s THR 309 CO 0.24 -0.37 1.43 0.15 -0.69 0.00 0.00 174.62 175.39 1vgr h PHE 310 N 1.83 -0.28 -0.29 4.92 3.57 -1.95 -3.20 116.94 121.54 1vgr h PHE 310 Ca -0.45 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 60.97 1vgr h PHE 310 Cb 1.25 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 40.06 1vgr h PHE 310 CO 0.67 -0.01 -0.16 0.93 -2.23 0.00 0.00 178.31 177.51 1vgr h GLU 311 N -0.53 0.52 -2.88 1.11 5.08 -1.97 -3.00 114.58 112.91 1vgr h GLU 311 Ca -0.03 -0.16 -0.76 0.00 -1.00 0.00 0.00 59.36 57.40 1vgr h GLU 311 Cb 0.39 -0.05 -0.17 0.00 0.50 0.00 0.00 28.75 29.42 1vgr h GLU 311 CO 0.05 0.66 1.92 0.41 -1.00 0.00 0.00 179.01 181.05 1vgr n GLY 312 N -0.55 5.20 0.00 -3.84 0.00 -1.21 -4.09 105.19 100.69 1vgr n GLY 312 Ca 0.00 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.81 1vgr n GLY 312 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vgr n ARG 313 N 2.10 0.00 -0.30 1.61 0.63 -1.16 -2.12 116.66 117.43 1vgr n ARG 313 Ca 0.49 0.00 -0.00 0.00 -0.92 0.00 0.00 57.85 57.42 1vgr n ARG 313 Cb 0.29 0.00 0.19 0.00 0.45 0.00 0.00 32.46 33.39 1vgr n ARG 313 CO 0.00 0.00 0.00 -0.39 -2.51 0.00 0.00 177.63 174.73 1vgr h VAL 314 N 0.00 1.21 -0.62 5.15 -1.51 -1.68 -2.48 116.25 116.32 1vgr h VAL 314 Ca 0.00 -0.40 0.18 0.00 -1.23 0.00 0.00 66.70 65.25 1vgr h VAL 314 Cb 0.00 -0.07 -0.02 0.00 -2.13 0.00 0.00 31.29 29.07 1vgr h VAL 314 CO 0.00 0.21 0.57 -2.24 -1.23 0.00 0.00 177.57 174.89 1vgr h ASP 315 N 1.17 0.00 -0.94 4.19 2.03 -1.90 -1.99 116.42 118.97 1vgr h ASP 315 Ca 0.33 0.00 -0.38 0.00 -0.73 0.00 0.00 57.03 56.25 1vgr h ASP 315 Cb -0.10 0.00 -0.41 0.00 -0.83 0.00 0.00 39.33 38.00 1vgr h ASP 315 CO -0.08 0.00 -1.08 2.29 -1.03 0.00 0.00 179.24 179.34 1vgr n LYS 316 N -3.84 1.80 -0.09 4.15 2.85 -0.99 -4.37 118.16 117.66 1vgr n LYS 316 Ca 0.12 -3.57 -0.14 0.00 -1.05 0.00 0.00 58.31 53.67 1vgr n LYS 316 Cb 0.81 -1.55 -0.04 0.00 -0.65 0.00 0.00 35.03 33.60 1vgr n LYS 316 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 177.40 178.60 1vgr h LEU 317 N 2.79 1.00 0.00 -5.58 6.46 -0.92 -3.16 115.31 115.90 1vgr h LEU 317 Ca -0.01 -0.51 0.00 0.00 -0.12 0.00 0.00 57.88 57.23 1vgr h LEU 317 Cb 1.18 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 40.83 1vgr h LEU 317 CO 0.50 1.32 -0.37 0.23 -0.62 0.00 0.00 178.44 179.50 1vgr n MET 318 N -4.02 0.08 0.03 1.25 2.81 -1.26 -3.59 117.12 112.41 1vgr n MET 318 Ca -0.04 0.03 -0.15 0.00 -1.81 0.00 0.00 57.70 55.74 1vgr n MET 318 Cb 0.61 -1.56 -0.04 0.00 -0.71 0.00 0.00 33.22 31.51 1vgr n MET 318 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1vgr h ASP 319 N 0.00 0.72 -0.25 7.83 3.32 -1.93 -2.90 116.42 123.21 1vgr h ASP 319 Ca 0.00 -0.51 -0.02 0.00 0.02 0.00 0.00 57.03 56.52 1vgr h ASP 319 Cb 0.57 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1vgr h ASP 319 CO 0.00 1.30 0.11 0.40 -1.72 0.00 0.00 179.24 179.33 1vgr h ILE 320 N 0.38 1.13 0.06 0.35 2.04 -1.61 -2.76 117.51 117.09 1vgr h ILE 320 Ca -0.07 -0.42 -0.13 0.00 1.00 0.00 0.00 64.86 65.24 1vgr h ILE 320 Cb 1.47 0.78 0.01 0.00 -0.74 0.00 0.00 36.82 38.34 1vgr h ILE 320 CO 0.16 0.16 -0.56 -0.26 0.00 0.00 0.00 178.15 177.65 1vgr h PHE 321 N 0.43 0.45 0.00 1.37 0.05 -1.63 -3.19 116.94 114.43 1vgr h PHE 321 Ca 0.11 -0.29 -0.02 0.00 3.82 0.00 0.00 57.97 61.59 1vgr h PHE 321 Cb 0.11 -0.04 -0.00 0.00 2.00 0.00 0.00 35.95 38.03 1vgr h PHE 321 CO 0.00 1.16 -0.11 0.77 -0.18 0.00 0.00 178.31 179.95 1vgr h SER 322 N -0.38 0.00 0.47 2.17 0.02 -1.56 -2.79 113.55 111.48 1vgr h SER 322 Ca -0.09 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 1vgr h SER 322 Cb 1.36 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.88 1vgr h SER 322 CO 0.11 0.11 -0.46 0.15 -1.14 0.00 0.00 176.83 175.59 1vgr h PHE 323 N 0.00 -1.28 -0.08 3.45 3.57 -1.48 -3.25 116.94 117.88 1vgr h PHE 323 Ca -0.00 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.37 1vgr h PHE 323 Cb 0.36 0.50 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 1vgr h PHE 323 CO 0.00 -0.63 -0.55 0.82 -2.23 0.00 0.00 178.31 175.72 1vgr h ILE 324 N -0.94 1.37 -0.75 1.41 2.04 -1.51 -3.17 117.51 115.95 1vgr h ILE 324 Ca -0.05 -1.86 0.18 0.00 1.00 0.00 0.00 64.86 64.13 1vgr h ILE 324 Cb 0.82 1.92 -0.04 0.00 -0.74 0.00 0.00 36.82 38.78 1vgr h ILE 324 CO -0.06 0.55 0.52 -0.08 0.00 0.00 0.00 178.15 179.07 1vgr h GLU 325 N 0.17 0.22 -0.10 2.37 4.81 -1.54 0.54 114.58 121.05 1vgr h GLU 325 Ca 0.00 -0.01 -0.21 0.00 -0.13 0.00 0.00 59.36 59.01 1vgr h GLU 325 Cb 1.02 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.36 1vgr h GLU 325 CO 0.08 0.14 -0.77 1.79 -0.73 0.00 0.00 179.01 179.52 1vgr h THR 326 N 0.22 1.34 0.00 0.32 1.35 -1.67 -3.05 112.91 111.42 1vgr h THR 326 Ca 0.37 -2.10 0.00 0.00 -0.55 0.00 0.00 66.41 64.13 1vgr h THR 326 Cb 1.12 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 1vgr h THR 326 CO -0.08 0.64 0.00 0.11 -0.25 0.00 0.00 175.52 175.95 1vgr h LYS 327 N 0.38 0.00 -0.02 4.72 1.57 -0.13 -2.40 116.57 120.69 1vgr h LYS 327 Ca -0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1vgr h LYS 327 Cb 1.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.69 1vgr h LYS 327 CO 0.14 0.00 -0.11 1.19 -0.57 0.00 0.00 179.45 180.11 1vgr n PHE 328 N -2.42 0.00 0.27 -1.35 3.72 0.04 -4.63 117.46 113.08 1vgr n PHE 328 Ca 0.01 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.54 1vgr n PHE 328 Cb 0.21 0.00 0.75 0.00 -0.94 0.00 0.00 39.48 39.50 1vgr n PHE 328 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1vgr h ALA 329 N 4.18 1.40 -2.23 4.37 0.00 -1.31 -3.11 119.26 122.55 1vgr h ALA 329 Ca 0.00 -0.09 -0.60 0.00 0.00 0.00 0.00 54.91 54.23 1vgr h ALA 329 Cb 0.87 -0.01 -0.42 0.00 0.00 0.00 0.00 17.79 18.23 1vgr h ALA 329 CO 0.00 0.12 -0.61 -3.47 0.00 0.00 0.00 179.25 175.29 1vgr n ASP 330 N -3.78 3.61 0.00 0.00 2.03 -1.26 -4.00 116.55 113.15 1vgr n ASP 330 Ca -0.02 -3.41 0.00 0.00 0.52 0.00 0.00 54.79 51.88 1vgr n ASP 330 Cb 0.20 -0.67 0.00 0.00 -0.72 0.00 0.00 41.12 39.92 1vgr n ASP 330 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1vgr n LYS 331 N 0.92 0.00 -1.62 -0.67 5.02 -1.18 -5.00 118.16 115.63 1vgr n LYS 331 Ca 0.29 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.27 1vgr n LYS 331 Cb 0.41 0.00 0.04 0.00 -0.02 0.00 0.00 35.03 35.47 1vgr n LYS 331 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 1vgr s ASP 332 N 0.00 5.49 0.02 4.39 1.47 -1.26 -1.43 116.67 125.35 1vgr s ASP 332 Ca 0.00 1.57 -0.03 0.00 1.18 0.00 0.00 52.55 55.28 1vgr s ASP 332 Cb 0.00 -2.48 0.00 0.00 -0.34 0.00 0.00 42.92 40.11 1vgr s ASP 332 CO 0.00 -1.36 0.15 0.29 0.68 0.00 0.00 175.17 174.93 1vgr n LYS 333 N -3.08 -0.04 0.09 2.11 5.02 -1.26 -1.12 118.16 119.89 1vgr n LYS 333 Ca 0.07 0.15 -0.16 0.00 -2.02 0.00 0.00 58.31 56.36 1vgr n LYS 333 Cb 0.54 -0.22 -0.10 0.00 -0.02 0.00 0.00 35.03 35.23 1vgr n LYS 333 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1vgr h PHE 334 N 0.00 0.62 -0.06 2.13 0.04 -1.95 -2.14 116.94 115.59 1vgr h PHE 334 Ca 0.02 -0.39 -0.10 0.00 2.80 0.00 0.00 57.97 60.30 1vgr h PHE 334 Cb 0.05 -0.05 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 1vgr h PHE 334 CO -0.10 1.26 -0.44 0.93 -0.60 0.00 0.00 178.31 179.36 1vgr h GLU 335 N 0.16 0.13 -0.10 1.51 5.08 -1.62 -1.48 114.58 118.26 1vgr h GLU 335 Ca -0.12 -0.06 -0.19 0.00 -1.00 0.00 0.00 59.36 57.98 1vgr h GLU 335 Cb 1.80 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.05 1vgr h GLU 335 CO 0.19 0.55 -0.74 0.28 -1.00 0.00 0.00 179.01 178.29 1vgr h VAL 336 N 0.11 1.36 -0.42 3.13 2.07 -1.12 -2.19 116.25 119.19 1vgr h VAL 336 Ca 0.01 -2.10 -0.12 0.00 0.82 0.00 0.00 66.70 65.30 1vgr h VAL 336 Cb 0.82 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 1vgr h VAL 336 CO 0.06 0.64 -0.23 0.74 0.02 0.00 0.00 177.57 178.80 1vgr h THR 337 N 0.33 1.27 0.03 2.57 2.02 -1.10 -3.03 112.91 115.01 1vgr h THR 337 Ca -0.04 -1.37 -0.00 0.00 0.77 0.00 0.00 66.41 65.77 1vgr h THR 337 Cb 1.32 1.19 0.00 0.00 -1.74 0.00 0.00 68.15 68.93 1vgr h THR 337 CO 0.13 0.46 -0.01 -0.08 0.37 0.00 0.00 175.52 176.39 1vgr h GLU 338 N 0.75 -0.04 -1.25 6.66 4.81 -1.30 -1.16 114.58 123.05 1vgr h GLU 338 Ca 0.10 0.00 0.37 0.00 -0.13 0.00 0.00 59.36 59.70 1vgr h GLU 338 Cb 0.77 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 30.07 1vgr h GLU 338 CO 0.06 0.51 0.84 2.35 -0.73 0.00 0.00 179.01 182.04 1vgr h TRP 339 N -0.61 0.41 0.00 0.92 7.01 -1.39 -1.42 115.95 120.88 1vgr h TRP 339 Ca -0.00 0.02 -0.24 0.00 2.11 0.00 0.00 58.89 60.78 1vgr h TRP 339 Cb 0.56 -0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.46 1vgr h TRP 339 CO 0.12 -0.05 -2.15 0.00 -2.79 0.00 0.00 178.44 173.57 1vgr n ALA 340 N -2.59 1.89 0.73 2.65 0.00 -1.15 -4.64 120.51 117.40 1vgr n ALA 340 Ca 0.31 -0.99 0.07 0.00 0.00 0.00 0.00 53.44 52.83 1vgr n ALA 340 Cb 1.25 -0.29 0.37 0.00 0.00 0.00 0.00 19.45 20.78 1vgr n ALA 340 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vgr n ALA 341 N -2.53 1.86 0.29 0.00 0.00 -0.44 -2.30 120.51 117.39 1vgr n ALA 341 Ca -0.22 -0.07 0.04 0.00 0.00 0.00 0.00 53.44 53.18 1vgr n ALA 341 Cb 0.92 -1.23 0.17 0.00 0.00 0.00 0.00 19.45 19.32 1vgr n ALA 341 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1vgr n GLN 342 N -1.20 0.03 -0.04 0.00 6.02 -1.24 -3.25 117.38 117.70 1vgr n GLN 342 Ca 0.08 0.32 0.04 0.00 -0.01 0.00 0.00 57.00 57.43 1vgr n GLN 342 Cb 0.09 -1.50 0.06 0.00 1.02 0.00 0.00 30.24 29.91 1vgr n GLN 342 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1vgr n TYR 343 N -1.44 0.10 -1.97 1.08 4.01 -0.97 -5.00 117.16 112.98 1vgr n TYR 343 Ca 0.02 -0.15 -0.06 0.00 -0.16 0.00 0.00 57.90 57.55 1vgr n TYR 343 Cb 0.08 -0.01 -0.01 0.00 -0.31 0.00 0.00 39.34 39.09 1vgr n TYR 343 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1vgr n GLY 344 N 0.39 0.23 3.71 2.72 0.00 -1.20 -4.90 105.19 106.15 1vgr n GLY 344 Ca 0.06 -0.66 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 1vgr n GLY 344 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vgr s ILE 345 N -2.29 5.02 -0.99 -0.61 1.01 -1.26 -4.98 121.20 117.09 1vgr s ILE 345 Ca 0.00 1.54 -0.24 0.00 0.00 0.00 0.00 60.65 61.95 1vgr s ILE 345 Cb 0.00 -4.08 -0.08 0.00 0.01 0.00 0.00 42.46 38.31 1vgr s ILE 345 CO 0.00 0.23 2.00 -2.16 0.00 0.00 0.00 174.94 175.01 1vgr s PRO 346 N 0.86 2.36 -0.05 2.79 0.04 -1.26 -4.87 135.00 134.87 1vgr s PRO 346 Ca 0.40 -0.51 0.01 0.00 0.04 0.00 0.00 61.00 60.94 1vgr s PRO 346 Cb -0.18 -5.09 0.02 0.00 0.04 0.00 0.00 34.50 29.29 1vgr s PRO 346 CO 0.19 -3.80 -0.05 0.00 0.04 0.00 0.00 177.00 173.38 1vgr s GLY 348 N 0.92 -0.13 0.44 0.00 0.00 -0.96 -4.96 107.32 102.63 1vgr s GLY 348 Ca -0.11 0.08 -0.22 0.00 0.00 0.00 0.00 44.72 44.47 1vgr s GLY 348 CO 0.00 -0.14 1.02 2.56 0.00 0.00 0.00 173.10 176.54 1vgr s PRO 349 N -2.27 4.03 -0.27 2.90 0.04 -1.26 -0.72 135.00 137.46 1vgr s PRO 349 Ca -0.07 1.34 -0.29 0.00 0.04 0.00 0.00 61.00 62.03 1vgr s PRO 349 Cb -0.02 -2.26 -0.01 0.00 0.04 0.00 0.00 34.50 32.24 1vgr s PRO 349 CO -0.02 -0.23 1.53 0.08 0.04 0.00 0.00 177.00 178.40 1vgr s VAL 350 N -1.92 3.81 -0.05 -0.36 1.01 -0.41 -4.85 120.40 117.64 1vgr s VAL 350 Ca 0.63 0.90 -0.23 0.00 0.00 0.00 0.00 61.98 63.28 1vgr s VAL 350 Cb -0.16 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1vgr s VAL 350 CO 0.20 -0.40 0.69 -0.04 0.00 0.00 0.00 175.10 175.55 1vgr s MET 351 N 4.66 4.43 0.57 2.72 -1.94 -1.26 -4.76 119.30 123.72 1vgr s MET 351 Ca 0.67 0.87 -0.08 0.00 -1.71 0.00 0.00 55.69 55.44 1vgr s MET 351 Cb -0.21 -3.42 -0.03 0.00 2.01 0.00 0.00 34.83 33.17 1vgr s MET 351 CO 0.28 0.13 0.93 -1.54 -0.01 0.00 0.00 175.02 174.81 1vgr s SER 352 N 0.58 6.16 0.43 3.03 1.04 -1.26 -4.92 113.70 118.75 1vgr s SER 352 Ca 0.36 1.17 0.11 0.00 0.48 0.00 0.00 55.95 58.08 1vgr s SER 352 Cb -0.18 -2.31 0.92 0.00 0.10 0.00 0.00 66.02 64.55 1vgr s SER 352 CO 0.18 -0.80 1.99 0.24 0.98 0.00 0.00 173.24 175.84 1vgr h MET 353 N -0.12 0.19 -0.49 4.02 2.86 -1.99 -1.43 114.93 117.97 1vgr h MET 353 Ca -0.45 -0.03 -0.13 0.00 -2.06 0.00 0.00 59.70 57.03 1vgr h MET 353 Cb 1.20 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 1vgr h MET 353 CO 0.62 0.27 -0.18 1.57 1.06 0.00 0.00 176.91 180.24 1vgr h LYS 354 N 0.18 0.99 -0.43 1.72 2.10 -1.99 -1.25 116.57 117.90 1vgr h LYS 354 Ca 0.04 -0.41 -0.04 0.00 -2.00 0.00 0.00 60.65 58.24 1vgr h LYS 354 Cb 0.24 -0.04 -0.02 0.00 -0.90 0.00 0.00 32.23 31.51 1vgr h LYS 354 CO 0.01 1.09 0.11 0.93 -2.00 0.00 0.00 179.45 179.58 1vgr h GLU 355 N 0.85 0.68 -0.32 0.07 5.08 -1.85 -3.04 114.58 116.05 1vgr h GLU 355 Ca 0.12 -0.16 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 1vgr h GLU 355 Cb 0.76 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.92 1vgr h GLU 355 CO 0.06 0.69 -0.45 -0.07 -1.00 0.00 0.00 179.01 178.24 1vgr h LEU 356 N 0.56 0.96 -1.91 1.33 3.38 -1.23 -0.81 115.31 117.58 1vgr h LEU 356 Ca 0.13 -0.50 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 1vgr h LEU 356 Cb 0.31 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1vgr h LEU 356 CO 0.00 1.27 -0.00 0.00 0.09 0.00 0.00 178.44 179.80 1vgr h ALA 357 N 0.71 1.93 -0.05 1.53 0.00 -1.23 -3.12 119.26 119.03 1vgr h ALA 357 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1vgr h ALA 357 Cb 1.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1vgr h ALA 357 CO 0.11 0.06 0.00 0.72 0.00 0.00 0.00 179.25 180.13 1vgr n HIS 358 N -4.50 0.07 -1.86 0.00 8.25 -1.13 -5.02 115.22 111.02 1vgr n HIS 358 Ca -0.02 -0.43 -0.42 0.00 -0.26 0.00 0.00 57.72 56.59 1vgr n HIS 358 Cb 0.11 -0.04 -0.03 0.00 1.12 0.00 0.00 29.99 31.15 1vgr n HIS 358 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1vgr s ASP 359 N -0.88 6.53 0.25 0.41 2.15 -0.32 -4.91 116.67 119.90 1vgr s ASP 359 Ca 0.04 2.39 -0.05 0.00 0.43 0.00 0.00 52.55 55.35 1vgr s ASP 359 Cb 0.02 -2.53 0.27 0.00 -0.30 0.00 0.00 42.92 40.38 1vgr s ASP 359 CO 0.03 -1.02 1.86 1.55 -0.17 0.00 0.00 175.17 177.42 1vgr h PRO 360 N 10.17 1.18 -0.36 4.34 0.13 -1.92 -2.78 132.00 142.76 1vgr h PRO 360 Ca -0.43 -0.14 0.08 0.00 -0.87 0.00 0.00 66.00 64.63 1vgr h PRO 360 Cb 1.20 -0.23 -0.08 0.00 0.13 0.00 0.00 31.00 32.03 1vgr h PRO 360 CO 0.95 0.87 -0.14 0.77 -0.23 0.00 0.00 178.00 180.22 1vgr h SER 361 N 1.18 -0.49 0.14 1.44 0.02 -1.99 -0.51 113.55 113.34 1vgr h SER 361 Ca 0.29 0.13 -0.08 0.00 -0.84 0.00 0.00 61.79 61.29 1vgr h SER 361 Cb 0.05 0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.86 1vgr h SER 361 CO -0.04 -0.18 -0.28 -0.07 -1.14 0.00 0.00 176.83 175.12 1vgr h LEU 362 N -0.07 0.23 -0.41 5.07 3.38 -1.86 -2.04 115.31 119.61 1vgr h LEU 362 Ca 0.18 -0.07 -0.18 0.00 0.09 0.00 0.00 57.88 57.89 1vgr h LEU 362 Cb 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1vgr h LEU 362 CO -0.41 0.51 -0.76 1.56 0.09 0.00 0.00 178.44 179.44 1vgr h GLN 363 N 0.21 0.33 -0.69 1.13 4.20 -1.27 -0.76 115.11 118.26 1vgr h GLN 363 Ca 0.03 -0.28 -0.06 0.00 0.06 0.00 0.00 58.65 58.40 1vgr h GLN 363 Cb 0.60 0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.42 1vgr h GLN 363 CO 0.04 0.94 0.19 0.87 -0.67 0.00 0.00 178.83 180.20 1vgr h LYS 364 N 0.21 1.09 -0.14 1.46 1.57 -0.44 -2.58 116.57 117.75 1vgr h LYS 364 Ca -0.03 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1vgr h LYS 364 Cb 1.33 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1vgr h LYS 364 CO 0.12 0.95 0.00 1.33 -0.57 0.00 0.00 179.45 181.28 1vgr n VAL 365 N -4.24 0.17 -1.44 0.50 0.24 -0.84 -4.94 118.33 107.78 1vgr n VAL 365 Ca 0.05 -0.34 -0.07 0.00 -2.04 0.00 0.00 64.34 61.94 1vgr n VAL 365 Cb 0.24 0.44 -0.02 0.00 -1.47 0.00 0.00 33.84 33.03 1vgr n VAL 365 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vgr n GLY 366 N 1.16 0.72 0.11 7.63 0.00 -0.97 -4.92 105.19 108.92 1vgr n GLY 366 Ca 0.17 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.34 1vgr n GLY 366 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1vgr h THR 367 N 0.00 0.87 -3.35 2.61 2.02 -1.42 -3.37 112.91 110.27 1vgr h THR 367 Ca -0.15 -2.61 -0.65 0.00 0.77 0.00 0.00 66.41 63.77 1vgr h THR 367 Cb 0.63 2.56 -0.25 0.00 -1.74 0.00 0.00 68.15 69.35 1vgr h THR 367 CO 0.21 0.74 -0.71 -0.69 0.37 0.00 0.00 175.52 175.44 1vgr s VAL 368 N -2.59 3.53 -0.06 3.16 1.01 -0.81 -0.79 120.40 123.85 1vgr s VAL 368 Ca -0.12 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.42 1vgr s VAL 368 Cb 0.07 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.90 1vgr s VAL 368 CO 0.81 0.47 -0.15 -0.69 0.00 0.00 0.00 175.10 175.54 1vgr s VAL 369 N 0.75 1.35 -0.45 2.92 1.01 0.62 -3.88 120.40 122.71 1vgr s VAL 369 Ca -0.03 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.03 1vgr s VAL 369 Cb -0.15 -1.19 0.03 0.00 0.00 0.00 0.00 36.38 35.07 1vgr s VAL 369 CO 0.02 0.40 1.13 -1.61 0.00 0.00 0.00 175.10 175.03 1vgr s GLU 370 N 0.37 3.77 -0.07 2.72 0.41 -1.26 -0.54 118.70 124.10 1vgr s GLU 370 Ca -0.11 0.64 -0.24 0.00 -0.41 0.00 0.00 54.97 54.85 1vgr s GLU 370 Cb -0.14 -3.88 -0.03 0.00 -1.78 0.00 0.00 34.13 28.29 1vgr s GLU 370 CO 0.04 -1.31 0.74 0.08 -0.49 0.00 0.00 175.26 174.32 1vgr s VAL 371 N 4.33 5.02 -0.60 2.63 1.01 0.41 -4.96 120.40 128.22 1vgr s VAL 371 Ca 0.47 1.52 -0.25 0.00 0.00 0.00 0.00 61.98 63.72 1vgr s VAL 371 Cb -0.08 -4.07 0.04 0.00 0.00 0.00 0.00 36.38 32.27 1vgr s VAL 371 CO 0.29 0.22 1.07 -0.69 0.00 0.00 0.00 175.10 175.99 1vgr s VAL 372 N 0.95 4.17 -0.36 2.92 1.01 -1.26 -2.78 120.40 125.06 1vgr s VAL 372 Ca 0.39 0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.78 1vgr s VAL 372 Cb -0.18 -4.67 0.10 0.00 0.00 0.00 0.00 36.38 31.63 1vgr s VAL 372 CO 0.19 -1.34 0.07 -0.62 0.00 0.00 0.00 175.10 173.39 1vgr s ASP 373 N 3.14 4.77 0.50 3.32 -1.08 -1.26 -4.41 116.67 121.64 1vgr s ASP 373 Ca 0.33 -2.21 0.32 0.00 -0.52 0.00 0.00 52.55 50.47 1vgr s ASP 373 Cb -0.11 -1.64 1.26 0.00 -1.46 0.00 0.00 42.92 40.96 1vgr s ASP 373 CO 0.19 -0.38 1.93 1.05 0.52 0.00 0.00 175.17 178.48 1vgr h GLU 374 N 7.56 0.00 0.04 4.34 9.09 -1.93 0.10 114.58 133.79 1vgr h GLU 374 Ca -0.05 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.30 1vgr h GLU 374 Cb 1.01 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 28.12 1vgr h GLU 374 CO 0.54 0.00 -0.26 0.82 0.05 0.00 0.00 179.01 180.16 1vgr h ILE 375 N 0.00 1.69 0.00 -1.06 1.08 -2.00 -3.41 117.51 113.82 1vgr h ILE 375 Ca 0.00 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.10 1vgr h ILE 375 Cb 0.52 3.29 0.00 0.00 -3.07 0.00 0.00 36.82 37.56 1vgr h ILE 375 CO 0.00 0.63 -0.80 0.54 -0.69 0.00 0.00 178.15 177.83 1vgr n ARG 376 N -4.46 2.12 0.00 2.37 1.74 -1.22 -5.10 116.66 112.11 1vgr n ARG 376 Ca -0.11 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1vgr n ARG 376 Cb 0.58 -1.18 0.00 0.00 -1.02 0.00 0.00 32.46 30.84 1vgr n ARG 376 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1vgr n GLY 377 N 1.38 0.51 3.71 -0.13 0.00 0.35 -5.03 105.19 105.98 1vgr n GLY 377 Ca 0.02 -1.54 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 1vgr n GLY 377 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vgr s ASN 378 N -0.87 3.83 0.09 1.61 0.02 -1.21 -4.40 114.94 114.02 1vgr s ASN 378 Ca 0.00 2.41 -0.07 0.00 -1.02 0.00 0.00 52.86 54.19 1vgr s ASN 378 Cb 0.00 -2.59 -0.01 0.00 0.02 0.00 0.00 41.25 38.66 1vgr s ASN 378 CO 0.00 -2.51 0.15 -1.38 0.02 0.00 0.00 177.10 173.38 1vgr s HIS 379 N -1.99 0.31 0.45 2.20 -3.43 -1.12 -4.94 115.29 106.77 1vgr s HIS 379 Ca 0.75 -0.75 -0.06 0.00 -0.80 0.00 0.00 55.06 54.20 1vgr s HIS 379 Cb -0.30 -0.16 -0.04 0.00 -1.43 0.00 0.00 32.58 30.65 1vgr s HIS 379 CO 0.48 -0.53 0.76 -0.51 -2.00 0.00 0.00 174.74 172.94 1vgr s LEU 380 N -2.90 3.71 0.23 5.38 1.43 -1.26 -0.45 118.68 124.83 1vgr s LEU 380 Ca 0.08 0.96 -0.13 0.00 -1.03 0.00 0.00 54.13 54.01 1vgr s LEU 380 Cb 0.05 -3.89 -0.00 0.00 0.03 0.00 0.00 46.19 42.39 1vgr s LEU 380 CO -0.09 -0.50 0.47 0.28 0.23 0.00 0.00 176.35 176.74 1vgr s THR 381 N -2.60 0.01 -0.02 5.49 -1.32 0.30 -4.88 115.64 112.62 1vgr s THR 381 Ca 0.48 -1.32 -0.20 0.00 -1.21 0.00 0.00 61.69 59.44 1vgr s THR 381 Cb -0.10 -2.08 -0.05 0.00 -1.51 0.00 0.00 72.50 68.75 1vgr s THR 381 CO 0.40 -0.05 0.59 -0.69 -2.21 0.00 0.00 174.62 172.67 1vgr s VAL 382 N -3.99 4.95 0.00 5.08 1.01 -1.26 -0.27 120.40 125.92 1vgr s VAL 382 Ca 0.20 1.23 0.00 0.00 0.00 0.00 0.00 61.98 63.40 1vgr s VAL 382 Cb -0.00 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.45 1vgr s VAL 382 CO 0.07 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.17 1vgr n GLY 383 N 2.58 0.86 3.68 4.51 0.00 0.03 -4.88 105.19 111.98 1vgr n GLY 383 Ca -0.06 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 1vgr n GLY 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vgr s ALA 384 N -3.04 3.55 -2.07 4.61 0.00 -1.26 -4.90 121.76 118.65 1vgr s ALA 384 Ca 0.00 0.67 0.30 0.00 0.00 0.00 0.00 51.96 52.93 1vgr s ALA 384 Cb 0.00 -3.57 1.68 0.00 0.00 0.00 0.00 23.12 21.24 1vgr s ALA 384 CO 0.00 -0.90 2.09 -0.35 0.00 0.00 0.00 175.76 176.60 1vgr n PRO 385 N 5.58 1.10 -4.37 0.00 -0.04 -1.26 -4.63 135.00 131.37 1vgr n PRO 385 Ca 0.12 -0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 63.10 1vgr n PRO 385 Cb 0.45 -1.47 -0.13 0.00 -0.04 0.00 0.00 33.50 32.31 1vgr n PRO 385 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1vgr s PHE 386 N -2.00 2.93 -0.15 0.54 -0.12 -1.26 -5.10 117.98 112.82 1vgr s PHE 386 Ca 0.44 -0.60 -0.05 0.00 -0.05 0.00 0.00 56.93 56.67 1vgr s PHE 386 Cb 0.21 -1.97 -0.03 0.00 -0.63 0.00 0.00 43.02 40.60 1vgr s PHE 386 CO 0.34 -0.25 0.02 0.15 -0.05 0.00 0.00 175.22 175.43 1vgr s LYS 387 N 0.71 3.68 -0.03 1.99 -0.14 -1.26 -5.05 119.74 119.64 1vgr s LYS 387 Ca -0.03 -0.42 0.07 0.00 -1.36 0.00 0.00 55.97 54.23 1vgr s LYS 387 Cb -0.15 -3.03 -0.02 0.00 -1.68 0.00 0.00 37.83 32.96 1vgr s LYS 387 CO 0.02 0.35 -0.25 -0.06 -0.76 0.00 0.00 175.35 174.65 1vgr s PHE 388 N 0.11 2.29 0.46 3.18 0.40 -1.26 -5.04 117.98 118.13 1vgr s PHE 388 Ca 0.02 -0.50 0.16 0.00 -0.60 0.00 0.00 56.93 56.01 1vgr s PHE 388 Cb -0.13 -1.48 1.11 0.00 0.51 0.00 0.00 43.02 43.03 1vgr s PHE 388 CO 0.02 -0.09 2.03 0.66 0.70 0.00 0.00 175.22 178.54 1vgr h SER 389 N 5.66 0.00 -0.16 1.36 4.64 -2.02 -3.24 113.55 119.79 1vgr h SER 389 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1vgr h SER 389 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1vgr h SER 389 CO 0.47 0.14 0.00 0.61 -0.87 0.00 0.00 176.83 177.18 1vgr n GLY 390 N -1.09 0.90 3.51 -0.77 0.00 -1.26 -5.01 105.19 101.48 1vgr n GLY 390 Ca -0.03 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.40 1vgr n GLY 390 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vgr s PHE 391 N -1.13 -0.64 -0.06 1.61 5.36 -1.22 -2.62 117.98 119.28 1vgr s PHE 391 Ca 0.21 1.27 0.03 0.00 -0.96 0.00 0.00 56.93 57.49 1vgr s PHE 391 Cb 0.13 0.33 0.01 0.00 -0.34 0.00 0.00 43.02 43.15 1vgr s PHE 391 CO 0.19 -0.51 -0.16 -0.65 -1.46 0.00 0.00 175.22 172.63 1vgr s GLN 392 N -0.69 1.96 0.44 10.12 -1.52 -1.26 -4.26 119.66 124.45 1vgr s GLN 392 Ca -0.08 -0.55 -0.25 0.00 -1.95 0.00 0.00 55.36 52.53 1vgr s GLN 392 Cb -0.02 -1.61 -0.08 0.00 -0.22 0.00 0.00 33.01 31.09 1vgr s GLN 392 CO 0.07 0.12 1.30 -2.14 -0.25 0.00 0.00 175.29 174.39 1vgr s PRO 393 N 0.41 3.76 -0.35 2.91 0.02 -1.26 -5.01 135.00 135.49 1vgr s PRO 393 Ca -0.12 2.13 -0.02 0.00 0.02 0.00 0.00 61.00 63.01 1vgr s PRO 393 Cb -0.15 -2.60 0.08 0.00 0.02 0.00 0.00 34.50 31.85 1vgr s PRO 393 CO 0.04 -0.65 0.09 -1.21 -0.33 0.00 0.00 177.00 174.94 1vgr s GLU 394 N -2.45 2.17 0.05 5.54 2.02 -1.26 -5.10 118.70 119.66 1vgr s GLU 394 Ca 0.61 -1.55 -0.20 0.00 0.02 0.00 0.00 54.97 53.85 1vgr s GLU 394 Cb -0.37 -3.36 -0.06 0.00 0.10 0.00 0.00 34.13 30.44 1vgr s GLU 394 CO 0.47 -0.84 0.58 0.42 0.02 0.00 0.00 175.26 175.91 1vgr s ILE 395 N 1.18 4.79 -0.01 -1.63 1.01 -1.26 -4.96 121.20 120.31 1vgr s ILE 395 Ca 0.02 1.24 -0.02 0.00 0.00 0.00 0.00 60.65 61.89 1vgr s ILE 395 Cb -0.21 -3.92 0.00 0.00 0.01 0.00 0.00 42.46 38.35 1vgr s ILE 395 CO -0.03 0.51 0.04 -0.89 0.00 0.00 0.00 174.94 174.57 1vgr s THR 396 N -0.78 0.01 0.83 2.92 2.01 -1.26 -4.77 115.64 114.60 1vgr s THR 396 Ca 0.30 -0.08 -0.12 0.00 0.31 0.00 0.00 61.69 62.10 1vgr s THR 396 Cb -0.19 -0.09 0.09 0.00 0.01 0.00 0.00 72.50 72.32 1vgr s THR 396 CO 0.18 -0.05 1.16 0.00 -0.69 0.00 0.00 174.62 175.23 1vgr s ARG 397 N -0.12 1.61 0.45 4.92 1.70 -1.26 -1.35 118.95 124.90 1vgr s ARG 397 Ca -0.02 1.57 -0.23 0.00 -0.47 0.00 0.00 55.73 56.58 1vgr s ARG 397 Cb -0.01 -1.79 -0.07 0.00 -0.57 0.00 0.00 34.95 32.50 1vgr s ARG 397 CO 0.00 -2.19 1.20 0.00 -1.08 0.00 0.00 175.30 173.22 1vgr s ALA 398 N -2.45 3.02 0.36 7.88 0.00 -1.26 -4.14 121.76 125.16 1vgr s ALA 398 Ca 0.69 1.01 -0.25 0.00 0.00 0.00 0.00 51.96 53.40 1vgr s ALA 398 Cb -0.24 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.37 1vgr s ALA 398 CO 0.53 -0.72 1.02 -1.25 0.00 0.00 0.00 175.76 175.33 1vgr s PRO 399 N -2.60 4.36 0.79 0.00 0.04 -1.25 -4.99 135.00 131.34 1vgr s PRO 399 Ca 0.63 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 63.01 1vgr s PRO 399 Cb -0.31 -2.69 0.07 0.00 0.04 0.00 0.00 34.50 31.61 1vgr s PRO 399 CO 0.38 0.04 1.15 -0.51 0.04 0.00 0.00 177.00 178.10 1vgr s LEU 400 N -2.33 3.12 -0.04 -3.56 1.43 -1.26 -4.92 118.68 111.12 1vgr s LEU 400 Ca 0.54 2.13 -0.30 0.00 -1.03 0.00 0.00 54.13 55.47 1vgr s LEU 400 Cb -0.21 -4.56 -0.06 0.00 0.03 0.00 0.00 46.19 41.38 1vgr s LEU 400 CO 0.27 -2.38 1.68 -0.22 0.23 0.00 0.00 176.35 175.94 1vgr s LEU 401 N -5.73 4.33 -1.51 1.79 2.96 -1.26 -1.54 118.68 117.72 1vgr s LEU 401 Ca 0.68 2.29 0.00 0.00 -0.22 0.00 0.00 54.13 56.88 1vgr s LEU 401 Cb -0.23 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 42.92 1vgr s LEU 401 CO 0.51 -0.93 0.00 0.61 -1.32 0.00 0.00 176.35 175.22 1vgr n GLY 402 N 4.16 1.23 0.25 7.98 0.00 -1.26 -4.89 105.19 112.67 1vgr n GLY 402 Ca 0.17 -0.32 0.06 0.00 0.00 0.00 0.00 46.02 45.93 1vgr n GLY 402 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1vgr h GLU 403 N 0.00 0.10 -0.37 1.61 4.81 -1.28 -2.74 114.58 116.71 1vgr h GLU 403 Ca -0.31 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1vgr h GLU 403 Cb 1.01 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.37 1vgr h GLU 403 CO 0.44 0.15 0.00 0.72 -0.73 0.00 0.00 179.01 179.59 1vgr n HIS 404 N -4.43 0.49 -0.24 0.92 8.25 -0.33 -4.76 115.22 115.13 1vgr n HIS 404 Ca -0.02 -0.48 -0.13 0.00 -0.26 0.00 0.00 57.72 56.83 1vgr n HIS 404 Cb 0.16 -0.02 -0.10 0.00 1.12 0.00 0.00 29.99 31.14 1vgr n HIS 404 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1vgr h THR 405 N 2.23 0.00 -0.41 1.59 2.02 -1.15 0.18 112.91 117.38 1vgr h THR 405 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 1vgr h THR 405 Cb 0.75 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 1vgr h THR 405 CO 0.00 0.00 -0.03 0.44 0.37 0.00 0.00 175.52 176.30 1vgr h ASP 406 N -0.26 0.74 -0.87 4.18 3.32 -1.86 -0.67 116.42 121.00 1vgr h ASP 406 Ca 0.10 -0.33 0.01 0.00 0.02 0.00 0.00 57.03 56.83 1vgr h ASP 406 Cb 0.53 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.84 1vgr h ASP 406 CO -0.72 0.89 0.57 -0.08 -1.72 0.00 0.00 179.24 178.19 1vgr h GLU 407 N 0.57 1.15 -0.32 3.56 4.81 -1.79 -0.59 114.58 121.97 1vgr h GLU 407 Ca 0.11 -0.07 -0.12 0.00 -0.13 0.00 0.00 59.36 59.15 1vgr h GLU 407 Cb 0.53 -0.26 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1vgr h GLU 407 CO 0.03 0.76 -0.28 0.28 -0.73 0.00 0.00 179.01 179.07 1vgr h VAL 408 N 1.18 1.29 -0.04 0.32 2.07 -0.35 -2.85 116.25 117.87 1vgr h VAL 408 Ca 0.32 -1.44 -0.06 0.00 0.82 0.00 0.00 66.70 66.34 1vgr h VAL 408 Cb -0.13 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1vgr h VAL 408 CO -0.07 0.47 -0.26 -0.07 0.02 0.00 0.00 177.57 177.65 1vgr h LEU 409 N 0.51 0.06 -0.32 2.57 3.38 -0.65 -2.71 115.31 118.15 1vgr h LEU 409 Ca 0.06 -0.02 -0.19 0.00 0.09 0.00 0.00 57.88 57.82 1vgr h LEU 409 Cb 0.85 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1vgr h LEU 409 CO 0.07 0.33 -0.85 0.11 0.09 0.00 0.00 178.44 178.19 1vgr h LYS 410 N 0.06 0.10 0.00 1.13 1.57 -1.12 -2.96 116.57 115.35 1vgr h LYS 410 Ca 0.01 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1vgr h LYS 410 Cb 0.50 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 1vgr h LYS 410 CO 0.04 0.89 -0.16 0.93 -0.57 0.00 0.00 179.45 180.58 1vgr h GLU 411 N 0.06 0.00 0.00 3.15 5.08 -1.24 -2.37 114.58 119.26 1vgr h GLU 411 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1vgr h GLU 411 Cb 1.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.73 1vgr h GLU 411 CO 0.12 0.16 0.00 1.28 -1.00 0.00 0.00 179.01 179.57 1vgr n LEU 412 N -3.58 0.00 0.00 1.33 4.77 -1.13 -4.92 117.00 113.47 1vgr n LEU 412 Ca -0.01 0.39 0.00 0.00 -0.03 0.00 0.00 56.01 56.36 1vgr n LEU 412 Cb 0.30 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1vgr n LEU 412 CO 0.31 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 1vgr n GLY 413 N 1.35 0.88 3.76 -0.72 0.00 -0.89 -5.07 105.19 104.50 1vgr n GLY 413 Ca 0.11 -0.06 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1vgr n GLY 413 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vgr s LEU 414 N 0.00 4.58 0.82 0.99 1.43 -1.15 -5.05 118.68 120.31 1vgr s LEU 414 Ca 0.00 1.70 -0.12 0.00 -1.03 0.00 0.00 54.13 54.67 1vgr s LEU 414 Cb 0.00 -3.38 0.09 0.00 0.03 0.00 0.00 46.19 42.93 1vgr s LEU 414 CO 0.00 0.14 1.19 1.51 0.23 0.00 0.00 176.35 179.43 1vgr s ASP 415 N -0.88 4.35 0.26 2.29 -4.77 -1.26 -4.52 116.67 112.13 1vgr s ASP 415 Ca 0.38 0.71 0.01 0.00 -3.30 0.00 0.00 52.55 50.36 1vgr s ASP 415 Cb -0.23 -1.16 0.34 0.00 -1.09 0.00 0.00 42.92 40.78 1vgr s ASP 415 CO 0.27 -2.00 1.67 0.44 0.70 0.00 0.00 175.17 176.26 1vgr h ASP 416 N -1.12 0.51 -0.19 2.11 5.19 -2.00 -2.51 116.42 118.42 1vgr h ASP 416 Ca -0.46 -0.19 -0.19 0.00 -0.62 0.00 0.00 57.03 55.57 1vgr h ASP 416 Cb 1.32 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.69 1vgr h ASP 416 CO 0.63 0.80 -0.59 0.00 -3.12 0.00 0.00 179.24 176.95 1vgr h ALA 417 N 1.24 0.49 0.00 3.45 0.00 -2.00 -2.95 119.26 119.48 1vgr h ALA 417 Ca 0.05 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1vgr h ALA 417 Cb 0.76 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1vgr h ALA 417 CO 0.06 0.69 -0.25 -0.22 0.00 0.00 0.00 179.25 179.53 1vgr h LYS 418 N 0.59 0.00 -0.43 0.00 3.64 -1.92 -2.78 116.57 115.67 1vgr h LYS 418 Ca 0.00 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.23 1vgr h LYS 418 Cb 1.19 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.00 1vgr h LYS 418 CO 0.13 0.25 -0.31 0.82 -2.27 0.00 0.00 179.45 178.06 1vgr h ILE 419 N 0.00 1.27 -0.15 2.00 2.04 -1.33 -2.80 117.51 118.54 1vgr h ILE 419 Ca -0.00 -1.48 -0.07 0.00 1.00 0.00 0.00 64.86 64.30 1vgr h ILE 419 Cb 0.49 1.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 1vgr h ILE 419 CO 0.03 0.50 -0.24 0.11 0.00 0.00 0.00 178.15 178.56 1vgr h LYS 420 N 0.81 0.27 -0.23 2.37 1.57 -1.34 -2.39 116.57 117.63 1vgr h LYS 420 Ca 0.08 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1vgr h LYS 420 Cb 0.90 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 1vgr h LYS 420 CO 0.08 0.50 -0.01 1.49 -0.57 0.00 0.00 179.45 180.94 1vgr h GLU 421 N 0.24 0.40 -0.64 3.15 4.81 -1.38 -1.64 114.58 119.52 1vgr h GLU 421 Ca 0.04 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.10 1vgr h GLU 421 Cb 0.56 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.88 1vgr h GLU 421 CO 0.04 0.60 0.26 -0.07 -0.73 0.00 0.00 179.01 179.10 1vgr h LEU 422 N 0.17 0.86 0.22 1.64 3.38 -1.39 0.57 115.31 120.76 1vgr h LEU 422 Ca 0.06 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1vgr h LEU 422 Cb 0.42 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1vgr h LEU 422 CO 0.01 0.77 -0.11 0.45 0.09 0.00 0.00 178.44 179.65 1vgr h HIS 423 N 0.93 -0.29 0.00 1.13 3.86 -1.31 -2.39 115.15 117.08 1vgr h HIS 423 Ca 0.22 -0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.37 1vgr h HIS 423 Cb 0.18 0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.74 1vgr h HIS 423 CO 0.01 -0.18 -0.24 0.00 0.86 0.00 0.00 177.93 178.38 1vgr h ALA 424 N 0.47 1.00 -0.02 2.45 0.00 -0.76 -2.22 119.26 120.18 1vgr h ALA 424 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1vgr h ALA 424 Cb 0.24 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1vgr h ALA 424 CO 0.04 0.30 0.00 1.63 0.00 0.00 0.00 179.25 181.22 1vgr n LYS 425 N -3.37 1.19 -2.17 0.00 5.02 0.14 -4.91 118.16 114.05 1vgr n LYS 425 Ca 0.00 -0.28 -0.18 0.00 -2.02 0.00 0.00 58.31 55.84 1vgr n LYS 425 Cb 0.45 -1.41 -0.02 0.00 -0.02 0.00 0.00 35.03 34.03 1vgr n LYS 425 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1vgr n GLN 426 N -0.59 -1.37 -0.01 1.97 3.00 -0.84 -4.89 117.38 114.66 1vgr n GLN 426 Ca 0.19 0.91 -0.06 0.00 -0.01 0.00 0.00 57.00 58.03 1vgr n GLN 426 Cb 0.16 -5.34 -0.12 0.00 0.00 0.00 0.00 30.24 24.93 1vgr n GLN 426 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.06 178.39 1vgr n VAL 427 N -3.72 1.44 -0.39 5.09 0.24 -0.92 -4.68 118.33 115.39 1vgr n VAL 427 Ca -0.20 -0.76 0.00 0.00 -2.04 0.00 0.00 64.34 61.33 1vgr n VAL 427 Cb 0.64 -0.88 0.00 0.00 -1.47 0.00 0.00 33.84 32.13 1vgr n VAL 427 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24