#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vak s MET 11 N 0.00 4.29 0.81 -0.78 0.00 -1.26 -4.84 119.30 117.52 2vak s MET 11 Ca 0.00 0.83 -0.12 0.00 0.00 0.00 0.00 55.69 56.40 2vak s MET 11 Cb 0.00 -3.55 0.08 0.00 0.00 0.00 0.00 34.83 31.36 2vak s MET 11 CO 0.00 -0.22 1.15 0.00 0.00 0.00 0.00 175.02 175.95 2vak s ALA 12 N 1.81 1.90 0.12 4.11 0.00 -1.26 -1.68 121.76 126.76 2vak s ALA 12 Ca 0.34 0.62 -0.30 0.00 0.00 0.00 0.00 51.96 52.62 2vak s ALA 12 Cb -0.16 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.48 2vak s ALA 12 CO 0.13 -2.19 1.00 0.50 0.00 0.00 0.00 175.76 175.20 2vak s ARG 13 N -4.43 4.66 0.00 0.00 6.06 -1.21 -3.72 118.95 120.31 2vak s ARG 13 Ca 0.68 1.52 0.00 0.00 -2.50 0.00 0.00 55.73 55.43 2vak s ARG 13 Cb -0.23 -3.36 0.00 0.00 0.06 0.00 0.00 34.95 31.42 2vak s ARG 13 CO 0.52 0.15 0.00 0.00 -2.50 0.00 0.00 175.30 173.48 2vak n ALA 14 N 2.80 1.60 -3.59 6.12 0.00 -1.26 -4.95 120.51 121.23 2vak n ALA 14 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.12 2vak n ALA 14 Cb 0.49 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.79 2vak n ALA 14 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2vak s ILE 15 N -1.47 3.07 -0.86 0.00 1.01 -1.26 -5.06 121.20 116.63 2vak s ILE 15 Ca 0.00 -0.60 -0.00 0.00 0.00 0.00 0.00 60.65 60.04 2vak s ILE 15 Cb 0.00 -2.37 0.21 0.00 0.01 0.00 0.00 42.46 40.31 2vak s ILE 15 CO 0.00 0.46 0.73 -0.31 0.00 0.00 0.00 174.94 175.82 2vak s TYR 16 N 1.34 3.84 0.47 3.97 2.02 -1.26 -5.06 117.35 122.66 2vak s TYR 16 Ca 0.04 -3.09 -0.04 0.00 -0.37 0.00 0.00 57.07 53.61 2vak s TYR 16 Cb -0.14 -3.15 -0.03 0.00 -0.40 0.00 0.00 41.96 38.24 2vak s TYR 16 CO -0.05 -0.70 0.75 -0.51 -1.57 0.00 0.00 175.55 173.47 2vak s ASP 17 N -0.38 6.18 -0.02 2.29 1.01 -1.26 -1.14 116.67 123.35 2vak s ASP 17 Ca 0.27 0.79 0.03 0.00 0.71 0.00 0.00 52.55 54.35 2vak s ASP 17 Cb -0.07 -2.12 -0.00 0.00 1.01 0.00 0.00 42.92 41.74 2vak s ASP 17 CO -0.13 -0.58 -0.11 0.12 0.21 0.00 0.00 175.17 174.68 2vak s PHE 18 N -2.68 1.07 -0.18 4.23 5.36 0.45 -4.79 117.98 121.44 2vak s PHE 18 Ca 0.47 -0.25 -0.03 0.00 -0.96 0.00 0.00 56.93 56.15 2vak s PHE 18 Cb -0.10 -0.73 -0.02 0.00 -0.34 0.00 0.00 43.02 41.83 2vak s PHE 18 CO 0.43 -0.08 -0.06 0.12 -1.46 0.00 0.00 175.22 174.17 2vak s PHE 19 N 0.03 2.94 0.60 10.12 5.36 -1.26 -0.84 117.98 134.93 2vak s PHE 19 Ca -0.01 -0.69 -0.12 0.00 -0.96 0.00 0.00 56.93 55.15 2vak s PHE 19 Cb -0.08 -2.01 -0.04 0.00 -0.34 0.00 0.00 43.02 40.55 2vak s PHE 19 CO 0.00 -0.34 1.02 -1.54 -1.46 0.00 0.00 175.22 172.91 2vak s SER 20 N 0.94 6.23 0.12 6.13 1.04 -0.23 -4.15 113.70 123.79 2vak s SER 20 Ca -0.01 1.48 -0.31 0.00 0.48 0.00 0.00 55.95 57.59 2vak s SER 20 Cb -0.15 -2.48 -0.10 0.00 0.10 0.00 0.00 66.02 63.40 2vak s SER 20 CO 0.01 -0.86 1.65 -0.89 0.98 0.00 0.00 173.24 174.12 2vak s THR 21 N -3.02 2.73 0.41 2.02 2.01 -1.26 -3.30 115.64 115.23 2vak s THR 21 Ca 0.56 0.37 -0.27 0.00 0.31 0.00 0.00 61.69 62.67 2vak s THR 21 Cb -0.11 -3.24 -0.09 0.00 0.01 0.00 0.00 72.50 69.07 2vak s THR 21 CO 0.49 0.01 1.40 -2.84 -0.69 0.00 0.00 174.62 172.98 2vak s PRO 22 N 1.99 3.94 0.15 4.92 0.02 -1.26 -2.74 135.00 142.01 2vak s PRO 22 Ca 0.74 2.37 -0.07 0.00 0.02 0.00 0.00 61.00 64.06 2vak s PRO 22 Cb -0.43 -2.81 -0.02 0.00 0.02 0.00 0.00 34.50 31.27 2vak s PRO 22 CO 0.32 -0.59 0.21 -0.59 -0.33 0.00 0.00 177.00 176.02 2vak s PHE 23 N -1.19 0.49 0.00 6.54 -0.71 -1.26 -4.87 117.98 116.98 2vak s PHE 23 Ca 0.56 -0.87 0.00 0.00 -1.04 0.00 0.00 56.93 55.59 2vak s PHE 23 Cb -0.43 -0.17 0.00 0.00 -1.21 0.00 0.00 43.02 41.22 2vak s PHE 23 CO 0.56 -0.65 0.00 0.41 -1.34 0.00 0.00 175.22 174.20 2vak n GLY 24 N -0.16 1.14 0.36 1.99 0.00 -1.26 -4.91 105.19 102.35 2vak n GLY 24 Ca -0.08 -0.70 0.09 0.00 0.00 0.00 0.00 46.02 45.33 2vak n GLY 24 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vak h ASN 25 N 0.00 0.63 -0.37 1.61 2.35 -1.99 -3.18 115.58 114.63 2vak h ASN 25 Ca 0.00 0.01 -0.10 0.00 -0.55 0.00 0.00 56.30 55.67 2vak h ASN 25 Cb 0.00 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 38.19 2vak h ASN 25 CO 0.00 0.38 0.03 0.54 -1.65 0.00 0.00 177.43 176.73 2vak n ARG 26 N -4.50 2.65 0.00 0.81 5.12 -1.26 -5.08 116.66 114.41 2vak n ARG 26 Ca 0.13 -2.99 0.00 0.00 -1.93 0.00 0.00 57.85 53.06 2vak n ARG 26 Cb 0.32 -1.89 0.00 0.00 -1.16 0.00 0.00 32.46 29.72 2vak n ARG 26 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2vak n GLY 27 N -0.69 -2.03 3.74 -0.13 0.00 -1.20 -4.81 105.19 100.08 2vak n GLY 27 Ca 0.29 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.44 2vak n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vak s LEU 28 N 0.00 4.37 -0.99 0.99 2.96 -1.26 -4.35 118.68 120.40 2vak s LEU 28 Ca 0.00 2.75 -0.05 0.00 -0.22 0.00 0.00 54.13 56.61 2vak s LEU 28 Cb 0.00 -3.62 0.09 0.00 0.50 0.00 0.00 46.19 43.16 2vak s LEU 28 CO 0.00 -0.79 2.54 0.00 -1.32 0.00 0.00 176.35 176.79 2vak n ALA 29 N 2.55 6.68 -2.58 5.97 0.00 -1.26 -4.79 120.51 127.08 2vak n ALA 29 Ca 0.08 -3.68 -0.16 0.00 0.00 0.00 0.00 53.44 49.68 2vak n ALA 29 Cb 0.39 -2.54 -0.06 0.00 0.00 0.00 0.00 19.45 17.24 2vak n ALA 29 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2vak s THR 30 N -1.53 0.00 0.34 0.00 -1.32 -1.24 -1.43 115.64 110.46 2vak s THR 30 Ca 0.56 -1.80 -0.09 0.00 -1.21 0.00 0.00 61.69 59.15 2vak s THR 30 Cb 0.26 -2.56 0.04 0.00 -1.51 0.00 0.00 72.50 68.73 2vak s THR 30 CO -0.14 0.00 0.62 -0.46 -2.21 0.00 0.00 174.62 172.43 2vak n ASN 31 N -1.35 -1.78 0.07 8.08 0.23 -1.26 -4.63 115.26 114.61 2vak n ASN 31 Ca 0.04 -2.54 -0.00 0.00 -0.53 0.00 0.00 54.58 51.54 2vak n ASN 31 Cb 0.62 3.06 0.29 0.00 -2.08 0.00 0.00 39.78 41.67 2vak n ASN 31 CO 0.00 0.00 0.00 -0.09 -0.93 0.00 0.00 177.26 176.24 2vak h ARG 32 N 0.00 0.35 -0.16 -3.83 2.43 -1.94 -2.25 114.38 108.97 2vak h ARG 32 Ca -0.28 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 58.74 2vak h ARG 32 Cb 1.11 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.62 2vak h ARG 32 CO 0.37 0.53 -0.06 1.15 -1.51 0.00 0.00 179.97 180.45 2vak h THR 33 N 0.32 1.30 -0.48 0.20 2.02 -1.97 -2.17 112.91 112.13 2vak h THR 33 Ca 0.06 -1.06 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 2vak h THR 33 Cb 0.53 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 2vak h THR 33 CO 0.03 0.31 0.20 -0.61 0.37 0.00 0.00 175.52 175.83 2vak h GLN 34 N 0.02 0.71 -0.24 6.66 4.15 -1.92 -2.97 115.11 121.53 2vak h GLN 34 Ca 0.04 -0.12 -0.12 0.00 0.77 0.00 0.00 58.65 59.22 2vak h GLN 34 Cb 0.51 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 2vak h GLN 34 CO 0.02 0.63 -0.35 -0.07 -1.93 0.00 0.00 178.83 177.13 2vak h LEU 35 N 0.64 0.54 -0.71 -2.39 3.38 -1.40 -3.02 115.31 112.35 2vak h LEU 35 Ca 0.16 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2vak h LEU 35 Cb 0.17 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2vak h LEU 35 CO -0.02 0.85 0.43 0.28 0.09 0.00 0.00 178.44 180.08 2vak h SER 36 N 0.44 0.86 0.00 -0.43 0.02 -1.32 -2.56 113.55 110.56 2vak h SER 36 Ca 0.05 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 2vak h SER 36 Cb 0.82 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.15 2vak h SER 36 CO 0.07 0.67 0.05 0.77 -1.14 0.00 0.00 176.83 177.25 2vak h SER 37 N 0.97 0.00 0.30 3.07 4.64 -1.38 -2.62 113.55 118.52 2vak h SER 37 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2vak h SER 37 Cb -0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2vak h SER 37 CO -0.05 0.00 -0.30 0.18 -0.87 0.00 0.00 176.83 175.79 2vak n LEU 38 N -2.84 0.89 -4.86 5.97 4.77 -0.96 -4.93 117.00 115.04 2vak n LEU 38 Ca -0.02 -0.20 -0.33 0.00 -0.03 0.00 0.00 56.01 55.43 2vak n LEU 38 Cb 0.11 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 40.99 2vak n LEU 38 CO 0.16 0.17 0.24 -0.76 -1.33 0.00 0.00 177.39 175.88 2vak s LEU 39 N -2.60 4.20 1.05 2.23 1.43 -0.99 -4.83 118.68 119.15 2vak s LEU 39 Ca 0.22 1.00 -0.13 0.00 -1.03 0.00 0.00 54.13 54.19 2vak s LEU 39 Cb 0.19 -3.63 0.21 0.00 0.03 0.00 0.00 46.19 42.99 2vak s LEU 39 CO 0.56 -0.05 1.08 -0.94 0.23 0.00 0.00 176.35 177.23 2vak s SER 40 N -2.20 2.20 0.42 2.29 1.04 -0.61 -4.87 113.70 111.97 2vak s SER 40 Ca 0.46 1.16 0.19 0.00 0.48 0.00 0.00 55.95 58.24 2vak s SER 40 Cb -0.12 -1.82 0.94 0.00 0.10 0.00 0.00 66.02 65.12 2vak s SER 40 CO 0.20 -3.40 1.88 0.77 0.98 0.00 0.00 173.24 173.68 2vak h SER 41 N -2.07 0.00 0.00 7.02 4.64 -1.98 0.35 113.55 121.50 2vak h SER 41 Ca -0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2vak h SER 41 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 2vak h SER 41 CO 0.56 0.29 0.00 -1.54 -0.87 0.00 0.00 176.83 175.26 2vak n SER 42 N -3.83 0.00 0.00 4.97 3.41 -1.26 -4.90 113.62 112.01 2vak n SER 42 Ca -0.01 -1.20 0.00 0.00 -0.26 0.00 0.00 58.87 57.40 2vak n SER 42 Cb 0.37 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 2vak n SER 42 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2vak n ASN 43 N -0.78 -2.95 -4.71 4.04 3.02 0.11 -4.87 115.26 109.12 2vak n ASN 43 Ca 0.11 0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.26 2vak n ASN 43 Cb 0.05 -0.49 -0.05 0.00 -0.61 0.00 0.00 39.78 38.68 2vak n ASN 43 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2vak s SER 44 N -2.41 6.96 0.00 6.41 0.15 -1.25 -0.63 113.70 122.93 2vak s SER 44 Ca 0.00 1.16 0.31 0.00 0.70 0.00 0.00 55.95 58.12 2vak s SER 44 Cb 0.00 -2.41 1.61 0.00 -1.71 0.00 0.00 66.02 63.51 2vak s SER 44 CO 0.00 -0.15 2.09 -0.81 1.20 0.00 0.00 173.24 175.57 2vak n PRO 45 N 3.97 0.59 -0.00 5.44 -0.04 -1.26 -1.58 135.00 142.12 2vak n PRO 45 Ca -0.01 -0.02 0.11 0.00 -0.04 0.00 0.00 63.50 63.54 2vak n PRO 45 Cb 0.51 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.33 2vak n PRO 45 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2vak n TRP 46 N -1.19 0.02 -3.73 0.54 7.02 -1.26 -4.99 117.44 113.85 2vak n TRP 46 Ca 0.17 0.01 -0.29 0.00 -1.02 0.00 0.00 57.50 56.36 2vak n TRP 46 Cb 0.21 -0.32 -0.16 0.00 -2.42 0.00 0.00 31.31 28.63 2vak n TRP 46 CO 0.00 0.00 0.00 1.14 -2.02 0.00 0.00 177.69 176.81 2vak s GLN 47 N -3.31 0.70 -1.12 -0.99 1.03 -1.26 -5.05 119.66 109.66 2vak s GLN 47 Ca -0.02 -0.77 -0.22 0.00 0.04 0.00 0.00 55.36 54.39 2vak s GLN 47 Cb 0.15 -2.00 -0.04 0.00 0.03 0.00 0.00 33.01 31.15 2vak s GLN 47 CO 0.89 -0.83 1.85 0.42 -2.54 0.00 0.00 175.29 175.08 2vak s ILE 61 N 1.74 3.66 0.00 3.63 1.01 -1.26 -4.80 121.20 125.18 2vak s ILE 61 Ca 0.05 -0.94 -0.02 0.00 0.00 0.00 0.00 60.65 59.74 2vak s ILE 61 Cb -0.17 -4.59 -0.09 0.00 0.01 0.00 0.00 42.46 37.62 2vak s ILE 61 CO -0.18 -1.26 1.63 0.55 0.00 0.00 0.00 174.94 175.68 2vak n VAL 62 N 7.48 1.14 -3.61 2.92 3.14 -1.26 -4.85 118.33 123.30 2vak n VAL 62 Ca 0.43 -0.55 -0.20 0.00 -2.96 0.00 0.00 64.34 61.07 2vak n VAL 62 Cb 0.47 -1.64 -0.01 0.00 -1.06 0.00 0.00 33.84 31.60 2vak n VAL 62 CO 0.00 0.00 0.00 -0.94 -6.46 0.00 0.00 176.83 169.43 2vak s SER 63 N 2.53 5.91 0.07 6.55 1.04 -1.26 -5.12 113.70 123.42 2vak s SER 63 Ca 0.23 -0.20 -0.01 0.00 0.48 0.00 0.00 55.95 56.45 2vak s SER 63 Cb 0.11 -1.29 -0.04 0.00 0.10 0.00 0.00 66.02 64.91 2vak s SER 63 CO 0.00 -0.36 -0.01 0.28 0.98 0.00 0.00 173.24 174.14 2vak s THR 64 N -2.17 0.19 0.44 2.02 -1.32 -1.15 -5.00 115.64 108.66 2vak s THR 64 Ca 0.43 -1.81 0.12 0.00 -1.21 0.00 0.00 61.69 59.22 2vak s THR 64 Cb -0.09 -1.62 0.31 0.00 -1.51 0.00 0.00 72.50 69.59 2vak s THR 64 CO 0.30 -0.88 2.01 -0.65 -2.21 0.00 0.00 174.62 173.19 2vak h PRO 65 N 3.08 0.40 -0.00 7.08 0.11 -2.00 -1.63 132.00 139.05 2vak h PRO 65 Ca -0.34 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2vak h PRO 65 Cb 1.15 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2vak h PRO 65 CO 0.64 0.27 -0.35 -0.85 -0.21 0.00 0.00 178.00 177.50 2vak n GLU 66 N -4.47 0.00 -3.15 1.05 0.00 -1.26 -4.20 120.64 108.62 2vak n GLU 66 Ca 0.07 -0.00 -0.22 0.00 0.00 0.00 0.00 57.16 57.01 2vak n GLU 66 Cb 0.27 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 30.16 2vak n GLU 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2vak n ALA 67 N -1.50 1.90 0.29 -1.84 0.00 -1.12 -4.70 120.51 113.54 2vak n ALA 67 Ca 0.06 -3.07 0.15 0.00 0.00 0.00 0.00 53.44 50.58 2vak n ALA 67 Cb 0.34 -0.88 0.70 0.00 0.00 0.00 0.00 19.45 19.61 2vak n ALA 67 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2vak h PRO 68 N 4.20 0.00 -5.56 0.00 0.13 -1.47 -3.03 132.00 126.27 2vak h PRO 68 Ca 0.06 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.75 2vak h PRO 68 Cb 0.91 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.88 2vak h PRO 68 CO 0.43 0.00 -0.75 0.71 -0.23 0.00 0.00 178.00 178.16 2vak s TYR 69 N -3.62 1.63 0.28 1.56 1.51 -1.26 -4.71 117.35 112.74 2vak s TYR 69 Ca -0.00 -0.57 0.02 0.00 -1.01 0.00 0.00 57.07 55.51 2vak s TYR 69 Cb 0.09 -0.79 0.65 0.00 -0.11 0.00 0.00 41.96 41.80 2vak s TYR 69 CO 0.36 0.29 1.75 -1.35 -1.11 0.00 0.00 175.55 175.48 2vak h PRO 70 N 2.90 0.60 0.00 -1.71 0.11 -1.83 -1.97 132.00 130.10 2vak h PRO 70 Ca -0.39 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.68 2vak h PRO 70 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2vak h PRO 70 CO 0.58 0.40 0.00 0.41 -0.21 0.00 0.00 178.00 179.17 2vak n GLY 71 N -1.33 -1.22 0.14 -0.55 0.00 -0.15 -3.45 105.19 98.63 2vak n GLY 71 Ca 0.20 -0.08 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 2vak n GLY 71 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2vak h SER 72 N 0.00 0.33 -0.19 1.61 0.02 -1.56 -3.01 113.55 110.74 2vak h SER 72 Ca 0.00 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2vak h SER 72 Cb 0.35 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 2vak h SER 72 CO 0.00 0.24 0.12 -0.07 -1.14 0.00 0.00 176.83 175.98 2vak h LEU 73 N 0.38 0.23 -0.69 5.07 3.38 -1.69 -0.37 115.31 121.61 2vak h LEU 73 Ca 0.10 -0.04 0.15 0.00 0.09 0.00 0.00 57.88 58.18 2vak h LEU 73 Cb -0.04 -0.06 -0.12 0.00 0.09 0.00 0.00 40.66 40.53 2vak h LEU 73 CO -0.02 0.21 -0.03 0.24 0.09 0.00 0.00 178.44 178.93 2vak h MET 74 N 0.24 0.09 -0.17 1.13 2.86 -1.73 0.16 114.93 117.51 2vak h MET 74 Ca 0.07 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.58 2vak h MET 74 Cb 0.02 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2vak h MET 74 CO -0.01 0.06 -0.37 -0.92 1.06 0.00 0.00 176.91 176.72 2vak h TYR 75 N 0.09 0.70 -0.09 -0.22 3.20 -1.31 -1.86 116.97 117.48 2vak h TYR 75 Ca 0.37 -0.26 -0.09 0.00 3.14 0.00 0.00 58.73 61.89 2vak h TYR 75 Cb 0.61 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2vak h TYR 75 CO -0.42 1.00 -0.34 1.96 -1.64 0.00 0.00 178.16 178.72 2vak h GLN 76 N 0.20 0.17 -0.19 1.82 4.20 -0.85 -2.15 115.11 118.31 2vak h GLN 76 Ca 0.00 -0.07 -0.16 0.00 0.06 0.00 0.00 58.65 58.48 2vak h GLN 76 Cb 0.98 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.74 2vak h GLN 76 CO 0.08 0.50 -0.54 0.93 -0.67 0.00 0.00 178.83 179.13 2vak h GLU 77 N 0.15 0.56 -0.81 1.46 5.08 -0.65 -1.43 114.58 118.94 2vak h GLU 77 Ca 0.02 -0.34 -0.01 0.00 -1.00 0.00 0.00 59.36 58.03 2vak h GLU 77 Cb 0.68 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.93 2vak h GLU 77 CO 0.05 0.95 0.48 0.66 -1.00 0.00 0.00 179.01 180.15 2vak h SER 78 N 0.43 0.98 -0.25 1.42 4.64 -0.94 -0.70 113.55 119.12 2vak h SER 78 Ca 0.01 -0.06 -0.10 0.00 -0.47 0.00 0.00 61.79 61.17 2vak h SER 78 Cb 1.08 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.90 2vak h SER 78 CO 0.10 0.76 -0.17 0.24 -0.87 0.00 0.00 176.83 176.90 2vak h MET 79 N 1.12 0.69 -0.73 4.77 2.86 -1.17 -1.59 114.93 120.88 2vak h MET 79 Ca 0.29 -0.24 0.01 0.00 -2.06 0.00 0.00 59.70 57.69 2vak h MET 79 Cb -0.03 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 2vak h MET 79 CO -0.05 0.82 0.48 1.25 1.06 0.00 0.00 176.91 180.46 2vak h LEU 80 N 0.62 0.85 -0.28 1.22 5.85 -0.59 -1.69 115.31 121.27 2vak h LEU 80 Ca 0.10 -0.03 -0.13 0.00 0.84 0.00 0.00 57.88 58.66 2vak h LEU 80 Cb 0.63 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 2vak h LEU 80 CO 0.04 0.62 -0.32 0.45 -0.34 0.00 0.00 178.44 178.89 2vak h HIS 81 N 0.99 0.87 -0.28 1.25 3.86 -1.07 -2.44 115.15 118.32 2vak h HIS 81 Ca 0.27 -0.27 -0.02 0.00 -1.16 0.00 0.00 60.37 59.19 2vak h HIS 81 Cb -0.10 -0.18 -0.02 0.00 1.06 0.00 0.00 27.41 28.18 2vak h HIS 81 CO -0.02 1.03 0.09 0.77 0.86 0.00 0.00 177.93 180.66 2vak h SER 82 N 0.46 0.36 0.03 2.45 0.02 -1.22 -1.47 113.55 114.19 2vak h SER 82 Ca 0.04 -0.03 -0.25 0.00 -0.84 0.00 0.00 61.79 60.71 2vak h SER 82 Cb 0.90 -0.09 0.02 0.00 0.14 0.00 0.00 62.40 63.37 2vak h SER 82 CO 0.08 0.35 -0.98 0.00 -1.14 0.00 0.00 176.83 175.14 2vak h ALA 83 N 1.71 0.07 0.00 3.77 0.00 -1.22 -3.41 119.26 120.17 2vak h ALA 83 Ca 0.10 -0.69 -0.24 0.00 0.00 0.00 0.00 54.91 54.08 2vak h ALA 83 Cb 0.12 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2vak h ALA 83 CO -0.01 0.59 -2.00 0.25 0.00 0.00 0.00 179.25 178.09 2vak n THR 84 N -3.94 0.92 -0.08 0.00 -2.24 -0.93 -4.60 114.28 103.41 2vak n THR 84 Ca -0.12 -0.61 -0.13 0.00 -2.27 0.00 0.00 64.05 60.93 2vak n THR 84 Cb 0.86 -0.52 -0.07 0.00 -2.10 0.00 0.00 70.33 68.49 2vak n THR 84 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2vak h VAL 85 N 0.00 0.69 -0.91 2.28 2.07 -1.50 -3.39 116.25 115.48 2vak h VAL 85 Ca -0.36 -1.71 0.16 0.00 0.82 0.00 0.00 66.70 65.60 2vak h VAL 85 Cb 1.80 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 32.99 2vak h VAL 85 CO 0.02 0.23 0.59 -0.65 0.02 0.00 0.00 177.57 177.78 2vak h PRO 86 N -1.00 0.63 0.00 1.57 0.11 -1.79 -2.58 132.00 128.94 2vak h PRO 86 Ca -0.14 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2vak h PRO 86 Cb 0.85 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.82 2vak h PRO 86 CO -0.09 0.42 0.00 0.78 -0.21 0.00 0.00 178.00 178.90 2vak h GLY 87 N 0.65 0.00 -1.38 -0.55 0.00 -1.81 -2.70 103.07 97.27 2vak h GLY 87 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 2vak h GLY 87 CO -0.23 0.00 -0.06 1.55 0.00 0.00 0.00 176.54 177.81 2vak n VAL 88 N -2.32 0.00 0.89 4.60 3.14 -0.97 -4.50 118.33 119.16 2vak n VAL 88 Ca 0.02 -0.47 0.13 0.00 -2.96 0.00 0.00 64.34 61.06 2vak n VAL 88 Cb 0.24 1.36 0.56 0.00 -1.06 0.00 0.00 33.84 34.93 2vak n VAL 88 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2vak n LEU 89 N 0.86 0.16 0.25 6.55 4.77 -1.02 -3.80 117.00 124.77 2vak n LEU 89 Ca 0.10 0.52 0.17 0.00 -0.03 0.00 0.00 56.01 56.77 2vak n LEU 89 Cb 0.45 -0.47 0.85 0.00 -2.33 0.00 0.00 43.42 41.92 2vak n LEU 89 CO 0.13 -0.06 1.00 1.23 -1.33 0.00 0.00 177.39 178.36 2vak h GLY 90 N 4.70 0.00 0.00 -0.72 0.00 -1.79 -3.37 103.07 101.88 2vak h GLY 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vak h GLY 90 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 176.54 175.28 2vak n SER 91 N -2.69 0.00 0.23 0.19 2.88 -1.25 -5.00 113.62 107.98 2vak n SER 91 Ca -0.01 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.61 2vak n SER 91 Cb 0.10 0.00 0.62 0.00 -0.75 0.00 0.00 64.21 64.19 2vak n SER 91 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2vak h ARG 92 N 0.00 0.04 -0.28 -1.46 3.08 -1.91 -3.00 114.38 110.86 2vak h ARG 92 Ca 0.00 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2vak h ARG 92 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.04 2vak h ARG 92 CO 0.00 0.03 0.00 -0.25 -1.07 0.00 0.00 179.97 178.68 2vak n ASP 93 N -4.53 2.97 -0.33 7.04 8.00 -1.26 -4.61 116.55 123.83 2vak n ASP 93 Ca -0.02 -2.22 0.07 0.00 0.71 0.00 0.00 54.79 53.32 2vak n ASP 93 Cb 0.11 -0.27 0.23 0.00 -0.02 0.00 0.00 41.12 41.16 2vak n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vak h ALA 94 N 1.67 1.39 -0.02 2.24 0.00 -1.80 -2.04 119.26 120.70 2vak h ALA 94 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.96 2vak h ALA 94 Cb 0.84 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 2vak h ALA 94 CO 0.04 0.09 0.06 0.11 0.00 0.00 0.00 179.25 179.55 2vak h TRP 95 N 0.83 0.00 0.58 0.00 5.08 -1.81 -2.11 115.95 118.52 2vak h TRP 95 Ca 0.47 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 60.42 2vak h TRP 95 Cb 0.54 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.70 2vak h TRP 95 CO -0.04 0.00 -0.38 0.00 -1.28 0.00 0.00 178.44 176.74 2vak h ARG 96 N 0.00 -0.88 -0.01 0.12 3.08 -1.71 -3.31 114.38 111.68 2vak h ARG 96 Ca 0.01 0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2vak h ARG 96 Cb 0.13 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2vak h ARG 96 CO -0.00 -0.58 -0.69 0.25 -1.07 0.00 0.00 179.97 177.88 2vak n THR 97 N -4.79 0.00 -1.67 2.04 -2.24 -1.22 -4.98 114.28 101.42 2vak n THR 97 Ca -0.11 -0.14 -0.45 0.00 -2.27 0.00 0.00 64.05 61.07 2vak n THR 97 Cb 0.38 1.10 -0.03 0.00 -2.10 0.00 0.00 70.33 69.68 2vak n THR 97 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2vak n PHE 98 N -0.68 2.18 -3.75 4.78 7.35 -0.79 -4.49 117.46 122.06 2vak n PHE 98 Ca 0.07 0.38 -0.13 0.00 -0.76 0.00 0.00 57.45 57.00 2vak n PHE 98 Cb 0.41 -2.49 -0.09 0.00 0.35 0.00 0.00 39.48 37.66 2vak n PHE 98 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2vak s ASN 99 N 0.54 -0.28 -0.15 -2.13 2.20 -1.26 -4.46 114.94 109.40 2vak s ASN 99 Ca 0.73 0.36 -0.12 0.00 -0.94 0.00 0.00 52.86 52.88 2vak s ASN 99 Cb -0.67 0.49 0.04 0.00 -2.00 0.00 0.00 41.25 39.11 2vak s ASN 99 CO 0.45 -0.33 0.39 0.54 -2.94 0.00 0.00 177.10 175.21 2vak s VAL 100 N -0.73 -0.01 -0.86 3.54 0.11 -0.54 -0.81 120.40 121.10 2vak s VAL 100 Ca -0.08 0.02 -0.06 0.00 -2.93 0.00 0.00 61.98 58.93 2vak s VAL 100 Cb -0.04 -0.55 0.05 0.00 -1.53 0.00 0.00 36.38 34.31 2vak s VAL 100 CO 0.03 0.01 0.22 0.49 -3.33 0.00 0.00 175.10 172.52 2vak n PHE 101 N 3.18 -1.70 -1.51 1.54 3.72 -1.26 -0.77 117.46 120.66 2vak n PHE 101 Ca -0.15 0.23 -0.04 0.00 -0.05 0.00 0.00 57.45 57.43 2vak n PHE 101 Cb 0.57 -2.09 -0.01 0.00 -0.94 0.00 0.00 39.48 37.00 2vak n PHE 101 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vak n GLY 102 N -0.84 0.48 3.18 1.37 0.00 -1.26 -4.05 105.19 104.07 2vak n GLY 102 Ca -0.02 -0.83 -0.21 0.00 0.00 0.00 0.00 46.02 44.96 2vak n GLY 102 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vak s LEU 103 N -0.98 2.21 0.06 0.99 1.43 0.05 -0.55 118.68 121.88 2vak s LEU 103 Ca 0.00 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 52.61 2vak s LEU 103 Cb 0.00 -0.68 -0.03 0.00 0.03 0.00 0.00 46.19 45.51 2vak s LEU 103 CO 0.00 0.04 -0.10 -0.44 0.23 0.00 0.00 176.35 176.07 2vak s SER 104 N -1.35 1.20 0.37 2.29 0.01 0.99 -1.47 113.70 115.74 2vak s SER 104 Ca 0.02 -0.60 -0.25 0.00 1.31 0.00 0.00 55.95 56.43 2vak s SER 104 Cb -0.09 0.00 -0.09 0.00 0.21 0.00 0.00 66.02 66.06 2vak s SER 104 CO 0.02 -0.17 1.03 0.26 0.41 0.00 0.00 173.24 174.79 2vak s TRP 105 N -1.47 3.39 -0.67 2.43 0.52 -1.26 -0.40 118.94 121.48 2vak s TRP 105 Ca -0.06 1.68 0.25 0.00 0.02 0.00 0.00 56.10 57.99 2vak s TRP 105 Cb -0.09 -3.08 0.48 0.00 -1.15 0.00 0.00 33.47 29.63 2vak s TRP 105 CO 0.01 -0.42 1.46 0.25 0.02 0.00 0.00 176.95 178.27 2vak n THR 106 N 0.15 0.43 -3.70 2.01 -2.24 -0.73 -4.89 114.28 105.31 2vak n THR 106 Ca 0.04 -0.28 -0.07 0.00 -2.27 0.00 0.00 64.05 61.47 2vak n THR 106 Cb 0.49 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 2vak n THR 106 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2vak s ASP 107 N -4.32 -0.32 0.39 3.42 -4.77 -1.26 -5.02 116.67 104.79 2vak s ASP 107 Ca 0.08 -0.37 0.14 0.00 -3.30 0.00 0.00 52.55 49.10 2vak s ASP 107 Cb 0.13 0.61 0.80 0.00 -1.09 0.00 0.00 42.92 43.37 2vak s ASP 107 CO 0.68 -1.09 1.86 -0.08 0.70 0.00 0.00 175.17 177.25 2vak h GLU 108 N 2.00 0.00 0.00 2.11 4.81 -1.93 -2.38 114.58 119.18 2vak h GLU 108 Ca -0.24 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2vak h GLU 108 Cb 1.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2vak h GLU 108 CO 0.28 0.33 0.00 0.41 -0.73 0.00 0.00 179.01 179.29 2vak n GLY 109 N -0.54 -0.65 4.00 1.92 0.00 -1.26 -4.87 105.19 103.79 2vak n GLY 109 Ca -0.02 -0.12 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 2vak n GLY 109 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vak n LEU 110 N -0.96 -2.13 0.11 0.99 4.77 -0.90 -4.93 117.00 113.96 2vak n LEU 110 Ca 0.14 -1.01 0.04 0.00 -0.03 0.00 0.00 56.01 55.14 2vak n LEU 110 Cb 0.06 -2.19 0.01 0.00 -2.33 0.00 0.00 43.42 38.97 2vak n LEU 110 CO 0.11 0.42 0.25 0.77 -1.33 0.00 0.00 177.39 177.61 2vak h SER 111 N -1.80 0.00 -5.01 -1.43 4.64 -1.90 -3.47 113.55 104.59 2vak h SER 111 Ca -0.63 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.60 2vak h SER 111 Cb 1.38 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.28 2vak h SER 111 CO 0.65 0.42 -0.13 -0.83 -0.87 0.00 0.00 176.83 176.07 2vak s GLY 112 N -4.52 -0.27 -0.16 -0.77 0.00 -1.26 -4.34 107.32 96.00 2vak s GLY 112 Ca 0.02 0.52 -0.06 0.00 0.00 0.00 0.00 44.72 45.20 2vak s GLY 112 CO 0.76 0.27 0.06 1.08 0.00 0.00 0.00 173.10 175.27 2vak s LEU 113 N -1.51 3.87 0.32 0.66 1.43 0.20 -1.76 118.68 121.88 2vak s LEU 113 Ca -0.11 0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.18 2vak s LEU 113 Cb -0.03 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 2vak s LEU 113 CO 0.03 0.25 0.11 0.68 0.23 0.00 0.00 176.35 177.66 2vak s VAL 114 N -0.08 0.63 0.35 -1.59 -7.23 0.47 -4.83 120.40 108.13 2vak s VAL 114 Ca 0.07 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 57.95 2vak s VAL 114 Cb -0.12 -2.58 -0.11 0.00 0.56 0.00 0.00 36.38 34.13 2vak s VAL 114 CO 0.01 0.00 1.50 0.00 -0.31 0.00 0.00 175.10 176.30 2vak s ALA 115 N -3.51 3.61 0.38 1.32 0.00 -1.26 -0.01 121.76 122.30 2vak s ALA 115 Ca 0.34 1.56 -0.25 0.00 0.00 0.00 0.00 51.96 53.61 2vak s ALA 115 Cb 0.06 -3.61 -0.09 0.00 0.00 0.00 0.00 23.12 19.48 2vak s ALA 115 CO 0.15 -1.02 1.12 0.00 0.00 0.00 0.00 175.76 176.02 2vak s ALA 116 N -0.85 3.16 -0.02 0.00 0.00 0.29 -4.42 121.76 119.92 2vak s ALA 116 Ca 0.55 0.87 -0.35 0.00 0.00 0.00 0.00 51.96 53.02 2vak s ALA 116 Cb -0.46 -3.34 -0.14 0.00 0.00 0.00 0.00 23.12 19.18 2vak s ALA 116 CO 0.59 -0.38 1.69 0.94 0.00 0.00 0.00 175.76 178.61 2vak n GLN 117 N 0.17 1.85 -4.17 0.00 7.27 -1.26 -4.89 117.38 116.35 2vak n GLN 117 Ca 0.04 0.68 -0.24 0.00 0.07 0.00 0.00 57.00 57.54 2vak n GLN 117 Cb 0.47 -2.44 -0.17 0.00 2.41 0.00 0.00 30.24 30.51 2vak n GLN 117 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2vak s ASP 118 N 2.56 1.71 0.49 1.69 3.68 -1.26 -2.63 116.67 122.91 2vak s ASP 118 Ca 0.88 -0.24 -0.23 0.00 2.13 0.00 0.00 52.55 55.10 2vak s ASP 118 Cb -0.79 -0.71 -0.06 0.00 -1.45 0.00 0.00 42.92 39.91 2vak s ASP 118 CO 0.49 -0.06 1.29 -2.16 0.13 0.00 0.00 175.17 174.86 2vak s PRO 119 N 1.22 3.49 0.02 4.34 0.04 -1.26 -5.10 135.00 137.74 2vak s PRO 119 Ca -0.05 2.08 -0.30 0.00 0.04 0.00 0.00 61.00 62.77 2vak s PRO 119 Cb -0.14 -2.39 -0.05 0.00 0.04 0.00 0.00 34.50 31.96 2vak s PRO 119 CO -0.02 -0.86 1.22 -1.25 0.04 0.00 0.00 177.00 176.13 2vak s PRO 120 N -2.72 4.39 0.27 0.56 0.04 -1.08 -4.93 135.00 131.52 2vak s PRO 120 Ca 0.66 1.76 -0.00 0.00 0.04 0.00 0.00 61.00 63.47 2vak s PRO 120 Cb -0.36 -3.43 0.55 0.00 0.04 0.00 0.00 34.50 31.29 2vak s PRO 120 CO 0.44 -0.35 1.78 -1.35 0.04 0.00 0.00 177.00 177.56 2vak h PRO 121 N 7.10 0.68 -6.12 0.56 0.11 -1.92 -3.42 132.00 129.00 2vak h PRO 121 Ca -0.39 -0.04 -0.65 0.00 0.11 0.00 0.00 66.00 65.03 2vak h PRO 121 Cb 1.19 -0.15 -0.11 0.00 0.11 0.00 0.00 31.00 32.04 2vak h PRO 121 CO 0.84 0.45 -0.61 0.00 -0.21 0.00 0.00 178.00 178.48 2vak s ALA 122 N -5.96 3.49 0.36 -0.75 0.00 -1.26 -5.09 121.76 112.55 2vak s ALA 122 Ca -0.12 -0.95 -0.28 0.00 0.00 0.00 0.00 51.96 50.61 2vak s ALA 122 Cb 0.22 -1.45 -0.12 0.00 0.00 0.00 0.00 23.12 21.77 2vak s ALA 122 CO 0.79 0.70 1.36 0.00 0.00 0.00 0.00 175.76 178.61 2vak n ALA 123 N 0.97 1.70 -1.67 0.00 0.00 -1.26 -4.86 120.51 115.38 2vak n ALA 123 Ca -0.12 0.35 -0.45 0.00 0.00 0.00 0.00 53.44 53.22 2vak n ALA 123 Cb 0.52 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.63 2vak n ALA 123 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2vak n PRO 124 N 0.48 2.02 -1.73 0.00 -0.02 -1.26 -4.74 135.00 129.75 2vak n PRO 124 Ca 0.03 0.72 -0.40 0.00 -2.02 0.00 0.00 63.50 61.83 2vak n PRO 124 Cb 0.37 -2.39 0.02 0.00 -0.02 0.00 0.00 33.50 31.48 2vak n PRO 124 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 2vak n TYR 125 N 2.11 2.40 -3.78 6.00 9.36 0.01 -5.01 117.16 128.24 2vak n TYR 125 Ca 0.12 0.47 -0.37 0.00 3.32 0.00 0.00 57.90 61.44 2vak n TYR 125 Cb 0.31 -2.41 -0.12 0.00 -0.63 0.00 0.00 39.34 36.48 2vak n TYR 125 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 2vak s GLN 126 N -2.36 2.28 0.54 2.98 -1.52 -1.26 -4.75 119.66 115.57 2vak s GLN 126 Ca 0.62 -1.54 -0.20 0.00 -1.95 0.00 0.00 55.36 52.29 2vak s GLN 126 Cb -0.47 -3.49 -0.08 0.00 -0.22 0.00 0.00 33.01 28.75 2vak s GLN 126 CO 0.57 -0.88 0.78 -2.30 -0.25 0.00 0.00 175.29 173.20 2vak n PRO 127 N 4.68 0.81 -4.31 2.91 -0.02 -1.26 -5.00 135.00 132.81 2vak n PRO 127 Ca -0.08 0.31 -0.34 0.00 -2.02 0.00 0.00 63.50 61.37 2vak n PRO 127 Cb 0.42 -1.92 -0.10 0.00 -0.02 0.00 0.00 33.50 31.88 2vak n PRO 127 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vak s ALA 128 N -1.54 3.22 0.18 3.55 0.00 -1.26 -4.89 121.76 121.01 2vak s ALA 128 Ca 0.70 -0.80 -0.30 0.00 0.00 0.00 0.00 51.96 51.56 2vak s ALA 128 Cb -0.47 -1.60 -0.08 0.00 0.00 0.00 0.00 23.12 20.97 2vak s ALA 128 CO 0.52 0.38 1.26 0.45 0.00 0.00 0.00 175.76 178.37 2vak s SER 129 N -0.20 6.99 -1.30 0.00 0.15 -1.26 -4.16 113.70 113.91 2vak s SER 129 Ca 0.05 2.30 -0.23 0.00 0.70 0.00 0.00 55.95 58.77 2vak s SER 129 Cb -0.12 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 61.61 2vak s SER 129 CO 0.02 -0.46 0.52 0.00 1.20 0.00 0.00 173.24 174.51 2vak n ALA 130 N 2.73 -2.43 -2.35 5.45 0.00 -1.11 -4.89 120.51 117.91 2vak n ALA 130 Ca 0.06 -0.49 -0.30 0.00 0.00 0.00 0.00 53.44 52.70 2vak n ALA 130 Cb 0.44 -2.28 -0.15 0.00 0.00 0.00 0.00 19.45 17.46 2vak n ALA 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2vak s GLN 131 N -7.23 1.77 0.35 0.00 2.00 -1.26 -4.86 119.66 110.42 2vak s GLN 131 Ca 0.35 -1.13 -0.13 0.00 -2.00 0.00 0.00 55.36 52.44 2vak s GLN 131 Cb -0.18 -1.97 -0.08 0.00 0.80 0.00 0.00 33.01 31.57 2vak s GLN 131 CO 0.96 0.51 0.74 -1.58 -0.50 0.00 0.00 175.29 175.42 2vak s TRP 132 N -0.83 3.40 -0.03 1.67 0.52 -1.26 -1.07 118.94 121.35 2vak s TRP 132 Ca 0.12 1.15 -0.05 0.00 0.02 0.00 0.00 56.10 57.34 2vak s TRP 132 Cb -0.10 -2.50 0.01 0.00 -1.15 0.00 0.00 33.47 29.73 2vak s TRP 132 CO 0.02 0.03 0.13 -1.12 0.02 0.00 0.00 176.95 176.03 2vak s SER 133 N -2.57 -0.08 -0.41 2.95 0.01 -0.02 -4.95 113.70 108.63 2vak s SER 133 Ca 0.53 0.11 -0.14 0.00 1.31 0.00 0.00 55.95 57.75 2vak s SER 133 Cb -0.10 0.25 0.03 0.00 0.21 0.00 0.00 66.02 66.40 2vak s SER 133 CO 0.22 -0.14 0.30 -0.62 0.41 0.00 0.00 173.24 173.40 2vak s ASP 134 N -0.38 6.04 0.50 2.44 2.15 -1.26 -0.41 116.67 125.75 2vak s ASP 134 Ca -0.05 -0.98 0.27 0.00 0.43 0.00 0.00 52.55 52.21 2vak s ASP 134 Cb -0.03 -2.14 1.31 0.00 -0.30 0.00 0.00 42.92 41.77 2vak s ASP 134 CO 0.00 -0.47 2.01 -0.07 -0.17 0.00 0.00 175.17 176.48 2vak h LEU 135 N 8.61 0.00 -0.02 -1.34 3.38 -1.47 -1.91 115.31 122.55 2vak h LEU 135 Ca -0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2vak h LEU 135 Cb 1.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.87 2vak h LEU 135 CO 0.74 0.15 0.00 0.18 0.09 0.00 0.00 178.44 179.60 2vak n LEU 136 N -3.57 0.02 0.20 1.67 4.77 -1.26 -1.83 117.00 116.99 2vak n LEU 136 Ca -0.01 0.50 0.17 0.00 -0.03 0.00 0.00 56.01 56.65 2vak n LEU 136 Cb 0.29 -0.50 0.82 0.00 -2.33 0.00 0.00 43.42 41.70 2vak n LEU 136 CO 0.31 -0.30 1.15 0.78 -1.33 0.00 0.00 177.39 178.00 2vak h ASN 137 N 0.00 0.00 -3.67 -1.43 2.35 -1.67 -3.39 115.58 107.78 2vak h ASN 137 Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.18 2vak h ASN 137 Cb 0.21 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.51 2vak h ASN 137 CO 0.00 0.00 0.88 -0.47 -1.65 0.00 0.00 177.43 176.19 2vak s TYR 138 N -4.63 2.86 0.27 1.19 5.04 -0.76 -4.76 117.35 116.57 2vak s TYR 138 Ca -0.05 0.73 0.01 0.00 -2.44 0.00 0.00 57.07 55.32 2vak s TYR 138 Cb 0.15 -4.30 0.60 0.00 0.35 0.00 0.00 41.96 38.76 2vak s TYR 138 CO 0.55 -1.20 1.74 -1.35 -1.34 0.00 0.00 175.55 173.95 2vak h PRO 139 N 9.09 0.53 -0.66 4.97 0.11 -1.87 0.20 132.00 144.36 2vak h PRO 139 Ca -0.23 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 2vak h PRO 139 Cb 1.06 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.02 2vak h PRO 139 CO 1.11 0.35 0.31 -0.09 -0.21 0.00 0.00 178.00 179.47 2vak h ARG 140 N 0.54 0.93 -0.11 1.05 2.43 -1.93 -2.32 114.38 114.97 2vak h ARG 140 Ca 0.50 -0.12 -0.19 0.00 -0.81 0.00 0.00 59.98 59.35 2vak h ARG 140 Cb 0.80 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 2vak h ARG 140 CO -0.42 0.72 -0.72 -1.49 -1.51 0.00 0.00 179.97 176.55 2vak h TRP 141 N 0.93 0.72 -0.49 2.20 6.55 -1.22 0.52 115.95 125.16 2vak h TRP 141 Ca 0.23 -0.31 -0.03 0.00 0.95 0.00 0.00 58.89 59.72 2vak h TRP 141 Cb 0.10 -0.11 -0.02 0.00 -0.86 0.00 0.00 29.16 28.26 2vak h TRP 141 CO 0.01 1.09 0.16 0.00 -1.05 0.00 0.00 178.44 178.65 2vak h ALA 142 N 0.83 1.36 0.00 1.49 0.00 -1.31 -2.84 119.26 118.78 2vak h ALA 142 Ca -0.03 -0.16 -0.27 0.00 0.00 0.00 0.00 54.91 54.45 2vak h ALA 142 Cb 1.31 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 2vak h ALA 142 CO 0.13 0.47 -1.64 -0.91 0.00 0.00 0.00 179.25 177.30 2vak h ASN 143 N 0.71 0.00 -2.68 0.00 2.35 -1.32 -3.40 115.58 111.24 2vak h ASN 143 Ca 0.17 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.31 2vak h ASN 143 Cb 0.20 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 38.16 2vak h ASN 143 CO -0.01 0.93 -0.67 0.54 -1.65 0.00 0.00 177.43 176.57 2vak n ARG 144 N -3.02 1.71 -0.08 0.81 1.74 0.18 -4.96 116.66 113.04 2vak n ARG 144 Ca -0.15 -4.27 -0.02 0.00 -0.77 0.00 0.00 57.85 52.64 2vak n ARG 144 Cb 1.01 -2.12 0.24 0.00 -1.02 0.00 0.00 32.46 30.57 2vak n ARG 144 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2vak h ARG 145 N 5.01 0.71 -1.04 5.56 2.43 -1.73 -1.83 114.38 123.49 2vak h ARG 145 Ca 0.17 -0.14 0.28 0.00 -0.81 0.00 0.00 59.98 59.48 2vak h ARG 145 Cb 0.76 -0.11 -0.12 0.00 -0.42 0.00 0.00 29.97 30.08 2vak h ARG 145 CO 0.68 0.66 0.63 -0.09 -1.51 0.00 0.00 179.97 180.34 2vak h ARG 146 N 0.68 0.44 0.00 0.20 9.65 -1.93 0.23 114.38 123.66 2vak h ARG 146 Ca 0.15 -0.03 -0.07 0.00 -1.10 0.00 0.00 59.98 58.94 2vak h ARG 146 Cb 0.29 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.76 2vak h ARG 146 CO 0.00 0.29 -0.33 0.93 2.80 0.00 0.00 179.97 183.66 2vak h GLU 147 N 0.45 0.00 0.10 0.20 5.08 -1.69 -2.04 114.58 116.68 2vak h GLU 147 Ca 0.66 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.72 2vak h GLU 147 Cb 1.48 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.72 2vak h GLU 147 CO -0.45 0.33 -1.54 1.25 -1.00 0.00 0.00 179.01 177.60 2vak h LEU 148 N 0.00 0.33 -1.39 1.33 5.85 -1.08 -3.28 115.31 117.08 2vak h LEU 148 Ca -0.00 -0.48 -0.05 0.00 0.84 0.00 0.00 57.88 58.18 2vak h LEU 148 Cb 0.58 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 2vak h LEU 148 CO 0.04 1.40 -0.12 1.56 -0.34 0.00 0.00 178.44 180.98 2vak h GLN 149 N 0.06 0.26 -0.40 1.25 4.20 -0.54 0.20 115.11 120.13 2vak h GLN 149 Ca -0.24 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.39 2vak h GLN 149 Cb 2.00 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 29.73 2vak h GLN 149 CO 0.15 0.39 0.16 1.03 -0.67 0.00 0.00 178.83 179.89 2vak h SER 150 N 0.24 0.56 1.12 1.46 0.87 -1.50 -3.28 113.55 113.03 2vak h SER 150 Ca 0.05 -0.17 -0.11 0.00 -1.23 0.00 0.00 61.79 60.33 2vak h SER 150 Cb 0.37 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 2vak h SER 150 CO 0.02 0.57 -0.93 0.11 -0.53 0.00 0.00 176.83 176.07 2vak h LYS 151 N 0.51 0.00 -0.95 2.24 1.57 -1.46 -3.41 116.57 115.06 2vak h LYS 151 Ca 0.14 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.94 2vak h LYS 151 Cb 0.19 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.44 2vak h LYS 151 CO -0.01 0.31 0.63 -0.92 -0.57 0.00 0.00 179.45 178.88 2vak h TYR 152 N 0.00 1.18 -0.96 -1.35 3.20 -0.68 -2.63 116.97 115.73 2vak h TYR 152 Ca -0.07 0.03 0.23 0.00 3.14 0.00 0.00 58.73 62.06 2vak h TYR 152 Cb 1.39 -0.40 -0.12 0.00 1.54 0.00 0.00 36.73 39.15 2vak h TYR 152 CO 0.00 0.70 0.51 -1.35 -1.64 0.00 0.00 178.16 176.39 2vak h PRO 153 N 1.24 0.51 -0.21 1.82 0.11 -1.80 0.72 132.00 134.38 2vak h PRO 153 Ca 0.37 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.35 2vak h PRO 153 Cb -0.06 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 30.94 2vak h PRO 153 CO -0.10 0.34 -0.24 1.25 -0.21 0.00 0.00 178.00 179.03 2vak h LEU 154 N 0.52 0.57 -0.32 2.35 5.85 -1.79 -0.16 115.31 122.35 2vak h LEU 154 Ca 0.60 -0.49 -0.19 0.00 0.84 0.00 0.00 57.88 58.64 2vak h LEU 154 Cb 1.13 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2vak h LEU 154 CO -0.49 0.95 -0.62 -0.07 -0.34 0.00 0.00 178.44 177.88 2vak h LEU 155 N 0.21 0.87 -0.84 2.25 3.38 -1.17 -2.72 115.31 117.29 2vak h LEU 155 Ca 0.03 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 2vak h LEU 155 Cb 0.80 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 2vak h LEU 155 CO 0.06 1.28 0.35 0.25 0.09 0.00 0.00 178.44 180.47 2vak h LEU 156 N 0.57 1.10 -0.83 1.67 5.85 0.39 -1.42 115.31 122.63 2vak h LEU 156 Ca -0.01 -0.16 0.11 0.00 0.84 0.00 0.00 57.88 58.67 2vak h LEU 156 Cb 1.22 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.88 2vak h LEU 156 CO 0.13 0.96 0.46 -0.09 -0.34 0.00 0.00 178.44 179.56 2vak h ARG 157 N 1.18 0.72 -0.12 1.25 2.43 -0.91 -0.22 114.38 118.71 2vak h ARG 157 Ca 0.28 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.38 2vak h ARG 157 Cb 0.18 -0.16 -0.00 0.00 -0.42 0.00 0.00 29.97 29.56 2vak h ARG 157 CO -0.03 0.48 0.00 0.77 -1.51 0.00 0.00 179.97 179.68 2vak h SER 158 N 0.74 0.20 -0.68 -3.80 0.02 -1.36 -2.08 113.55 106.58 2vak h SER 158 Ca 0.42 -0.30 0.15 0.00 -0.84 0.00 0.00 61.79 61.21 2vak h SER 158 Cb 0.45 -0.05 -0.11 0.00 0.14 0.00 0.00 62.40 62.82 2vak h SER 158 CO -0.28 0.45 0.01 0.74 -1.14 0.00 0.00 176.83 176.61 2vak h THR 159 N -0.06 0.43 -0.08 -2.27 2.02 -0.82 0.12 112.91 112.26 2vak h THR 159 Ca 0.03 -0.04 -0.18 0.00 0.77 0.00 0.00 66.41 66.99 2vak h THR 159 Cb 0.34 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.05 2vak h THR 159 CO 0.01 0.02 -0.72 -0.07 0.37 0.00 0.00 175.52 175.13 2vak h LEU 160 N 0.12 0.50 -0.17 2.58 3.38 -1.08 0.43 115.31 121.07 2vak h LEU 160 Ca 0.36 -0.33 -0.18 0.00 0.09 0.00 0.00 57.88 57.82 2vak h LEU 160 Cb 0.61 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.21 2vak h LEU 160 CO -0.58 1.06 -0.60 0.25 0.09 0.00 0.00 178.44 178.66 2vak h LEU 161 N 0.29 0.83 -0.83 1.67 5.85 -0.81 -1.59 115.31 120.71 2vak h LEU 161 Ca -0.03 -0.60 -0.00 0.00 0.84 0.00 0.00 57.88 58.08 2vak h LEU 161 Cb 1.30 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 2vak h LEU 161 CO 0.13 1.29 0.51 0.28 -0.34 0.00 0.00 178.44 180.31 2vak h SER 162 N 0.41 0.99 0.75 1.25 0.02 -0.70 -3.03 113.55 113.25 2vak h SER 162 Ca -0.03 -0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 60.77 2vak h SER 162 Cb 1.23 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.51 2vak h SER 162 CO 0.13 0.76 -0.43 0.00 -1.14 0.00 0.00 176.83 176.15 2vak h ALA 163 N 1.28 1.02 -2.75 3.77 0.00 -0.83 -3.45 119.26 118.30 2vak h ALA 163 Ca 0.30 -0.39 -0.51 0.00 0.00 0.00 0.00 54.91 54.31 2vak h ALA 163 Cb -0.06 -0.07 0.05 0.00 0.00 0.00 0.00 17.79 17.71 2vak h ALA 163 CO -0.06 0.53 0.51 -1.64 0.00 0.00 0.00 179.25 178.60 2vak s MET 164 N -3.66 4.16 0.19 0.00 1.00 -0.61 -1.52 119.30 118.87 2vak s MET 164 Ca -0.00 1.86 -0.00 0.00 0.00 0.00 0.00 55.69 57.54 2vak s MET 164 Cb 0.12 -2.77 0.11 0.00 0.00 0.00 0.00 34.83 32.28 2vak s MET 164 CO 0.70 -0.23 1.47 -0.09 0.00 0.00 0.00 175.02 176.87 2vak h ARG 165 N 2.85 0.38 0.00 2.03 2.43 -1.86 -3.45 114.38 116.76 2vak h ARG 165 Ca -0.48 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.39 2vak h ARG 165 Cb 1.23 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 2vak h ARG 165 CO 0.63 0.92 0.00 0.00 -1.51 0.00 0.00 179.97 180.01 2vak n ALA 166 N -2.50 0.00 -1.88 2.80 0.00 -1.26 -5.00 120.51 112.67 2vak n ALA 166 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.11 2vak n ALA 166 Cb 0.67 0.00 0.15 0.00 0.00 0.00 0.00 19.45 20.27 2vak n ALA 166 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2vak s GLY 167 N 0.00 1.69 0.64 0.00 0.00 0.37 -5.00 107.32 105.03 2vak s GLY 167 Ca 0.00 -0.95 -0.16 0.00 0.00 0.00 0.00 44.72 43.61 2vak s GLY 167 CO 0.00 -0.30 1.12 2.56 0.00 0.00 0.00 173.10 176.49 2vak s PRO 168 N -5.73 2.89 0.10 2.90 0.04 -1.26 -4.04 135.00 129.90 2vak s PRO 168 Ca 0.69 1.48 -0.07 0.00 0.04 0.00 0.00 61.00 63.13 2vak s PRO 168 Cb -0.07 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.46 2vak s PRO 168 CO 0.51 -1.19 0.37 0.54 0.04 0.00 0.00 177.00 177.27 2vak s VAL 169 N -2.17 5.16 0.01 -0.36 0.11 -1.26 -2.57 120.40 119.32 2vak s VAL 169 Ca 0.69 0.23 0.03 0.00 -2.93 0.00 0.00 61.98 60.01 2vak s VAL 169 Cb -0.22 -3.62 -0.03 0.00 -1.53 0.00 0.00 36.38 30.97 2vak s VAL 169 CO 0.38 0.19 -0.07 -0.76 -3.33 0.00 0.00 175.10 171.52 2vak s LEU 170 N -2.20 3.16 -0.40 2.54 1.43 0.40 -4.70 118.68 118.91 2vak s LEU 170 Ca 0.36 -0.16 -0.18 0.00 -1.03 0.00 0.00 54.13 53.12 2vak s LEU 170 Cb -0.13 -1.81 0.01 0.00 0.03 0.00 0.00 46.19 44.29 2vak s LEU 170 CO 0.20 0.28 0.50 -0.47 0.23 0.00 0.00 176.35 177.09 2vak s TYR 171 N -1.00 3.15 -0.25 0.29 5.04 -1.26 -1.97 117.35 121.35 2vak s TYR 171 Ca 0.17 -0.13 -0.02 0.00 -2.44 0.00 0.00 57.07 54.65 2vak s TYR 171 Cb -0.11 -2.99 0.03 0.00 0.35 0.00 0.00 41.96 39.24 2vak s TYR 171 CO 0.08 -0.68 -0.06 0.08 -1.34 0.00 0.00 175.55 173.63 2vak s VAL 172 N 2.35 2.86 -0.02 3.14 1.01 -0.10 -4.74 120.40 124.89 2vak s VAL 172 Ca 0.16 -1.04 -0.00 0.00 0.00 0.00 0.00 61.98 61.09 2vak s VAL 172 Cb -0.16 -2.46 0.03 0.00 0.00 0.00 0.00 36.38 33.79 2vak s VAL 172 CO 0.15 0.19 0.03 -0.70 0.00 0.00 0.00 175.10 174.77 2vak s GLU 173 N 1.32 -0.04 0.17 2.72 2.12 -1.26 -0.98 118.70 122.74 2vak s GLU 173 Ca -0.00 0.21 0.11 0.00 0.36 0.00 0.00 54.97 55.65 2vak s GLU 173 Cb -0.17 -0.27 -0.04 0.00 0.26 0.00 0.00 34.13 33.91 2vak s GLU 173 CO -0.04 -0.18 -0.24 0.95 -0.54 0.00 0.00 175.26 175.20 2vak s THR 174 N 1.16 2.27 -0.01 -1.70 -4.23 -0.48 -4.69 115.64 107.97 2vak s THR 174 Ca -0.08 -1.93 -0.21 0.00 -1.18 0.00 0.00 61.69 58.29 2vak s THR 174 Cb -0.13 -2.05 0.04 0.00 1.34 0.00 0.00 72.50 71.70 2vak s THR 174 CO -0.03 -0.06 0.45 -1.66 -0.54 0.00 0.00 174.62 172.78 2vak s TRP 175 N -1.49 -0.36 0.19 3.99 -2.14 -1.26 -0.46 118.94 117.41 2vak s TRP 175 Ca 0.18 0.54 -0.09 0.00 2.66 0.00 0.00 56.10 59.39 2vak s TRP 175 Cb -0.08 0.23 0.26 0.00 -3.10 0.00 0.00 33.47 30.77 2vak s TRP 175 CO 0.08 -0.50 1.13 -2.30 -2.66 0.00 0.00 176.95 172.70 2vak n PRO 176 N 0.99 -0.12 -1.56 3.25 -0.02 -1.26 -1.67 135.00 134.61 2vak n PRO 176 Ca -0.20 1.13 -0.23 0.00 -2.02 0.00 0.00 63.50 62.18 2vak n PRO 176 Cb 0.57 -1.68 0.08 0.00 -0.02 0.00 0.00 33.50 32.45 2vak n PRO 176 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2vak n ASN 177 N -5.13 5.16 0.08 2.55 4.13 -1.26 -4.43 115.26 116.37 2vak n ASN 177 Ca 0.10 -3.77 -0.13 0.00 1.68 0.00 0.00 54.58 52.45 2vak n ASN 177 Cb 0.33 -0.59 -0.06 0.00 -1.54 0.00 0.00 39.78 37.92 2vak n ASN 177 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2vak h MET 178 N 1.87 -0.53 -4.27 3.52 -0.00 -1.72 -3.22 114.93 110.58 2vak h MET 178 Ca 0.41 0.04 -0.74 0.00 -0.00 0.00 0.00 59.70 59.40 2vak h MET 178 Cb 1.37 0.12 -0.23 0.00 -0.00 0.00 0.00 31.60 32.86 2vak h MET 178 CO 0.92 -0.36 -0.12 0.42 -0.00 0.00 0.00 176.91 177.77 2vak s ILE 179 N -5.96 5.10 0.19 -0.10 1.01 -1.26 -4.83 121.20 115.34 2vak s ILE 179 Ca -0.16 -1.36 -0.24 0.00 0.00 0.00 0.00 60.65 58.90 2vak s ILE 179 Cb 0.08 -4.39 0.05 0.00 0.01 0.00 0.00 42.46 38.22 2vak s ILE 179 CO 0.64 -0.95 0.84 -0.94 0.00 0.00 0.00 174.94 174.54 2vak s SER 180 N 3.60 -0.24 0.95 3.58 1.04 -1.22 -4.69 113.70 116.72 2vak s SER 180 Ca 0.06 -0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.05 2vak s SER 180 Cb -0.28 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.42 2vak s SER 180 CO 0.04 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 173.81 2vak n GLY 181 N -0.45 2.83 0.19 7.32 0.00 -1.26 -2.57 105.19 111.25 2vak n GLY 181 Ca -0.06 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 45.83 2vak n GLY 181 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2vak h ARG 182 N 0.00 0.02 -0.29 1.61 -0.00 -1.99 -2.83 114.38 110.90 2vak h ARG 182 Ca 0.00 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.98 59.43 2vak h ARG 182 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 29.97 29.96 2vak h ARG 182 CO 0.00 0.36 0.02 1.25 0.00 0.00 0.00 179.97 181.60 2vak h LEU 183 N 0.01 0.49 -1.61 3.04 5.85 -1.85 -0.69 115.31 120.55 2vak h LEU 183 Ca -0.00 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.41 2vak h LEU 183 Cb 0.61 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 2vak h LEU 183 CO 0.04 0.65 -0.02 0.00 -0.34 0.00 0.00 178.44 178.78 2vak h ALA 184 N 0.85 1.69 -0.13 1.25 0.00 -1.42 0.25 119.26 121.75 2vak h ALA 184 Ca 0.09 -0.12 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 2vak h ALA 184 Cb 0.39 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.11 2vak h ALA 184 CO 0.01 0.24 -0.73 -0.44 0.00 0.00 0.00 179.25 178.33 2vak h ASP 185 N 0.22 0.70 -0.28 0.00 3.32 -1.30 -0.64 116.42 118.44 2vak h ASP 185 Ca 0.05 -0.45 -0.01 0.00 0.02 0.00 0.00 57.03 56.65 2vak h ASP 185 Cb 0.19 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2vak h ASP 185 CO 0.01 1.21 0.15 -0.25 -1.72 0.00 0.00 179.24 178.63 2vak h TRP 186 N 0.41 0.39 -0.64 4.55 7.01 -0.51 -1.71 115.95 125.45 2vak h TRP 186 Ca -0.03 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 60.98 2vak h TRP 186 Cb 1.32 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 28.22 2vak h TRP 186 CO 0.06 0.34 0.43 0.74 -2.79 0.00 0.00 178.44 177.22 2vak h PHE 187 N 0.33 0.75 -0.27 2.65 0.04 -0.87 -2.64 116.94 116.94 2vak h PHE 187 Ca 0.10 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.74 2vak h PHE 187 Cb 0.08 -0.25 -0.01 0.00 2.20 0.00 0.00 35.95 37.97 2vak h PHE 187 CO -0.03 0.44 -0.41 1.98 -0.60 0.00 0.00 178.31 179.69 2vak h MET 188 N 0.78 0.66 0.00 1.51 4.05 -0.89 -2.38 114.93 118.67 2vak h MET 188 Ca 0.25 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2vak h MET 188 Cb 0.04 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 30.85 2vak h MET 188 CO -0.07 0.95 0.00 0.66 0.23 0.00 0.00 176.91 178.68 2vak h SER 189 N 0.54 0.00 -0.28 1.39 4.64 -0.94 -2.28 113.55 116.62 2vak h SER 189 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2vak h SER 189 Cb 0.94 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.03 2vak h SER 189 CO 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.05 2vak n GLN 190 N -2.97 2.30 -1.51 4.77 1.13 -0.90 -4.99 117.38 115.21 2vak n GLN 190 Ca -0.03 -1.95 -0.59 0.00 -1.94 0.00 0.00 57.00 52.50 2vak n GLN 190 Cb 0.07 -1.48 -0.08 0.00 0.11 0.00 0.00 30.24 28.86 2vak n GLN 190 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 2vak n TYR 191 N 1.20 0.71 -0.87 1.08 9.36 -0.86 -0.33 117.16 127.45 2vak n TYR 191 Ca 0.18 1.03 0.00 0.00 3.32 0.00 0.00 57.90 62.43 2vak n TYR 191 Cb 0.54 -2.11 0.00 0.00 -0.63 0.00 0.00 39.34 37.14 2vak n TYR 191 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2vak n GLY 192 N 1.59 1.01 3.83 2.98 0.00 0.12 -4.98 105.19 109.72 2vak n GLY 192 Ca 0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 2vak n GLY 192 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vak s ASN 193 N -2.94 6.37 0.20 1.61 0.01 0.55 -4.65 114.94 116.09 2vak s ASN 193 Ca 0.00 1.66 -0.30 0.00 -0.71 0.00 0.00 52.86 53.51 2vak s ASN 193 Cb 0.00 -2.52 -0.08 0.00 0.41 0.00 0.00 41.25 39.06 2vak s ASN 193 CO 0.00 -0.76 0.95 0.21 -1.51 0.00 0.00 177.10 175.99 2vak s ASN 194 N -2.92 7.58 0.20 -1.22 3.84 -1.26 -0.90 114.94 120.26 2vak s ASN 194 Ca 0.61 1.91 -0.11 0.00 0.21 0.00 0.00 52.86 55.48 2vak s ASN 194 Cb -0.12 -2.60 0.24 0.00 -0.55 0.00 0.00 41.25 38.22 2vak s ASN 194 CO 0.32 0.07 1.74 0.15 -2.79 0.00 0.00 177.10 176.59 2vak h PHE 195 N 4.63 0.33 -0.54 0.43 3.57 -1.13 -0.04 116.94 124.19 2vak h PHE 195 Ca -0.44 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.05 2vak h PHE 195 Cb 1.20 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.86 2vak h PHE 195 CO 0.62 0.08 0.21 0.28 -2.23 0.00 0.00 178.31 177.27 2vak h VAL 196 N 0.36 1.22 -0.93 1.41 2.07 -1.92 0.54 116.25 119.00 2vak h VAL 196 Ca 0.28 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 67.11 2vak h VAL 196 Cb 0.35 0.66 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2vak h VAL 196 CO -0.30 0.26 0.56 0.44 0.02 0.00 0.00 177.57 178.55 2vak h ASP 197 N 0.73 1.11 -0.03 0.57 3.32 -1.88 0.65 116.42 120.89 2vak h ASP 197 Ca 0.18 -0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.16 2vak h ASP 197 Cb 0.20 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2vak h ASP 197 CO -0.01 0.86 0.01 0.24 -1.72 0.00 0.00 179.24 178.61 2vak h MET 198 N 1.28 0.04 -0.29 3.56 2.86 -0.45 -1.19 114.93 120.75 2vak h MET 198 Ca 0.33 -0.01 0.05 0.00 -2.06 0.00 0.00 59.70 58.01 2vak h MET 198 Cb -0.05 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.56 2vak h MET 198 CO -0.06 0.19 0.02 0.00 1.06 0.00 0.00 176.91 178.12 2vak h ALA 200 N 1.23 1.60 -0.10 0.00 0.00 -0.77 -1.76 119.26 119.47 2vak h ALA 200 Ca 0.14 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 2vak h ALA 200 Cb 0.17 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2vak h ALA 200 CO -0.21 0.11 -0.72 -0.09 0.00 0.00 0.00 179.25 178.33 2vak h ARG 201 N 0.00 0.50 -0.26 0.00 2.43 -0.85 -2.97 114.38 113.22 2vak h ARG 201 Ca -0.00 -0.40 -0.15 0.00 -0.81 0.00 0.00 59.98 58.63 2vak h ARG 201 Cb 0.18 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.81 2vak h ARG 201 CO 0.01 1.03 -0.41 -0.07 -1.51 0.00 0.00 179.97 179.01 2vak h LEU 202 N 0.34 0.82 -0.35 3.80 3.38 -1.10 -1.51 115.31 120.69 2vak h LEU 202 Ca -0.03 -0.52 0.07 0.00 0.09 0.00 0.00 57.88 57.49 2vak h LEU 202 Cb 1.31 -0.23 -0.09 0.00 0.09 0.00 0.00 40.66 41.74 2vak h LEU 202 CO 0.13 1.18 -0.30 0.74 0.09 0.00 0.00 178.44 180.28 2vak h THR 203 N 0.48 0.28 0.00 0.22 2.02 -1.34 0.20 112.91 114.78 2vak h THR 203 Ca 0.02 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.11 2vak h THR 203 Cb 1.01 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 2vak h THR 203 CO 0.09 0.00 -0.43 0.06 0.37 0.00 0.00 175.52 175.61 2vak h GLN 204 N -0.25 0.00 -0.09 6.66 -0.00 -1.54 -2.55 115.11 117.34 2vak h GLN 204 Ca 0.16 0.00 -0.09 0.00 -0.00 0.00 0.00 58.65 58.72 2vak h GLN 204 Cb 0.52 0.00 -0.01 0.00 -0.00 0.00 0.00 27.48 27.98 2vak h GLN 204 CO -0.49 0.43 -0.37 0.77 -0.00 0.00 0.00 178.83 179.17 2vak h SER 205 N 0.00 0.19 -0.16 0.06 0.02 -0.83 -3.16 113.55 109.66 2vak h SER 205 Ca -0.00 -0.07 -0.05 0.00 -0.84 0.00 0.00 61.79 60.83 2vak h SER 205 Cb 1.21 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.68 2vak h SER 205 CO 0.06 0.54 0.06 0.00 -1.14 0.00 0.00 176.83 176.35 2vak h SER 207 N 0.57 -0.56 -3.28 0.00 0.02 -1.61 -3.39 113.55 105.30 2vak h SER 207 Ca 0.06 -0.04 -0.56 0.00 -0.84 0.00 0.00 61.79 60.41 2vak h SER 207 Cb 1.06 0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.70 2vak h SER 207 CO 0.16 -0.14 0.52 0.54 -1.14 0.00 0.00 176.83 176.76 2vak s ASN 208 N -4.82 7.21 -0.72 3.07 4.22 -1.26 -4.94 114.94 117.71 2vak s ASN 208 Ca -0.12 1.49 -0.03 0.00 -2.14 0.00 0.00 52.86 52.07 2vak s ASN 208 Cb 0.01 -2.54 0.25 0.00 1.28 0.00 0.00 41.25 40.25 2vak s ASN 208 CO 0.37 -0.42 2.28 0.23 -2.04 0.00 0.00 177.10 177.53 2vak n MET 209 N 4.92 2.68 -1.99 3.55 2.81 -1.26 -4.70 117.12 123.12 2vak n MET 209 Ca 0.08 -3.14 -0.29 0.00 -1.81 0.00 0.00 57.70 52.54 2vak n MET 209 Cb 0.49 -2.23 -0.06 0.00 -0.71 0.00 0.00 33.22 30.71 2vak n MET 209 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 2vak n PRO 210 N -0.04 1.59 -3.74 0.03 -0.02 -1.26 -4.85 135.00 126.71 2vak n PRO 210 Ca 0.52 -2.42 -0.37 0.00 -2.02 0.00 0.00 63.50 59.21 2vak n PRO 210 Cb 0.34 -3.67 -0.11 0.00 -0.02 0.00 0.00 33.50 30.04 2vak n PRO 210 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2vak s VAL 211 N 10.62 3.49 0.20 -1.45 1.01 -1.26 -5.02 120.40 127.99 2vak s VAL 211 Ca 0.68 -2.23 -0.21 0.00 0.00 0.00 0.00 61.98 60.21 2vak s VAL 211 Cb 0.01 -3.35 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 2vak s VAL 211 CO 0.14 -0.74 0.74 -1.61 0.00 0.00 0.00 175.10 173.62 2vak s GLU 212 N 0.89 4.35 0.21 2.72 0.41 -1.26 -4.87 118.70 121.15 2vak s GLU 212 Ca 0.10 0.96 -0.32 0.00 -0.41 0.00 0.00 54.97 55.30 2vak s GLU 212 Cb -0.23 -3.01 -0.14 0.00 -1.78 0.00 0.00 34.13 28.98 2vak s GLU 212 CO -0.04 0.46 1.46 -2.30 -0.49 0.00 0.00 175.26 174.35 2vak n PRO 213 N 1.03 2.07 -0.86 0.39 -0.02 -1.26 -1.57 135.00 134.78 2vak n PRO 213 Ca -0.04 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2vak n PRO 213 Cb 0.50 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2vak n PRO 213 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2vak n ASP 214 N 2.56 -2.18 -4.49 2.55 9.92 -1.26 -4.91 116.55 118.74 2vak n ASP 214 Ca 0.13 0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 54.11 2vak n ASP 214 Cb 0.30 -1.70 0.24 0.00 -0.64 0.00 0.00 41.12 39.33 2vak n ASP 214 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2vak s GLY 215 N -2.00 1.54 0.07 0.44 0.00 -0.61 -4.76 107.32 102.00 2vak s GLY 215 Ca 0.00 -0.24 0.25 0.00 0.00 0.00 0.00 44.72 44.72 2vak s GLY 215 CO 0.00 0.49 1.35 1.16 0.00 0.00 0.00 173.10 176.10 2vak n ASN 216 N -4.84 0.61 -0.07 1.64 0.23 -1.26 -1.76 115.26 109.81 2vak n ASN 216 Ca 0.03 -0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 53.99 2vak n ASN 216 Cb 0.55 0.20 -0.02 0.00 -2.08 0.00 0.00 39.78 38.44 2vak n ASN 216 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 2vak h TYR 217 N 0.00 0.25 0.14 -2.53 0.05 -1.92 0.18 116.97 113.14 2vak h TYR 217 Ca 0.00 0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.81 2vak h TYR 217 Cb 0.66 -0.08 -0.04 0.00 1.01 0.00 0.00 36.73 38.28 2vak h TYR 217 CO 0.00 0.14 -0.42 0.22 -1.05 0.00 0.00 178.16 177.06 2vak h ASP 218 N 0.28 -1.22 -0.96 3.88 3.58 -1.73 -2.16 116.42 118.09 2vak h ASP 218 Ca 0.10 0.13 0.01 0.00 0.42 0.00 0.00 57.03 57.70 2vak h ASP 218 Cb 0.02 0.46 -0.05 0.00 1.72 0.00 0.00 39.33 41.48 2vak h ASP 218 CO -0.06 -0.49 0.63 1.56 -2.88 0.00 0.00 179.24 177.99 2vak h GLN 219 N -0.66 1.27 -0.65 0.28 4.20 -1.23 -2.31 115.11 116.01 2vak h GLN 219 Ca 0.02 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 2vak h GLN 219 Cb 0.68 -0.28 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 2vak h GLN 219 CO -0.23 0.85 0.25 1.96 -0.67 0.00 0.00 178.83 180.99 2vak h GLN 220 N 1.31 0.97 -0.24 1.46 4.20 -0.80 -0.52 115.11 121.48 2vak h GLN 220 Ca 0.35 -0.18 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 2vak h GLN 220 Cb -0.14 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.47 2vak h GLN 220 CO -0.07 0.82 0.11 0.52 -0.67 0.00 0.00 178.83 179.54 2vak h MET 221 N 0.91 0.35 -0.24 1.46 2.86 -0.87 -0.23 114.93 119.17 2vak h MET 221 Ca 0.21 -0.05 -0.16 0.00 -2.06 0.00 0.00 59.70 57.64 2vak h MET 221 Cb 0.22 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 2vak h MET 221 CO -0.02 0.36 -0.51 0.00 1.06 0.00 0.00 176.91 177.80 2vak h ARG 222 N 0.26 0.67 -0.25 1.72 3.08 -1.26 -2.17 114.38 116.42 2vak h ARG 222 Ca 0.08 -0.40 -0.12 0.00 0.07 0.00 0.00 59.98 59.61 2vak h ARG 222 Cb 0.13 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 2vak h ARG 222 CO -0.01 1.02 -0.35 0.00 -1.07 0.00 0.00 179.97 179.56 2vak h ALA 223 N 0.90 0.91 -0.47 0.04 0.00 -1.09 -2.82 119.26 116.74 2vak h ALA 223 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2vak h ALA 223 Cb 1.07 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 2vak h ALA 223 CO 0.10 0.62 0.30 1.25 0.00 0.00 0.00 179.25 181.53 2vak h LEU 224 N 0.47 0.54 -0.01 0.00 5.85 -0.84 -1.32 115.31 120.00 2vak h LEU 224 Ca 0.05 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2vak h LEU 224 Cb 0.83 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.73 2vak h LEU 224 CO 0.07 0.41 0.01 0.40 -0.34 0.00 0.00 178.44 178.98 2vak h ILE 225 N 0.63 1.14 -0.12 4.05 2.04 -1.36 -1.77 117.51 122.12 2vak h ILE 225 Ca 0.17 -0.40 -0.18 0.00 1.00 0.00 0.00 64.86 65.45 2vak h ILE 225 Cb -0.05 1.38 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 2vak h ILE 225 CO -0.04 0.11 -0.62 0.77 0.00 0.00 0.00 178.15 178.37 2vak h SER 226 N -0.15 0.76 -0.13 1.72 4.64 -1.53 0.63 113.55 119.49 2vak h SER 226 Ca 0.00 -0.64 0.01 0.00 -0.47 0.00 0.00 61.79 60.70 2vak h SER 226 Cb 0.17 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 2vak h SER 226 CO -0.00 1.28 0.03 0.25 -0.87 0.00 0.00 176.83 177.52 2vak h LEU 227 N 0.29 0.03 -0.58 5.97 5.85 -1.29 -0.89 115.31 124.68 2vak h LEU 227 Ca -0.04 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.69 2vak h LEU 227 Cb 1.27 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.29 2vak h LEU 227 CO 0.13 0.04 0.36 -0.25 -0.34 0.00 0.00 178.44 178.38 2vak h TRP 228 N 0.09 0.76 -0.27 1.25 7.01 -1.31 -2.30 115.95 121.18 2vak h TRP 228 Ca 0.06 0.00 -0.12 0.00 2.11 0.00 0.00 58.89 60.94 2vak h TRP 228 Cb 0.04 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 26.84 2vak h TRP 228 CO -0.12 0.51 -0.33 1.25 -2.79 0.00 0.00 178.44 176.96 2vak h LEU 229 N 0.79 0.60 -0.81 0.65 5.85 -0.59 -1.96 115.31 119.84 2vak h LEU 229 Ca 0.21 -0.24 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 2vak h LEU 229 Cb -0.04 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2vak h LEU 229 CO -0.04 0.89 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.45 2vak h LEU 230 N 0.49 0.00 -0.99 2.25 3.38 -1.11 -1.74 115.31 117.60 2vak h LEU 230 Ca 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2vak h LEU 230 Cb 0.82 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2vak h LEU 230 CO 0.07 0.43 -0.24 0.28 0.09 0.00 0.00 178.44 179.06 2vak h SER 231 N 0.00 0.44 0.76 -0.43 0.02 -1.15 -0.22 113.55 112.97 2vak h SER 231 Ca -0.00 -0.14 -0.21 0.00 -0.84 0.00 0.00 61.79 60.59 2vak h SER 231 Cb 0.98 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 2vak h SER 231 CO 0.06 0.69 -0.97 0.22 -1.14 0.00 0.00 176.83 175.68 2vak h TYR 232 N 0.39 0.19 -0.02 3.45 3.20 -0.75 -3.01 116.97 120.42 2vak h TYR 232 Ca 0.06 -0.12 0.00 0.00 3.14 0.00 0.00 58.73 61.81 2vak h TYR 232 Cb 0.64 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.90 2vak h TYR 232 CO 0.02 1.01 -0.06 0.44 -1.64 0.00 0.00 178.16 177.92 2vak n ILE 233 N -3.53 0.00 0.00 1.81 -5.35 -0.71 -4.65 119.36 106.93 2vak n ILE 233 Ca -0.03 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 62.13 2vak n ILE 233 Cb 0.88 0.89 0.00 0.00 -1.74 0.00 0.00 39.64 39.68 2vak n ILE 233 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2vak n GLY 234 N 1.27 3.36 0.22 3.28 0.00 -1.14 -3.85 105.19 108.33 2vak n GLY 234 Ca 0.16 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 2vak n GLY 234 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2vak h VAL 235 N 0.00 1.26 -3.32 1.61 2.07 -1.60 -3.39 116.25 112.88 2vak h VAL 235 Ca 0.00 -1.26 -0.64 0.00 0.82 0.00 0.00 66.70 65.62 2vak h VAL 235 Cb 0.00 1.49 -0.22 0.00 -1.52 0.00 0.00 31.29 31.03 2vak h VAL 235 CO 0.00 0.38 -0.68 -0.69 0.02 0.00 0.00 177.57 176.61 2vak s VAL 236 N -4.38 3.81 0.07 2.57 1.01 -0.18 -4.87 120.40 118.44 2vak s VAL 236 Ca -0.05 -0.38 -0.03 0.00 0.00 0.00 0.00 61.98 61.52 2vak s VAL 236 Cb 0.14 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.86 2vak s VAL 236 CO 0.76 0.49 0.14 -0.46 0.00 0.00 0.00 175.10 176.03 2vak n ASN 237 N 3.61 -0.39 0.26 3.32 0.23 -0.72 -4.02 115.26 117.54 2vak n ASN 237 Ca -0.17 -1.27 0.12 0.00 -0.53 0.00 0.00 54.58 52.72 2vak n ASN 237 Cb 0.52 0.66 0.72 0.00 -2.08 0.00 0.00 39.78 39.60 2vak n ASN 237 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 2vak h GLN 238 N 0.00 0.00 -0.14 -3.83 4.15 -1.96 -2.40 115.11 110.94 2vak h GLN 238 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.36 2vak h GLN 238 Cb 0.21 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.90 2vak h GLN 238 CO 0.07 0.11 0.00 0.25 -1.93 0.00 0.00 178.83 177.34 2vak n THR 239 N -3.78 0.16 -3.07 2.39 -2.24 -1.26 -4.69 114.28 101.79 2vak n THR 239 Ca -0.02 -0.45 -0.01 0.00 -2.27 0.00 0.00 64.05 61.31 2vak n THR 239 Cb 0.22 0.83 -0.00 0.00 -2.10 0.00 0.00 70.33 69.28 2vak n THR 239 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2vak s ASN 240 N -1.78 -1.49 0.23 3.42 2.47 -0.90 -3.75 114.94 113.14 2vak s ASN 240 Ca 0.34 -1.09 0.07 0.00 0.42 0.00 0.00 52.86 52.61 2vak s ASN 240 Cb 0.20 1.93 -0.04 0.00 -1.45 0.00 0.00 41.25 41.90 2vak s ASN 240 CO 0.30 -0.13 0.10 0.42 -3.72 0.00 0.00 177.10 174.07 2vak s THR 241 N 1.54 4.07 -0.40 -5.21 -4.23 0.29 -1.75 115.64 109.95 2vak s THR 241 Ca 0.20 -1.50 -0.16 0.00 -1.18 0.00 0.00 61.69 59.05 2vak s THR 241 Cb -0.03 -3.15 0.01 0.00 1.34 0.00 0.00 72.50 70.67 2vak s THR 241 CO -0.06 -0.29 0.38 -0.63 -0.54 0.00 0.00 174.62 173.48 2vak s ILE 242 N -2.07 5.15 -1.46 2.99 1.01 -0.42 -0.69 121.20 125.71 2vak s ILE 242 Ca 0.31 -0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.65 2vak s ILE 242 Cb -0.08 -3.95 0.00 0.00 0.01 0.00 0.00 42.46 38.44 2vak s ILE 242 CO 0.22 -0.30 0.00 -1.20 0.00 0.00 0.00 174.94 173.66 2vak n SER 243 N 5.44 -4.42 0.00 3.58 7.64 -1.26 -0.95 113.62 123.64 2vak n SER 243 Ca -0.09 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.02 2vak n SER 243 Cb 0.48 -3.84 0.00 0.00 -1.01 0.00 0.00 64.21 59.84 2vak n SER 243 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vak n GLY 244 N -0.64 0.06 3.84 0.23 0.00 -1.26 -4.98 105.19 102.44 2vak n GLY 244 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.53 2vak n GLY 244 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vak s PHE 245 N -2.00 3.38 -0.03 1.61 0.08 -0.13 -1.02 117.98 119.87 2vak s PHE 245 Ca 0.00 0.23 -0.29 0.00 0.12 0.00 0.00 56.93 56.99 2vak s PHE 245 Cb 0.00 -1.74 0.09 0.00 -0.57 0.00 0.00 43.02 40.80 2vak s PHE 245 CO 0.00 0.58 0.77 1.52 -0.10 0.00 0.00 175.22 177.99 2vak s TYR 246 N -1.33 -0.52 -0.04 0.36 1.13 -1.07 -1.30 117.35 114.57 2vak s TYR 246 Ca 0.28 0.74 -0.09 0.00 -1.41 0.00 0.00 57.07 56.58 2vak s TYR 246 Cb -0.12 0.46 -0.05 0.00 -1.10 0.00 0.00 41.96 41.15 2vak s TYR 246 CO 0.19 -0.58 0.26 -0.06 -2.51 0.00 0.00 175.55 172.85 2vak s PHE 247 N -1.89 3.63 0.11 -3.49 0.40 -1.26 -0.60 117.98 114.87 2vak s PHE 247 Ca -0.04 0.67 0.08 0.00 -0.60 0.00 0.00 56.93 57.04 2vak s PHE 247 Cb -0.00 -2.05 -0.04 0.00 0.51 0.00 0.00 43.02 41.44 2vak s PHE 247 CO 0.01 0.67 -0.19 0.45 0.70 0.00 0.00 175.22 176.86 2vak s SER 248 N -1.27 2.41 -0.02 1.36 0.15 0.13 -4.85 113.70 111.61 2vak s SER 248 Ca 0.22 -0.72 -0.00 0.00 0.70 0.00 0.00 55.95 56.15 2vak s SER 248 Cb -0.14 -0.13 0.02 0.00 -1.71 0.00 0.00 66.02 64.07 2vak s SER 248 CO 0.11 0.01 0.03 -0.55 1.20 0.00 0.00 173.24 174.04 2vak s SER 249 N -2.05 0.04 0.24 5.45 0.15 -1.25 -0.07 113.70 116.20 2vak s SER 249 Ca 0.07 0.05 -0.05 0.00 0.70 0.00 0.00 55.95 56.72 2vak s SER 249 Cb -0.09 -0.03 0.25 0.00 -1.71 0.00 0.00 66.02 64.44 2vak s SER 249 CO 0.04 -0.09 1.76 0.11 1.20 0.00 0.00 173.24 176.26 2vak h LYS 250 N 6.94 0.97 -6.25 5.44 1.57 -1.90 -3.43 116.57 119.91 2vak h LYS 250 Ca -0.39 -0.23 -0.56 0.00 -1.87 0.00 0.00 60.65 57.59 2vak h LYS 250 Cb 1.15 -0.13 -0.09 0.00 0.08 0.00 0.00 32.23 33.24 2vak h LYS 250 CO 0.48 0.88 -0.63 0.95 -0.57 0.00 0.00 179.45 180.57 2vak s THR 251 N -5.19 3.72 -0.06 -0.16 -4.23 -1.26 -5.12 115.64 103.33 2vak s THR 251 Ca -0.11 -1.66 -0.01 0.00 -1.18 0.00 0.00 61.69 58.74 2vak s THR 251 Cb 0.15 -2.95 0.03 0.00 1.34 0.00 0.00 72.50 71.06 2vak s THR 251 CO 0.83 -0.28 -0.01 -0.60 -0.54 0.00 0.00 174.62 174.01 2vak s ARG 252 N -3.46 0.67 0.00 3.99 6.06 -1.26 -4.63 118.95 120.32 2vak s ARG 252 Ca 0.30 0.04 0.00 0.00 -2.50 0.00 0.00 55.73 53.58 2vak s ARG 252 Cb -0.08 -0.93 0.00 0.00 0.06 0.00 0.00 34.95 34.01 2vak s ARG 252 CO 0.20 -0.24 0.00 0.41 -2.50 0.00 0.00 175.30 173.18 2vak n GLY 253 N 4.81 0.64 3.50 8.12 0.00 -1.26 -4.39 105.19 116.61 2vak n GLY 253 Ca -0.13 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.23 2vak n GLY 253 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2vak s GLN 254 N -0.91 1.82 0.31 1.61 0.74 -1.26 -4.35 119.66 117.62 2vak s GLN 254 Ca 0.00 -2.07 0.03 0.00 0.05 0.00 0.00 55.36 53.37 2vak s GLN 254 Cb 0.00 -0.81 0.61 0.00 1.10 0.00 0.00 33.01 33.90 2vak s GLN 254 CO 0.00 -0.33 1.89 0.00 -0.55 0.00 0.00 175.29 176.30 2vak h ALA 255 N 1.91 1.59 -0.20 1.58 0.00 -1.96 -3.14 119.26 119.03 2vak h ALA 255 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2vak h ALA 255 Cb 1.26 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2vak h ALA 255 CO 0.64 0.23 0.00 1.28 0.00 0.00 0.00 179.25 181.41 2vak n LEU 256 N -4.53 2.37 -4.71 0.00 4.77 -1.26 -4.93 117.00 108.71 2vak n LEU 256 Ca 0.15 -1.20 -0.42 0.00 -0.03 0.00 0.00 56.01 54.51 2vak n LEU 256 Cb 0.28 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 2vak n LEU 256 CO 0.31 0.37 1.19 -1.81 -1.33 0.00 0.00 177.39 176.12 2vak s ASP 257 N -0.39 6.67 -0.21 -1.43 -0.00 -1.19 -4.63 116.67 115.49 2vak s ASP 257 Ca 0.18 2.49 -0.07 0.00 -0.00 0.00 0.00 52.55 55.14 2vak s ASP 257 Cb 0.13 -2.58 0.09 0.00 -0.00 0.00 0.00 42.92 40.56 2vak s ASP 257 CO 0.06 -0.78 0.44 -0.55 -0.00 0.00 0.00 175.17 174.34 2vak s SER 258 N 1.37 -0.34 -0.32 0.27 0.15 -1.26 -5.03 113.70 108.54 2vak s SER 258 Ca 0.69 1.05 -0.12 0.00 0.70 0.00 0.00 55.95 58.26 2vak s SER 258 Cb -0.41 1.43 -0.03 0.00 -1.71 0.00 0.00 66.02 65.31 2vak s SER 258 CO 0.31 -0.23 0.23 0.26 1.20 0.00 0.00 173.24 175.00 2vak s TRP 259 N 2.62 3.23 -0.08 3.44 0.52 -1.26 -3.94 118.94 123.47 2vak s TRP 259 Ca -0.02 -0.14 0.01 0.00 0.02 0.00 0.00 56.10 55.97 2vak s TRP 259 Cb -0.12 -2.45 -0.02 0.00 -1.15 0.00 0.00 33.47 29.73 2vak s TRP 259 CO -0.13 -0.31 -0.11 0.99 0.02 0.00 0.00 176.95 177.41 2vak s THR 260 N 1.73 3.33 -0.18 2.01 2.01 0.91 -0.43 115.64 125.01 2vak s THR 260 Ca 0.06 -0.60 -0.29 0.00 0.31 0.00 0.00 61.69 61.17 2vak s THR 260 Cb -0.17 -2.36 -0.01 0.00 0.01 0.00 0.00 72.50 69.98 2vak s THR 260 CO 0.11 0.57 1.20 -0.22 -0.69 0.00 0.00 174.62 175.58 2vak s LEU 261 N -0.40 4.16 0.44 4.42 2.96 -0.08 -0.70 118.68 129.49 2vak s LEU 261 Ca 0.05 1.60 0.04 0.00 -0.22 0.00 0.00 54.13 55.60 2vak s LEU 261 Cb -0.12 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.98 2vak s LEU 261 CO 0.02 -0.73 0.02 -0.36 -1.32 0.00 0.00 176.35 173.98 2vak s PHE 262 N 3.40 2.17 -0.16 5.38 0.08 0.23 0.11 117.98 129.20 2vak s PHE 262 Ca 0.51 -0.84 -0.09 0.00 0.12 0.00 0.00 56.93 56.64 2vak s PHE 262 Cb -0.20 -1.64 0.06 0.00 -0.57 0.00 0.00 43.02 40.67 2vak s PHE 262 CO 0.12 0.28 0.38 -0.47 -0.10 0.00 0.00 175.22 175.43 2vak s TYR 263 N -2.85 -0.54 0.08 0.36 5.04 -1.26 -2.60 117.35 115.58 2vak s TYR 263 Ca 0.23 1.18 0.09 0.00 -2.44 0.00 0.00 57.07 56.13 2vak s TYR 263 Cb 0.06 0.22 -0.03 0.00 0.35 0.00 0.00 41.96 42.56 2vak s TYR 263 CO 0.12 -0.31 -0.24 0.95 -1.34 0.00 0.00 175.55 174.72 2vak s THR 264 N 1.30 2.37 -0.01 4.34 -4.23 -0.19 -5.01 115.64 114.22 2vak s THR 264 Ca -0.09 -1.49 0.09 0.00 -1.18 0.00 0.00 61.69 59.02 2vak s THR 264 Cb -0.08 -2.00 -0.23 0.00 1.34 0.00 0.00 72.50 71.53 2vak s THR 264 CO -0.11 0.24 0.79 0.74 -0.54 0.00 0.00 174.62 175.74 2vak h THR 265 N 3.99 1.03 -0.06 3.99 2.02 -1.98 -3.41 112.91 118.50 2vak h THR 265 Ca -0.49 -2.83 0.00 0.00 0.77 0.00 0.00 66.41 63.86 2vak h THR 265 Cb 1.16 2.54 0.00 0.00 -1.74 0.00 0.00 68.15 70.11 2vak h THR 265 CO 0.43 0.64 0.00 -0.46 0.37 0.00 0.00 175.52 176.50 2vak n ASN 266 N -3.17 2.28 -4.58 4.18 6.94 -1.26 -5.02 115.26 114.64 2vak n ASN 266 Ca -0.14 -2.28 -0.26 0.00 -0.02 0.00 0.00 54.58 51.87 2vak n ASN 266 Cb 1.03 -0.15 -0.10 0.00 -2.36 0.00 0.00 39.78 38.20 2vak n ASN 266 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2vak s THR 267 N -1.49 2.32 0.07 5.53 -4.23 -1.26 -5.08 115.64 111.49 2vak s THR 267 Ca 0.12 -2.12 -0.37 0.00 -1.18 0.00 0.00 61.69 58.14 2vak s THR 267 Cb 0.09 -2.72 -0.16 0.00 1.34 0.00 0.00 72.50 71.05 2vak s THR 267 CO 0.03 -0.18 1.41 -3.20 -0.54 0.00 0.00 174.62 172.14 2vak n ASN 268 N -0.86 1.92 -4.74 3.99 5.15 -1.25 -4.84 115.26 114.64 2vak n ASN 268 Ca -0.05 1.11 -0.35 0.00 -0.60 0.00 0.00 54.58 54.69 2vak n ASN 268 Cb 0.63 -1.22 -0.08 0.00 -0.53 0.00 0.00 39.78 38.58 2vak n ASN 268 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2vak s ARG 269 N 0.83 3.91 0.65 1.20 0.52 -1.26 -0.54 118.95 124.25 2vak s ARG 269 Ca 0.85 -0.24 -0.16 0.00 -0.52 0.00 0.00 55.73 55.66 2vak s ARG 269 Cb -0.92 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 31.26 2vak s ARG 269 CO 0.47 0.42 1.14 0.14 0.02 0.00 0.00 175.30 177.50 2vak s VAL 270 N -0.02 2.96 -0.61 3.52 -7.23 0.13 -4.90 120.40 114.25 2vak s VAL 270 Ca 0.09 0.49 0.03 0.00 -1.81 0.00 0.00 61.98 60.77 2vak s VAL 270 Cb -0.12 -3.06 0.15 0.00 0.56 0.00 0.00 36.38 33.92 2vak s VAL 270 CO 0.00 -0.23 0.39 -1.10 -0.31 0.00 0.00 175.10 173.85 2vak s GLN 271 N -3.83 2.30 0.11 4.82 -1.52 -1.25 -4.70 119.66 115.60 2vak s GLN 271 Ca 0.71 -2.84 -0.31 0.00 -1.95 0.00 0.00 55.36 50.97 2vak s GLN 271 Cb -0.24 -3.47 -0.07 0.00 -0.22 0.00 0.00 33.01 29.01 2vak s GLN 271 CO 0.39 -1.18 1.32 0.42 -0.25 0.00 0.00 175.29 175.99 2vak s ILE 272 N -0.63 3.51 -0.05 1.08 1.01 -1.25 -4.41 121.20 120.45 2vak s ILE 272 Ca 0.20 1.11 0.05 0.00 0.00 0.00 0.00 60.65 62.01 2vak s ILE 272 Cb -0.18 -3.71 -0.07 0.00 0.01 0.00 0.00 42.46 38.51 2vak s ILE 272 CO -0.06 0.10 0.03 0.41 0.00 0.00 0.00 174.94 175.42 2vak n THR 273 N 3.71 0.37 -4.18 2.92 -1.04 -0.13 -4.22 114.28 111.72 2vak n THR 273 Ca 0.10 -0.23 -0.11 0.00 -2.04 0.00 0.00 64.05 61.76 2vak n THR 273 Cb 0.44 -0.78 -0.10 0.00 -1.82 0.00 0.00 70.33 68.07 2vak n THR 273 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2vak s GLN 274 N -2.15 1.16 0.19 -2.82 -2.07 -1.24 -4.80 119.66 107.94 2vak s GLN 274 Ca -0.03 -1.56 -0.30 0.00 -1.82 0.00 0.00 55.36 51.65 2vak s GLN 274 Cb 0.02 0.28 -0.08 0.00 -1.09 0.00 0.00 33.01 32.13 2vak s GLN 274 CO 0.23 -0.38 1.23 0.50 -1.32 0.00 0.00 175.29 175.56 2vak s ARG 275 N -4.13 4.46 -0.02 9.60 3.52 -1.26 -4.30 118.95 126.82 2vak s ARG 275 Ca 0.35 1.93 0.07 0.00 -0.13 0.00 0.00 55.73 57.95 2vak s ARG 275 Cb 0.07 -3.22 -0.02 0.00 -1.56 0.00 0.00 34.95 30.22 2vak s ARG 275 CO 0.10 -0.14 -0.23 -1.01 -0.81 0.00 0.00 175.30 173.21 2vak s HIS 276 N -0.04 2.05 -0.03 5.12 3.76 0.40 -5.00 115.29 121.56 2vak s HIS 276 Ca 0.54 -0.42 -0.02 0.00 -0.15 0.00 0.00 55.06 55.00 2vak s HIS 276 Cb -0.34 -1.33 0.01 0.00 1.11 0.00 0.00 32.58 32.03 2vak s HIS 276 CO 0.37 -0.06 0.07 0.12 -0.85 0.00 0.00 174.74 174.40 2vak s PHE 277 N -0.46 -0.08 0.04 1.40 5.36 -1.26 -1.38 117.98 121.60 2vak s PHE 277 Ca 0.07 0.20 -0.14 0.00 -0.96 0.00 0.00 56.93 56.10 2vak s PHE 277 Cb -0.09 0.02 0.02 0.00 -0.34 0.00 0.00 43.02 42.62 2vak s PHE 277 CO -0.00 -0.04 0.30 0.00 -1.46 0.00 0.00 175.22 174.02 2vak s ALA 278 N 0.09 -0.69 -0.13 11.12 0.00 -0.16 -5.01 121.76 126.99 2vak s ALA 278 Ca -0.00 0.02 -0.11 0.00 0.00 0.00 0.00 51.96 51.86 2vak s ALA 278 Cb -0.01 0.31 -0.05 0.00 0.00 0.00 0.00 23.12 23.37 2vak s ALA 278 CO -0.00 -0.40 0.23 0.71 0.00 0.00 0.00 175.76 176.30 2vak s TYR 279 N -2.48 3.53 -0.04 0.00 2.02 -1.26 -0.93 117.35 118.19 2vak s TYR 279 Ca -0.05 0.58 -0.01 0.00 -0.37 0.00 0.00 57.07 57.22 2vak s TYR 279 Cb -0.01 -2.18 0.03 0.00 -0.40 0.00 0.00 41.96 39.40 2vak s TYR 279 CO -0.03 0.46 0.02 0.08 -1.57 0.00 0.00 175.55 174.51 2vak s VAL 280 N -0.22 0.11 0.26 0.71 1.01 -0.83 -0.98 120.40 120.45 2vak s VAL 280 Ca 0.15 0.23 0.10 0.00 0.00 0.00 0.00 61.98 62.46 2vak s VAL 280 Cb -0.13 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.93 2vak s VAL 280 CO 0.04 0.18 -0.02 0.00 0.00 0.00 0.00 175.10 175.30 2vak s ALA 282 N -2.29 3.39 -0.02 0.00 0.00 -1.06 -1.08 121.76 120.70 2vak s ALA 282 Ca 0.31 0.19 -0.20 0.00 0.00 0.00 0.00 51.96 52.26 2vak s ALA 282 Cb -0.06 -3.21 -0.30 0.00 0.00 0.00 0.00 23.12 19.55 2vak s ALA 282 CO 0.19 -0.43 0.97 -0.09 0.00 0.00 0.00 175.76 176.40 2vak h ARG 283 N 7.06 0.37 -6.65 0.00 2.43 -0.38 0.11 114.38 117.31 2vak h ARG 283 Ca -0.35 -0.55 -0.50 0.00 -0.81 0.00 0.00 59.98 57.77 2vak h ARG 283 Cb 1.17 0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.88 2vak h ARG 283 CO 0.80 1.24 0.08 -1.54 -1.51 0.00 0.00 179.97 179.05 2vak s SER 284 N -7.01 6.85 0.59 -3.80 1.04 -1.25 -4.45 113.70 105.69 2vak s SER 284 Ca -0.13 1.30 0.37 0.00 0.48 0.00 0.00 55.95 57.97 2vak s SER 284 Cb 0.02 -2.38 1.77 0.00 0.10 0.00 0.00 66.02 65.53 2vak s SER 284 CO 0.85 -0.12 2.14 -0.65 0.98 0.00 0.00 173.24 176.44 2vak h PRO 285 N 2.67 0.00 0.00 4.02 0.11 -1.92 -2.53 132.00 134.35 2vak h PRO 285 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2vak h PRO 285 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2vak h PRO 285 CO 0.65 0.02 0.00 -0.40 -0.21 0.00 0.00 178.00 178.06 2vak n ASP 286 N -3.15 0.00 -0.05 -2.05 5.68 -1.26 -1.50 116.55 114.22 2vak n ASP 286 Ca -0.01 0.09 0.07 0.00 -0.50 0.00 0.00 54.79 54.44 2vak n ASP 286 Cb 0.21 -0.12 0.44 0.00 -1.14 0.00 0.00 41.12 40.52 2vak n ASP 286 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 2vak h TRP 287 N 0.00 0.51 -1.10 2.11 5.08 -1.83 -1.86 115.95 118.86 2vak h TRP 287 Ca 0.00 0.01 0.32 0.00 1.08 0.00 0.00 58.89 60.30 2vak h TRP 287 Cb 0.00 -0.17 -0.04 0.00 -3.00 0.00 0.00 29.16 25.95 2vak h TRP 287 CO 0.00 0.29 0.86 -0.91 -1.28 0.00 0.00 178.44 177.40 2vak h ASN 288 N 0.52 0.00 -0.01 0.11 2.35 -1.54 -0.27 115.58 116.74 2vak h ASN 288 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2vak h ASN 288 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2vak h ASN 288 CO -0.05 0.00 -0.28 0.55 -1.65 0.00 0.00 177.43 176.00 2vak n VAL 289 N -4.01 0.00 -3.09 2.81 3.14 -0.71 -0.98 118.33 115.49 2vak n VAL 289 Ca 0.24 -0.36 -0.45 0.00 -2.96 0.00 0.00 64.34 60.81 2vak n VAL 289 Cb 1.22 1.23 -0.03 0.00 -1.06 0.00 0.00 33.84 35.19 2vak n VAL 289 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2vak s ASP 290 N -1.84 6.40 0.48 6.55 -1.08 -0.11 -4.88 116.67 122.18 2vak s ASP 290 Ca 0.15 -1.79 0.18 0.00 -0.52 0.00 0.00 52.55 50.57 2vak s ASP 290 Cb 0.14 -2.32 1.17 0.00 -1.46 0.00 0.00 42.92 40.45 2vak s ASP 290 CO 0.38 -1.03 2.05 0.11 0.52 0.00 0.00 175.17 177.20 2vak h LYS 291 N 8.87 0.00 -0.03 4.34 1.57 -1.90 -2.08 116.57 127.34 2vak h LYS 291 Ca -0.11 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.50 2vak h LYS 291 Cb 1.06 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.38 2vak h LYS 291 CO 1.04 0.13 -0.65 0.77 -0.57 0.00 0.00 179.45 180.18 2vak h SER 292 N 0.00 0.62 -0.41 0.86 0.02 -1.96 -1.49 113.55 111.18 2vak h SER 292 Ca -0.00 -0.73 -0.02 0.00 -0.84 0.00 0.00 61.79 60.20 2vak h SER 292 Cb 0.24 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 2vak h SER 292 CO 0.02 1.26 0.19 -0.25 -1.14 0.00 0.00 176.83 176.91 2vak h TRP 293 N 0.04 0.64 0.18 3.45 2.91 -1.85 -1.86 115.95 119.46 2vak h TRP 293 Ca -0.07 -0.02 -0.31 0.00 1.13 0.00 0.00 58.89 59.62 2vak h TRP 293 Cb 1.33 -0.20 0.02 0.00 -0.51 0.00 0.00 29.16 29.80 2vak h TRP 293 CO 0.13 0.50 -1.39 0.82 -1.03 0.00 0.00 178.44 177.47 2vak h ILE 294 N 0.65 1.36 -0.74 2.65 2.04 -1.40 -2.46 117.51 119.60 2vak h ILE 294 Ca 0.16 -2.88 -0.05 0.00 1.00 0.00 0.00 64.86 63.09 2vak h ILE 294 Cb 0.11 2.95 -0.03 0.00 -0.74 0.00 0.00 36.82 39.12 2vak h ILE 294 CO -0.02 0.85 0.28 0.00 0.00 0.00 0.00 178.15 179.26 2vak h ALA 295 N 0.39 0.97 0.00 1.87 0.00 -1.11 -1.78 119.26 119.60 2vak h ALA 295 Ca -0.20 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 2vak h ALA 295 Cb 2.06 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 2vak h ALA 295 CO 0.23 0.61 -0.12 0.00 0.00 0.00 0.00 179.25 179.97 2vak h ALA 296 N 1.14 1.05 0.00 0.00 0.00 -1.33 -2.58 119.26 117.54 2vak h ALA 296 Ca 0.24 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 54.84 2vak h ALA 296 Cb 0.24 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2vak h ALA 296 CO -0.02 0.14 -1.04 0.00 0.00 0.00 0.00 179.25 178.34 2vak h ALA 297 N 1.88 0.43 -0.35 0.00 0.00 -1.26 -2.41 119.26 117.55 2vak h ALA 297 Ca -0.00 -0.93 -0.05 0.00 0.00 0.00 0.00 54.91 53.93 2vak h ALA 297 Cb 0.57 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2vak h ALA 297 CO 0.02 1.23 0.02 -0.91 0.00 0.00 0.00 179.25 179.61 2vak h ASN 298 N 0.00 0.58 0.28 0.00 2.35 -1.10 -2.86 115.58 114.83 2vak h ASN 298 Ca -0.04 -0.29 -0.12 0.00 -0.55 0.00 0.00 56.30 55.30 2vak h ASN 298 Cb 1.76 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 39.96 2vak h ASN 298 CO 0.12 0.73 -0.48 -0.07 -1.65 0.00 0.00 177.43 176.07 2vak h LEU 299 N 0.42 0.25 -0.75 1.61 3.38 -1.51 -3.01 115.31 115.69 2vak h LEU 299 Ca 0.10 -0.12 0.03 0.00 0.09 0.00 0.00 57.88 57.98 2vak h LEU 299 Cb 0.41 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 2vak h LEU 299 CO 0.01 0.70 0.47 0.74 0.09 0.00 0.00 178.44 180.46 2vak h THR 300 N 0.19 1.10 0.00 0.22 2.02 -1.45 0.47 112.91 115.46 2vak h THR 300 Ca 0.01 -0.32 -0.10 0.00 0.77 0.00 0.00 66.41 66.77 2vak h THR 300 Cb 0.92 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 2vak h THR 300 CO 0.07 0.17 -0.48 0.00 0.37 0.00 0.00 175.52 175.66 2vak h ALA 301 N 1.32 1.13 -0.10 6.16 0.00 -1.41 0.20 119.26 126.57 2vak h ALA 301 Ca 0.30 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 2vak h ALA 301 Cb 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2vak h ALA 301 CO -0.11 0.60 -0.20 0.82 0.00 0.00 0.00 179.25 180.35 2vak h ILE 302 N 0.00 1.40 -0.36 0.00 2.04 -1.33 -0.88 117.51 118.38 2vak h ILE 302 Ca -0.00 -1.50 0.02 0.00 1.00 0.00 0.00 64.86 64.38 2vak h ILE 302 Cb 0.89 2.13 -0.03 0.00 -0.74 0.00 0.00 36.82 39.07 2vak h ILE 302 CO 0.06 0.43 0.19 0.58 0.00 0.00 0.00 178.15 179.41 2vak h VAL 303 N -0.14 1.00 0.00 1.67 2.07 -0.82 -2.95 116.25 117.09 2vak h VAL 303 Ca 0.00 -0.13 -0.10 0.00 0.82 0.00 0.00 66.70 67.29 2vak h VAL 303 Cb 0.80 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 2vak h VAL 303 CO 0.05 0.07 -0.48 0.24 0.02 0.00 0.00 177.57 177.47 2vak h MET 304 N 0.39 0.00 -0.13 1.57 2.86 -0.63 -3.20 114.93 115.78 2vak h MET 304 Ca 0.15 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2vak h MET 304 Cb 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 2vak h MET 304 CO -0.09 0.48 -0.12 0.00 1.06 0.00 0.00 176.91 178.24 2vak h ALA 305 N 1.52 1.55 -0.01 6.32 0.00 -0.98 -3.21 119.26 124.45 2vak h ALA 305 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2vak h ALA 305 Cb 0.96 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2vak h ALA 305 CO 0.06 0.33 -0.24 0.00 0.00 0.00 0.00 179.25 179.39 2vak s ARG 307 N -2.48 1.86 -0.47 0.00 1.70 -1.21 -3.31 118.95 115.04 2vak s ARG 307 Ca 0.25 -2.12 -0.19 0.00 -0.47 0.00 0.00 55.73 53.20 2vak s ARG 307 Cb 0.19 -0.37 0.04 0.00 -0.57 0.00 0.00 34.95 34.24 2vak s ARG 307 CO 0.51 -0.51 0.58 -0.65 -1.08 0.00 0.00 175.30 174.15 2vak s GLN 308 N -3.67 3.15 0.80 3.89 -1.52 -0.68 -4.15 119.66 117.48 2vak s GLN 308 Ca 0.28 -0.75 -0.11 0.00 -1.95 0.00 0.00 55.36 52.84 2vak s GLN 308 Cb 0.03 -4.03 0.09 0.00 -0.22 0.00 0.00 33.01 28.87 2vak s GLN 308 CO 0.17 -1.08 1.15 -1.25 -0.25 0.00 0.00 175.29 174.03 2vak s PRO 309 N 2.54 1.84 0.18 2.91 0.04 -1.26 -4.81 135.00 136.44 2vak s PRO 309 Ca 0.16 -0.09 -0.33 0.00 0.04 0.00 0.00 61.00 60.78 2vak s PRO 309 Cb -0.18 -2.00 -0.15 0.00 0.04 0.00 0.00 34.50 32.21 2vak s PRO 309 CO 0.14 -1.61 1.35 -2.30 0.04 0.00 0.00 177.00 174.62 2vak n PRO 310 N -3.26 1.65 -2.21 0.56 -0.02 -1.26 -4.95 135.00 125.51 2vak n PRO 310 Ca 0.09 0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 61.75 2vak n PRO 310 Cb 0.61 -2.21 -0.03 0.00 -0.02 0.00 0.00 33.50 31.84 2vak n PRO 310 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2vak s VAL 311 N 0.16 2.95 0.51 -1.45 1.01 -1.26 -4.90 120.40 117.42 2vak s VAL 311 Ca 0.74 0.93 -0.21 0.00 0.00 0.00 0.00 61.98 63.45 2vak s VAL 311 Cb -0.77 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 31.95 2vak s VAL 311 CO 0.48 0.21 1.12 -0.36 0.00 0.00 0.00 175.10 176.55 2vak s PHE 312 N -0.99 2.80 0.36 5.22 0.08 0.36 -0.77 117.98 125.04 2vak s PHE 312 Ca 0.49 1.55 -0.28 0.00 0.12 0.00 0.00 56.93 58.81 2vak s PHE 312 Cb -0.38 -3.26 -0.11 0.00 -0.57 0.00 0.00 43.02 38.70 2vak s PHE 312 CO 0.48 -1.38 1.47 0.00 -0.10 0.00 0.00 175.22 175.70 2vak s ALA 313 N -1.75 3.58 0.44 5.36 0.00 0.86 -1.35 121.76 128.90 2vak s ALA 313 Ca 0.69 1.53 0.21 0.00 0.00 0.00 0.00 51.96 54.39 2vak s ALA 313 Cb -0.24 -3.60 1.18 0.00 0.00 0.00 0.00 23.12 20.46 2vak s ALA 313 CO 0.28 -1.00 1.84 -0.91 0.00 0.00 0.00 175.76 175.97 2vak h ASN 314 N 3.26 0.33 0.08 0.00 2.35 -1.81 -0.88 115.58 118.91 2vak h ASN 314 Ca -0.50 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.26 2vak h ASN 314 Cb 1.24 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.58 2vak h ASN 314 CO 0.66 0.11 -0.11 1.56 -1.65 0.00 0.00 177.43 178.00 2vak h GLN 315 N 0.32 0.07 0.00 0.81 4.20 -1.91 -3.00 115.11 115.59 2vak h GLN 315 Ca 0.50 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.20 2vak h GLN 315 Cb 1.39 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.16 2vak h GLN 315 CO -0.17 0.18 0.00 0.41 -0.67 0.00 0.00 178.83 178.58 2vak n GLY 316 N -1.14 -1.38 3.33 3.46 0.00 -0.34 -4.86 105.19 104.27 2vak n GLY 316 Ca -0.02 -0.05 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 2vak n GLY 316 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vak s VAL 317 N -3.05 1.79 0.83 1.61 -7.23 -1.14 -4.52 120.40 108.69 2vak s VAL 317 Ca 0.10 -1.92 -0.12 0.00 -1.81 0.00 0.00 61.98 58.23 2vak s VAL 317 Cb 0.14 -1.83 0.10 0.00 0.56 0.00 0.00 36.38 35.34 2vak s VAL 317 CO 0.46 -0.33 1.18 0.27 -0.31 0.00 0.00 175.10 176.37 2vak s ILE 318 N -2.09 2.13 0.22 -0.62 -4.36 -0.57 -4.80 121.20 111.10 2vak s ILE 318 Ca 0.16 0.05 -0.10 0.00 -0.26 0.00 0.00 60.65 60.50 2vak s ILE 318 Cb -0.05 -2.35 0.20 0.00 1.25 0.00 0.00 42.46 41.50 2vak s ILE 318 CO 0.06 -0.05 1.67 0.78 0.24 0.00 0.00 174.94 177.65 2vak h ASN 319 N -1.16 -0.20 0.63 4.36 2.35 -1.92 0.59 115.58 120.23 2vak h ASN 319 Ca -0.45 0.15 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 2vak h ASN 319 Cb 1.28 0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.90 2vak h ASN 319 CO 0.45 -0.09 0.00 1.56 -1.65 0.00 0.00 177.43 177.70 2vak h GLN 320 N 0.15 0.00 -0.03 0.81 7.50 -1.93 -1.76 115.11 119.86 2vak h GLN 320 Ca 0.33 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.48 2vak h GLN 320 Cb 0.54 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.07 2vak h GLN 320 CO -0.51 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 176.82 2vak n ALA 321 N -1.91 2.56 -1.85 3.87 0.00 0.19 -4.94 120.51 118.44 2vak n ALA 321 Ca 0.00 -0.48 -0.35 0.00 0.00 0.00 0.00 53.44 52.61 2vak n ALA 321 Cb 0.21 -1.12 -0.07 0.00 0.00 0.00 0.00 19.45 18.47 2vak n ALA 321 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2vak s GLN 322 N -1.98 4.38 -0.94 0.00 -0.21 -0.66 -4.15 119.66 116.10 2vak s GLN 322 Ca 0.37 1.17 -0.03 0.00 0.02 0.00 0.00 55.36 56.88 2vak s GLN 322 Cb 0.21 -2.54 0.00 0.00 1.00 0.00 0.00 33.01 31.67 2vak s GLN 322 CO 0.33 0.16 0.37 0.09 -2.12 0.00 0.00 175.29 174.12 2vak n ASN 323 N 0.05 -4.30 -4.44 5.90 3.02 -1.23 -4.99 115.26 109.28 2vak n ASN 323 Ca 0.04 -0.17 -0.44 0.00 -0.03 0.00 0.00 54.58 53.98 2vak n ASN 323 Cb 0.52 -3.18 -0.07 0.00 -0.61 0.00 0.00 39.78 36.44 2vak n ASN 323 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2vak s ARG 324 N -5.23 3.07 0.10 3.52 6.06 -1.12 -4.97 118.95 120.38 2vak s ARG 324 Ca 0.18 -0.99 -0.36 0.00 -2.50 0.00 0.00 55.73 52.07 2vak s ARG 324 Cb -0.08 -4.07 -0.17 0.00 0.06 0.00 0.00 34.95 30.69 2vak s ARG 324 CO 0.22 -1.06 1.17 -2.30 -2.50 0.00 0.00 175.30 170.83 2vak n PRO 325 N 5.72 0.80 0.00 5.12 -0.02 -1.26 -0.23 135.00 145.13 2vak n PRO 325 Ca -0.08 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2vak n PRO 325 Cb 0.45 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 2vak n PRO 325 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vak n GLY 326 N 2.08 2.44 0.89 -1.23 0.00 -1.26 -4.77 105.19 103.33 2vak n GLY 326 Ca 0.18 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.17 2vak n GLY 326 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2vak n PHE 327 N -2.00 0.00 -3.83 1.61 7.35 0.68 -4.70 117.46 116.56 2vak n PHE 327 Ca 0.00 0.00 -0.12 0.00 -0.76 0.00 0.00 57.45 56.57 2vak n PHE 327 Cb 0.00 -0.11 -0.11 0.00 0.35 0.00 0.00 39.48 39.61 2vak n PHE 327 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 2vak s SER 328 N -5.71 -0.10 0.02 -2.13 1.04 -0.42 -0.49 113.70 105.91 2vak s SER 328 Ca -0.05 0.12 -0.29 0.00 0.48 0.00 0.00 55.95 56.21 2vak s SER 328 Cb 0.01 0.31 0.10 0.00 0.10 0.00 0.00 66.02 66.54 2vak s SER 328 CO 0.07 -0.22 1.02 0.00 0.98 0.00 0.00 173.24 175.09 2vak s MET 329 N -0.62 0.80 0.22 4.02 0.23 -0.46 -2.80 119.30 120.68 2vak s MET 329 Ca -0.07 -0.38 -0.30 0.00 -1.03 0.00 0.00 55.69 53.91 2vak s MET 329 Cb -0.04 0.31 -0.10 0.00 -1.53 0.00 0.00 34.83 33.47 2vak s MET 329 CO 0.01 -0.36 1.45 -0.80 -2.03 0.00 0.00 175.02 173.29 2vak s ASN 330 N -2.67 6.68 -0.50 -1.18 0.01 -1.26 -1.88 114.94 114.14 2vak s ASN 330 Ca 0.09 2.60 0.00 0.00 -0.71 0.00 0.00 52.86 54.84 2vak s ASN 330 Cb -0.00 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 39.05 2vak s ASN 330 CO -0.04 -0.70 0.00 0.61 -1.51 0.00 0.00 177.10 175.46 2vak n GLY 331 N 2.63 0.74 3.57 0.66 0.00 -1.26 -4.98 105.19 106.55 2vak n GLY 331 Ca 0.08 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 2vak n GLY 331 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vak s GLY 332 N -2.76 1.56 0.13 -0.02 0.00 -0.79 -4.92 107.32 100.53 2vak s GLY 332 Ca 0.00 -0.90 -0.31 0.00 0.00 0.00 0.00 44.72 43.51 2vak s GLY 332 CO 0.00 -0.02 1.73 -1.59 0.00 0.00 0.00 173.10 173.22 2vak s THR 333 N -2.93 2.60 0.68 0.90 2.01 0.05 -3.99 115.64 114.96 2vak s THR 333 Ca 0.70 0.22 -0.16 0.00 0.31 0.00 0.00 61.69 62.76 2vak s THR 333 Cb -0.11 -3.14 0.01 0.00 0.01 0.00 0.00 72.50 69.28 2vak s THR 333 CO 0.56 0.00 1.17 -2.84 -0.69 0.00 0.00 174.62 172.83 2vak s PRO 334 N 2.25 2.52 -0.47 4.92 0.02 -1.26 -0.10 135.00 142.89 2vak s PRO 334 Ca 0.77 1.65 -0.12 0.00 0.02 0.00 0.00 61.00 63.31 2vak s PRO 334 Cb -0.45 -1.89 0.09 0.00 0.02 0.00 0.00 34.50 32.28 2vak s PRO 334 CO 0.34 -1.52 0.36 0.08 -0.33 0.00 0.00 177.00 175.93 2vak s VAL 335 N -2.03 4.71 0.75 3.83 1.01 -1.26 -4.06 120.40 123.35 2vak s VAL 335 Ca 0.72 -1.38 -0.11 0.00 0.00 0.00 0.00 61.98 61.22 2vak s VAL 335 Cb -0.26 -3.92 0.04 0.00 0.00 0.00 0.00 36.38 32.24 2vak s VAL 335 CO 0.41 -0.64 1.08 -1.00 0.00 0.00 0.00 175.10 174.96 2vak s HIS 336 N 1.51 2.71 0.01 5.22 3.76 -0.15 -4.89 115.29 123.45 2vak s HIS 336 Ca 0.04 1.52 0.01 0.00 -0.15 0.00 0.00 55.06 56.48 2vak s HIS 336 Cb -0.25 -3.01 -0.01 0.00 1.11 0.00 0.00 32.58 30.42 2vak s HIS 336 CO 0.03 -1.66 -0.04 -1.83 -0.85 0.00 0.00 174.74 170.40 2vak s GLU 337 N -4.92 0.28 -0.14 1.40 -1.05 -1.26 -0.54 118.70 112.48 2vak s GLU 337 Ca 0.60 -0.27 0.00 0.00 -0.15 0.00 0.00 54.97 55.16 2vak s GLU 337 Cb -0.16 -0.18 0.02 0.00 -0.44 0.00 0.00 34.13 33.37 2vak s GLU 337 CO 0.55 0.04 -0.13 -0.51 0.95 0.00 0.00 175.26 176.16 2vak s LEU 338 N -0.50 1.61 -0.02 1.83 1.43 -0.24 -3.67 118.68 119.12 2vak s LEU 338 Ca -0.03 -0.45 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 2vak s LEU 338 Cb -0.04 -1.12 -0.05 0.00 0.03 0.00 0.00 46.19 45.02 2vak s LEU 338 CO -0.00 -0.06 1.30 0.21 0.23 0.00 0.00 176.35 178.03 2vak s ASN 339 N 1.46 6.96 0.27 2.29 3.84 -1.26 0.41 114.94 128.91 2vak s ASN 339 Ca 0.04 1.98 0.12 0.00 0.21 0.00 0.00 52.86 55.20 2vak s ASN 339 Cb -0.13 -2.56 0.33 0.00 -0.55 0.00 0.00 41.25 38.34 2vak s ASN 339 CO -0.09 -0.64 1.58 -0.07 -2.79 0.00 0.00 177.10 175.09 2vak h LEU 340 N 8.15 0.00 0.06 3.21 3.38 -1.95 -2.42 115.31 125.74 2vak h LEU 340 Ca -0.36 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.60 2vak h LEU 340 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2vak h LEU 340 CO 0.89 0.61 -0.03 0.25 0.09 0.00 0.00 178.44 180.25 2vak h LEU 341 N 0.00 -0.07 -1.96 1.67 5.85 -1.96 -2.46 115.31 116.37 2vak h LEU 341 Ca -0.01 -0.53 0.28 0.00 0.84 0.00 0.00 57.88 58.46 2vak h LEU 341 Cb 1.16 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 2vak h LEU 341 CO 0.08 0.54 0.73 0.74 -0.34 0.00 0.00 178.44 180.19 2vak h THR 342 N -0.74 0.45 0.06 1.05 2.02 -1.96 -1.96 112.91 111.83 2vak h THR 342 Ca -0.01 0.00 -0.29 0.00 0.77 0.00 0.00 66.41 66.88 2vak h THR 342 Cb 0.60 0.48 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 2vak h THR 342 CO 0.01 0.00 -1.53 0.74 0.37 0.00 0.00 175.52 175.11 2vak h THR 343 N 0.00 1.11 -0.76 3.16 2.02 -1.39 -2.76 112.91 114.29 2vak h THR 343 Ca 0.46 -2.84 -0.02 0.00 0.77 0.00 0.00 66.41 64.78 2vak h THR 343 Cb 1.92 2.64 -0.04 0.00 -1.74 0.00 0.00 68.15 70.94 2vak h THR 343 CO -0.00 0.74 0.39 0.00 0.37 0.00 0.00 175.52 177.01 2vak h ALA 344 N 0.71 0.97 -0.43 6.16 0.00 -0.88 0.11 119.26 125.91 2vak h ALA 344 Ca -0.23 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.43 2vak h ALA 344 Cb 1.97 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 2vak h ALA 344 CO 0.12 0.52 -0.15 1.96 0.00 0.00 0.00 179.25 181.70 2vak h GLN 345 N 1.06 0.86 -0.26 0.00 4.20 -1.48 -1.35 115.11 118.14 2vak h GLN 345 Ca 0.26 -0.35 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 2vak h GLN 345 Cb 0.08 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2vak h GLN 345 CO -0.04 0.99 0.02 0.93 -0.67 0.00 0.00 178.83 180.07 2vak h GLU 346 N 0.69 0.44 -0.52 1.46 4.39 -1.46 -1.55 114.58 118.03 2vak h GLU 346 Ca 0.10 -0.13 0.10 0.00 0.34 0.00 0.00 59.36 59.78 2vak h GLU 346 Cb 0.70 -0.05 -0.09 0.00 -0.10 0.00 0.00 28.75 29.22 2vak h GLU 346 CO 0.05 0.59 -0.02 0.00 -1.16 0.00 0.00 179.01 178.47 2vak h ILE 348 N 0.10 1.17 -0.62 0.00 2.04 -1.21 -2.20 117.51 116.78 2vak h ILE 348 Ca 0.26 -0.49 0.09 0.00 1.00 0.00 0.00 64.86 65.71 2vak h ILE 348 Cb 0.40 1.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.41 2vak h ILE 348 CO -0.45 0.17 0.27 -0.09 0.00 0.00 0.00 178.15 178.05 2vak h ARG 349 N 0.29 0.46 -0.93 2.37 2.43 -1.01 -0.09 114.38 117.90 2vak h ARG 349 Ca 0.09 -0.03 0.15 0.00 -0.81 0.00 0.00 59.98 59.38 2vak h ARG 349 Cb 0.16 -0.10 -0.08 0.00 -0.42 0.00 0.00 29.97 29.53 2vak h ARG 349 CO -0.01 0.31 0.59 1.96 -1.51 0.00 0.00 179.97 181.31 2vak h GLN 350 N 0.47 0.71 -0.08 0.20 1.08 -0.91 -1.38 115.11 115.21 2vak h GLN 350 Ca 0.31 -0.04 -0.16 0.00 -1.45 0.00 0.00 58.65 57.30 2vak h GLN 350 Cb 0.34 -0.16 0.01 0.00 -0.05 0.00 0.00 27.48 27.62 2vak h GLN 350 CO -0.27 0.47 -0.57 -1.49 -0.95 0.00 0.00 178.83 176.01 2vak h TRP 351 N 0.73 0.73 -0.45 2.96 6.55 -0.51 -2.38 115.95 123.57 2vak h TRP 351 Ca 0.48 -0.34 0.08 0.00 0.95 0.00 0.00 58.89 60.06 2vak h TRP 351 Cb 0.74 -0.10 -0.07 0.00 -0.86 0.00 0.00 29.16 28.87 2vak h TRP 351 CO -0.00 1.13 0.03 0.28 -1.05 0.00 0.00 178.44 178.83 2vak h VAL 352 N 0.11 0.69 -0.07 1.49 2.07 -0.97 0.23 116.25 119.80 2vak h VAL 352 Ca -0.05 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 2vak h VAL 352 Cb 1.23 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 2vak h VAL 352 CO 0.12 0.03 -0.24 0.24 0.02 0.00 0.00 177.57 177.73 2vak h MET 353 N 0.15 0.12 -0.26 1.57 2.86 -1.21 -2.53 114.93 115.63 2vak h MET 353 Ca 0.22 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.83 2vak h MET 353 Cb 0.31 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.96 2vak h MET 353 CO -0.34 0.36 0.00 0.00 1.06 0.00 0.00 176.91 177.99 2vak n ALA 354 N -2.49 2.48 -2.94 6.32 0.00 -0.90 -4.92 120.51 118.07 2vak n ALA 354 Ca -0.02 -0.57 -0.22 0.00 0.00 0.00 0.00 53.44 52.63 2vak n ALA 354 Cb 0.33 -1.03 0.03 0.00 0.00 0.00 0.00 19.45 18.77 2vak n ALA 354 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vak n GLY 355 N 1.10 -0.52 0.09 0.00 0.00 -0.95 -4.88 105.19 100.02 2vak n GLY 355 Ca 0.14 0.11 0.08 0.00 0.00 0.00 0.00 46.02 46.36 2vak n GLY 355 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vak n LEU 356 N -3.87 0.66 -4.08 0.99 4.77 0.78 -4.88 117.00 111.37 2vak n LEU 356 Ca -0.13 0.26 -0.10 0.00 -0.03 0.00 0.00 56.01 56.01 2vak n LEU 356 Cb 0.63 -0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.61 2vak n LEU 356 CO 0.45 -0.06 -0.38 0.68 -1.33 0.00 0.00 177.39 176.74 2vak s VAL 357 N -3.28 0.44 1.11 4.08 -7.23 -1.14 -4.99 120.40 109.39 2vak s VAL 357 Ca -0.03 -1.44 -0.14 0.00 -1.81 0.00 0.00 61.98 58.56 2vak s VAL 357 Cb 0.10 -1.04 0.24 0.00 0.56 0.00 0.00 36.38 36.25 2vak s VAL 357 CO 0.82 -0.67 1.07 -0.94 -0.31 0.00 0.00 175.10 175.07 2vak s SER 358 N -2.25 1.63 0.23 4.85 1.04 -1.26 -4.34 113.70 113.60 2vak s SER 358 Ca -0.01 1.14 -0.05 0.00 0.48 0.00 0.00 55.95 57.51 2vak s SER 358 Cb -0.02 -1.77 0.24 0.00 0.10 0.00 0.00 66.02 64.57 2vak s SER 358 CO -0.03 -3.75 1.74 0.00 0.98 0.00 0.00 173.24 172.18 2vak h ALA 359 N -2.31 1.04 -0.21 5.32 0.00 -1.99 -2.01 119.26 119.10 2vak h ALA 359 Ca -0.55 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.08 2vak h ALA 359 Cb 1.33 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 2vak h ALA 359 CO 0.51 0.61 0.01 0.00 0.00 0.00 0.00 179.25 180.39 2vak h ALA 360 N 1.19 0.28 -0.30 0.00 0.00 -2.00 -1.89 119.26 116.53 2vak h ALA 360 Ca 0.18 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2vak h ALA 360 Cb 0.41 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2vak h ALA 360 CO 0.01 -0.03 -0.07 -0.22 0.00 0.00 0.00 179.25 178.94 2vak h LYS 361 N 0.13 0.49 -0.54 0.00 3.64 -1.93 -2.01 116.57 116.34 2vak h LYS 361 Ca 0.06 -0.12 0.09 0.00 -1.27 0.00 0.00 60.65 59.41 2vak h LYS 361 Cb 0.36 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.05 2vak h LYS 361 CO 0.01 0.57 0.16 0.78 -2.27 0.00 0.00 179.45 178.70 2vak h GLY 362 N 0.87 0.72 0.76 5.01 0.00 -1.14 -0.58 103.07 108.71 2vak h GLY 362 Ca 0.09 -0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.35 2vak h GLY 362 CO 0.02 -0.04 -0.01 1.46 0.00 0.00 0.00 176.54 177.97 2vak h GLN 363 N 0.32 -0.03 -0.85 4.80 4.20 -1.06 -1.83 115.11 120.67 2vak h GLN 363 Ca 0.27 0.00 0.21 0.00 0.06 0.00 0.00 58.65 59.20 2vak h GLN 363 Cb 0.34 0.01 -0.13 0.00 0.30 0.00 0.00 27.48 28.00 2vak h GLN 363 CO -0.31 0.21 0.26 0.00 -0.67 0.00 0.00 178.83 178.33 2vak h ALA 364 N 0.70 1.24 -0.29 3.87 0.00 -1.21 -0.08 119.26 123.49 2vak h ALA 364 Ca -0.00 0.19 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2vak h ALA 364 Cb 0.26 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2vak h ALA 364 CO 0.01 -0.40 -0.04 -0.07 0.00 0.00 0.00 179.25 178.74 2vak h LEU 365 N 0.27 0.53 -0.51 0.00 3.38 -0.99 -1.33 115.31 116.67 2vak h LEU 365 Ca 0.52 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 2vak h LEU 365 Cb 1.00 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2vak h LEU 365 CO -0.59 0.75 0.23 0.74 0.09 0.00 0.00 178.44 179.66 2vak h THR 366 N 0.31 1.20 -0.70 0.22 2.02 -0.83 -1.18 112.91 113.95 2vak h THR 366 Ca 0.08 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.62 2vak h THR 366 Cb 0.50 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 2vak h THR 366 CO 0.02 0.23 0.28 -0.61 0.37 0.00 0.00 175.52 175.82 2vak h GLN 367 N 0.68 1.04 -0.54 6.66 4.15 -0.96 0.41 115.11 126.54 2vak h GLN 367 Ca 0.17 -0.19 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2vak h GLN 367 Cb 0.15 -0.17 -0.03 0.00 0.21 0.00 0.00 27.48 27.65 2vak h GLN 367 CO -0.02 0.86 0.29 0.93 -1.93 0.00 0.00 178.83 178.96 2vak h GLU 368 N 1.00 0.74 0.11 1.69 5.08 -0.93 -1.64 114.58 120.63 2vak h GLU 368 Ca 0.23 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2vak h GLU 368 Cb 0.20 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2vak h GLU 368 CO -0.02 0.55 -0.06 0.00 -1.00 0.00 0.00 179.01 178.48 2vak h ALA 369 N 1.58 -0.15 -0.91 3.43 0.00 -0.79 -1.80 119.26 120.62 2vak h ALA 369 Ca 0.19 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2vak h ALA 369 Cb 0.02 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2vak h ALA 369 CO -0.03 -0.32 0.60 -0.91 0.00 0.00 0.00 179.25 178.58 2vak h ASN 370 N -0.68 1.03 -0.18 0.00 2.35 -0.95 -0.06 115.58 117.09 2vak h ASN 370 Ca -0.02 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.69 2vak h ASN 370 Cb 0.52 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 2vak h ASN 370 CO 0.03 0.74 0.02 0.44 -1.65 0.00 0.00 177.43 177.00 2vak h ASP 371 N 1.21 0.30 -0.10 5.81 3.45 -1.35 -2.13 116.42 123.60 2vak h ASP 371 Ca 0.34 -0.28 0.01 0.00 0.43 0.00 0.00 57.03 57.52 2vak h ASP 371 Cb -0.11 -0.08 -0.01 0.00 -0.56 0.00 0.00 39.33 38.57 2vak h ASP 371 CO -0.08 0.51 0.05 0.15 -1.57 0.00 0.00 179.24 178.30 2vak h PHE 372 N 0.08 0.09 -0.80 4.55 3.57 -1.06 -2.68 116.94 120.69 2vak h PHE 372 Ca 0.05 0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.67 2vak h PHE 372 Cb 0.34 -0.03 -0.08 0.00 2.79 0.00 0.00 35.95 38.98 2vak h PHE 372 CO 0.03 0.06 0.42 1.03 -2.23 0.00 0.00 178.31 177.62 2vak h SER 373 N 0.11 0.56 -0.80 0.41 0.87 -1.00 -1.20 113.55 112.50 2vak h SER 373 Ca 0.04 0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 2vak h SER 373 Cb 0.00 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 61.90 2vak h SER 373 CO -0.03 0.29 0.53 0.78 -0.53 0.00 0.00 176.83 177.87 2vak h ASN 374 N 0.67 0.92 -0.02 6.23 2.35 -1.13 0.10 115.58 124.71 2vak h ASN 374 Ca 0.41 -0.03 -0.01 0.00 -0.55 0.00 0.00 56.30 56.13 2vak h ASN 374 Cb 0.47 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.61 2vak h ASN 374 CO -0.30 0.67 -0.01 0.25 -1.65 0.00 0.00 177.43 176.39 2vak h LEU 375 N 1.09 0.05 -0.28 1.61 6.46 -0.95 -2.91 115.31 120.38 2vak h LEU 375 Ca 0.29 -0.42 -0.01 0.00 -0.12 0.00 0.00 57.88 57.62 2vak h LEU 375 Cb -0.12 -0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 39.78 2vak h LEU 375 CO -0.06 0.46 0.15 0.40 -0.62 0.00 0.00 178.44 178.77 2vak h ILE 376 N -0.36 1.14 -0.88 4.05 1.08 -1.08 -2.30 117.51 119.16 2vak h ILE 376 Ca 0.01 -0.38 0.17 0.00 -0.39 0.00 0.00 64.86 64.27 2vak h ILE 376 Cb 0.44 0.87 -0.10 0.00 -3.07 0.00 0.00 36.82 34.97 2vak h ILE 376 CO 0.00 0.14 0.44 -0.61 -0.69 0.00 0.00 178.15 177.43 2vak h GLN 377 N 0.33 0.55 0.02 2.37 4.15 -0.87 0.18 115.11 121.84 2vak h GLN 377 Ca 0.10 -0.03 -0.21 0.00 0.77 0.00 0.00 58.65 59.28 2vak h GLN 377 Cb 0.09 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.65 2vak h GLN 377 CO -0.01 0.36 -0.93 0.00 -1.93 0.00 0.00 178.83 176.32 2vak h ALA 378 N 1.61 0.45 0.07 3.38 0.00 -1.36 -1.47 119.26 121.95 2vak h ALA 378 Ca 0.50 -0.75 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2vak h ALA 378 Cb 0.80 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2vak h ALA 378 CO -0.41 0.93 -0.04 0.22 0.00 0.00 0.00 179.25 179.95 2vak h ASP 379 N 0.11 -0.08 -0.59 0.00 1.82 -1.07 -2.43 116.42 114.18 2vak h ASP 379 Ca -0.06 -0.38 -0.02 0.00 -0.39 0.00 0.00 57.03 56.18 2vak h ASP 379 Cb 1.58 0.02 -0.03 0.00 0.68 0.00 0.00 39.33 41.58 2vak h ASP 379 CO 0.14 0.36 0.30 -0.07 -1.61 0.00 0.00 179.24 178.35 2vak h LEU 380 N -0.55 0.78 -1.14 2.28 3.38 -0.74 -2.46 115.31 116.87 2vak h LEU 380 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2vak h LEU 380 Cb 0.46 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2vak h LEU 380 CO 0.02 0.66 0.53 1.23 0.09 0.00 0.00 178.44 180.97 2vak h GLY 381 N 0.95 1.19 0.94 0.83 0.00 -1.25 0.47 103.07 106.20 2vak h GLY 381 Ca 0.21 -0.46 -0.05 0.00 0.00 0.00 0.00 47.33 47.04 2vak h GLY 381 CO -0.03 0.45 0.08 -1.61 0.00 0.00 0.00 176.54 175.44 2vak h GLN 382 N 1.14 0.68 -0.28 4.80 5.75 -1.29 -0.07 115.11 125.84 2vak h GLN 382 Ca 0.30 -0.17 -0.04 0.00 -0.15 0.00 0.00 58.65 58.59 2vak h GLN 382 Cb -0.10 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.36 2vak h GLN 382 CO -0.06 0.71 0.02 0.82 -2.65 0.00 0.00 178.83 177.67 2vak h ILE 383 N 0.54 1.25 -0.88 2.39 2.04 -0.85 -1.85 117.51 120.16 2vak h ILE 383 Ca 0.13 -0.86 -0.01 0.00 1.00 0.00 0.00 64.86 65.12 2vak h ILE 383 Cb 0.35 1.26 -0.04 0.00 -0.74 0.00 0.00 36.82 37.65 2vak h ILE 383 CO 0.01 0.28 0.52 0.50 0.00 0.00 0.00 178.15 179.45 2vak h LYS 384 N 0.28 1.20 -0.02 2.37 3.64 -0.93 0.81 116.57 123.92 2vak h LYS 384 Ca 0.08 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.34 2vak h LYS 384 Cb 0.38 -0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2vak h LYS 384 CO 0.01 0.85 -0.00 0.00 -2.27 0.00 0.00 179.45 178.04 2vak h ALA 385 N 1.28 0.02 0.56 5.00 0.00 -0.87 -0.65 119.26 124.61 2vak h ALA 385 Ca 0.31 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2vak h ALA 385 Cb -0.03 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.76 2vak h ALA 385 CO -0.06 -0.30 -0.27 1.96 0.00 0.00 0.00 179.25 180.58 2vak h GLN 386 N -0.30 -0.73 -0.54 0.00 4.20 -1.37 -2.62 115.11 113.76 2vak h GLN 386 Ca 0.00 0.05 0.11 0.00 0.06 0.00 0.00 58.65 58.87 2vak h GLN 386 Cb 0.34 0.17 -0.09 0.00 0.30 0.00 0.00 27.48 28.20 2vak h GLN 386 CO 0.00 -0.47 0.01 -0.44 -0.67 0.00 0.00 178.83 177.27 2vak h ASP 387 N -0.79 -0.21 -0.08 1.46 5.19 -0.88 0.77 116.42 121.89 2vak h ASP 387 Ca -0.08 0.13 0.02 0.00 -0.62 0.00 0.00 57.03 56.48 2vak h ASP 387 Cb 0.59 0.22 -0.02 0.00 0.18 0.00 0.00 39.33 40.31 2vak h ASP 387 CO 0.13 -0.07 -0.03 0.44 -3.12 0.00 0.00 179.24 176.58 2vak h ASP 388 N 0.13 -0.11 -0.21 6.45 5.19 -1.14 0.17 116.42 126.91 2vak h ASP 388 Ca 0.28 0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.69 2vak h ASP 388 Cb 0.42 0.06 -0.01 0.00 0.18 0.00 0.00 39.33 39.99 2vak h ASP 388 CO -0.44 -0.05 0.02 0.00 -3.12 0.00 0.00 179.24 175.65 2vak h ALA 389 N 1.05 0.28 -0.44 3.45 0.00 -1.20 -2.61 119.26 119.78 2vak h ALA 389 Ca 0.04 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2vak h ALA 389 Cb 0.09 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2vak h ALA 389 CO -0.09 -0.04 -0.01 -0.07 0.00 0.00 0.00 179.25 179.04 2vak h LEU 390 N 0.13 0.69 -0.37 0.00 3.38 -0.76 -0.68 115.31 117.71 2vak h LEU 390 Ca 0.06 -0.16 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2vak h LEU 390 Cb 0.34 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2vak h LEU 390 CO 0.01 0.77 0.05 0.22 0.09 0.00 0.00 178.44 179.58 2vak h TYR 391 N 0.68 0.66 -0.22 1.13 5.03 -0.67 0.87 116.97 124.45 2vak h TYR 391 Ca 0.13 -0.09 -0.08 0.00 2.58 0.00 0.00 58.73 61.26 2vak h TYR 391 Cb 0.44 -0.18 -0.01 0.00 1.55 0.00 0.00 36.73 38.52 2vak h TYR 391 CO 0.02 0.67 -0.23 -0.97 -1.32 0.00 0.00 178.16 176.33 2vak h ASN 392 N 0.46 0.39 0.00 -2.11 -0.73 -1.27 -3.37 115.58 108.94 2vak h ASN 392 Ca 0.11 -0.12 -0.26 0.00 1.87 0.00 0.00 56.30 57.90 2vak h ASN 392 Cb 0.37 -0.11 -0.05 0.00 0.27 0.00 0.00 38.32 38.81 2vak h ASN 392 CO 0.01 0.63 -1.98 0.00 -0.37 0.00 0.00 177.43 175.72 2vak n GLN 393 N -4.15 1.03 -3.60 6.67 6.02 -0.28 -4.95 117.38 118.12 2vak n GLN 393 Ca -0.00 0.05 -0.39 0.00 -0.01 0.00 0.00 57.00 56.65 2vak n GLN 393 Cb 0.38 -1.36 -0.11 0.00 1.02 0.00 0.00 30.24 30.17 2vak n GLN 393 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2vak s GLN 394 N -2.35 3.46 0.27 -1.09 0.74 0.29 -5.06 119.66 115.91 2vak s GLN 394 Ca -0.16 -0.65 -0.31 0.00 0.05 0.00 0.00 55.36 54.29 2vak s GLN 394 Cb 0.05 -3.67 -0.12 0.00 1.10 0.00 0.00 33.01 30.37 2vak s GLN 394 CO 0.48 -0.41 1.61 -2.30 -0.55 0.00 0.00 175.29 174.13 2vak n PRO 395 N 5.04 2.66 -1.06 1.67 -0.02 -1.26 -2.74 135.00 139.29 2vak n PRO 395 Ca -0.13 0.95 -0.02 0.00 -2.02 0.00 0.00 63.50 62.27 2vak n PRO 395 Cb 0.50 -2.74 -0.01 0.00 -0.02 0.00 0.00 33.50 31.23 2vak n PRO 395 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vak n GLY 396 N 2.60 0.56 3.73 -1.23 0.00 -1.26 -5.03 105.19 104.57 2vak n GLY 396 Ca 0.11 -0.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 2vak n GLY 396 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2vak s TYR 397 N -2.05 3.71 -0.29 1.61 5.04 -1.11 -4.63 117.35 119.63 2vak s TYR 397 Ca 0.00 1.69 -0.12 0.00 -2.44 0.00 0.00 57.07 56.20 2vak s TYR 397 Cb 0.00 -3.15 -0.04 0.00 0.35 0.00 0.00 41.96 39.12 2vak s TYR 397 CO 0.00 -0.16 0.25 0.00 -1.34 0.00 0.00 175.55 174.30 2vak s ALA 398 N 0.11 3.53 0.30 3.97 0.00 -1.26 -3.72 121.76 124.69 2vak s ALA 398 Ca 0.49 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 51.10 2vak s ALA 398 Cb -0.25 -2.57 -0.10 0.00 0.00 0.00 0.00 23.12 20.19 2vak s ALA 398 CO 0.31 -0.65 1.26 1.03 0.00 0.00 0.00 175.76 177.71 2vak s ARG 399 N 1.85 4.42 -0.04 0.00 0.52 -0.51 -4.96 118.95 120.23 2vak s ARG 399 Ca 0.09 2.10 0.02 0.00 -0.52 0.00 0.00 55.73 57.43 2vak s ARG 399 Cb -0.16 -3.12 -0.25 0.00 0.52 0.00 0.00 34.95 31.94 2vak s ARG 399 CO 0.11 -0.11 0.68 0.00 0.02 0.00 0.00 175.30 176.00 2vak h ARG 400 N 3.78 0.15 -4.94 3.54 3.08 -1.90 -3.47 114.38 114.62 2vak h ARG 400 Ca -0.48 -0.25 -0.32 0.00 0.07 0.00 0.00 59.98 59.00 2vak h ARG 400 Cb 1.22 0.09 -0.15 0.00 0.08 0.00 0.00 29.97 31.22 2vak h ARG 400 CO 0.68 0.90 -0.67 0.96 -1.07 0.00 0.00 179.97 180.77 2vak s ILE 401 N -2.60 0.88 0.34 2.04 -4.36 -1.26 -4.42 121.20 111.81 2vak s ILE 401 Ca -0.10 -2.01 -0.29 0.00 -0.26 0.00 0.00 60.65 57.99 2vak s ILE 401 Cb 0.07 -2.14 -0.11 0.00 1.25 0.00 0.00 42.46 41.53 2vak s ILE 401 CO 0.82 -0.47 1.53 -0.75 0.24 0.00 0.00 174.94 176.30 2vak s LYS 402 N -3.87 4.12 0.42 0.37 2.20 -1.26 -4.97 119.74 116.75 2vak s LYS 402 Ca 0.24 2.57 -0.26 0.00 -0.36 0.00 0.00 55.97 58.16 2vak s LYS 402 Cb 0.05 -2.99 -0.10 0.00 -1.51 0.00 0.00 37.83 33.28 2vak s LYS 402 CO 0.05 -0.57 1.34 -2.30 -0.36 0.00 0.00 175.35 173.51 2vak n PRO 403 N 1.17 2.11 -4.39 4.03 -0.02 -1.26 -5.03 135.00 131.61 2vak n PRO 403 Ca 0.04 0.75 -0.22 0.00 -2.02 0.00 0.00 63.50 62.05 2vak n PRO 403 Cb 0.39 -2.47 -0.08 0.00 -0.02 0.00 0.00 33.50 31.31 2vak n PRO 403 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2vak s PHE 404 N -1.18 1.73 0.11 6.00 -0.71 -1.26 -5.00 117.98 117.68 2vak s PHE 404 Ca 0.60 -1.47 0.08 0.00 -1.04 0.00 0.00 56.93 55.10 2vak s PHE 404 Cb -0.50 -0.91 -0.04 0.00 -1.21 0.00 0.00 43.02 40.37 2vak s PHE 404 CO 0.59 -0.59 -0.20 0.14 -1.34 0.00 0.00 175.22 173.82 2vak s VAL 405 N -3.38 1.71 0.27 -2.49 -7.23 -1.26 -5.06 120.40 102.95 2vak s VAL 405 Ca 0.33 -1.60 0.21 0.00 -1.81 0.00 0.00 61.98 59.10 2vak s VAL 405 Cb 0.03 -1.59 0.18 0.00 0.56 0.00 0.00 36.38 35.56 2vak s VAL 405 CO 0.21 -0.12 1.86 0.78 -0.31 0.00 0.00 175.10 177.52 2vak h ASN 406 N 3.93 0.00 0.00 4.85 2.35 -2.03 -2.27 115.58 122.41 2vak h ASN 406 Ca -0.45 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 2vak h ASN 406 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2vak h ASN 406 CO 0.42 0.28 0.16 1.23 -1.65 0.00 0.00 177.43 177.87 2vak h GLY 407 N 1.56 0.00 2.00 2.83 0.00 -2.00 -1.80 103.07 105.66 2vak h GLY 407 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vak h GLY 407 CO 0.04 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.80 2vak n ASP 408 N -2.83 0.17 0.07 0.19 8.00 -0.86 -2.49 116.55 118.81 2vak n ASP 408 Ca -0.02 0.57 0.12 0.00 0.71 0.00 0.00 54.79 56.16 2vak n ASP 408 Cb 0.21 -0.59 0.21 0.00 -0.02 0.00 0.00 41.12 40.93 2vak n ASP 408 CO 0.00 0.00 0.00 -0.50 -0.39 0.00 0.00 177.20 176.31 2vak h TRP 409 N 0.00 0.00 -4.26 1.24 4.06 -1.55 -3.32 115.95 112.12 2vak h TRP 409 Ca 0.00 0.00 -0.51 0.00 2.06 0.00 0.00 58.89 60.44 2vak h TRP 409 Cb 0.10 0.00 0.11 0.00 -1.00 0.00 0.00 29.16 28.37 2vak h TRP 409 CO 0.00 0.00 0.35 0.95 -3.56 0.00 0.00 178.44 176.18 2vak s THR 410 N -3.16 3.40 0.44 1.49 -4.23 -1.04 -4.95 115.64 107.59 2vak s THR 410 Ca 0.07 0.55 0.13 0.00 -1.18 0.00 0.00 61.69 61.25 2vak s THR 410 Cb 0.13 -3.07 0.31 0.00 1.34 0.00 0.00 72.50 71.20 2vak s THR 410 CO 0.70 -0.51 2.02 -0.65 -0.54 0.00 0.00 174.62 175.64 2vak h PRO 411 N -0.50 0.37 0.00 3.99 0.11 -1.89 -3.45 132.00 130.63 2vak h PRO 411 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2vak h PRO 411 Cb 1.23 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2vak h PRO 411 CO 0.53 0.25 0.00 0.41 -0.21 0.00 0.00 178.00 178.98 2vak n GLY 412 N -1.52 3.52 2.17 -0.55 0.00 -1.26 -2.30 105.19 105.25 2vak n GLY 412 Ca 0.07 0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.84 2vak n GLY 412 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2vak n MET 413 N 14.00 2.43 -0.16 1.61 1.56 -1.26 -4.62 117.12 130.68 2vak n MET 413 Ca 0.00 -3.18 -0.02 0.00 -0.27 0.00 0.00 57.70 54.23 2vak n MET 413 Cb 0.00 -2.19 0.07 0.00 2.15 0.00 0.00 33.22 33.24 2vak n MET 413 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 2vak h THR 414 N 1.05 0.79 -0.78 1.12 2.02 -1.53 -2.55 112.91 113.02 2vak h THR 414 Ca 0.58 -0.11 0.01 0.00 0.77 0.00 0.00 66.41 67.67 2vak h THR 414 Cb 1.94 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 68.75 2vak h THR 414 CO 1.22 0.06 0.51 0.00 0.37 0.00 0.00 175.52 177.68 2vak h ALA 415 N 1.36 1.00 -0.31 6.16 0.00 -1.87 0.24 119.26 125.83 2vak h ALA 415 Ca 0.25 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2vak h ALA 415 Cb 0.30 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2vak h ALA 415 CO -0.28 0.37 0.16 1.96 0.00 0.00 0.00 179.25 181.47 2vak h GLN 416 N 1.03 0.45 -0.60 0.00 7.50 -1.90 -1.13 115.11 120.46 2vak h GLN 416 Ca 0.29 -0.06 -0.01 0.00 0.50 0.00 0.00 58.65 59.38 2vak h GLN 416 Cb -0.08 -0.08 -0.03 0.00 0.05 0.00 0.00 27.48 27.33 2vak h GLN 416 CO -0.08 0.40 0.34 0.00 -1.50 0.00 0.00 178.83 177.99 2vak h ALA 417 N 1.03 0.76 -0.51 3.87 0.00 -0.90 -1.40 119.26 122.10 2vak h ALA 417 Ca 0.11 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.88 2vak h ALA 417 Cb 0.09 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2vak h ALA 417 CO -0.02 0.27 0.11 -0.07 0.00 0.00 0.00 179.25 179.55 2vak h LEU 418 N 0.81 0.73 0.18 0.00 3.38 -0.45 -1.50 115.31 118.47 2vak h LEU 418 Ca 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2vak h LEU 418 Cb 0.02 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.58 2vak h LEU 418 CO -0.04 0.73 -0.09 0.00 0.09 0.00 0.00 178.44 179.14 2vak h ALA 419 N 1.37 -0.25 -0.08 1.53 0.00 -0.88 -1.81 119.26 119.14 2vak h ALA 419 Ca 0.17 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2vak h ALA 419 Cb 0.30 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2vak h ALA 419 CO -0.00 -0.55 -0.27 0.28 0.00 0.00 0.00 179.25 178.71 2vak h VAL 420 N -0.43 0.37 -0.47 0.00 2.07 -1.19 -2.88 116.25 113.73 2vak h VAL 420 Ca -0.03 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.58 2vak h VAL 420 Cb 0.33 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 2vak h VAL 420 CO 0.04 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.88 2vak h LEU 421 N -0.37 0.23 -1.99 2.57 3.38 -1.25 -1.79 115.31 116.09 2vak h LEU 421 Ca 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2vak h LEU 421 Cb 0.50 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2vak h LEU 421 CO -0.29 0.14 -0.10 0.00 0.09 0.00 0.00 178.44 178.28 2vak h ALA 422 N 1.76 1.33 -0.00 1.53 0.00 -1.09 -2.42 119.26 120.36 2vak h ALA 422 Ca 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2vak h ALA 422 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2vak h ALA 422 CO -0.04 0.13 -0.02 0.25 0.00 0.00 0.00 179.25 179.57 2vak n THR 423 N -3.70 0.00 1.20 0.00 -2.24 -0.67 -4.06 114.28 104.80 2vak n THR 423 Ca -0.02 -0.07 0.14 0.00 -2.27 0.00 0.00 64.05 61.83 2vak n THR 423 Cb 0.21 -0.18 0.62 0.00 -2.10 0.00 0.00 70.33 68.89 2vak n THR 423 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2vak n PHE 424 N -0.72 0.00 -0.51 4.78 3.01 -0.91 -2.28 117.46 120.84 2vak n PHE 424 Ca 0.20 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.75 2vak n PHE 424 Cb 0.21 -0.36 0.29 0.00 -0.01 0.00 0.00 39.48 39.61 2vak n PHE 424 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2vak n THR 425 N -1.35 1.51 0.65 4.37 -2.24 -1.26 -4.80 114.28 111.16 2vak n THR 425 Ca 0.10 -1.19 0.08 0.00 -2.27 0.00 0.00 64.05 60.77 2vak n THR 425 Cb 0.30 0.25 0.06 0.00 -2.10 0.00 0.00 70.33 68.85 2vak n THR 425 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50