#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vak h GLU 6 N 0.00 0.00 0.00 -1.46 4.11 -2.04 -3.20 114.58 111.99 2vak h GLU 6 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2vak h GLU 6 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2vak h GLU 6 CO 0.00 0.00 -1.29 1.19 0.07 0.00 0.00 179.01 178.98 2vak n PHE 7 N -2.58 0.00 -3.05 2.06 3.72 -1.26 -4.96 117.46 111.39 2vak n PHE 7 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 2vak n PHE 7 Cb 0.34 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.69 2vak n PHE 7 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2vak n GLY 8 N 1.44 0.46 3.04 1.37 0.00 -1.21 -4.56 105.19 105.73 2vak n GLY 8 Ca 0.00 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.85 2vak n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2vak s SER 9 N -4.00 4.86 -0.00 1.61 0.01 -1.26 -4.88 113.70 110.04 2vak s SER 9 Ca 0.00 -2.23 0.18 0.00 1.31 0.00 0.00 55.95 55.21 2vak s SER 9 Cb 0.00 -1.69 -0.21 0.00 0.21 0.00 0.00 66.02 64.33 2vak s SER 9 CO 0.00 -0.41 0.75 0.35 0.41 0.00 0.00 173.24 174.34 2vak n THR 10 N 4.21 0.00 -2.62 1.44 -2.24 -1.26 -4.85 114.28 108.95 2vak n THR 10 Ca 0.03 -0.10 -0.42 0.00 -2.27 0.00 0.00 64.05 61.28 2vak n THR 10 Cb 0.41 0.90 -0.03 0.00 -2.10 0.00 0.00 70.33 69.51 2vak n THR 10 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 2vak s MET 11 N -2.80 4.44 0.60 -0.78 1.00 -1.26 -4.82 119.30 115.68 2vak s MET 11 Ca 0.06 1.49 -0.19 0.00 0.00 0.00 0.00 55.69 57.05 2vak s MET 11 Cb 0.14 -3.51 -0.04 0.00 0.00 0.00 0.00 34.83 31.42 2vak s MET 11 CO 0.76 -0.27 1.09 0.00 0.00 0.00 0.00 175.02 176.60 2vak n ALA 12 N 4.66 0.57 -1.77 3.03 0.00 -1.26 -0.64 120.51 125.10 2vak n ALA 12 Ca 0.09 0.03 -0.38 0.00 0.00 0.00 0.00 53.44 53.17 2vak n ALA 12 Cb 0.49 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.71 2vak n ALA 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2vak s ARG 13 N -2.88 4.38 0.00 0.00 6.06 -0.93 -4.27 118.95 121.31 2vak s ARG 13 Ca 0.76 1.62 0.00 0.00 -2.50 0.00 0.00 55.73 55.61 2vak s ARG 13 Cb -0.41 -2.83 0.00 0.00 0.06 0.00 0.00 34.95 31.77 2vak s ARG 13 CO 0.46 0.03 0.00 0.00 -2.50 0.00 0.00 175.30 173.29 2vak n ALA 14 N 0.49 0.48 -3.12 6.12 0.00 -1.26 -4.94 120.51 118.28 2vak n ALA 14 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.08 2vak n ALA 14 Cb 0.48 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.80 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 -0.46 4.05 -0.81 0.00 1.01 -1.26 -5.02 121.20 118.71 2vak s ILE 15 Ca 0.00 -0.82 -0.07 0.00 0.00 0.00 0.00 60.65 59.77 2vak s ILE 15 Cb 0.00 -3.17 0.21 0.00 0.01 0.00 0.00 42.46 39.51 2vak s ILE 15 CO 0.00 -0.04 0.69 -0.31 0.00 0.00 0.00 174.94 175.29 2vak s TYR 16 N 1.49 3.72 0.06 3.97 2.02 -1.26 -5.05 117.35 122.30 2vak s TYR 16 Ca 0.01 -2.57 -0.03 0.00 -0.37 0.00 0.00 57.07 54.11 2vak s TYR 16 Cb -0.18 -3.47 -0.05 0.00 -0.40 0.00 0.00 41.96 37.86 2vak s TYR 16 CO 0.03 -0.87 0.26 -0.51 -1.57 0.00 0.00 175.55 172.89 2vak s ASP 17 N 1.00 6.42 -0.04 2.29 1.11 -1.26 -1.16 116.67 125.03 2vak s ASP 17 Ca 0.21 0.43 0.03 0.00 0.18 0.00 0.00 52.55 53.40 2vak s ASP 17 Cb -0.13 -2.03 0.00 0.00 1.07 0.00 0.00 42.92 41.83 2vak s ASP 17 CO -0.08 0.18 -0.12 0.12 1.18 0.00 0.00 175.17 176.45 2vak s PHE 18 N -1.46 1.28 -0.16 4.23 5.36 0.01 -4.82 117.98 122.41 2vak s PHE 18 Ca 0.33 -0.36 0.00 0.00 -0.96 0.00 0.00 56.93 55.94 2vak s PHE 18 Cb -0.13 -0.90 0.00 0.00 -0.34 0.00 0.00 43.02 41.66 2vak s PHE 18 CO 0.23 -0.15 -0.16 0.12 -1.46 0.00 0.00 175.22 173.80 2vak s PHE 19 N 0.23 2.79 0.52 10.12 5.36 -1.26 -0.45 117.98 135.29 2vak s PHE 19 Ca -0.05 -1.16 -0.17 0.00 -0.96 0.00 0.00 56.93 54.59 2vak s PHE 19 Cb -0.11 -1.91 -0.07 0.00 -0.34 0.00 0.00 43.02 40.60 2vak s PHE 19 CO 0.01 -0.55 1.01 -1.54 -1.46 0.00 0.00 175.22 172.70 2vak s SER 20 N 0.95 6.35 0.10 6.13 1.04 0.13 -4.31 113.70 124.09 2vak s SER 20 Ca -0.03 1.73 -0.34 0.00 0.48 0.00 0.00 55.95 57.78 2vak s SER 20 Cb -0.15 -2.53 -0.14 0.00 0.10 0.00 0.00 66.02 63.30 2vak s SER 20 CO -0.03 -0.78 1.60 0.41 0.98 0.00 0.00 173.24 175.43 2vak n THR 21 N -1.50 0.10 -2.13 2.02 -1.04 -1.26 -3.21 114.28 107.26 2vak n THR 21 Ca 0.08 -0.02 -0.41 0.00 -2.04 0.00 0.00 64.05 61.66 2vak n THR 21 Cb 0.53 -1.49 -0.02 0.00 -1.82 0.00 0.00 70.33 67.53 2vak n THR 21 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 2vak s PRO 22 N 1.40 4.35 0.16 -2.82 0.04 -1.26 -2.78 135.00 134.09 2vak s PRO 22 Ca 0.82 2.19 -0.01 0.00 0.04 0.00 0.00 61.00 64.03 2vak s PRO 22 Cb -0.73 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 30.67 2vak s PRO 22 CO 0.42 -0.24 0.09 -0.59 0.04 0.00 0.00 177.00 176.72 2vak s PHE 23 N -0.63 0.97 0.00 0.56 -0.71 -1.26 -4.89 117.98 112.02 2vak s PHE 23 Ca 0.53 -1.28 0.00 0.00 -1.04 0.00 0.00 56.93 55.14 2vak s PHE 23 Cb -0.39 -0.50 0.00 0.00 -1.21 0.00 0.00 43.02 40.92 2vak s PHE 23 CO 0.47 -0.58 0.00 0.41 -1.34 0.00 0.00 175.22 174.18 2vak n GLY 24 N -0.17 1.35 0.23 1.99 0.00 -1.26 -4.89 105.19 102.44 2vak n GLY 24 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 2vak n GLY 24 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2vak h ASN 25 N 0.00 0.74 -0.63 1.61 -0.00 -2.02 -3.20 115.58 112.08 2vak h ASN 25 Ca 0.00 -0.27 -0.30 0.00 -0.00 0.00 0.00 56.30 55.73 2vak h ASN 25 Cb 0.00 -0.20 -0.18 0.00 -0.00 0.00 0.00 38.32 37.95 2vak h ASN 25 CO 0.00 0.83 0.24 0.54 -0.00 0.00 0.00 177.43 179.04 2vak n ARG 26 N -4.44 2.31 0.00 6.67 5.12 -1.26 -5.07 116.66 119.99 2vak n ARG 26 Ca 0.00 -3.09 0.00 0.00 -1.93 0.00 0.00 57.85 52.84 2vak n ARG 26 Cb 0.26 -2.00 0.00 0.00 -1.16 0.00 0.00 32.46 29.56 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 -0.97 -2.34 3.68 -0.13 0.00 -1.21 -4.84 105.19 99.39 2vak n GLY 27 Ca 0.43 -1.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.18 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 4.35 -0.66 0.99 2.96 -1.26 -4.13 118.68 120.94 2vak s LEU 28 Ca 0.00 2.40 -0.06 0.00 -0.22 0.00 0.00 54.13 56.25 2vak s LEU 28 Cb 0.00 -3.55 -0.13 0.00 0.50 0.00 0.00 46.19 43.01 2vak s LEU 28 CO 0.00 -0.89 2.64 0.00 -1.32 0.00 0.00 176.35 176.77 2vak n ALA 29 N 6.12 5.50 -4.19 5.97 0.00 -1.26 -4.78 120.51 127.87 2vak n ALA 29 Ca 0.16 -2.05 -0.21 0.00 0.00 0.00 0.00 53.44 51.35 2vak n ALA 29 Cb 0.41 -2.76 -0.07 0.00 0.00 0.00 0.00 19.45 17.03 2vak n ALA 29 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2vak n THR 30 N 3.34 0.00 -3.88 0.00 5.66 -1.25 -1.54 114.28 116.61 2vak n THR 30 Ca 0.47 -2.25 -0.09 0.00 -3.05 0.00 0.00 64.05 59.13 2vak n THR 30 Cb 0.41 1.17 -0.01 0.00 -1.55 0.00 0.00 70.33 70.35 2vak n THR 30 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2vak s ASN 31 N -3.25 -0.01 0.30 1.09 2.20 -1.26 -4.65 114.94 109.35 2vak s ASN 31 Ca 0.37 -0.96 0.01 0.00 -0.94 0.00 0.00 52.86 51.34 2vak s ASN 31 Cb 0.01 0.76 0.54 0.00 -2.00 0.00 0.00 41.25 40.56 2vak s ASN 31 CO 0.26 -1.47 1.89 -0.09 -2.94 0.00 0.00 177.10 174.76 2vak h ARG 32 N 2.04 0.99 -0.30 3.55 2.43 -1.95 -1.04 114.38 120.10 2vak h ARG 32 Ca -0.26 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 58.82 2vak h ARG 32 Cb 1.25 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 30.56 2vak h ARG 32 CO 0.33 0.65 0.07 1.15 -1.51 0.00 0.00 179.97 180.67 2vak h THR 33 N 1.02 1.22 -0.13 0.20 2.02 -1.97 -1.64 112.91 113.63 2vak h THR 33 Ca 0.42 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 2vak h THR 33 Cb 0.28 1.13 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 2vak h THR 33 CO -0.17 0.24 0.00 -0.61 0.37 0.00 0.00 175.52 175.35 2vak h GLN 34 N 0.32 0.23 -0.92 6.66 4.15 -1.82 -2.04 115.11 121.69 2vak h GLN 34 Ca 0.09 -0.07 0.03 0.00 0.77 0.00 0.00 58.65 59.46 2vak h GLN 34 Cb 0.30 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.92 2vak h GLN 34 CO 0.00 0.47 0.60 -0.07 -1.93 0.00 0.00 178.83 177.90 2vak h LEU 35 N -0.03 1.01 -0.77 -2.39 3.38 -1.25 -2.46 115.31 112.80 2vak h LEU 35 Ca 0.04 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 2vak h LEU 35 Cb 0.36 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 2vak h LEU 35 CO 0.01 0.71 0.35 0.28 0.09 0.00 0.00 178.44 179.88 2vak h SER 36 N 1.19 1.03 -0.13 -0.43 0.02 -1.27 -2.68 113.55 111.28 2vak h SER 36 Ca 0.35 -0.15 0.04 0.00 -0.84 0.00 0.00 61.79 61.19 2vak h SER 36 Cb -0.05 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.22 2vak h SER 36 CO -0.10 0.89 0.15 0.77 -1.14 0.00 0.00 176.83 177.40 2vak h SER 37 N 1.10 0.00 0.86 3.07 4.64 -0.89 -0.59 113.55 121.74 2vak h SER 37 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2vak h SER 37 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 2vak h SER 37 CO -0.03 0.00 -0.08 0.18 -0.87 0.00 0.00 176.83 176.03 2vak n LEU 38 N -3.76 0.10 -4.88 5.97 4.77 -1.01 -4.92 117.00 113.26 2vak n LEU 38 Ca 0.00 0.38 -0.30 0.00 -0.03 0.00 0.00 56.01 56.07 2vak n LEU 38 Cb 0.26 -0.43 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 2vak n LEU 38 CO 0.27 0.02 0.39 -0.76 -1.33 0.00 0.00 177.39 175.98 2vak s LEU 39 N -2.93 3.87 0.62 2.23 1.43 -0.23 -4.84 118.68 118.83 2vak s LEU 39 Ca 0.16 1.04 -0.04 0.00 -1.03 0.00 0.00 54.13 54.25 2vak s LEU 39 Cb 0.19 -3.91 0.04 0.00 0.03 0.00 0.00 46.19 42.54 2vak s LEU 39 CO 0.55 -0.37 0.91 -0.94 0.23 0.00 0.00 176.35 176.73 2vak s SER 40 N -3.21 5.18 0.24 2.29 1.04 -1.07 -4.84 113.70 113.34 2vak s SER 40 Ca 0.50 0.41 0.11 0.00 0.48 0.00 0.00 55.95 57.45 2vak s SER 40 Cb -0.10 -1.23 0.83 0.00 0.10 0.00 0.00 66.02 65.61 2vak s SER 40 CO 0.32 -1.30 1.07 -1.54 0.98 0.00 0.00 173.24 172.76 2vak n SER 41 N -2.65 0.17 -1.66 7.02 3.41 -1.26 0.12 113.62 118.77 2vak n SER 41 Ca 0.07 1.13 -0.12 0.00 -0.26 0.00 0.00 58.87 59.68 2vak n SER 41 Cb 0.59 -0.52 0.20 0.00 -0.26 0.00 0.00 64.21 64.23 2vak n SER 41 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2vak n SER 42 N -4.61 3.21 -1.06 4.04 3.41 -1.26 -4.96 113.62 112.39 2vak n SER 42 Ca 0.24 -3.65 -0.13 0.00 -0.26 0.00 0.00 58.87 55.06 2vak n SER 42 Cb 0.79 -0.73 -0.06 0.00 -0.26 0.00 0.00 64.21 63.96 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 -1.05 -4.61 -4.66 4.04 5.03 0.32 -4.81 115.26 109.52 2vak n ASN 43 Ca 0.44 0.32 -0.41 0.00 0.87 0.00 0.00 54.58 55.80 2vak n ASN 43 Cb 1.32 -3.32 -0.04 0.00 -1.02 0.00 0.00 39.78 36.72 2vak n ASN 43 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2vak s SER 44 N -2.84 6.89 0.00 6.41 0.15 -1.26 -0.90 113.70 122.15 2vak s SER 44 Ca 0.00 1.09 0.25 0.00 0.70 0.00 0.00 55.95 57.99 2vak s SER 44 Cb 0.00 -2.43 1.33 0.00 -1.71 0.00 0.00 66.02 63.20 2vak s SER 44 CO 0.00 -0.40 1.82 -0.81 1.20 0.00 0.00 173.24 175.05 2vak n PRO 45 N 5.36 0.51 -0.10 5.44 -0.04 -1.26 -2.58 135.00 142.33 2vak n PRO 45 Ca 0.04 0.04 -0.17 0.00 -0.04 0.00 0.00 63.50 63.36 2vak n PRO 45 Cb 0.49 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.37 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 -1.18 0.00 -2.93 0.54 7.02 -1.26 -5.04 117.44 114.58 2vak n TRP 46 Ca 0.14 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.21 2vak n TRP 46 Cb 0.15 -0.72 -0.05 0.00 -2.42 0.00 0.00 31.31 28.28 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 -2.37 4.08 0.00 -0.99 1.03 -1.26 -5.09 119.66 115.06 2vak s GLN 47 Ca -0.27 0.75 0.00 0.00 0.04 0.00 0.00 55.36 55.88 2vak s GLN 47 Cb 0.09 -3.68 0.00 0.00 0.03 0.00 0.00 33.01 29.44 2vak s GLN 47 CO 0.39 -0.58 0.00 -0.89 -2.54 0.00 0.00 175.29 171.67 2vak n ILE 61 N 5.38 0.00 0.65 3.63 2.08 -1.26 -4.98 119.36 124.87 2vak n ILE 61 Ca 0.04 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.35 2vak n ILE 61 Cb 0.48 -0.31 0.00 0.00 -0.75 0.00 0.00 39.64 39.06 2vak n ILE 61 CO 0.00 0.00 0.00 0.55 0.56 0.00 0.00 176.55 177.66 2vak n VAL 62 N 1.22 0.52 -0.76 1.39 3.14 -1.26 -4.89 118.33 117.70 2vak n VAL 62 Ca 0.00 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.05 2vak n VAL 62 Cb 0.00 -0.72 0.14 0.00 -1.06 0.00 0.00 33.84 32.19 2vak n VAL 62 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2vak n SER 63 N 0.57 -2.52 -3.58 6.55 2.88 -1.26 -5.07 113.62 111.18 2vak n SER 63 Ca 0.00 0.08 -0.14 0.00 -1.33 0.00 0.00 58.87 57.48 2vak n SER 63 Cb 0.29 -1.02 -0.06 0.00 -0.75 0.00 0.00 64.21 62.67 2vak n SER 63 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2vak s THR 64 N -2.27 0.00 0.30 2.46 2.01 -1.12 -5.00 115.64 112.02 2vak s THR 64 Ca 0.54 0.00 0.05 0.00 0.31 0.00 0.00 61.69 62.60 2vak s THR 64 Cb -0.15 -1.00 0.30 0.00 0.01 0.00 0.00 72.50 71.66 2vak s THR 64 CO 0.68 0.00 1.78 -0.65 -0.69 0.00 0.00 174.62 175.74 2vak h PRO 65 N 3.83 0.76 -0.06 4.92 0.11 -1.97 -0.79 132.00 138.81 2vak h PRO 65 Ca -0.27 -0.05 -0.14 0.00 0.11 0.00 0.00 66.00 65.65 2vak h PRO 65 Cb 1.16 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 2vak h PRO 65 CO 0.22 0.50 -0.60 0.93 -0.21 0.00 0.00 178.00 178.84 2vak h GLU 66 N 0.79 0.20 -2.40 1.05 3.07 -2.00 -3.38 114.58 111.92 2vak h GLU 66 Ca 0.57 -0.14 -0.59 0.00 -0.50 0.00 0.00 59.36 58.70 2vak h GLU 66 Cb 0.86 0.02 -0.38 0.00 -0.84 0.00 0.00 28.75 28.41 2vak h GLU 66 CO -0.37 0.75 -0.96 0.00 -1.40 0.00 0.00 179.01 177.02 2vak s ALA 67 N -3.74 1.41 0.43 3.43 0.00 -0.98 -4.70 121.76 117.60 2vak s ALA 67 Ca -0.04 -2.43 0.26 0.00 0.00 0.00 0.00 51.96 49.75 2vak s ALA 67 Cb 0.12 -1.60 1.42 0.00 0.00 0.00 0.00 23.12 23.05 2vak s ALA 67 CO 0.79 -1.98 2.07 -1.00 0.00 0.00 0.00 175.76 175.64 2vak h PRO 68 N 5.74 0.00 -5.96 0.00 0.13 -1.34 -2.97 132.00 127.61 2vak h PRO 68 Ca 0.25 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.86 2vak h PRO 68 Cb 0.91 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 31.84 2vak h PRO 68 CO 0.37 0.12 -0.80 0.71 -0.23 0.00 0.00 178.00 178.17 2vak s TYR 69 N -4.28 1.73 0.37 1.56 1.51 -1.26 -4.52 117.35 112.46 2vak s TYR 69 Ca -0.03 -0.45 0.15 0.00 -1.01 0.00 0.00 57.07 55.73 2vak s TYR 69 Cb 0.14 -0.91 1.03 0.00 -0.11 0.00 0.00 41.96 42.11 2vak s TYR 69 CO 0.60 0.24 1.75 -1.00 -1.11 0.00 0.00 175.55 176.03 2vak h PRO 70 N 3.71 0.44 0.00 -1.71 0.13 -1.85 0.02 132.00 132.74 2vak h PRO 70 Ca -0.44 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2vak h PRO 70 Cb 1.19 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 32.22 2vak h PRO 70 CO 0.45 0.29 -0.01 0.78 -0.23 0.00 0.00 178.00 179.29 2vak h GLY 71 N 0.46 0.00 0.93 1.56 0.00 -1.18 -3.14 103.07 101.70 2vak h GLY 71 Ca 0.62 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.96 2vak h GLY 71 CO -0.36 0.00 0.25 1.76 0.00 0.00 0.00 176.54 178.18 2vak h SER 72 N 0.00 0.41 0.09 0.19 0.02 -1.18 -3.15 113.55 109.93 2vak h SER 72 Ca -0.00 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2vak h SER 72 Cb 0.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.65 2vak h SER 72 CO 0.00 0.29 -0.36 -0.07 -1.14 0.00 0.00 176.83 175.56 2vak h LEU 73 N 0.50 0.39 0.17 5.07 3.38 -1.68 -1.40 115.31 121.74 2vak h LEU 73 Ca 0.16 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2vak h LEU 73 Cb -0.01 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2vak h LEU 73 CO -0.06 0.72 -0.25 -0.03 0.09 0.00 0.00 178.44 178.90 2vak h MET 74 N 0.32 -0.47 -0.38 1.13 4.05 -1.70 0.15 114.93 118.03 2vak h MET 74 Ca 0.04 0.03 -0.03 0.00 -0.28 0.00 0.00 59.70 59.46 2vak h MET 74 Cb 0.78 0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.67 2vak h MET 74 CO 0.06 -0.32 0.14 -0.92 0.23 0.00 0.00 176.91 176.10 2vak h TYR 75 N -0.49 0.59 -0.22 1.39 3.20 -1.49 -2.54 116.97 117.41 2vak h TYR 75 Ca 0.01 -0.05 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 2vak h TYR 75 Cb 0.49 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 2vak h TYR 75 CO -0.21 0.55 0.13 1.96 -1.64 0.00 0.00 178.16 178.95 2vak h GLN 76 N 0.46 0.29 0.00 1.82 4.20 -1.23 -2.21 115.11 118.44 2vak h GLN 76 Ca 0.12 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.77 2vak h GLN 76 Cb 0.22 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 2vak h GLN 76 CO -0.01 0.24 -0.16 0.93 -0.67 0.00 0.00 178.83 179.16 2vak h GLU 77 N 0.26 0.00 -0.53 1.46 5.08 -0.70 -1.07 114.58 119.09 2vak h GLU 77 Ca 0.08 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.38 2vak h GLU 77 Cb 0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 2vak h GLU 77 CO -0.01 0.16 0.09 0.66 -1.00 0.00 0.00 179.01 178.91 2vak h SER 78 N 0.00 0.78 0.16 1.42 4.64 -1.05 -0.29 113.55 119.21 2vak h SER 78 Ca -0.00 -0.16 -0.16 0.00 -0.47 0.00 0.00 61.79 61.00 2vak h SER 78 Cb 0.36 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2vak h SER 78 CO 0.02 0.80 -0.60 0.24 -0.87 0.00 0.00 176.83 176.42 2vak h MET 79 N 0.79 0.44 -0.25 4.77 2.86 -0.73 -2.24 114.93 120.58 2vak h MET 79 Ca 0.17 -0.30 -0.02 0.00 -2.06 0.00 0.00 59.70 57.49 2vak h MET 79 Cb 0.35 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 2vak h MET 79 CO 0.01 0.91 0.08 1.25 1.06 0.00 0.00 176.91 180.21 2vak h LEU 80 N 0.33 0.37 -0.72 1.22 5.85 -0.84 -2.33 115.31 119.19 2vak h LEU 80 Ca -0.00 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.59 2vak h LEU 80 Cb 1.14 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 42.01 2vak h LEU 80 CO 0.11 0.48 0.39 0.45 -0.34 0.00 0.00 178.44 179.52 2vak h HIS 81 N 0.24 0.70 0.00 1.25 3.86 -1.09 -2.29 115.15 117.82 2vak h HIS 81 Ca 0.08 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.26 2vak h HIS 81 Cb 0.24 -0.21 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 2vak h HIS 81 CO 0.00 0.29 -0.29 0.77 0.86 0.00 0.00 177.93 179.56 2vak h SER 82 N 0.68 0.00 0.19 2.45 0.02 -1.23 -2.39 113.55 113.26 2vak h SER 82 Ca 0.34 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.94 2vak h SER 82 Cb 0.30 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.84 2vak h SER 82 CO -0.23 0.29 -1.84 0.00 -1.14 0.00 0.00 176.83 173.91 2vak h ALA 83 N 1.71 0.30 0.00 3.77 0.00 -1.21 -3.41 119.26 120.41 2vak h ALA 83 Ca -0.00 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.65 2vak h ALA 83 Cb 0.82 0.55 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2vak h ALA 83 CO 0.04 1.17 -1.63 0.25 0.00 0.00 0.00 179.25 179.08 2vak n THR 84 N -3.52 0.00 -0.08 0.00 -2.24 -0.88 -4.64 114.28 102.92 2vak n THR 84 Ca -0.27 -0.35 -0.08 0.00 -2.27 0.00 0.00 64.05 61.08 2vak n THR 84 Cb 1.06 0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 69.53 2vak n THR 84 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2vak n VAL 85 N -1.99 1.42 -0.33 2.28 0.31 -0.91 -4.43 118.33 114.69 2vak n VAL 85 Ca -0.02 0.16 0.22 0.00 -0.01 0.00 0.00 64.34 64.69 2vak n VAL 85 Cb 0.43 -2.29 0.48 0.00 -0.91 0.00 0.00 33.84 31.55 2vak n VAL 85 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2vak h PRO 86 N -0.93 0.42 0.00 5.55 0.11 -1.79 -2.10 132.00 133.27 2vak h PRO 86 Ca 0.00 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.08 2vak h PRO 86 Cb 0.93 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2vak h PRO 86 CO 0.00 0.28 0.00 0.41 -0.21 0.00 0.00 178.00 178.48 2vak n GLY 87 N -1.43 -1.16 0.74 -0.55 0.00 -1.26 -2.51 105.19 99.01 2vak n GLY 87 Ca 0.26 -0.08 0.09 0.00 0.00 0.00 0.00 46.02 46.29 2vak n GLY 87 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2vak n VAL 88 N -1.42 0.07 0.09 1.61 0.31 -0.79 -4.68 118.33 113.51 2vak n VAL 88 Ca 0.07 -0.53 -0.04 0.00 -0.01 0.00 0.00 64.34 63.83 2vak n VAL 88 Cb 0.22 1.32 0.16 0.00 -0.91 0.00 0.00 33.84 34.63 2vak n VAL 88 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2vak h LEU 89 N 3.50 0.24 -2.80 7.52 3.38 -1.55 -3.35 115.31 122.25 2vak h LEU 89 Ca 0.00 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 2vak h LEU 89 Cb 0.75 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 2vak h LEU 89 CO 0.00 0.74 0.10 0.61 0.09 0.00 0.00 178.44 179.98 2vak n GLY 90 N 0.13 2.69 0.00 0.83 0.00 -1.26 -3.62 105.19 103.95 2vak n GLY 90 Ca -0.02 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2vak n GLY 90 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vak n SER 91 N 0.87 0.00 -0.13 1.61 7.64 -1.26 -4.96 113.62 117.40 2vak n SER 91 Ca 0.08 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.10 2vak n SER 91 Cb 0.57 0.00 0.73 0.00 -1.01 0.00 0.00 64.21 64.49 2vak n SER 91 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2vak n ARG 92 N -1.03 0.93 -0.42 1.43 1.85 -1.26 -2.96 116.66 115.20 2vak n ARG 92 Ca 0.00 -0.25 0.07 0.00 -1.00 0.00 0.00 57.85 56.67 2vak n ARG 92 Cb 0.00 -1.49 0.16 0.00 -1.05 0.00 0.00 32.46 30.07 2vak n ARG 92 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2vak n ASP 93 N -0.81 1.85 0.07 2.89 8.00 -1.26 -4.75 116.55 122.53 2vak n ASP 93 Ca 0.18 -3.35 -0.10 0.00 0.71 0.00 0.00 54.79 52.23 2vak n ASP 93 Cb 0.23 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.87 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 0.53 0.52 0.00 2.24 0.00 -1.81 -3.24 119.26 117.50 2vak h ALA 94 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2vak h ALA 94 Cb 1.07 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2vak h ALA 94 CO 0.01 0.82 0.04 0.11 0.00 0.00 0.00 179.25 180.22 2vak h TRP 95 N 0.21 0.00 -0.01 0.00 5.08 -1.85 -1.90 115.95 117.48 2vak h TRP 95 Ca -0.05 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.90 2vak h TRP 95 Cb 1.43 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.59 2vak h TRP 95 CO 0.04 0.00 -0.08 0.00 -1.28 0.00 0.00 178.44 177.12 2vak h ARG 96 N 0.00 0.07 -0.01 0.12 3.08 -1.90 -3.36 114.38 112.37 2vak h ARG 96 Ca 0.00 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.99 2vak h ARG 96 Cb 0.08 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2vak h ARG 96 CO 0.00 0.78 -0.35 0.25 -1.07 0.00 0.00 179.97 179.58 2vak n THR 97 N -4.66 0.00 -1.77 2.04 -2.24 -1.19 -4.99 114.28 101.46 2vak n THR 97 Ca -0.09 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 60.94 2vak n THR 97 Cb 0.40 1.12 -0.03 0.00 -2.10 0.00 0.00 70.33 69.72 2vak n THR 97 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2vak s PHE 98 N -1.78 1.59 0.02 4.78 5.36 -0.72 -3.92 117.98 123.31 2vak s PHE 98 Ca 0.10 -0.22 0.02 0.00 -0.96 0.00 0.00 56.93 55.87 2vak s PHE 98 Cb 0.10 -4.14 -0.02 0.00 -0.34 0.00 0.00 43.02 38.63 2vak s PHE 98 CO 0.38 -5.00 -0.08 0.54 -1.46 0.00 0.00 175.22 169.60 2vak s ASN 99 N 3.89 0.92 -0.12 6.13 2.20 -1.26 -4.40 114.94 122.30 2vak s ASN 99 Ca 0.83 -0.34 -0.07 0.00 -0.94 0.00 0.00 52.86 52.34 2vak s ASN 99 Cb -0.41 -0.04 0.05 0.00 -2.00 0.00 0.00 41.25 38.86 2vak s ASN 99 CO 0.38 -0.04 0.30 0.54 -2.94 0.00 0.00 177.10 175.33 2vak s VAL 100 N -0.75 -0.03 -1.70 3.54 0.11 -0.28 -0.92 120.40 120.37 2vak s VAL 100 Ca -0.03 0.12 -0.19 0.00 -2.93 0.00 0.00 61.98 58.95 2vak s VAL 100 Cb -0.06 -0.45 0.16 0.00 -1.53 0.00 0.00 36.38 34.50 2vak s VAL 100 CO 0.00 0.05 0.81 0.49 -3.33 0.00 0.00 175.10 173.12 2vak n PHE 101 N 4.09 -1.77 -2.72 1.54 3.72 -1.26 -0.97 117.46 120.09 2vak n PHE 101 Ca -0.23 0.80 -0.20 0.00 -0.05 0.00 0.00 57.45 57.77 2vak n PHE 101 Cb 0.54 -2.98 0.02 0.00 -0.94 0.00 0.00 39.48 36.11 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 -1.40 -0.44 3.26 1.37 0.00 -1.26 -4.22 105.19 102.50 2vak n GLY 102 Ca 0.08 0.01 -0.21 0.00 0.00 0.00 0.00 46.02 45.90 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 -5.98 2.35 0.06 0.99 1.43 -0.14 -1.79 118.68 115.59 2vak s LEU 103 Ca 0.16 -0.74 -0.03 0.00 -1.03 0.00 0.00 54.13 52.49 2vak s LEU 103 Cb -0.07 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.41 2vak s LEU 103 CO 0.20 -0.04 0.04 -0.44 0.23 0.00 0.00 176.35 176.35 2vak s SER 104 N -2.16 0.34 0.31 2.29 0.01 -0.24 -1.12 113.70 113.13 2vak s SER 104 Ca 0.07 -0.82 -0.15 0.00 1.31 0.00 0.00 55.95 56.36 2vak s SER 104 Cb -0.08 0.23 -0.09 0.00 0.21 0.00 0.00 66.02 66.29 2vak s SER 104 CO 0.04 -0.60 0.73 0.26 0.41 0.00 0.00 173.24 174.09 2vak s TRP 105 N -3.57 3.40 -0.85 2.43 0.52 -1.26 -0.98 118.94 118.63 2vak s TRP 105 Ca 0.03 1.23 0.23 0.00 0.02 0.00 0.00 56.10 57.62 2vak s TRP 105 Cb 0.05 -2.54 0.92 0.00 -1.15 0.00 0.00 33.47 30.75 2vak s TRP 105 CO -0.09 0.12 1.72 0.25 0.02 0.00 0.00 176.95 178.97 2vak n THR 106 N -0.25 0.57 -0.57 2.01 -2.24 -0.30 -4.89 114.28 108.59 2vak n THR 106 Ca 0.03 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2vak n THR 106 Cb 0.53 -0.79 0.00 0.00 -2.10 0.00 0.00 70.33 67.97 2vak n THR 106 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2vak n ASP 107 N -1.78 0.00 0.10 3.42 5.68 -1.26 -5.00 116.55 117.71 2vak n ASP 107 Ca 0.05 0.00 -0.16 0.00 -0.50 0.00 0.00 54.79 54.17 2vak n ASP 107 Cb 0.29 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.15 2vak n ASP 107 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2vak h GLU 108 N 0.00 0.37 0.00 0.11 4.81 -1.93 -2.97 114.58 114.97 2vak h GLU 108 Ca 0.00 -0.53 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 2vak h GLU 108 Cb 0.00 0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2vak h GLU 108 CO 0.00 1.22 0.00 0.41 -0.73 0.00 0.00 179.01 179.91 2vak n GLY 109 N 1.36 -0.23 3.96 1.92 0.00 -1.26 -4.84 105.19 106.10 2vak n GLY 109 Ca -0.09 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.78 -2.26 0.10 0.99 4.77 -1.12 -4.89 117.00 113.81 2vak n LEU 110 Ca 0.03 -0.99 -0.01 0.00 -0.03 0.00 0.00 56.01 55.01 2vak n LEU 110 Cb 0.01 -2.26 -0.04 0.00 -2.33 0.00 0.00 43.42 38.81 2vak n LEU 110 CO 0.02 0.42 0.23 -1.28 -1.33 0.00 0.00 177.39 175.46 2vak h SER 111 N -1.82 0.00 -5.07 -1.43 0.87 -1.88 -3.47 113.55 100.74 2vak h SER 111 Ca -0.62 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 59.89 2vak h SER 111 Cb 1.37 0.00 -0.12 0.00 -0.44 0.00 0.00 62.40 63.21 2vak h SER 111 CO 0.64 0.67 -0.03 -0.83 -0.53 0.00 0.00 176.83 176.75 2vak s GLY 112 N -4.60 -0.28 -0.13 5.77 0.00 -1.26 -4.38 107.32 102.44 2vak s GLY 112 Ca 0.02 -0.03 0.02 0.00 0.00 0.00 0.00 44.72 44.74 2vak s GLY 112 CO 0.78 -0.26 -0.20 1.08 0.00 0.00 0.00 173.10 174.50 2vak s LEU 113 N -2.81 2.25 0.33 0.66 1.43 -0.08 -1.16 118.68 119.31 2vak s LEU 113 Ca 0.04 -0.52 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 2vak s LEU 113 Cb 0.01 -1.48 -0.05 0.00 0.03 0.00 0.00 46.19 44.71 2vak s LEU 113 CO -0.11 0.12 0.09 0.68 0.23 0.00 0.00 176.35 177.37 2vak s VAL 114 N 0.57 0.84 0.65 -1.59 -7.23 -0.15 -4.77 120.40 108.73 2vak s VAL 114 Ca -0.12 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 57.88 2vak s VAL 114 Cb -0.16 -2.63 -0.02 0.00 0.56 0.00 0.00 36.38 34.13 2vak s VAL 114 CO 0.04 0.00 1.11 0.00 -0.31 0.00 0.00 175.10 175.93 2vak n ALA 115 N -0.68 0.49 -2.34 1.32 0.00 -1.26 -1.08 120.51 116.94 2vak n ALA 115 Ca -0.02 -0.05 -0.26 0.00 0.00 0.00 0.00 53.44 53.11 2vak n ALA 115 Cb 0.66 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.91 2vak n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vak s ALA 116 N -1.54 3.51 0.41 0.00 0.00 -0.74 -4.46 121.76 118.94 2vak s ALA 116 Ca 0.79 -0.71 -0.25 0.00 0.00 0.00 0.00 51.96 51.78 2vak s ALA 116 Cb -0.38 -2.41 -0.10 0.00 0.00 0.00 0.00 23.12 20.22 2vak s ALA 116 CO 0.45 -0.34 1.18 1.04 0.00 0.00 0.00 175.76 178.08 2vak n GLN 117 N -2.17 1.73 -3.80 0.00 1.13 -1.26 -4.97 117.38 108.04 2vak n GLN 117 Ca -0.00 0.61 -0.26 0.00 -1.94 0.00 0.00 57.00 55.42 2vak n GLN 117 Cb 0.56 -2.25 -0.17 0.00 0.11 0.00 0.00 30.24 28.50 2vak n GLN 117 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 2vak s ASP 118 N -0.59 2.31 0.50 1.08 3.68 -1.26 -2.47 116.67 119.92 2vak s ASP 118 Ca 0.61 -0.45 -0.21 0.00 2.13 0.00 0.00 52.55 54.63 2vak s ASP 118 Cb -0.54 -0.63 -0.07 0.00 -1.45 0.00 0.00 42.92 40.23 2vak s ASP 118 CO 0.58 -0.22 1.13 -2.16 0.13 0.00 0.00 175.17 174.63 2vak s PRO 119 N 1.84 3.61 0.94 4.34 0.04 -1.26 -5.13 135.00 139.38 2vak s PRO 119 Ca 0.02 1.64 -0.11 0.00 0.04 0.00 0.00 61.00 62.59 2vak s PRO 119 Cb -0.14 -2.20 0.16 0.00 0.04 0.00 0.00 34.50 32.35 2vak s PRO 119 CO -0.07 -0.64 1.10 -1.25 0.04 0.00 0.00 177.00 176.18 2vak s PRO 120 N -3.01 0.88 0.00 0.56 0.04 -1.03 -4.92 135.00 127.52 2vak s PRO 120 Ca 0.68 1.10 0.29 0.00 0.04 0.00 0.00 61.00 63.10 2vak s PRO 120 Cb -0.25 -1.74 1.19 0.00 0.04 0.00 0.00 34.50 33.74 2vak s PRO 120 CO 0.29 -2.58 1.83 -0.35 0.04 0.00 0.00 177.00 176.23 2vak n PRO 121 N -4.15 0.98 -4.03 0.56 -0.05 -1.26 -4.83 135.00 122.21 2vak n PRO 121 Ca 0.08 -0.41 -0.10 0.00 -0.05 0.00 0.00 63.50 63.02 2vak n PRO 121 Cb 0.54 -1.49 -0.06 0.00 -0.05 0.00 0.00 33.50 32.44 2vak n PRO 121 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 2vak s ALA 122 N -2.31 -0.00 0.33 0.55 0.00 -1.25 -4.98 121.76 114.09 2vak s ALA 122 Ca 0.33 -1.02 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 2vak s ALA 122 Cb 0.20 1.12 -0.10 0.00 0.00 0.00 0.00 23.12 24.34 2vak s ALA 122 CO 0.44 -0.81 1.36 0.00 0.00 0.00 0.00 175.76 176.75 2vak s ALA 123 N -4.04 3.53 0.19 0.00 0.00 -1.26 -4.88 121.76 115.31 2vak s ALA 123 Ca 0.25 1.34 -0.33 0.00 0.00 0.00 0.00 51.96 53.22 2vak s ALA 123 Cb 0.01 -3.52 -0.13 0.00 0.00 0.00 0.00 23.12 19.48 2vak s ALA 123 CO 0.10 -0.74 1.58 -2.30 0.00 0.00 0.00 175.76 174.39 2vak n PRO 124 N 0.94 2.29 -1.73 0.00 -0.02 -1.26 -4.74 135.00 130.48 2vak n PRO 124 Ca 0.01 0.82 -0.42 0.00 -2.02 0.00 0.00 63.50 61.89 2vak n PRO 124 Cb 0.41 -2.59 -0.01 0.00 -0.02 0.00 0.00 33.50 31.29 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 3.14 2.65 -3.74 6.00 9.36 -0.10 -5.02 117.16 129.44 2vak n TYR 125 Ca 0.15 0.44 -0.38 0.00 3.32 0.00 0.00 57.90 61.43 2vak n TYR 125 Cb 0.31 -2.50 -0.12 0.00 -0.63 0.00 0.00 39.34 36.40 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 -1.52 2.96 0.74 2.98 -0.21 -1.26 -4.74 119.66 118.61 2vak s GLN 126 Ca 0.58 -0.95 -0.15 0.00 0.02 0.00 0.00 55.36 54.85 2vak s GLN 126 Cb -0.53 -3.43 0.01 0.00 1.00 0.00 0.00 33.01 30.07 2vak s GLN 126 CO 0.59 -0.52 0.89 -2.30 -2.12 0.00 0.00 175.29 171.83 2vak n PRO 127 N 4.87 0.38 -4.30 2.91 -0.02 -1.26 -5.01 135.00 132.57 2vak n PRO 127 Ca -0.14 0.19 -0.31 0.00 -2.02 0.00 0.00 63.50 61.21 2vak n PRO 127 Cb 0.47 -2.16 -0.09 0.00 -0.02 0.00 0.00 33.50 31.70 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 -1.91 3.16 -0.10 3.55 0.00 -1.26 -4.93 121.76 120.26 2vak s ALA 128 Ca 0.71 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 51.32 2vak s ALA 128 Cb -0.33 -1.18 -0.01 0.00 0.00 0.00 0.00 23.12 21.60 2vak s ALA 128 CO 0.53 0.65 1.00 0.45 0.00 0.00 0.00 175.76 178.39 2vak s SER 129 N -1.78 7.25 -1.08 0.00 0.15 -1.26 -4.50 113.70 112.48 2vak s SER 129 Ca 0.21 1.53 -0.13 0.00 0.70 0.00 0.00 55.95 58.26 2vak s SER 129 Cb -0.11 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.60 2vak s SER 129 CO 0.12 -0.44 0.85 0.00 1.20 0.00 0.00 173.24 174.97 2vak n ALA 130 N 4.98 -2.52 -2.60 5.45 0.00 -1.12 -4.89 120.51 119.80 2vak n ALA 130 Ca 0.09 -0.05 -0.22 0.00 0.00 0.00 0.00 53.44 53.26 2vak n ALA 130 Cb 0.49 -4.84 -0.13 0.00 0.00 0.00 0.00 19.45 14.97 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 -5.09 1.04 -0.02 0.00 2.00 -1.26 -4.85 119.66 111.48 2vak s GLN 131 Ca 0.45 -0.89 -0.10 0.00 -2.00 0.00 0.00 55.36 52.83 2vak s GLN 131 Cb -0.11 -1.11 -0.05 0.00 0.80 0.00 0.00 33.01 32.54 2vak s GLN 131 CO 0.80 0.27 0.29 -1.58 -0.50 0.00 0.00 175.29 174.57 2vak s TRP 132 N -0.95 3.63 0.07 1.67 0.52 -1.26 -0.70 118.94 121.93 2vak s TRP 132 Ca 0.03 0.72 0.05 0.00 0.02 0.00 0.00 56.10 56.93 2vak s TRP 132 Cb -0.09 -2.09 -0.03 0.00 -1.15 0.00 0.00 33.47 30.11 2vak s TRP 132 CO 0.02 0.65 -0.15 -1.12 0.02 0.00 0.00 176.95 176.37 2vak s SER 133 N -1.33 1.78 -0.35 2.95 0.01 0.40 -4.99 113.70 112.18 2vak s SER 133 Ca 0.24 -0.59 -0.13 0.00 1.31 0.00 0.00 55.95 56.77 2vak s SER 133 Cb -0.14 -0.07 -0.01 0.00 0.21 0.00 0.00 66.02 66.01 2vak s SER 133 CO 0.12 -0.04 0.24 -0.62 0.41 0.00 0.00 173.24 173.35 2vak s ASP 134 N -1.64 6.00 0.51 2.44 -1.08 -1.26 -0.81 116.67 120.84 2vak s ASP 134 Ca -0.00 -0.52 0.31 0.00 -0.52 0.00 0.00 52.55 51.82 2vak s ASP 134 Cb -0.10 -2.12 1.19 0.00 -1.46 0.00 0.00 42.92 40.43 2vak s ASP 134 CO 0.02 -0.27 1.91 -0.07 0.52 0.00 0.00 175.17 177.29 2vak h LEU 135 N 8.49 0.00 0.00 -1.34 3.38 -1.50 -2.28 115.31 122.06 2vak h LEU 135 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2vak h LEU 135 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 2vak h LEU 135 CO 0.65 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.36 2vak n LEU 136 N -3.03 0.00 0.31 1.67 4.77 -1.26 -2.74 117.00 116.73 2vak n LEU 136 Ca 0.01 0.32 0.20 0.00 -0.03 0.00 0.00 56.01 56.52 2vak n LEU 136 Cb 0.34 -0.32 1.09 0.00 -2.33 0.00 0.00 43.42 42.19 2vak n LEU 136 CO 0.28 -0.04 1.13 0.78 -1.33 0.00 0.00 177.39 178.21 2vak h ASN 137 N 0.00 0.00 -3.57 -1.43 2.35 -1.73 -3.38 115.58 107.82 2vak h ASN 137 Ca 0.00 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 55.15 2vak h ASN 137 Cb 0.28 0.00 -0.10 0.00 0.05 0.00 0.00 38.32 38.55 2vak h ASN 137 CO 0.00 0.00 0.53 -0.47 -1.65 0.00 0.00 177.43 175.84 2vak s TYR 138 N -4.06 3.02 0.19 1.19 5.04 -1.11 -4.61 117.35 117.02 2vak s TYR 138 Ca -0.04 0.54 -0.14 0.00 -2.44 0.00 0.00 57.07 54.99 2vak s TYR 138 Cb 0.11 -3.72 0.21 0.00 0.35 0.00 0.00 41.96 38.91 2vak s TYR 138 CO 0.36 -0.92 1.66 -1.35 -1.34 0.00 0.00 175.55 173.96 2vak h PRO 139 N 8.74 0.06 -0.74 4.97 0.11 -1.82 0.15 132.00 143.47 2vak h PRO 139 Ca -0.24 -0.00 0.16 0.00 0.11 0.00 0.00 66.00 66.03 2vak h PRO 139 Cb 1.08 -0.01 -0.13 0.00 0.11 0.00 0.00 31.00 32.04 2vak h PRO 139 CO 0.98 0.04 -0.08 0.00 -0.21 0.00 0.00 178.00 178.73 2vak h ARG 140 N 0.07 0.05 -0.10 1.05 2.47 -1.94 -0.79 114.38 115.19 2vak h ARG 140 Ca 0.27 -0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.87 2vak h ARG 140 Cb 0.42 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.73 2vak h ARG 140 CO -0.49 0.03 -0.39 -1.49 0.56 0.00 0.00 179.97 178.19 2vak h TRP 141 N 0.05 0.60 -0.48 3.04 6.55 -1.02 0.16 115.95 124.85 2vak h TRP 141 Ca 0.38 -0.25 0.10 0.00 0.95 0.00 0.00 58.89 60.07 2vak h TRP 141 Cb 0.64 -0.10 -0.10 0.00 -0.86 0.00 0.00 29.16 28.74 2vak h TRP 141 CO -0.49 1.00 -0.23 0.00 -1.05 0.00 0.00 178.44 177.67 2vak h ALA 142 N 0.48 0.12 0.00 1.49 0.00 -0.76 -3.13 119.26 117.45 2vak h ALA 142 Ca -0.02 0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 2vak h ALA 142 Cb 1.02 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 2vak h ALA 142 CO 0.08 -0.57 -0.81 -0.91 0.00 0.00 0.00 179.25 177.04 2vak h ASN 143 N -0.12 0.00 -3.15 0.00 2.35 -1.08 -3.38 115.58 110.20 2vak h ASN 143 Ca 0.23 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.36 2vak h ASN 143 Cb 0.47 0.00 -0.41 0.00 0.05 0.00 0.00 38.32 38.44 2vak h ASN 143 CO -0.56 0.23 -0.70 -0.13 -1.65 0.00 0.00 177.43 174.62 2vak s ARG 144 N -3.15 1.84 0.21 0.81 0.52 0.55 -4.99 118.95 114.74 2vak s ARG 144 Ca 0.01 -2.74 0.05 0.00 -0.52 0.00 0.00 55.73 52.53 2vak s ARG 144 Cb 0.08 -2.75 0.14 0.00 0.52 0.00 0.00 34.95 32.94 2vak s ARG 144 CO 0.76 -1.27 1.48 -0.09 0.02 0.00 0.00 175.30 176.21 2vak h ARG 145 N 5.83 0.17 0.00 3.54 2.43 -1.74 -2.82 114.38 121.79 2vak h ARG 145 Ca 0.12 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2vak h ARG 145 Cb 0.84 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.42 2vak h ARG 145 CO 0.59 0.83 0.00 2.89 -1.51 0.00 0.00 179.97 182.77 2vak n ARG 146 N -3.75 0.06 0.08 0.20 1.85 -1.26 -1.13 116.66 112.72 2vak n ARG 146 Ca -0.03 0.41 -0.11 0.00 -1.00 0.00 0.00 57.85 57.12 2vak n ARG 146 Cb 0.71 -1.65 -0.04 0.00 -1.05 0.00 0.00 32.46 30.43 2vak n ARG 146 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2vak h GLU 147 N 0.00 0.27 -0.04 2.89 5.08 -1.85 -2.05 114.58 118.88 2vak h GLU 147 Ca 0.00 -0.31 -0.08 0.00 -1.00 0.00 0.00 59.36 57.96 2vak h GLU 147 Cb 0.18 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.53 2vak h GLU 147 CO 0.00 1.04 -0.31 1.25 -1.00 0.00 0.00 179.01 179.99 2vak h LEU 148 N 0.14 0.34 -1.21 1.33 5.85 -1.23 -3.16 115.31 117.37 2vak h LEU 148 Ca -0.07 -0.69 -0.01 0.00 0.84 0.00 0.00 57.88 57.95 2vak h LEU 148 Cb 1.60 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 42.50 2vak h LEU 148 CO 0.15 0.98 0.42 1.56 -0.34 0.00 0.00 178.44 181.21 2vak h GLN 149 N -0.28 0.96 -0.29 1.25 4.20 -1.23 0.87 115.11 120.59 2vak h GLN 149 Ca -0.03 -0.08 0.05 0.00 0.06 0.00 0.00 58.65 58.64 2vak h GLN 149 Cb 0.99 -0.20 -0.04 0.00 0.30 0.00 0.00 27.48 28.53 2vak h GLN 149 CO 0.06 0.68 0.01 1.03 -0.67 0.00 0.00 178.83 179.95 2vak h SER 150 N 0.98 -0.08 1.10 1.46 0.87 -1.51 -3.22 113.55 113.14 2vak h SER 150 Ca 0.26 0.06 -0.17 0.00 -1.23 0.00 0.00 61.79 60.71 2vak h SER 150 Cb -0.03 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 2vak h SER 150 CO -0.05 -0.01 -0.81 0.11 -0.53 0.00 0.00 176.83 175.55 2vak h LYS 151 N 0.10 0.00 -0.82 2.24 1.57 -0.99 -3.41 116.57 115.27 2vak h LYS 151 Ca 0.14 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 2vak h LYS 151 Cb 0.17 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 2vak h LYS 151 CO -0.22 0.81 0.46 -0.92 -0.57 0.00 0.00 179.45 179.01 2vak h TYR 152 N 0.00 1.10 -1.01 -1.35 3.20 0.66 -2.79 116.97 116.79 2vak h TYR 152 Ca -0.01 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 61.97 2vak h TYR 152 Cb 1.58 -0.36 -0.09 0.00 1.54 0.00 0.00 36.73 39.41 2vak h TYR 152 CO 0.00 0.76 0.63 -1.35 -1.64 0.00 0.00 178.16 176.56 2vak h PRO 153 N 1.14 0.96 -0.24 1.82 0.11 -1.79 1.02 132.00 135.01 2vak h PRO 153 Ca 0.29 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.30 2vak h PRO 153 Cb 0.01 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 30.89 2vak h PRO 153 CO -0.05 0.63 -0.02 1.25 -0.21 0.00 0.00 178.00 179.60 2vak h LEU 154 N 0.99 0.44 -0.95 2.35 5.85 -1.81 -0.73 115.31 121.45 2vak h LEU 154 Ca 0.50 -0.33 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 2vak h LEU 154 Cb 0.51 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 2vak h LEU 154 CO -0.27 0.67 -0.08 -0.07 -0.34 0.00 0.00 178.44 178.35 2vak h LEU 155 N 0.21 0.66 -0.54 2.25 3.38 -1.21 -2.63 115.31 117.43 2vak h LEU 155 Ca 0.07 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 2vak h LEU 155 Cb 0.46 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2vak h LEU 155 CO 0.02 0.78 0.15 0.25 0.09 0.00 0.00 178.44 179.73 2vak h LEU 156 N 0.62 0.79 -0.73 1.67 5.85 0.11 -1.79 115.31 121.84 2vak h LEU 156 Ca 0.11 -0.22 0.09 0.00 0.84 0.00 0.00 57.88 58.71 2vak h LEU 156 Cb 0.51 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.26 2vak h LEU 156 CO 0.03 0.80 0.37 -0.09 -0.34 0.00 0.00 178.44 179.21 2vak h ARG 157 N 0.74 0.61 -0.44 1.25 2.43 -0.95 0.24 114.38 118.27 2vak h ARG 157 Ca 0.17 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.26 2vak h ARG 157 Cb 0.30 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 2vak h ARG 157 CO -0.00 0.40 0.10 0.77 -1.51 0.00 0.00 179.97 179.73 2vak h SER 158 N 0.63 0.68 -0.52 -3.80 0.02 -1.41 -1.50 113.55 107.65 2vak h SER 158 Ca 0.36 -0.24 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2vak h SER 158 Cb 0.37 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2vak h SER 158 CO -0.27 0.74 0.30 0.74 -1.14 0.00 0.00 176.83 177.20 2vak h THR 159 N 0.58 1.17 -0.47 -2.27 2.02 -0.26 -1.03 112.91 112.66 2vak h THR 159 Ca 0.14 -0.41 -0.09 0.00 0.77 0.00 0.00 66.41 66.82 2vak h THR 159 Cb 0.33 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2vak h THR 159 CO 0.00 0.18 -0.05 -0.07 0.37 0.00 0.00 175.52 175.96 2vak h LEU 160 N 0.70 0.86 -0.82 2.58 3.38 -0.56 -0.76 115.31 120.69 2vak h LEU 160 Ca 0.19 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 2vak h LEU 160 Cb 0.02 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 2vak h LEU 160 CO -0.03 0.99 0.29 0.25 0.09 0.00 0.00 178.44 180.03 2vak h LEU 161 N 0.72 1.08 -0.57 1.67 5.85 -0.94 -0.53 115.31 122.59 2vak h LEU 161 Ca 0.13 -0.18 -0.16 0.00 0.84 0.00 0.00 57.88 58.52 2vak h LEU 161 Cb 0.57 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 2vak h LEU 161 CO 0.03 0.97 -0.56 0.28 -0.34 0.00 0.00 178.44 178.83 2vak h SER 162 N 1.13 0.52 0.30 1.25 0.02 -1.11 -3.21 113.55 112.47 2vak h SER 162 Ca 0.26 -0.28 -0.15 0.00 -0.84 0.00 0.00 61.79 60.77 2vak h SER 162 Cb 0.24 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2vak h SER 162 CO -0.02 0.97 -0.61 0.00 -1.14 0.00 0.00 176.83 176.04 2vak h ALA 163 N 1.04 0.80 -2.85 3.77 0.00 -0.93 -3.44 119.26 117.65 2vak h ALA 163 Ca 0.00 -0.54 -0.53 0.00 0.00 0.00 0.00 54.91 53.84 2vak h ALA 163 Cb 1.09 -0.08 0.09 0.00 0.00 0.00 0.00 17.79 18.88 2vak h ALA 163 CO 0.10 0.73 0.81 -1.64 0.00 0.00 0.00 179.25 179.24 2vak s MET 164 N -3.78 4.16 0.35 0.00 1.00 -0.23 -0.65 119.30 120.16 2vak s MET 164 Ca -0.05 2.50 0.17 0.00 0.00 0.00 0.00 55.69 58.31 2vak s MET 164 Cb 0.12 -3.02 0.60 0.00 0.00 0.00 0.00 34.83 32.52 2vak s MET 164 CO 0.81 -0.52 1.70 -0.09 0.00 0.00 0.00 175.02 176.92 2vak h ARG 165 N 4.09 0.00 0.00 2.03 2.43 -1.85 -3.44 114.38 117.65 2vak h ARG 165 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2vak h ARG 165 Cb 1.23 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2vak h ARG 165 CO 0.72 0.42 0.00 0.00 -1.51 0.00 0.00 179.97 179.61 2vak n ALA 166 N -2.31 0.00 -1.68 2.80 0.00 -1.26 -4.99 120.51 113.07 2vak n ALA 166 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.14 2vak n ALA 166 Cb 0.54 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.18 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 1.70 0.61 0.00 0.00 0.15 -5.01 107.32 104.78 2vak s GLY 167 Ca 0.00 -1.06 -0.18 0.00 0.00 0.00 0.00 44.72 43.49 2vak s GLY 167 CO 0.00 -0.29 1.17 -4.14 0.00 0.00 0.00 173.10 169.84 2vak s PRO 168 N -5.70 2.92 0.11 2.90 0.02 -1.26 -4.34 135.00 129.65 2vak s PRO 168 Ca 0.72 1.67 -0.14 0.00 0.02 0.00 0.00 61.00 63.27 2vak s PRO 168 Cb -0.07 -1.94 -0.07 0.00 0.02 0.00 0.00 34.50 32.45 2vak s PRO 168 CO 0.54 -1.21 0.52 0.54 -0.33 0.00 0.00 177.00 177.06 2vak s VAL 169 N -1.84 4.89 -0.08 3.83 0.11 -1.26 -3.02 120.40 123.01 2vak s VAL 169 Ca 0.74 0.84 -0.01 0.00 -2.93 0.00 0.00 61.98 60.62 2vak s VAL 169 Cb -0.26 -3.75 -0.03 0.00 -1.53 0.00 0.00 36.38 30.81 2vak s VAL 169 CO 0.35 0.33 -0.04 -0.76 -3.33 0.00 0.00 175.10 171.65 2vak s LEU 170 N -1.72 3.34 -0.56 2.54 1.43 0.28 -4.67 118.68 119.32 2vak s LEU 170 Ca 0.34 0.03 -0.21 0.00 -1.03 0.00 0.00 54.13 53.26 2vak s LEU 170 Cb -0.16 -1.75 0.06 0.00 0.03 0.00 0.00 46.19 44.37 2vak s LEU 170 CO 0.18 0.35 0.80 -0.47 0.23 0.00 0.00 176.35 177.44 2vak s TYR 171 N -0.71 2.89 -0.34 0.29 5.04 -1.26 -1.89 117.35 121.37 2vak s TYR 171 Ca 0.11 -0.42 -0.05 0.00 -2.44 0.00 0.00 57.07 54.27 2vak s TYR 171 Cb -0.11 -3.91 0.05 0.00 0.35 0.00 0.00 41.96 38.33 2vak s TYR 171 CO 0.02 -1.28 0.10 0.08 -1.34 0.00 0.00 175.55 173.12 2vak s VAL 172 N 3.34 3.61 -0.12 3.14 1.01 0.71 -4.77 120.40 127.32 2vak s VAL 172 Ca 0.21 -1.26 -0.02 0.00 0.00 0.00 0.00 61.98 60.91 2vak s VAL 172 Cb -0.17 -3.09 0.04 0.00 0.00 0.00 0.00 36.38 33.16 2vak s VAL 172 CO 0.13 -0.21 0.01 -0.70 0.00 0.00 0.00 175.10 174.33 2vak s GLU 173 N 1.36 0.67 0.09 2.72 2.12 -1.26 -0.45 118.70 123.94 2vak s GLU 173 Ca -0.02 -0.13 0.04 0.00 0.36 0.00 0.00 54.97 55.23 2vak s GLU 173 Cb -0.20 -1.48 -0.04 0.00 0.26 0.00 0.00 34.13 32.67 2vak s GLU 173 CO 0.01 -0.44 0.03 0.95 -0.54 0.00 0.00 175.26 175.27 2vak s THR 174 N 1.91 4.20 0.07 -1.70 -4.23 -0.81 -4.67 115.64 110.41 2vak s THR 174 Ca 0.03 -0.92 -0.06 0.00 -1.18 0.00 0.00 61.69 59.56 2vak s THR 174 Cb -0.14 -3.01 -0.02 0.00 1.34 0.00 0.00 72.50 70.67 2vak s THR 174 CO -0.07 0.12 0.10 -1.66 -0.54 0.00 0.00 174.62 172.57 2vak s TRP 175 N -1.35 0.29 -0.24 3.99 -2.14 -1.26 -0.53 118.94 117.69 2vak s TRP 175 Ca 0.27 -0.74 -0.21 0.00 2.66 0.00 0.00 56.10 58.08 2vak s TRP 175 Cb -0.12 -0.19 -0.09 0.00 -3.10 0.00 0.00 33.47 29.97 2vak s TRP 175 CO 0.20 -0.46 1.02 -2.30 -2.66 0.00 0.00 176.95 172.74 2vak n PRO 176 N 0.11 0.00 -0.28 3.25 -0.02 -1.26 -2.74 135.00 134.07 2vak n PRO 176 Ca -0.15 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 2vak n PRO 176 Cb 0.61 -0.73 0.00 0.00 -0.02 0.00 0.00 33.50 33.37 2vak n PRO 176 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2vak n ASN 177 N 3.51 0.00 -0.02 2.55 0.23 -1.26 -4.94 115.26 115.32 2vak n ASN 177 Ca 0.26 0.00 -0.16 0.00 -0.53 0.00 0.00 54.58 54.15 2vak n ASN 177 Cb -0.02 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 37.56 2vak n ASN 177 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2vak h MET 178 N 0.58 0.16 -4.59 -3.83 -0.00 -1.93 -3.38 114.93 101.94 2vak h MET 178 Ca 0.00 -0.19 -0.73 0.00 -0.00 0.00 0.00 59.70 58.78 2vak h MET 178 Cb 0.00 0.06 -0.14 0.00 -0.00 0.00 0.00 31.60 31.52 2vak h MET 178 CO 0.00 0.97 1.82 -0.89 -0.00 0.00 0.00 176.91 178.81 2vak n ILE 179 N -4.48 4.16 -4.07 -0.10 5.41 -1.26 -4.82 119.36 114.20 2vak n ILE 179 Ca -0.10 -4.40 -0.05 0.00 1.00 0.00 0.00 62.75 59.20 2vak n ILE 179 Cb 0.54 -2.43 -0.02 0.00 -0.71 0.00 0.00 39.64 37.02 2vak n ILE 179 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2vak n SER 180 N 5.74 -0.16 0.00 4.38 3.41 -1.26 -4.56 113.62 121.17 2vak n SER 180 Ca 0.41 -1.53 0.00 0.00 -0.26 0.00 0.00 58.87 57.49 2vak n SER 180 Cb 0.41 0.41 0.00 0.00 -0.26 0.00 0.00 64.21 64.77 2vak n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vak n GLY 181 N -0.14 1.44 0.23 5.00 0.00 -1.26 -2.07 105.19 108.40 2vak n GLY 181 Ca 0.02 -0.53 0.16 0.00 0.00 0.00 0.00 46.02 45.66 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 0.00 -0.08 1.61 3.08 -1.99 -3.11 114.38 113.88 2vak h ARG 182 Ca 0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.87 2vak h ARG 182 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 2vak h ARG 182 CO 0.00 0.00 -0.73 1.25 -1.07 0.00 0.00 179.97 179.42 2vak h LEU 183 N 0.00 0.49 -1.43 3.04 5.85 -1.87 -1.73 115.31 119.66 2vak h LEU 183 Ca 0.00 -0.32 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 2vak h LEU 183 Cb 0.39 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 2vak h LEU 183 CO 0.00 1.06 -0.28 0.00 -0.34 0.00 0.00 178.44 178.88 2vak h ALA 184 N 0.93 1.32 -0.25 1.25 0.00 -1.34 -1.51 119.26 119.66 2vak h ALA 184 Ca -0.03 -0.25 -0.18 0.00 0.00 0.00 0.00 54.91 54.45 2vak h ALA 184 Cb 1.30 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2vak h ALA 184 CO 0.13 0.35 -0.55 -0.44 0.00 0.00 0.00 179.25 178.73 2vak h ASP 185 N 0.00 0.83 -0.66 0.00 3.32 -1.55 -1.55 116.42 116.81 2vak h ASP 185 Ca -0.00 -0.45 -0.06 0.00 0.02 0.00 0.00 57.03 56.53 2vak h ASP 185 Cb 0.57 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 2vak h ASP 185 CO 0.04 1.21 0.17 -0.25 -1.72 0.00 0.00 179.24 178.69 2vak h TRP 186 N 0.57 1.12 0.00 4.55 7.01 -0.93 0.64 115.95 128.91 2vak h TRP 186 Ca 0.01 -0.12 -0.04 0.00 2.11 0.00 0.00 58.89 60.84 2vak h TRP 186 Cb 1.14 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.87 2vak h TRP 186 CO 0.06 0.91 -0.21 0.74 -2.79 0.00 0.00 178.44 177.15 2vak h PHE 187 N 1.02 0.00 0.08 2.65 0.04 -1.29 -2.32 116.94 117.13 2vak h PHE 187 Ca 0.22 0.00 -0.27 0.00 2.80 0.00 0.00 57.97 60.71 2vak h PHE 187 Cb 0.35 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.48 2vak h PHE 187 CO 0.03 0.21 -1.37 1.98 -0.60 0.00 0.00 178.31 178.56 2vak h MET 188 N 0.00 0.16 0.00 1.51 4.05 -0.51 -3.22 114.93 116.91 2vak h MET 188 Ca -0.00 -0.27 0.00 0.00 -0.28 0.00 0.00 59.70 59.15 2vak h MET 188 Cb 0.76 0.10 0.00 0.00 -0.80 0.00 0.00 31.60 31.66 2vak h MET 188 CO 0.03 1.02 0.00 -1.13 0.23 0.00 0.00 176.91 177.06 2vak n SER 189 N -3.39 0.00 -1.99 1.39 3.41 0.22 -3.27 113.62 109.98 2vak n SER 189 Ca -0.11 0.20 -0.25 0.00 -0.26 0.00 0.00 58.87 58.45 2vak n SER 189 Cb 1.02 -0.38 0.09 0.00 -0.26 0.00 0.00 64.21 64.68 2vak n SER 189 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vak n GLN 190 N -1.38 2.78 -2.62 4.33 1.13 -0.88 -5.04 117.38 115.70 2vak n GLN 190 Ca 0.08 -3.53 -0.41 0.00 -1.94 0.00 0.00 57.00 51.21 2vak n GLN 190 Cb 0.21 -2.18 -0.04 0.00 0.11 0.00 0.00 30.24 28.33 2vak n GLN 190 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 2vak s TYR 191 N -3.60 3.73 0.00 1.08 5.04 -1.20 -3.45 117.35 118.95 2vak s TYR 191 Ca 0.56 1.72 0.00 0.00 -2.44 0.00 0.00 57.07 56.91 2vak s TYR 191 Cb 0.46 -3.16 0.00 0.00 0.35 0.00 0.00 41.96 39.61 2vak s TYR 191 CO 0.02 -0.18 0.00 0.41 -1.34 0.00 0.00 175.55 174.46 2vak n GLY 192 N 1.95 0.28 3.85 8.97 0.00 -0.04 -4.95 105.19 115.25 2vak n GLY 192 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.18 5.85 -0.11 1.61 -0.87 -1.22 -4.52 114.94 113.51 2vak s ASN 193 Ca 0.00 1.52 -0.21 0.00 -1.57 0.00 0.00 52.86 52.60 2vak s ASN 193 Cb 0.00 -2.48 -0.04 0.00 -0.02 0.00 0.00 41.25 38.71 2vak s ASN 193 CO 0.00 -1.13 0.61 0.21 -2.57 0.00 0.00 177.10 174.23 2vak s ASN 194 N -3.96 6.84 0.18 -1.22 3.84 -1.26 -0.80 114.94 118.56 2vak s ASN 194 Ca 0.57 1.01 -0.23 0.00 0.21 0.00 0.00 52.86 54.41 2vak s ASN 194 Cb -0.12 -2.36 0.09 0.00 -0.55 0.00 0.00 41.25 38.30 2vak s ASN 194 CO 0.54 -0.10 1.58 0.15 -2.79 0.00 0.00 177.10 176.47 2vak h PHE 195 N 6.86 -1.08 -1.00 0.43 3.57 -0.86 -1.60 116.94 123.26 2vak h PHE 195 Ca -0.39 0.08 0.15 0.00 3.53 0.00 0.00 57.97 61.33 2vak h PHE 195 Cb 1.18 0.55 -0.09 0.00 2.79 0.00 0.00 35.95 40.39 2vak h PHE 195 CO 0.65 -0.40 0.62 0.28 -2.23 0.00 0.00 178.31 177.23 2vak h VAL 196 N -0.19 0.84 -0.09 1.41 2.07 -1.92 -1.49 116.25 116.89 2vak h VAL 196 Ca 0.21 -0.31 -0.14 0.00 0.82 0.00 0.00 66.70 67.27 2vak h VAL 196 Cb 0.56 -0.14 -0.01 0.00 -1.52 0.00 0.00 31.29 30.18 2vak h VAL 196 CO -0.68 0.17 -0.58 -0.78 0.02 0.00 0.00 177.57 175.72 2vak h ASP 197 N 0.90 0.32 -0.62 0.57 -0.00 -1.72 -1.53 116.42 114.34 2vak h ASP 197 Ca 0.52 -0.17 -0.04 0.00 -0.00 0.00 0.00 57.03 57.34 2vak h ASP 197 Cb 0.64 -0.09 -0.03 0.00 -0.00 0.00 0.00 39.33 39.85 2vak h ASP 197 CO -0.30 0.83 0.23 0.24 -0.00 0.00 0.00 179.24 180.24 2vak h MET 198 N 0.21 0.94 -0.58 0.28 2.86 -0.50 -2.68 114.93 115.47 2vak h MET 198 Ca -0.00 -0.18 -0.09 0.00 -2.06 0.00 0.00 59.70 57.37 2vak h MET 198 Cb 1.08 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 2vak h MET 198 CO 0.09 0.81 0.01 0.00 1.06 0.00 0.00 176.91 178.88 2vak h ALA 200 N 0.98 1.33 -0.27 0.00 0.00 -1.26 0.20 119.26 120.24 2vak h ALA 200 Ca 0.16 -0.31 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 2vak h ALA 200 Cb 0.53 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.24 2vak h ALA 200 CO 0.03 0.47 -0.56 -0.09 0.00 0.00 0.00 179.25 179.09 2vak h ARG 201 N 0.15 0.85 -0.19 0.00 2.43 -1.33 -2.91 114.38 113.39 2vak h ARG 201 Ca 0.02 -0.56 -0.06 0.00 -0.81 0.00 0.00 59.98 58.57 2vak h ARG 201 Cb 0.61 0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2vak h ARG 201 CO 0.04 1.19 -0.12 -0.07 -1.51 0.00 0.00 179.97 179.51 2vak h LEU 202 N 0.63 0.43 -1.88 3.80 3.38 -1.17 -2.47 115.31 118.02 2vak h LEU 202 Ca 0.00 -0.43 0.02 0.00 0.09 0.00 0.00 57.88 57.56 2vak h LEU 202 Cb 1.18 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.81 2vak h LEU 202 CO 0.12 0.77 0.39 0.74 0.09 0.00 0.00 178.44 180.55 2vak h THR 203 N 0.09 0.06 0.00 0.22 2.02 -0.67 -1.77 112.91 112.86 2vak h THR 203 Ca 0.04 0.00 -0.33 0.00 0.77 0.00 0.00 66.41 66.89 2vak h THR 203 Cb 0.62 0.62 -0.06 0.00 -1.74 0.00 0.00 68.15 67.59 2vak h THR 203 CO 0.03 0.00 -2.02 1.67 0.37 0.00 0.00 175.52 175.57 2vak n GLN 204 N -3.00 0.66 0.13 6.66 7.27 -1.08 -4.16 117.38 123.87 2vak n GLN 204 Ca -0.00 0.16 -0.01 0.00 0.07 0.00 0.00 57.00 57.22 2vak n GLN 204 Cb 0.46 -1.67 0.23 0.00 2.41 0.00 0.00 30.24 31.67 2vak n GLN 204 CO 0.00 0.00 0.00 0.77 0.07 0.00 0.00 177.06 177.90 2vak h SER 205 N 0.00 0.10 -0.10 1.69 0.02 -0.87 -3.11 113.55 111.28 2vak h SER 205 Ca -0.41 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.49 2vak h SER 205 Cb 2.12 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 64.63 2vak h SER 205 CO 0.06 0.58 0.00 0.00 -1.14 0.00 0.00 176.83 176.32 2vak h SER 207 N 1.06 -0.24 -1.84 0.00 0.02 -1.71 -3.32 113.55 107.53 2vak h SER 207 Ca 0.00 0.02 -0.52 0.00 -0.84 0.00 0.00 61.79 60.45 2vak h SER 207 Cb 0.24 0.07 -0.07 0.00 0.14 0.00 0.00 62.40 62.78 2vak h SER 207 CO 0.00 -0.12 1.19 0.54 -1.14 0.00 0.00 176.83 177.29 2vak s ASN 208 N -2.56 5.94 0.00 3.07 2.20 -1.26 -4.95 114.94 117.39 2vak s ASN 208 Ca -0.03 -0.52 0.00 0.00 -0.94 0.00 0.00 52.86 51.36 2vak s ASN 208 Cb 0.01 -2.56 0.00 0.00 -2.00 0.00 0.00 41.25 36.70 2vak s ASN 208 CO 0.10 -1.97 0.20 0.23 -2.94 0.00 0.00 177.10 172.72 2vak n MET 209 N 9.18 0.00 0.00 3.55 2.81 -1.25 -4.92 117.12 126.49 2vak n MET 209 Ca 0.17 0.20 0.00 0.00 -1.81 0.00 0.00 57.70 56.26 2vak n MET 209 Cb 0.50 -0.44 0.00 0.00 -0.71 0.00 0.00 33.22 32.57 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 -0.60 0.00 -4.03 0.03 -0.02 -1.26 -4.72 135.00 124.39 2vak n PRO 210 Ca 0.00 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.16 2vak n PRO 210 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 33.50 33.33 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 0.00 2.07 -0.11 -1.45 1.01 -1.26 -5.02 120.40 115.63 2vak s VAL 211 Ca 0.00 -1.70 -0.05 0.00 0.00 0.00 0.00 61.98 60.22 2vak s VAL 211 Cb 0.00 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 2vak s VAL 211 CO 0.00 -0.16 0.08 -0.70 0.00 0.00 0.00 175.10 174.32 2vak s GLU 212 N 1.12 3.34 0.24 2.72 2.12 -1.26 -4.83 118.70 122.14 2vak s GLU 212 Ca -0.04 -0.25 -0.31 0.00 0.36 0.00 0.00 54.97 54.73 2vak s GLU 212 Cb -0.20 -3.05 -0.14 0.00 0.26 0.00 0.00 34.13 31.00 2vak s GLU 212 CO -0.06 0.70 1.31 -2.30 -0.54 0.00 0.00 175.26 174.37 2vak n PRO 213 N 2.20 1.78 -0.78 4.30 -0.02 -1.26 -2.08 135.00 139.13 2vak n PRO 213 Ca -0.19 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 2vak n PRO 213 Cb 0.54 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 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 1.93 0.00 -3.29 2.55 10.43 -1.26 -5.01 116.55 121.90 2vak n ASP 214 Ca 0.12 0.00 -0.22 0.00 2.57 0.00 0.00 54.79 57.26 2vak n ASP 214 Cb 0.30 -1.07 0.17 0.00 1.84 0.00 0.00 41.12 42.37 2vak n ASP 214 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2vak n GLY 215 N -2.00 -2.41 0.10 0.44 0.00 -0.88 -4.79 105.19 95.64 2vak n GLY 215 Ca 0.00 -1.53 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 2vak n GLY 215 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vak h ASN 216 N -2.05 -0.13 -0.48 1.61 2.35 -1.95 -2.19 115.58 112.75 2vak h ASN 216 Ca -0.30 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.47 2vak h ASN 216 Cb 0.90 0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.27 2vak h ASN 216 CO 0.20 -0.08 0.26 1.88 -1.65 0.00 0.00 177.43 178.04 2vak h TYR 217 N -0.17 0.48 -0.61 1.19 0.05 -1.94 0.47 116.97 116.44 2vak h TYR 217 Ca -0.02 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.83 2vak h TYR 217 Cb 0.13 -0.14 -0.05 0.00 1.01 0.00 0.00 36.73 37.68 2vak h TYR 217 CO -0.07 0.25 0.33 0.22 -1.05 0.00 0.00 178.16 177.85 2vak h ASP 218 N 0.51 0.49 0.01 3.88 3.58 -1.79 -2.09 116.42 121.02 2vak h ASP 218 Ca 0.20 0.03 -0.23 0.00 0.42 0.00 0.00 57.03 57.45 2vak h ASP 218 Cb 0.08 -0.07 0.01 0.00 1.72 0.00 0.00 39.33 41.07 2vak h ASP 218 CO -0.13 0.33 -0.86 1.56 -2.88 0.00 0.00 179.24 177.26 2vak h GLN 219 N 0.63 0.67 -0.26 0.28 4.20 -0.97 -1.52 115.11 118.14 2vak h GLN 219 Ca 0.27 -0.61 0.03 0.00 0.06 0.00 0.00 58.65 58.40 2vak h GLN 219 Cb 0.15 0.15 -0.04 0.00 0.30 0.00 0.00 27.48 28.04 2vak h GLN 219 CO -0.17 1.21 -0.21 1.96 -0.67 0.00 0.00 178.83 180.96 2vak h GLN 220 N 0.43 -0.07 -0.95 1.46 7.50 -0.86 -2.51 115.11 120.12 2vak h GLN 220 Ca -0.07 0.00 0.05 0.00 0.50 0.00 0.00 58.65 59.13 2vak h GLN 220 Cb 1.49 0.02 -0.06 0.00 0.05 0.00 0.00 27.48 28.98 2vak h GLN 220 CO 0.17 -0.05 0.61 0.52 -1.50 0.00 0.00 178.83 178.58 2vak h MET 221 N -0.07 1.13 -0.25 1.46 2.86 -1.27 -1.36 114.93 117.42 2vak h MET 221 Ca 0.04 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.54 2vak h MET 221 Cb 0.19 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 2vak h MET 221 CO -0.29 0.74 -0.15 0.00 1.06 0.00 0.00 176.91 178.28 2vak h ARG 222 N 1.16 0.55 -0.23 1.72 3.08 -1.22 -0.94 114.38 118.50 2vak h ARG 222 Ca 0.39 -0.25 -0.18 0.00 0.07 0.00 0.00 59.98 60.01 2vak h ARG 222 Cb 0.06 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.10 2vak h ARG 222 CO -0.14 0.82 -0.56 0.00 -1.07 0.00 0.00 179.97 179.02 2vak h ALA 223 N 0.71 0.37 -0.27 0.04 0.00 -1.39 -2.90 119.26 115.82 2vak h ALA 223 Ca 0.05 -0.52 0.06 0.00 0.00 0.00 0.00 54.91 54.51 2vak h ALA 223 Cb 0.67 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 18.33 2vak h ALA 223 CO 0.04 0.60 -0.32 1.25 0.00 0.00 0.00 179.25 180.81 2vak h LEU 224 N 0.52 -1.05 -0.25 0.00 5.85 -1.22 0.58 115.31 119.75 2vak h LEU 224 Ca -0.01 0.17 0.04 0.00 0.84 0.00 0.00 57.88 58.93 2vak h LEU 224 Cb 1.17 0.47 -0.04 0.00 0.37 0.00 0.00 40.66 42.63 2vak h LEU 224 CO 0.12 -0.34 -0.00 0.40 -0.34 0.00 0.00 178.44 178.28 2vak h ILE 225 N -0.32 0.82 0.00 4.05 2.04 -1.22 -2.80 117.51 120.07 2vak h ILE 225 Ca 0.13 -0.02 -0.20 0.00 1.00 0.00 0.00 64.86 65.77 2vak h ILE 225 Cb 0.54 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.33 2vak h ILE 225 CO -0.45 0.01 -1.10 0.77 0.00 0.00 0.00 178.15 177.38 2vak h SER 226 N 0.07 0.00 -0.15 1.72 4.64 -1.25 -2.39 113.55 116.20 2vak h SER 226 Ca 0.12 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.48 2vak h SER 226 Cb 0.15 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.20 2vak h SER 226 CO -0.20 0.81 -0.12 0.25 -0.87 0.00 0.00 176.83 176.71 2vak h LEU 227 N 0.00 -0.37 -0.70 5.97 5.85 0.13 -2.67 115.31 123.53 2vak h LEU 227 Ca -0.09 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 2vak h LEU 227 Cb 1.70 0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.89 2vak h LEU 227 CO 0.09 -0.15 0.31 -0.25 -0.34 0.00 0.00 178.44 178.09 2vak h TRP 228 N -0.13 1.04 -0.34 1.25 7.01 -1.47 -2.46 115.95 120.85 2vak h TRP 228 Ca 0.09 -0.07 -0.13 0.00 2.11 0.00 0.00 58.89 60.90 2vak h TRP 228 Cb 0.26 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.00 2vak h TRP 228 CO -0.25 0.79 -0.32 1.25 -2.79 0.00 0.00 178.44 177.13 2vak h LEU 229 N 0.99 0.78 -0.67 0.65 5.85 -1.34 0.29 115.31 121.86 2vak h LEU 229 Ca 0.24 -0.32 -0.11 0.00 0.84 0.00 0.00 57.88 58.53 2vak h LEU 229 Cb 0.17 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2vak h LEU 229 CO -0.02 1.04 -0.13 -0.07 -0.34 0.00 0.00 178.44 178.91 2vak h LEU 230 N 0.63 0.90 -0.65 2.25 3.38 -1.38 -0.37 115.31 120.07 2vak h LEU 230 Ca 0.07 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.74 2vak h LEU 230 Cb 0.85 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 2vak h LEU 230 CO 0.07 1.04 0.39 0.28 0.09 0.00 0.00 178.44 180.31 2vak h SER 231 N 0.80 0.78 0.67 -0.43 0.02 -1.25 -1.45 113.55 112.70 2vak h SER 231 Ca 0.13 -0.07 -0.03 0.00 -0.84 0.00 0.00 61.79 60.98 2vak h SER 231 Cb 0.66 -0.20 -0.00 0.00 0.14 0.00 0.00 62.40 63.00 2vak h SER 231 CO 0.05 0.62 -0.16 0.22 -1.14 0.00 0.00 176.83 176.42 2vak h TYR 232 N 0.88 0.00 -0.30 3.45 3.20 0.20 -2.80 116.97 121.61 2vak h TYR 232 Ca 0.23 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.10 2vak h TYR 232 Cb -0.02 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.25 2vak h TYR 232 CO -0.02 0.16 0.00 0.44 -1.64 0.00 0.00 178.16 177.11 2vak n ILE 233 N -3.46 0.61 -0.13 1.81 -5.35 -0.21 -4.83 119.36 107.80 2vak n ILE 233 Ca -0.01 -0.80 0.00 0.00 -0.27 0.00 0.00 62.75 61.67 2vak n ILE 233 Cb 0.33 0.82 0.00 0.00 -1.74 0.00 0.00 39.64 39.05 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 0.87 1.82 0.19 3.28 0.00 -1.06 -4.25 105.19 106.04 2vak n GLY 234 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 2vak n GLY 234 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2vak h VAL 235 N 0.00 1.35 -2.72 1.61 -1.51 -1.75 -3.42 116.25 109.81 2vak h VAL 235 Ca 0.00 -2.09 -0.66 0.00 -1.23 0.00 0.00 66.70 62.72 2vak h VAL 235 Cb 0.00 2.07 -0.06 0.00 -2.13 0.00 0.00 31.29 31.17 2vak h VAL 235 CO 0.00 0.64 -0.46 -0.69 -1.23 0.00 0.00 177.57 175.83 2vak s VAL 236 N -3.65 5.45 0.00 7.19 1.01 -0.58 -4.94 120.40 124.87 2vak s VAL 236 Ca -0.07 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2vak s VAL 236 Cb 0.10 -3.47 0.00 0.00 0.00 0.00 0.00 36.38 33.01 2vak s VAL 236 CO 0.86 0.52 0.00 -0.46 0.00 0.00 0.00 175.10 176.01 2vak n ASN 237 N 1.62 0.00 0.01 3.32 0.23 -0.70 -4.05 115.26 115.69 2vak n ASN 237 Ca -0.16 0.00 -0.18 0.00 -0.53 0.00 0.00 54.58 53.71 2vak n ASN 237 Cb 0.54 0.00 -0.13 0.00 -2.08 0.00 0.00 39.78 38.11 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 0.28 0.00 -3.83 4.15 -1.97 -3.24 115.11 110.50 2vak h GLN 238 Ca 0.00 -0.37 0.00 0.00 0.77 0.00 0.00 58.65 59.05 2vak h GLN 238 Cb 0.00 0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.81 2vak h GLN 238 CO 0.00 1.11 0.00 0.25 -1.93 0.00 0.00 178.83 178.26 2vak n THR 239 N -4.28 0.00 -3.09 2.39 -2.24 -1.26 -4.67 114.28 101.13 2vak n THR 239 Ca -0.11 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.56 2vak n THR 239 Cb 0.67 -0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 68.37 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 -2.04 -0.38 0.50 3.42 2.47 -1.22 -2.10 114.94 115.58 2vak s ASN 240 Ca 0.46 -1.79 0.06 0.00 0.42 0.00 0.00 52.86 52.01 2vak s ASN 240 Cb 0.22 1.19 0.01 0.00 -1.45 0.00 0.00 41.25 41.22 2vak s ASN 240 CO 0.38 -0.14 0.33 0.42 -3.72 0.00 0.00 177.10 174.37 2vak s THR 241 N 1.01 1.87 -0.42 -5.21 -4.23 -0.31 -1.72 115.64 106.63 2vak s THR 241 Ca 0.25 -1.54 -0.01 0.00 -1.18 0.00 0.00 61.69 59.21 2vak s THR 241 Cb -0.03 -2.41 0.11 0.00 1.34 0.00 0.00 72.50 71.51 2vak s THR 241 CO -0.08 0.00 0.20 -0.63 -0.54 0.00 0.00 174.62 173.57 2vak s ILE 242 N -2.71 3.06 -1.50 2.99 1.01 -0.13 -1.32 121.20 122.60 2vak s ILE 242 Ca 0.35 -2.30 -0.08 0.00 0.00 0.00 0.00 60.65 58.62 2vak s ILE 242 Cb -0.01 -3.12 0.06 0.00 0.01 0.00 0.00 42.46 39.40 2vak s ILE 242 CO 0.21 -0.70 0.68 -1.20 0.00 0.00 0.00 174.94 173.93 2vak n SER 243 N 4.30 -2.24 0.00 3.58 7.64 -1.26 -2.17 113.62 123.47 2vak n SER 243 Ca 0.01 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.95 2vak n SER 243 Cb 0.41 -3.29 0.00 0.00 -1.01 0.00 0.00 64.21 60.32 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 -1.71 2.97 3.81 0.23 0.00 -1.26 -5.02 105.19 104.20 2vak n GLY 244 Ca -0.13 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.57 3.26 0.21 1.61 0.08 -0.92 -2.25 117.98 119.40 2vak s PHE 245 Ca 0.00 1.61 -0.22 0.00 0.12 0.00 0.00 56.93 58.45 2vak s PHE 245 Cb 0.00 -2.91 0.05 0.00 -0.57 0.00 0.00 43.02 39.59 2vak s PHE 245 CO 0.00 -0.27 0.64 1.52 -0.10 0.00 0.00 175.22 177.01 2vak s TYR 246 N -2.09 -0.37 0.20 0.36 1.13 -0.29 -0.95 117.35 115.34 2vak s TYR 246 Ca 0.62 0.05 0.05 0.00 -1.41 0.00 0.00 57.07 56.38 2vak s TYR 246 Cb -0.12 0.60 -0.03 0.00 -1.10 0.00 0.00 41.96 41.31 2vak s TYR 246 CO 0.16 -1.01 0.24 -0.06 -2.51 0.00 0.00 175.55 172.37 2vak s PHE 247 N -3.83 3.30 -0.10 -3.49 0.40 -1.26 -0.55 117.98 112.46 2vak s PHE 247 Ca 0.06 -0.00 -0.11 0.00 -0.60 0.00 0.00 56.93 56.28 2vak s PHE 247 Cb -0.03 -1.54 0.03 0.00 0.51 0.00 0.00 43.02 41.99 2vak s PHE 247 CO -0.04 0.50 0.29 0.45 0.70 0.00 0.00 175.22 177.12 2vak s SER 248 N -3.49 -0.29 -0.04 1.36 0.15 -0.60 -4.88 113.70 105.91 2vak s SER 248 Ca 0.33 0.52 0.03 0.00 0.70 0.00 0.00 55.95 57.53 2vak s SER 248 Cb -0.10 0.57 0.00 0.00 -1.71 0.00 0.00 66.02 64.78 2vak s SER 248 CO 0.26 -0.14 -0.11 -0.55 1.20 0.00 0.00 173.24 173.90 2vak s SER 249 N -0.02 1.52 -0.02 5.45 0.15 -1.25 -2.62 113.70 116.91 2vak s SER 249 Ca -0.02 -0.24 -0.22 0.00 0.70 0.00 0.00 55.95 56.17 2vak s SER 249 Cb -0.03 -0.49 -0.15 0.00 -1.71 0.00 0.00 66.02 63.65 2vak s SER 249 CO 0.01 0.07 1.01 0.11 1.20 0.00 0.00 173.24 175.64 2vak h LYS 250 N 6.52 -0.42 -7.36 5.44 6.56 -1.95 -3.43 116.57 121.92 2vak h LYS 250 Ca -0.33 0.03 -0.51 0.00 -1.06 0.00 0.00 60.65 58.78 2vak h LYS 250 Cb 1.17 0.09 0.08 0.00 -0.57 0.00 0.00 32.23 33.01 2vak h LYS 250 CO 0.48 -0.09 0.39 0.95 -2.06 0.00 0.00 179.45 179.12 2vak s THR 251 N -4.07 4.11 -0.27 -0.16 -4.23 -1.26 -5.09 115.64 104.66 2vak s THR 251 Ca -0.13 0.68 -0.01 0.00 -1.18 0.00 0.00 61.69 61.06 2vak s THR 251 Cb 0.01 -3.52 0.13 0.00 1.34 0.00 0.00 72.50 70.46 2vak s THR 251 CO 0.46 -0.89 0.31 -0.60 -0.54 0.00 0.00 174.62 173.36 2vak s ARG 252 N -5.12 0.32 0.00 3.99 6.06 -1.26 -4.73 118.95 118.21 2vak s ARG 252 Ca 0.57 0.05 0.00 0.00 -2.50 0.00 0.00 55.73 53.85 2vak s ARG 252 Cb -0.13 -0.68 0.00 0.00 0.06 0.00 0.00 34.95 34.20 2vak s ARG 252 CO 0.54 -0.91 0.00 0.41 -2.50 0.00 0.00 175.30 172.84 2vak n GLY 253 N 5.33 0.85 3.69 8.12 0.00 -1.26 -4.50 105.19 117.41 2vak n GLY 253 Ca -0.03 -0.52 -0.31 0.00 0.00 0.00 0.00 46.02 45.17 2vak n GLY 253 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2vak s GLN 254 N -1.49 2.09 0.25 1.61 -0.21 -1.26 -4.42 119.66 116.23 2vak s GLN 254 Ca 0.00 -2.29 -0.03 0.00 0.02 0.00 0.00 55.36 53.06 2vak s GLN 254 Cb 0.00 -1.42 0.51 0.00 1.00 0.00 0.00 33.01 33.10 2vak s GLN 254 CO 0.00 -0.30 1.71 0.00 -2.12 0.00 0.00 175.29 174.59 2vak h ALA 255 N 1.53 1.11 0.00 6.09 0.00 -1.96 -3.17 119.26 122.86 2vak h ALA 255 Ca -0.43 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2vak h ALA 255 Cb 1.29 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2vak h ALA 255 CO 0.74 -0.26 0.00 1.28 0.00 0.00 0.00 179.25 181.01 2vak n LEU 256 N -5.04 0.56 -4.67 0.00 4.77 -1.26 -4.92 117.00 106.44 2vak n LEU 256 Ca 0.16 0.58 -0.65 0.00 -0.03 0.00 0.00 56.01 56.07 2vak n LEU 256 Cb 0.47 -0.44 -0.10 0.00 -2.33 0.00 0.00 43.42 41.02 2vak n LEU 256 CO 0.16 -0.27 1.27 0.47 -1.33 0.00 0.00 177.39 177.69 2vak n ASP 257 N -2.06 1.34 -4.20 -1.43 10.43 -1.20 -4.88 116.55 114.55 2vak n ASP 257 Ca 0.05 1.09 -0.26 0.00 2.57 0.00 0.00 54.79 58.24 2vak n ASP 257 Cb 0.33 -0.93 -0.15 0.00 1.84 0.00 0.00 41.12 42.21 2vak n ASP 257 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 2vak s SER 258 N 3.59 2.25 -0.35 -2.24 0.01 -1.26 -5.05 113.70 110.64 2vak s SER 258 Ca 1.06 -0.38 -0.09 0.00 1.31 0.00 0.00 55.95 57.86 2vak s SER 258 Cb -1.42 -0.24 0.03 0.00 0.21 0.00 0.00 66.02 64.60 2vak s SER 258 CO 0.77 0.22 0.15 0.26 0.41 0.00 0.00 173.24 175.05 2vak s TRP 259 N -0.52 3.24 0.02 2.43 0.52 -1.26 -3.90 118.94 119.47 2vak s TRP 259 Ca 0.07 -1.13 0.05 0.00 0.02 0.00 0.00 56.10 55.12 2vak s TRP 259 Cb -0.08 -2.36 -0.03 0.00 -1.15 0.00 0.00 33.47 29.86 2vak s TRP 259 CO -0.00 -0.67 -0.14 0.95 0.02 0.00 0.00 176.95 177.11 2vak s THR 260 N 1.49 3.08 -0.25 2.01 -4.23 -1.08 -0.07 115.64 116.59 2vak s THR 260 Ca 0.01 -1.00 -0.21 0.00 -1.18 0.00 0.00 61.69 59.30 2vak s THR 260 Cb -0.19 -2.30 -0.02 0.00 1.34 0.00 0.00 72.50 71.34 2vak s THR 260 CO 0.05 0.39 0.67 -0.22 -0.54 0.00 0.00 174.62 174.97 2vak s LEU 261 N -1.33 4.07 0.09 4.79 2.96 0.02 -1.55 118.68 127.72 2vak s LEU 261 Ca 0.15 0.78 0.07 0.00 -0.22 0.00 0.00 54.13 54.91 2vak s LEU 261 Cb -0.11 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.62 2vak s LEU 261 CO 0.05 -0.40 -0.18 -0.36 -1.32 0.00 0.00 176.35 174.14 2vak s PHE 262 N 2.58 1.57 -0.06 5.38 0.08 0.29 -0.86 117.98 126.96 2vak s PHE 262 Ca 0.28 -0.44 0.02 0.00 0.12 0.00 0.00 56.93 56.92 2vak s PHE 262 Cb -0.15 -0.87 0.01 0.00 -0.57 0.00 0.00 43.02 41.44 2vak s PHE 262 CO 0.08 0.15 -0.11 -0.47 -0.10 0.00 0.00 175.22 174.77 2vak s TYR 263 N -1.23 1.32 0.00 0.36 5.04 -1.26 -1.13 117.35 120.45 2vak s TYR 263 Ca 0.03 -0.45 0.02 0.00 -2.44 0.00 0.00 57.07 54.23 2vak s TYR 263 Cb -0.10 -0.97 -0.04 0.00 0.35 0.00 0.00 41.96 41.20 2vak s TYR 263 CO 0.04 -0.23 -0.01 -0.08 -1.34 0.00 0.00 175.55 173.92 2vak s THR 264 N 0.59 4.04 -0.03 4.34 -1.32 -0.95 -5.00 115.64 117.30 2vak s THR 264 Ca -0.12 -0.65 0.16 0.00 -1.21 0.00 0.00 61.69 59.87 2vak s THR 264 Cb -0.14 -2.80 -0.24 0.00 -1.51 0.00 0.00 72.50 67.81 2vak s THR 264 CO 0.03 0.37 0.33 1.07 -2.21 0.00 0.00 174.62 174.21 2vak n THR 265 N 1.40 0.09 -0.06 5.08 5.66 -1.26 -4.62 114.28 120.58 2vak n THR 265 Ca -0.15 -0.39 -0.04 0.00 -3.05 0.00 0.00 64.05 60.42 2vak n THR 265 Cb 0.53 0.07 -0.12 0.00 -1.55 0.00 0.00 70.33 69.25 2vak n THR 265 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 175.07 171.56 2vak n ASN 266 N -2.10 1.24 -4.99 1.09 6.94 -1.26 -5.04 115.26 111.12 2vak n ASN 266 Ca -0.05 0.00 -0.18 0.00 -0.02 0.00 0.00 54.58 54.33 2vak n ASN 266 Cb 0.47 1.08 0.03 0.00 -2.36 0.00 0.00 39.78 39.00 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 -2.55 2.73 0.39 5.53 -4.23 -1.26 -5.06 115.64 111.19 2vak s THR 267 Ca -0.07 -0.93 -0.26 0.00 -1.18 0.00 0.00 61.69 59.24 2vak s THR 267 Cb 0.06 -2.80 -0.11 0.00 1.34 0.00 0.00 72.50 71.00 2vak s THR 267 CO 0.64 0.00 1.25 -3.20 -0.54 0.00 0.00 174.62 172.77 2vak n ASN 268 N -2.05 2.49 -4.33 3.99 5.15 -0.89 -4.85 115.26 114.76 2vak n ASN 268 Ca 0.10 1.14 -0.30 0.00 -0.60 0.00 0.00 54.58 54.91 2vak n ASN 268 Cb 0.60 -1.48 -0.15 0.00 -0.53 0.00 0.00 39.78 38.22 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 -2.07 1.91 0.44 1.20 0.52 -1.26 -1.16 118.95 118.53 2vak s ARG 269 Ca 0.59 -1.05 -0.24 0.00 -0.52 0.00 0.00 55.73 54.52 2vak s ARG 269 Cb -0.53 -2.00 -0.08 0.00 0.52 0.00 0.00 34.95 32.86 2vak s ARG 269 CO 0.59 0.53 1.20 0.08 0.02 0.00 0.00 175.30 177.72 2vak s VAL 270 N -0.74 2.97 -0.64 3.52 1.01 -0.44 -4.90 120.40 121.18 2vak s VAL 270 Ca 0.11 0.77 0.05 0.00 0.00 0.00 0.00 61.98 62.91 2vak s VAL 270 Cb -0.10 -3.41 0.21 0.00 0.00 0.00 0.00 36.38 33.08 2vak s VAL 270 CO 0.01 0.03 0.58 0.00 0.00 0.00 0.00 175.10 175.72 2vak n GLN 271 N -0.31 1.90 -2.08 2.72 6.02 -1.26 -4.81 117.38 119.57 2vak n GLN 271 Ca 0.06 -4.38 -0.43 0.00 -0.01 0.00 0.00 57.00 52.25 2vak n GLN 271 Cb 0.47 -2.16 -0.03 0.00 1.02 0.00 0.00 30.24 29.54 2vak n GLN 271 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2vak s ILE 272 N -1.72 3.63 0.00 5.09 1.01 -1.26 -3.91 121.20 124.03 2vak s ILE 272 Ca 0.32 0.70 0.00 0.00 0.00 0.00 0.00 60.65 61.66 2vak s ILE 272 Cb 0.05 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.84 2vak s ILE 272 CO -0.11 -0.32 0.02 0.41 0.00 0.00 0.00 174.94 174.94 2vak n THR 273 N 6.63 0.00 -2.44 2.92 -1.04 -1.26 -4.17 114.28 114.91 2vak n THR 273 Ca 0.20 0.11 -0.29 0.00 -2.04 0.00 0.00 64.05 62.03 2vak n THR 273 Cb 0.45 -0.30 -0.00 0.00 -1.82 0.00 0.00 70.33 68.66 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 -0.04 3.58 0.43 -2.82 1.03 -1.26 -4.03 119.66 116.55 2vak s GLN 274 Ca 0.00 0.37 -0.25 0.00 0.04 0.00 0.00 55.36 55.52 2vak s GLN 274 Cb 0.00 -2.29 -0.08 0.00 0.03 0.00 0.00 33.01 30.66 2vak s GLN 274 CO 0.00 -0.29 1.34 0.50 -2.54 0.00 0.00 175.29 174.29 2vak s ARG 275 N -4.80 3.81 -0.01 9.60 3.52 -1.26 -4.59 118.95 125.21 2vak s ARG 275 Ca 0.50 2.22 0.06 0.00 -0.13 0.00 0.00 55.73 58.38 2vak s ARG 275 Cb -0.10 -2.67 -0.02 0.00 -1.56 0.00 0.00 34.95 30.60 2vak s ARG 275 CO 0.46 -0.65 -0.19 -1.01 -0.81 0.00 0.00 175.30 173.11 2vak s HIS 276 N -1.26 1.70 -0.01 5.12 3.76 0.31 -4.97 115.29 119.93 2vak s HIS 276 Ca 0.60 -0.32 0.00 0.00 -0.15 0.00 0.00 55.06 55.19 2vak s HIS 276 Cb -0.39 -1.09 0.01 0.00 1.11 0.00 0.00 32.58 32.22 2vak s HIS 276 CO 0.50 -0.02 -0.00 0.12 -0.85 0.00 0.00 174.74 174.49 2vak s PHE 277 N -0.47 0.16 -0.02 1.40 5.36 -1.26 -1.92 117.98 121.23 2vak s PHE 277 Ca 0.07 0.01 -0.06 0.00 -0.96 0.00 0.00 56.93 55.99 2vak s PHE 277 Cb -0.07 -0.18 0.00 0.00 -0.34 0.00 0.00 43.02 42.43 2vak s PHE 277 CO -0.01 -0.04 0.13 0.00 -1.46 0.00 0.00 175.22 173.84 2vak s ALA 278 N 0.38 -0.31 -0.25 11.12 0.00 0.40 -5.02 121.76 128.09 2vak s ALA 278 Ca -0.03 0.03 -0.19 0.00 0.00 0.00 0.00 51.96 51.76 2vak s ALA 278 Cb -0.06 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 2vak s ALA 278 CO -0.01 -0.16 0.59 0.71 0.00 0.00 0.00 175.76 176.89 2vak s TYR 279 N -0.87 3.29 -0.13 0.00 2.02 -1.25 -0.20 117.35 120.20 2vak s TYR 279 Ca -0.10 0.77 0.01 0.00 -0.37 0.00 0.00 57.07 57.38 2vak s TYR 279 Cb -0.05 -2.79 0.02 0.00 -0.40 0.00 0.00 41.96 38.74 2vak s TYR 279 CO 0.01 -0.28 -0.17 0.08 -1.57 0.00 0.00 175.55 173.62 2vak s VAL 280 N 2.33 1.68 0.25 0.71 1.01 -0.79 -0.44 120.40 125.15 2vak s VAL 280 Ca 0.25 -0.73 0.10 0.00 0.00 0.00 0.00 61.98 61.60 2vak s VAL 280 Cb -0.16 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.65 2vak s VAL 280 CO 0.09 0.48 -0.10 0.00 0.00 0.00 0.00 175.10 175.57 2vak s ALA 282 N -2.19 3.25 -0.06 0.00 0.00 -1.17 -1.18 121.76 120.42 2vak s ALA 282 Ca 0.29 0.66 -0.24 0.00 0.00 0.00 0.00 51.96 52.66 2vak s ALA 282 Cb -0.07 -3.38 -0.25 0.00 0.00 0.00 0.00 23.12 19.43 2vak s ALA 282 CO 0.17 -0.31 0.98 -0.09 0.00 0.00 0.00 175.76 176.51 2vak h ARG 283 N 6.79 0.18 -6.41 0.00 2.43 -0.87 0.47 114.38 116.97 2vak h ARG 283 Ca -0.41 -0.22 -0.54 0.00 -0.81 0.00 0.00 59.98 57.99 2vak h ARG 283 Cb 1.22 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.80 2vak h ARG 283 CO 0.77 0.99 0.02 -1.54 -1.51 0.00 0.00 179.97 178.70 2vak s SER 284 N -6.42 7.03 0.64 -3.80 1.04 -1.25 -4.50 113.70 106.44 2vak s SER 284 Ca -0.16 1.31 0.29 0.00 0.48 0.00 0.00 55.95 57.87 2vak s SER 284 Cb 0.01 -2.38 1.53 0.00 0.10 0.00 0.00 66.02 65.28 2vak s SER 284 CO 0.75 0.13 1.89 -0.65 0.98 0.00 0.00 173.24 176.35 2vak h PRO 285 N 3.84 0.00 0.00 4.02 0.11 -1.92 -2.46 132.00 135.59 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 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2vak h PRO 285 CO 0.65 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.04 2vak n ASP 286 N -3.20 0.00 0.17 -2.05 5.68 -1.26 -1.93 116.55 113.96 2vak n ASP 286 Ca 0.02 -0.50 0.03 0.00 -0.50 0.00 0.00 54.79 53.84 2vak n ASP 286 Cb 0.50 0.00 0.42 0.00 -1.14 0.00 0.00 41.12 40.90 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 0.12 -1.10 2.11 5.08 -1.82 -3.01 115.95 117.33 2vak h TRP 287 Ca 0.00 -0.01 0.30 0.00 1.08 0.00 0.00 58.89 60.26 2vak h TRP 287 Cb 0.00 -0.03 -0.07 0.00 -3.00 0.00 0.00 29.16 26.06 2vak h TRP 287 CO 0.00 0.31 0.75 -0.91 -1.28 0.00 0.00 178.44 177.31 2vak h ASN 288 N 0.10 0.22 -0.00 0.11 2.35 -1.67 -0.87 115.58 115.83 2vak h ASN 288 Ca 0.02 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 2vak h ASN 288 Cb 0.42 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.80 2vak h ASN 288 CO 0.03 0.04 -0.80 0.55 -1.65 0.00 0.00 177.43 175.59 2vak n VAL 289 N -4.42 0.00 -2.77 2.81 3.14 -1.14 -0.67 118.33 115.27 2vak n VAL 289 Ca 0.25 -0.10 -0.43 0.00 -2.96 0.00 0.00 64.34 61.11 2vak n VAL 289 Cb 1.05 1.04 -0.03 0.00 -1.06 0.00 0.00 33.84 34.83 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 -2.68 6.21 0.53 6.55 -1.08 -0.33 -4.86 116.67 121.02 2vak s ASP 290 Ca 0.09 -0.95 0.31 0.00 -0.52 0.00 0.00 52.55 51.48 2vak s ASP 290 Cb 0.14 -2.46 1.41 0.00 -1.46 0.00 0.00 42.92 40.56 2vak s ASP 290 CO 0.72 -1.52 2.01 0.11 0.52 0.00 0.00 175.17 177.02 2vak h LYS 291 N 9.64 0.00 0.07 4.34 1.57 -1.88 -2.26 116.57 128.05 2vak h LYS 291 Ca -0.24 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.40 2vak h LYS 291 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.37 2vak h LYS 291 CO 1.21 0.08 -0.69 0.77 -0.57 0.00 0.00 179.45 180.25 2vak h SER 292 N 0.00 0.23 -0.14 0.86 0.02 -1.94 -1.92 113.55 110.66 2vak h SER 292 Ca -0.00 -0.90 0.03 0.00 -0.84 0.00 0.00 61.79 60.08 2vak h SER 292 Cb 0.47 -0.08 -0.05 0.00 0.14 0.00 0.00 62.40 62.88 2vak h SER 292 CO 0.01 1.31 -0.44 -0.25 -1.14 0.00 0.00 176.83 176.32 2vak h TRP 293 N -0.65 -1.31 -0.94 3.45 2.91 -1.92 -1.56 115.95 115.92 2vak h TRP 293 Ca -0.15 0.05 0.27 0.00 1.13 0.00 0.00 58.89 60.20 2vak h TRP 293 Cb 1.40 0.59 -0.14 0.00 -0.51 0.00 0.00 29.16 30.50 2vak h TRP 293 CO 0.20 -0.43 0.40 0.82 -1.03 0.00 0.00 178.44 178.40 2vak h ILE 294 N -0.45 0.33 -0.43 2.65 2.04 -1.50 0.14 117.51 120.29 2vak h ILE 294 Ca 0.03 -0.10 -0.11 0.00 1.00 0.00 0.00 64.86 65.68 2vak h ILE 294 Cb 0.54 0.01 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2vak h ILE 294 CO -0.37 0.05 -0.16 0.00 0.00 0.00 0.00 178.15 177.67 2vak h ALA 295 N 1.81 0.59 -0.25 1.87 0.00 -0.80 -1.72 119.26 120.76 2vak h ALA 295 Ca 0.63 -0.36 -0.11 0.00 0.00 0.00 0.00 54.91 55.08 2vak h ALA 295 Cb 1.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 2vak h ALA 295 CO -0.62 0.52 -0.33 0.00 0.00 0.00 0.00 179.25 178.83 2vak h ALA 296 N 0.84 0.98 -0.46 0.00 0.00 -0.27 -2.70 119.26 117.65 2vak h ALA 296 Ca 0.10 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2vak h ALA 296 Cb 0.71 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2vak h ALA 296 CO 0.05 0.60 0.20 0.00 0.00 0.00 0.00 179.25 180.11 2vak h ALA 297 N 1.21 1.49 -0.28 0.00 0.00 -0.50 1.00 119.26 122.17 2vak h ALA 297 Ca 0.05 -0.11 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 2vak h ALA 297 Cb 0.79 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2vak h ALA 297 CO 0.06 0.40 -0.21 -0.91 0.00 0.00 0.00 179.25 178.59 2vak h ASN 298 N 0.65 0.67 -0.66 0.00 2.35 -1.19 -2.79 115.58 114.60 2vak h ASN 298 Ca 0.16 -0.44 -0.06 0.00 -0.55 0.00 0.00 56.30 55.41 2vak h ASN 298 Cb 0.10 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 2vak h ASN 298 CO -0.02 0.97 0.20 -0.07 -1.65 0.00 0.00 177.43 176.86 2vak h LEU 299 N 0.37 0.99 -0.89 1.61 3.38 -1.32 -2.69 115.31 116.76 2vak h LEU 299 Ca 0.05 -0.18 0.16 0.00 0.09 0.00 0.00 57.88 58.00 2vak h LEU 299 Cb 0.75 -0.26 -0.10 0.00 0.09 0.00 0.00 40.66 41.14 2vak h LEU 299 CO 0.06 0.93 0.47 0.74 0.09 0.00 0.00 178.44 180.73 2vak h THR 300 N 1.02 0.71 -0.64 0.22 2.02 -0.70 0.39 112.91 115.92 2vak h THR 300 Ca 0.22 -0.22 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 2vak h THR 300 Cb 0.31 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.70 2vak h THR 300 CO -0.01 0.12 0.12 0.00 0.37 0.00 0.00 175.52 176.12 2vak h ALA 301 N 1.59 0.85 -0.14 6.16 0.00 -1.21 0.25 119.26 126.77 2vak h ALA 301 Ca 0.49 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 2vak h ALA 301 Cb 0.73 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 2vak h ALA 301 CO -0.38 0.60 -0.19 0.82 0.00 0.00 0.00 179.25 180.10 2vak h ILE 302 N 0.97 1.36 -0.14 0.00 2.04 -1.15 -0.77 117.51 119.82 2vak h ILE 302 Ca 0.20 -1.40 0.04 0.00 1.00 0.00 0.00 64.86 64.70 2vak h ILE 302 Cb 0.41 1.95 -0.05 0.00 -0.74 0.00 0.00 36.82 38.39 2vak h ILE 302 CO 0.01 0.41 -0.17 0.58 0.00 0.00 0.00 178.15 178.98 2vak h VAL 303 N -0.02 0.56 0.00 1.67 2.07 -0.86 -2.42 116.25 117.25 2vak h VAL 303 Ca 0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 2vak h VAL 303 Cb 0.74 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2vak h VAL 303 CO 0.04 0.00 -0.04 0.24 0.02 0.00 0.00 177.57 177.83 2vak h MET 304 N -0.20 0.00 0.00 1.57 2.86 -0.48 -3.26 114.93 115.42 2vak h MET 304 Ca 0.10 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.57 2vak h MET 304 Cb 0.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 2vak h MET 304 CO -0.26 0.04 -0.81 0.00 1.06 0.00 0.00 176.91 176.94 2vak h ALA 305 N 1.96 0.53 0.00 6.32 0.00 -0.62 -3.28 119.26 124.17 2vak h ALA 305 Ca -0.00 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 54.17 2vak h ALA 305 Cb 0.42 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2vak h ALA 305 CO 0.01 1.01 -0.36 0.00 0.00 0.00 0.00 179.25 179.91 2vak s ARG 307 N -3.14 1.69 -0.51 0.00 1.70 -1.24 -2.20 118.95 115.26 2vak s ARG 307 Ca 0.08 -1.95 -0.22 0.00 -0.47 0.00 0.00 55.73 53.17 2vak s ARG 307 Cb 0.13 -0.85 0.05 0.00 -0.57 0.00 0.00 34.95 33.71 2vak s ARG 307 CO 0.67 -0.23 0.76 -0.65 -1.08 0.00 0.00 175.30 174.78 2vak s GLN 308 N -3.87 3.24 0.63 3.89 -1.52 0.18 -4.21 119.66 118.00 2vak s GLN 308 Ca 0.34 -0.52 -0.04 0.00 -1.95 0.00 0.00 55.36 53.19 2vak s GLN 308 Cb 0.08 -4.05 0.04 0.00 -0.22 0.00 0.00 33.01 28.86 2vak s GLN 308 CO 0.15 -1.29 0.91 -1.25 -0.25 0.00 0.00 175.29 173.56 2vak s PRO 309 N 3.22 2.48 0.20 2.91 0.04 -1.26 -4.70 135.00 137.89 2vak s PRO 309 Ca 0.23 -0.35 -0.31 0.00 0.04 0.00 0.00 61.00 60.61 2vak s PRO 309 Cb -0.15 -2.29 -0.15 0.00 0.04 0.00 0.00 34.50 31.94 2vak s PRO 309 CO 0.16 -0.95 1.06 -2.30 0.04 0.00 0.00 177.00 175.02 2vak n PRO 310 N -2.66 1.07 -2.70 0.56 -0.02 -1.26 -4.94 135.00 125.05 2vak n PRO 310 Ca 0.07 0.38 -0.42 0.00 -2.02 0.00 0.00 63.50 61.51 2vak n PRO 310 Cb 0.60 -1.80 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 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 -0.50 4.84 0.49 -1.45 1.01 -1.26 -4.92 120.40 118.61 2vak s VAL 311 Ca 0.69 2.04 -0.22 0.00 0.00 0.00 0.00 61.98 64.49 2vak s VAL 311 Cb -0.83 -4.31 -0.07 0.00 0.00 0.00 0.00 36.38 31.18 2vak s VAL 311 CO 0.55 0.16 1.18 -0.36 0.00 0.00 0.00 175.10 176.63 2vak s PHE 312 N 1.00 2.76 0.19 5.22 0.08 0.27 -0.13 117.98 127.38 2vak s PHE 312 Ca 0.52 1.52 -0.30 0.00 0.12 0.00 0.00 56.93 58.79 2vak s PHE 312 Cb -0.21 -3.42 -0.09 0.00 -0.57 0.00 0.00 43.02 38.73 2vak s PHE 312 CO 0.28 -1.70 1.38 0.00 -0.10 0.00 0.00 175.22 175.09 2vak s ALA 313 N -1.55 3.59 0.44 5.36 0.00 0.83 -0.26 121.76 130.17 2vak s ALA 313 Ca 0.66 1.19 0.23 0.00 0.00 0.00 0.00 51.96 54.04 2vak s ALA 313 Cb -0.29 -3.53 1.21 0.00 0.00 0.00 0.00 23.12 20.52 2vak s ALA 313 CO 0.35 -0.63 1.79 -0.91 0.00 0.00 0.00 175.76 176.36 2vak h ASN 314 N 5.67 0.33 1.05 0.00 4.21 -1.51 -0.19 115.58 125.14 2vak h ASN 314 Ca -0.44 0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.12 2vak h ASN 314 Cb 1.21 0.01 -0.00 0.00 -1.12 0.00 0.00 38.32 38.42 2vak h ASN 314 CO 0.80 0.07 -0.04 1.56 -1.29 0.00 0.00 177.43 178.53 2vak h GLN 315 N 0.29 0.00 -0.42 0.81 4.20 -1.91 -3.02 115.11 115.06 2vak h GLN 315 Ca 0.57 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.28 2vak h GLN 315 Cb 1.65 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.43 2vak h GLN 315 CO -0.22 0.04 0.00 0.41 -0.67 0.00 0.00 178.83 178.39 2vak n GLY 316 N 0.10 1.12 3.22 3.46 0.00 -0.08 -4.90 105.19 108.10 2vak n GLY 316 Ca 0.01 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.45 0.73 0.95 1.61 -7.23 -1.14 -4.63 120.40 109.24 2vak s VAL 317 Ca 0.33 -1.97 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 2vak s VAL 317 Cb 0.17 -1.96 0.16 0.00 0.56 0.00 0.00 36.38 35.31 2vak s VAL 317 CO 0.23 -0.62 1.09 0.27 -0.31 0.00 0.00 175.10 175.77 2vak s ILE 318 N -3.62 2.39 0.18 -0.62 -4.36 0.18 -4.87 121.20 110.49 2vak s ILE 318 Ca 0.20 0.13 -0.13 0.00 -0.26 0.00 0.00 60.65 60.58 2vak s ILE 318 Cb 0.05 -2.37 0.11 0.00 1.25 0.00 0.00 42.46 41.51 2vak s ILE 318 CO 0.01 -0.17 1.71 0.78 0.24 0.00 0.00 174.94 177.51 2vak h ASN 319 N -1.87 -0.04 0.68 4.36 2.35 -1.92 -2.34 115.58 116.80 2vak h ASN 319 Ca -0.50 0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 2vak h ASN 319 Cb 1.29 0.14 0.00 0.00 0.05 0.00 0.00 38.32 39.79 2vak h ASN 319 CO 0.49 0.01 0.00 1.56 -1.65 0.00 0.00 177.43 177.84 2vak h GLN 320 N 0.21 0.00 -0.41 0.81 7.50 -1.91 -2.52 115.11 118.80 2vak h GLN 320 Ca 0.24 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.39 2vak h GLN 320 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.86 2vak h GLN 320 CO -0.33 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 177.00 2vak n ALA 321 N -1.99 2.44 -2.16 3.87 0.00 -0.88 -4.92 120.51 116.87 2vak n ALA 321 Ca 0.00 -0.86 -0.32 0.00 0.00 0.00 0.00 53.44 52.26 2vak n ALA 321 Cb 0.22 -0.96 -0.05 0.00 0.00 0.00 0.00 19.45 18.66 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 -1.47 3.92 -1.37 0.00 -0.21 -0.95 -4.29 119.66 115.29 2vak s GLN 322 Ca 0.36 0.59 -0.05 0.00 0.02 0.00 0.00 55.36 56.28 2vak s GLN 322 Cb 0.20 -2.42 0.03 0.00 1.00 0.00 0.00 33.01 31.81 2vak s GLN 322 CO 0.27 0.09 0.86 0.09 -2.12 0.00 0.00 175.29 174.48 2vak n ASN 323 N -0.70 -2.79 -4.53 5.90 3.02 -1.24 -4.99 115.26 109.93 2vak n ASN 323 Ca 0.03 -0.76 -0.40 0.00 -0.03 0.00 0.00 54.58 53.41 2vak n ASN 323 Cb 0.53 -4.20 -0.10 0.00 -0.61 0.00 0.00 39.78 35.40 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 -6.14 3.47 -0.10 3.52 6.06 -1.11 -4.96 118.95 119.70 2vak s ARG 324 Ca 0.25 -0.66 -0.36 0.00 -2.50 0.00 0.00 55.73 52.46 2vak s ARG 324 Cb -0.12 -3.82 -0.14 0.00 0.06 0.00 0.00 34.95 30.94 2vak s ARG 324 CO 0.80 -0.46 1.75 -2.30 -2.50 0.00 0.00 175.30 172.59 2vak n PRO 325 N 5.11 1.76 -0.00 5.12 -0.02 -1.26 -0.38 135.00 145.33 2vak n PRO 325 Ca -0.12 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 2vak n PRO 325 Cb 0.50 -2.41 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 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 4.03 1.76 0.88 -1.23 0.00 -1.26 -4.84 105.19 104.54 2vak n GLY 326 Ca 0.23 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.22 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 -4.12 1.61 7.35 0.49 -4.72 117.46 116.07 2vak n PHE 327 Ca 0.00 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.53 2vak n PHE 327 Cb 0.00 -0.11 -0.12 0.00 0.35 0.00 0.00 39.48 39.60 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 -5.76 1.26 0.05 -2.13 1.04 -0.34 -0.57 113.70 107.26 2vak s SER 328 Ca -0.05 -0.58 -0.22 0.00 0.48 0.00 0.00 55.95 55.58 2vak s SER 328 Cb 0.01 -0.01 0.05 0.00 0.10 0.00 0.00 66.02 66.18 2vak s SER 328 CO 0.07 -0.13 0.51 0.00 0.98 0.00 0.00 173.24 174.67 2vak s MET 329 N -1.63 1.03 0.06 4.02 0.23 0.64 -2.73 119.30 120.92 2vak s MET 329 Ca -0.06 -0.24 -0.30 0.00 -1.03 0.00 0.00 55.69 54.06 2vak s MET 329 Cb -0.10 0.47 -0.09 0.00 -1.53 0.00 0.00 34.83 33.58 2vak s MET 329 CO 0.01 -0.37 1.77 -0.80 -2.03 0.00 0.00 175.02 173.61 2vak s ASN 330 N -1.97 6.53 0.00 -1.18 0.02 -1.26 -1.23 114.94 115.85 2vak s ASN 330 Ca -0.05 2.57 0.00 0.00 -1.02 0.00 0.00 52.86 54.36 2vak s ASN 330 Cb -0.01 -2.55 0.00 0.00 0.02 0.00 0.00 41.25 38.71 2vak s ASN 330 CO -0.02 -0.96 0.00 0.61 0.02 0.00 0.00 177.10 176.75 2vak n GLY 331 N 4.21 0.50 1.77 0.66 0.00 -1.26 -4.97 105.19 106.10 2vak n GLY 331 Ca 0.17 -0.87 -0.14 0.00 0.00 0.00 0.00 46.02 45.18 2vak n GLY 331 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vak n GLY 332 N -1.82 -1.84 3.71 -0.02 0.00 -1.06 -4.90 105.19 99.25 2vak n GLY 332 Ca 0.00 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 2vak n GLY 332 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vak s THR 333 N -2.21 2.63 0.60 2.61 2.01 0.81 -4.16 115.64 117.92 2vak s THR 333 Ca 0.35 0.42 -0.15 0.00 0.31 0.00 0.00 61.69 62.63 2vak s THR 333 Cb -0.02 -3.27 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 2vak s THR 333 CO 0.26 0.03 1.04 -2.84 -0.69 0.00 0.00 174.62 172.42 2vak s PRO 334 N 1.31 3.38 -0.42 4.92 0.02 -1.26 -0.12 135.00 142.83 2vak s PRO 334 Ca 0.71 1.09 -0.11 0.00 0.02 0.00 0.00 61.00 62.70 2vak s PRO 334 Cb -0.44 -2.05 0.06 0.00 0.02 0.00 0.00 34.50 32.10 2vak s PRO 334 CO 0.31 -0.75 0.27 0.08 -0.33 0.00 0.00 177.00 176.58 2vak s VAL 335 N -2.64 4.53 0.28 3.83 1.01 -1.26 -3.91 120.40 122.24 2vak s VAL 335 Ca 0.61 -1.17 -0.28 0.00 0.00 0.00 0.00 61.98 61.13 2vak s VAL 335 Cb -0.14 -3.69 -0.09 0.00 0.00 0.00 0.00 36.38 32.46 2vak s VAL 335 CO 0.40 -0.44 0.99 -1.00 0.00 0.00 0.00 175.10 175.06 2vak s HIS 336 N 1.51 3.75 0.12 5.22 3.76 0.42 -4.89 115.29 125.17 2vak s HIS 336 Ca 0.03 1.81 -0.11 0.00 -0.15 0.00 0.00 55.06 56.63 2vak s HIS 336 Cb -0.22 -3.07 -0.06 0.00 1.11 0.00 0.00 32.58 30.34 2vak s HIS 336 CO 0.04 0.03 0.47 -1.21 -0.85 0.00 0.00 174.74 173.23 2vak s GLU 337 N -1.55 3.85 -0.23 1.40 2.02 -1.26 -0.79 118.70 122.14 2vak s GLU 337 Ca 0.45 0.30 -0.01 0.00 0.02 0.00 0.00 54.97 55.73 2vak s GLU 337 Cb -0.26 -2.94 0.07 0.00 0.10 0.00 0.00 34.13 31.10 2vak s GLU 337 CO 0.32 0.51 0.02 -0.51 0.02 0.00 0.00 175.26 175.62 2vak s LEU 338 N -2.02 1.84 -0.31 1.80 1.43 -0.32 -4.14 118.68 116.95 2vak s LEU 338 Ca 0.36 -1.10 -0.29 0.00 -1.03 0.00 0.00 54.13 52.07 2vak s LEU 338 Cb -0.14 -0.83 -0.01 0.00 0.03 0.00 0.00 46.19 45.24 2vak s LEU 338 CO 0.19 -0.31 1.54 0.21 0.23 0.00 0.00 176.35 178.21 2vak s ASN 339 N 1.66 6.31 0.43 2.29 3.84 -1.26 -0.13 114.94 128.09 2vak s ASN 339 Ca -0.00 1.25 0.24 0.00 0.21 0.00 0.00 52.86 54.56 2vak s ASN 339 Cb -0.18 -2.53 0.68 0.00 -0.55 0.00 0.00 41.25 38.67 2vak s ASN 339 CO -0.11 -1.37 1.72 -0.07 -2.79 0.00 0.00 177.10 174.48 2vak h LEU 340 N 12.12 0.00 0.42 3.21 3.38 -1.94 0.25 115.31 132.75 2vak h LEU 340 Ca -0.31 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 2vak h LEU 340 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2vak h LEU 340 CO 1.04 0.17 -0.20 0.25 0.09 0.00 0.00 178.44 179.79 2vak h LEU 341 N 0.00 -0.47 -0.80 1.67 5.85 -1.96 -2.10 115.31 117.50 2vak h LEU 341 Ca -0.00 -0.11 0.19 0.00 0.84 0.00 0.00 57.88 58.79 2vak h LEU 341 Cb 0.90 0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.93 2vak h LEU 341 CO 0.02 -0.08 0.18 0.74 -0.34 0.00 0.00 178.44 178.96 2vak h THR 342 N -0.94 0.42 0.00 1.05 2.02 -1.89 0.46 112.91 114.03 2vak h THR 342 Ca -0.06 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 2vak h THR 342 Cb 0.56 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.13 2vak h THR 342 CO 0.09 0.04 -0.01 0.74 0.37 0.00 0.00 175.52 176.76 2vak h THR 343 N 0.23 0.56 0.01 3.16 2.02 -0.98 0.41 112.91 118.33 2vak h THR 343 Ca 0.47 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.62 2vak h THR 343 Cb 0.86 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 2vak h THR 343 CO -0.58 0.01 -0.04 0.00 0.37 0.00 0.00 175.52 175.27 2vak h ALA 344 N 1.99 -0.00 -0.72 6.16 0.00 0.57 -2.34 119.26 124.92 2vak h ALA 344 Ca -0.00 -0.50 0.10 0.00 0.00 0.00 0.00 54.91 54.51 2vak h ALA 344 Cb 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.73 2vak h ALA 344 CO 0.00 0.01 0.34 1.96 0.00 0.00 0.00 179.25 181.56 2vak h GLN 345 N -0.95 0.54 0.00 0.00 4.20 -0.78 -1.20 115.11 116.92 2vak h GLN 345 Ca -0.01 -0.03 -0.05 0.00 0.06 0.00 0.00 58.65 58.62 2vak h GLN 345 Cb 1.01 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.67 2vak h GLN 345 CO 0.01 0.36 -0.22 0.93 -0.67 0.00 0.00 178.83 179.23 2vak h GLU 346 N 0.56 0.00 -0.02 1.46 4.39 -1.04 0.27 114.58 120.20 2vak h GLU 346 Ca 0.36 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.88 2vak h GLU 346 Cb 0.43 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 2vak h GLU 346 CO -0.30 0.22 -0.80 0.00 -1.16 0.00 0.00 179.01 176.97 2vak h ILE 348 N 0.14 1.66 -1.06 0.00 2.04 -1.09 -1.76 117.51 117.45 2vak h ILE 348 Ca -0.03 -2.22 0.37 0.00 1.00 0.00 0.00 64.86 63.97 2vak h ILE 348 Cb 1.40 3.14 -0.15 0.00 -0.74 0.00 0.00 36.82 40.46 2vak h ILE 348 CO 0.12 0.60 0.61 -0.09 0.00 0.00 0.00 178.15 179.39 2vak h ARG 349 N -0.72 0.18 -0.15 2.37 1.12 -0.55 1.04 114.38 117.66 2vak h ARG 349 Ca -0.04 -0.01 -0.13 0.00 -1.11 0.00 0.00 59.98 58.69 2vak h ARG 349 Cb 1.10 -0.04 -0.01 0.00 -0.01 0.00 0.00 29.97 31.01 2vak h ARG 349 CO 0.04 0.12 -0.48 1.96 -3.11 0.00 0.00 179.97 178.50 2vak h GLN 350 N 0.19 0.39 -0.02 0.20 1.08 -1.31 -2.93 115.11 112.70 2vak h GLN 350 Ca 0.78 -0.22 -0.19 0.00 -1.45 0.00 0.00 58.65 57.58 2vak h GLN 350 Cb 2.00 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 29.44 2vak h GLN 350 CO -0.62 0.79 -0.80 -1.49 -0.95 0.00 0.00 178.83 175.76 2vak h TRP 351 N 0.31 0.35 0.03 2.96 4.06 0.20 -0.86 115.95 123.00 2vak h TRP 351 Ca 0.02 -0.17 -0.25 0.00 2.06 0.00 0.00 58.89 60.55 2vak h TRP 351 Cb 0.96 -0.05 0.01 0.00 -1.00 0.00 0.00 29.16 29.09 2vak h TRP 351 CO 0.03 0.95 -1.03 0.28 -3.56 0.00 0.00 178.44 175.10 2vak h VAL 352 N 0.15 1.38 0.00 1.49 2.07 -1.07 0.14 116.25 120.42 2vak h VAL 352 Ca -0.04 -2.49 -0.17 0.00 0.82 0.00 0.00 66.70 64.82 2vak h VAL 352 Cb 1.40 2.51 -0.02 0.00 -1.52 0.00 0.00 31.29 33.65 2vak h VAL 352 CO 0.13 0.75 -0.80 0.24 0.02 0.00 0.00 177.57 177.90 2vak h MET 353 N 0.24 0.02 0.00 1.57 2.86 -1.51 -2.08 114.93 116.03 2vak h MET 353 Ca -0.11 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.52 2vak h MET 353 Cb 1.68 0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.35 2vak h MET 353 CO 0.18 0.81 0.00 0.00 1.06 0.00 0.00 176.91 178.96 2vak n ALA 354 N -2.39 2.25 -2.64 6.32 0.00 -0.33 -4.90 120.51 118.81 2vak n ALA 354 Ca -0.01 -0.12 -0.18 0.00 0.00 0.00 0.00 53.44 53.13 2vak n ALA 354 Cb 0.77 -1.39 0.01 0.00 0.00 0.00 0.00 19.45 18.85 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 0.67 -0.34 0.14 0.00 0.00 -0.78 -4.90 105.19 99.98 2vak n GLY 355 Ca 0.13 -0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.11 2vak n GLY 355 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2vak h LEU 356 N -0.65 0.00 -8.42 0.99 3.38 -0.96 -3.47 115.31 106.18 2vak h LEU 356 Ca -0.43 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.34 2vak h LEU 356 Cb 1.31 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.91 2vak h LEU 356 CO 0.49 0.40 -0.66 0.68 0.09 0.00 0.00 178.44 179.43 2vak s VAL 357 N -3.02 0.31 0.69 1.22 -7.23 -1.22 -5.04 120.40 106.10 2vak s VAL 357 Ca 0.03 -1.90 -0.12 0.00 -1.81 0.00 0.00 61.98 58.18 2vak s VAL 357 Cb 0.07 -1.88 0.01 0.00 0.56 0.00 0.00 36.38 35.14 2vak s VAL 357 CO 0.75 -0.65 1.07 -0.94 -0.31 0.00 0.00 175.10 175.01 2vak s SER 358 N -3.04 5.24 0.48 4.85 1.04 -1.26 -4.70 113.70 116.32 2vak s SER 358 Ca 0.18 1.75 0.32 0.00 0.48 0.00 0.00 55.95 58.69 2vak s SER 358 Cb 0.07 -2.52 1.45 0.00 0.10 0.00 0.00 66.02 65.12 2vak s SER 358 CO -0.02 -1.54 1.96 0.00 0.98 0.00 0.00 173.24 174.63 2vak h ALA 359 N -0.46 1.00 0.00 5.32 0.00 -1.97 0.57 119.26 123.72 2vak h ALA 359 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2vak h ALA 359 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2vak h ALA 359 CO 0.55 0.00 -0.32 0.00 0.00 0.00 0.00 179.25 179.48 2vak h ALA 360 N 2.06 0.83 0.14 0.00 0.00 -1.98 -1.77 119.26 118.54 2vak h ALA 360 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 2vak h ALA 360 Cb 0.35 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2vak h ALA 360 CO 0.00 0.00 -1.76 -0.22 0.00 0.00 0.00 179.25 177.27 2vak h LYS 361 N 0.00 0.29 -0.87 0.00 3.64 -1.56 -3.16 116.57 114.92 2vak h LYS 361 Ca 0.00 -0.50 -0.00 0.00 -1.27 0.00 0.00 60.65 58.88 2vak h LYS 361 Cb 0.95 0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.92 2vak h LYS 361 CO 0.00 1.17 0.52 0.78 -2.27 0.00 0.00 179.45 179.65 2vak h GLY 362 N 1.28 1.26 2.00 5.01 0.00 0.07 -0.02 103.07 112.67 2vak h GLY 362 Ca -0.33 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2vak h GLY 362 CO 0.14 0.51 0.00 1.46 0.00 0.00 0.00 176.54 178.65 2vak h GLN 363 N 1.19 0.00 0.31 4.80 4.20 -1.50 -2.84 115.11 121.27 2vak h GLN 363 Ca 0.31 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.01 2vak h GLN 363 Cb -0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.73 2vak h GLN 363 CO -0.06 0.00 -0.15 0.00 -0.67 0.00 0.00 178.83 177.95 2vak h ALA 364 N 2.38 -0.42 -0.12 3.87 0.00 -1.21 -2.84 119.26 120.92 2vak h ALA 364 Ca 0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2vak h ALA 364 Cb 0.75 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 2vak h ALA 364 CO 0.00 -0.40 -0.12 -0.07 0.00 0.00 0.00 179.25 178.66 2vak h LEU 365 N -1.09 0.17 -1.08 0.00 3.38 -1.14 -0.26 115.31 115.29 2vak h LEU 365 Ca -0.04 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2vak h LEU 365 Cb 0.37 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2vak h LEU 365 CO 0.07 0.32 0.06 0.74 0.09 0.00 0.00 178.44 179.72 2vak h THR 366 N 0.18 1.22 -0.06 0.22 2.02 -1.64 0.04 112.91 114.89 2vak h THR 366 Ca 0.04 -0.84 -0.20 0.00 0.77 0.00 0.00 66.41 66.18 2vak h THR 366 Cb 0.33 0.80 -0.00 0.00 -1.74 0.00 0.00 68.15 67.54 2vak h THR 366 CO 0.02 0.30 -0.81 -0.61 0.37 0.00 0.00 175.52 174.79 2vak h GLN 367 N 0.69 0.44 0.07 6.66 5.75 -0.91 -1.32 115.11 126.48 2vak h GLN 367 Ca 0.15 -0.40 -0.25 0.00 -0.15 0.00 0.00 58.65 58.00 2vak h GLN 367 Cb 0.33 0.09 -0.00 0.00 1.07 0.00 0.00 27.48 28.98 2vak h GLN 367 CO 0.01 1.04 -1.10 0.93 -2.65 0.00 0.00 178.83 177.06 2vak h GLU 368 N 0.28 0.27 -0.39 1.69 5.08 -1.02 -2.15 114.58 118.33 2vak h GLU 368 Ca -0.05 -0.38 -0.14 0.00 -1.00 0.00 0.00 59.36 57.79 2vak h GLU 368 Cb 1.41 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.79 2vak h GLU 368 CO 0.14 1.14 -0.29 0.00 -1.00 0.00 0.00 179.01 179.00 2vak h ALA 369 N 0.71 0.57 0.00 3.43 0.00 -1.04 -1.32 119.26 121.60 2vak h ALA 369 Ca -0.10 -0.41 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 2vak h ALA 369 Cb 1.79 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 19.45 2vak h ALA 369 CO 0.18 0.60 -0.09 -0.91 0.00 0.00 0.00 179.25 179.03 2vak h ASN 370 N 0.71 0.00 -0.07 0.00 4.21 -1.28 -1.47 115.58 117.68 2vak h ASN 370 Ca 0.07 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.53 2vak h ASN 370 Cb 0.87 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.07 2vak h ASN 370 CO 0.08 0.09 -0.17 0.44 -1.29 0.00 0.00 177.43 176.58 2vak h ASP 371 N 0.00 0.26 -0.06 5.81 3.45 -1.09 -2.70 116.42 122.10 2vak h ASP 371 Ca -0.00 -0.59 -0.01 0.00 0.43 0.00 0.00 57.03 56.86 2vak h ASP 371 Cb 0.16 -0.08 -0.00 0.00 -0.56 0.00 0.00 39.33 38.85 2vak h ASP 371 CO 0.01 0.81 -0.00 0.15 -1.57 0.00 0.00 179.24 178.64 2vak h PHE 372 N -0.27 0.12 0.00 4.55 3.57 -1.11 -2.52 116.94 121.28 2vak h PHE 372 Ca -0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2vak h PHE 372 Cb 0.78 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.49 2vak h PHE 372 CO 0.12 0.39 0.00 0.43 -2.23 0.00 0.00 178.31 177.02 2vak n SER 373 N -4.86 0.27 0.13 0.41 7.64 -0.57 -0.73 113.62 115.91 2vak n SER 373 Ca -0.07 0.59 -0.24 0.00 1.01 0.00 0.00 58.87 60.16 2vak n SER 373 Cb 0.19 -0.64 -0.16 0.00 -1.01 0.00 0.00 64.21 62.59 2vak n SER 373 CO 0.00 0.00 0.00 -1.13 -3.01 0.00 0.00 175.04 170.90 2vak h ASN 374 N 0.00 0.79 0.18 6.43 -1.24 -1.14 -2.91 115.58 117.69 2vak h ASN 374 Ca 0.00 -0.93 -0.01 0.00 0.71 0.00 0.00 56.30 56.07 2vak h ASN 374 Cb 0.16 -0.26 0.00 0.00 0.73 0.00 0.00 38.32 38.95 2vak h ASN 374 CO 0.00 1.74 -0.08 -0.07 -1.29 0.00 0.00 177.43 177.73 2vak h LEU 375 N 0.13 -0.20 -0.50 0.34 3.38 -0.67 -2.78 115.31 115.02 2vak h LEU 375 Ca -0.28 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.45 2vak h LEU 375 Cb 2.15 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 42.93 2vak h LEU 375 CO 0.25 0.16 0.32 0.40 0.09 0.00 0.00 178.44 179.66 2vak h ILE 376 N -0.58 1.10 -0.61 1.22 1.08 -1.10 -0.37 117.51 118.24 2vak h ILE 376 Ca -0.02 -0.22 0.06 0.00 -0.39 0.00 0.00 64.86 64.28 2vak h ILE 376 Cb 0.44 0.40 -0.04 0.00 -3.07 0.00 0.00 36.82 34.55 2vak h ILE 376 CO 0.04 0.12 0.41 -0.61 -0.69 0.00 0.00 178.15 177.41 2vak h GLN 377 N 0.65 0.60 0.17 2.37 4.15 -1.60 0.29 115.11 121.74 2vak h GLN 377 Ca 0.19 -0.04 -0.27 0.00 0.77 0.00 0.00 58.65 59.30 2vak h GLN 377 Cb -0.05 -0.14 0.03 0.00 0.21 0.00 0.00 27.48 27.54 2vak h GLN 377 CO -0.06 0.40 -1.15 0.00 -1.93 0.00 0.00 178.83 176.09 2vak h ALA 378 N 1.66 -0.09 0.89 3.38 0.00 -1.11 -0.43 119.26 123.56 2vak h ALA 378 Ca 0.26 -0.77 -0.04 0.00 0.00 0.00 0.00 54.91 54.36 2vak h ALA 378 Cb 0.24 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.17 2vak h ALA 378 CO -0.08 0.56 -0.44 0.22 0.00 0.00 0.00 179.25 179.51 2vak h ASP 379 N -0.00 -1.06 -0.46 0.00 -0.00 -0.82 -1.74 116.42 112.33 2vak h ASP 379 Ca -0.19 0.04 0.07 0.00 -0.00 0.00 0.00 57.03 56.95 2vak h ASP 379 Cb 1.88 0.28 -0.03 0.00 -0.00 0.00 0.00 39.33 41.47 2vak h ASP 379 CO 0.22 -0.74 0.31 -0.07 -0.00 0.00 0.00 179.24 178.96 2vak h LEU 380 N -1.21 0.30 -0.93 2.28 3.38 -0.53 -0.33 115.31 118.26 2vak h LEU 380 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2vak h LEU 380 Cb 0.94 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 2vak h LEU 380 CO 0.19 0.20 0.59 1.23 0.09 0.00 0.00 178.44 180.73 2vak h GLY 381 N 0.34 1.33 1.32 0.83 0.00 -0.91 -0.58 103.07 105.41 2vak h GLY 381 Ca 0.21 -0.53 -0.29 0.00 0.00 0.00 0.00 47.33 46.72 2vak h GLY 381 CO -0.05 0.52 -1.20 -1.61 0.00 0.00 0.00 176.54 174.20 2vak h GLN 382 N 1.27 0.56 -0.68 4.80 4.15 -0.17 -1.82 115.11 123.22 2vak h GLN 382 Ca 0.34 -0.74 0.05 0.00 0.77 0.00 0.00 58.65 59.07 2vak h GLN 382 Cb -0.09 0.24 -0.05 0.00 0.21 0.00 0.00 27.48 27.79 2vak h GLN 382 CO -0.07 1.33 0.40 0.82 -1.93 0.00 0.00 178.83 179.38 2vak h ILE 383 N 0.25 1.01 -0.49 2.39 2.04 -1.22 0.34 117.51 121.82 2vak h ILE 383 Ca -0.17 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 2vak h ILE 383 Cb 1.87 0.20 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 2vak h ILE 383 CO 0.22 0.14 0.26 0.50 0.00 0.00 0.00 178.15 179.27 2vak h LYS 384 N 0.75 0.69 -0.34 2.37 3.64 -1.09 -1.08 116.57 121.52 2vak h LYS 384 Ca 0.30 -0.09 -0.15 0.00 -1.27 0.00 0.00 60.65 59.44 2vak h LYS 384 Cb 0.14 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2vak h LYS 384 CO -0.16 0.56 -0.38 0.00 -2.27 0.00 0.00 179.45 177.19 2vak h ALA 385 N 1.10 0.68 0.01 5.00 0.00 -0.83 0.97 119.26 126.20 2vak h ALA 385 Ca 0.17 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 2vak h ALA 385 Cb 0.07 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.75 2vak h ALA 385 CO -0.03 0.67 -0.43 -0.56 0.00 0.00 0.00 179.25 178.90 2vak h GLN 386 N 0.66 0.27 -0.19 0.00 3.07 -0.95 -2.71 115.11 115.26 2vak h GLN 386 Ca 0.06 -0.30 0.05 0.00 0.09 0.00 0.00 58.65 58.54 2vak h GLN 386 Cb 0.95 0.09 -0.07 0.00 0.08 0.00 0.00 27.48 28.52 2vak h GLN 386 CO 0.09 1.02 -0.38 -0.44 0.09 0.00 0.00 178.83 179.21 2vak h ASP 387 N -0.36 -1.20 -0.66 0.06 5.19 -1.20 0.23 116.42 118.47 2vak h ASP 387 Ca -0.06 0.17 0.12 0.00 -0.62 0.00 0.00 57.03 56.65 2vak h ASP 387 Cb 1.18 0.51 -0.09 0.00 0.18 0.00 0.00 39.33 41.11 2vak h ASP 387 CO 0.08 -0.39 0.19 0.44 -3.12 0.00 0.00 179.24 176.45 2vak h ASP 388 N -0.42 0.10 0.19 6.45 3.45 -0.90 0.12 116.42 125.41 2vak h ASP 388 Ca 0.10 0.11 -0.01 0.00 0.43 0.00 0.00 57.03 57.66 2vak h ASP 388 Cb 0.59 0.13 0.00 0.00 -0.56 0.00 0.00 39.33 39.49 2vak h ASP 388 CO -0.42 0.04 -0.09 0.00 -1.57 0.00 0.00 179.24 177.21 2vak h ALA 389 N 1.51 -0.25 -0.26 3.45 0.00 -1.10 -3.12 119.26 119.49 2vak h ALA 389 Ca 0.35 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 2vak h ALA 389 Cb 0.53 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 2vak h ALA 389 CO -0.41 -0.46 -0.29 -0.07 0.00 0.00 0.00 179.25 178.02 2vak h LEU 390 N -0.60 0.54 -0.50 0.00 3.38 -0.30 -0.87 115.31 116.95 2vak h LEU 390 Ca -0.03 -0.20 0.02 0.00 0.09 0.00 0.00 57.88 57.77 2vak h LEU 390 Cb 0.45 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 2vak h LEU 390 CO 0.04 0.80 0.31 0.22 0.09 0.00 0.00 178.44 179.90 2vak h TYR 391 N 0.46 0.58 0.00 1.13 5.03 -0.85 0.59 116.97 123.90 2vak h TYR 391 Ca 0.06 0.02 -0.14 0.00 2.58 0.00 0.00 58.73 61.25 2vak h TYR 391 Cb 0.73 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.80 2vak h TYR 391 CO 0.03 0.34 -0.64 -0.91 -1.32 0.00 0.00 178.16 175.65 2vak h ASN 392 N 0.62 0.00 0.26 -2.11 2.35 -1.42 -3.35 115.58 111.93 2vak h ASN 392 Ca 0.20 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.61 2vak h ASN 392 Cb -0.00 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 2vak h ASN 392 CO -0.08 0.64 -1.91 0.00 -1.65 0.00 0.00 177.43 174.44 2vak n GLN 393 N -3.27 0.70 -4.06 0.81 6.02 -0.36 -4.94 117.38 112.28 2vak n GLN 393 Ca 0.01 0.27 -0.32 0.00 -0.01 0.00 0.00 57.00 56.95 2vak n GLN 393 Cb 0.79 -1.73 -0.15 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 -2.57 2.26 0.16 -1.09 0.74 0.19 -5.07 119.66 114.28 2vak s GLN 394 Ca -0.15 -1.22 -0.34 0.00 0.05 0.00 0.00 55.36 53.70 2vak s GLN 394 Cb 0.07 -2.79 -0.15 0.00 1.10 0.00 0.00 33.01 31.24 2vak s GLN 394 CO 0.79 -0.52 1.41 -2.30 -0.55 0.00 0.00 175.29 174.11 2vak n PRO 395 N 4.49 1.70 -1.70 1.67 -0.02 -1.26 -2.55 135.00 137.33 2vak n PRO 395 Ca -0.15 0.61 -0.09 0.00 -2.02 0.00 0.00 63.50 61.85 2vak n PRO 395 Cb 0.43 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.62 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 2.64 0.55 3.73 -1.23 0.00 -1.26 -5.02 105.19 104.60 2vak n GLY 396 Ca 0.16 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.39 3.66 -0.42 1.61 5.04 -1.06 -4.65 117.35 119.14 2vak s TYR 397 Ca 0.00 1.64 -0.18 0.00 -2.44 0.00 0.00 57.07 56.09 2vak s TYR 397 Cb 0.00 -3.19 0.02 0.00 0.35 0.00 0.00 41.96 39.14 2vak s TYR 397 CO 0.00 -0.31 0.49 0.00 -1.34 0.00 0.00 175.55 174.39 2vak s ALA 398 N 0.27 3.41 0.42 3.97 0.00 -1.26 -3.76 121.76 124.82 2vak s ALA 398 Ca 0.50 -1.43 -0.25 0.00 0.00 0.00 0.00 51.96 50.78 2vak s ALA 398 Cb -0.26 -3.12 -0.10 0.00 0.00 0.00 0.00 23.12 19.65 2vak s ALA 398 CO 0.31 -1.63 1.26 0.54 0.00 0.00 0.00 175.76 176.23 2vak n ARG 399 N 5.77 1.88 0.03 0.00 1.74 -0.59 -4.94 116.66 120.55 2vak n ARG 399 Ca -0.06 0.67 0.11 0.00 -0.77 0.00 0.00 57.85 57.80 2vak n ARG 399 Cb 0.47 -2.36 -0.09 0.00 -1.02 0.00 0.00 32.46 29.46 2vak n ARG 399 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2vak n ARG 400 N 0.02 0.58 -3.89 5.56 1.74 -1.26 -4.90 116.66 114.51 2vak n ARG 400 Ca 0.07 -0.07 -0.09 0.00 -0.77 0.00 0.00 57.85 57.00 2vak n ARG 400 Cb 0.40 -1.63 -0.08 0.00 -1.02 0.00 0.00 32.46 30.13 2vak n ARG 400 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2vak s ILE 401 N -3.42 0.15 0.12 0.55 -4.36 -1.26 -4.34 121.20 108.64 2vak s ILE 401 Ca -0.04 -1.26 -0.34 0.00 -0.26 0.00 0.00 60.65 58.75 2vak s ILE 401 Cb 0.13 -1.38 -0.14 0.00 1.25 0.00 0.00 42.46 42.32 2vak s ILE 401 CO 0.86 -0.68 1.61 1.17 0.24 0.00 0.00 174.94 178.14 2vak n LYS 402 N -0.05 2.11 -1.58 0.37 4.81 -1.26 -4.94 118.16 117.62 2vak n LYS 402 Ca -0.15 0.76 -0.42 0.00 -0.87 0.00 0.00 58.31 57.63 2vak n LYS 402 Cb 0.62 -2.54 0.00 0.00 0.02 0.00 0.00 35.03 33.14 2vak n LYS 402 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2vak n PRO 403 N 3.86 1.25 -4.04 1.64 -0.02 -1.26 -5.03 135.00 131.40 2vak n PRO 403 Ca 0.18 0.44 -0.10 0.00 -2.02 0.00 0.00 63.50 62.00 2vak n PRO 403 Cb 0.28 -1.90 -0.07 0.00 -0.02 0.00 0.00 33.50 31.79 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 -1.23 0.58 0.08 6.00 -0.71 -1.26 -5.02 117.98 116.42 2vak s PHE 404 Ca 0.62 -0.91 0.04 0.00 -1.04 0.00 0.00 56.93 55.64 2vak s PHE 404 Cb -0.61 -0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.06 2vak s PHE 404 CO 0.58 -0.79 0.03 0.14 -1.34 0.00 0.00 175.22 173.83 2vak s VAL 405 N -4.03 4.21 0.48 -2.49 -7.23 -1.26 -5.02 120.40 105.05 2vak s VAL 405 Ca 0.24 -0.87 0.14 0.00 -1.81 0.00 0.00 61.98 59.68 2vak s VAL 405 Cb 0.03 -3.00 0.24 0.00 0.56 0.00 0.00 36.38 34.22 2vak s VAL 405 CO 0.06 0.15 2.09 0.78 -0.31 0.00 0.00 175.10 177.87 2vak h ASN 406 N 3.50 0.10 -0.11 4.85 2.35 -2.03 -1.49 115.58 122.75 2vak h ASN 406 Ca -0.47 -0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.30 2vak h ASN 406 Cb 1.17 -0.03 -0.00 0.00 0.05 0.00 0.00 38.32 39.50 2vak h ASN 406 CO 0.61 0.13 0.33 1.23 -1.65 0.00 0.00 177.43 178.08 2vak h GLY 407 N 0.26 0.00 2.00 2.83 0.00 -1.99 -2.35 103.07 103.81 2vak h GLY 407 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 2vak h GLY 407 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.76 2vak n ASP 408 N -3.17 0.43 0.08 0.19 8.00 -0.56 -2.23 116.55 119.28 2vak n ASP 408 Ca 0.00 0.64 -0.01 0.00 0.71 0.00 0.00 54.79 56.13 2vak n ASP 408 Cb 0.42 -0.72 -0.05 0.00 -0.02 0.00 0.00 41.12 40.75 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 -3.94 1.24 4.06 -1.64 -3.31 115.95 112.36 2vak h TRP 409 Ca 0.00 0.00 -0.53 0.00 2.06 0.00 0.00 58.89 60.42 2vak h TRP 409 Cb 0.19 0.00 0.20 0.00 -1.00 0.00 0.00 29.16 28.55 2vak h TRP 409 CO 0.00 0.67 -0.04 0.25 -3.56 0.00 0.00 178.44 175.76 2vak n THR 410 N -3.15 0.41 0.27 1.49 -2.24 -0.95 -4.94 114.28 105.18 2vak n THR 410 Ca -0.03 -0.11 0.16 0.00 -2.27 0.00 0.00 64.05 61.80 2vak n THR 410 Cb 0.83 -0.90 0.69 0.00 -2.10 0.00 0.00 70.33 68.86 2vak n THR 410 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2vak h PRO 411 N -1.57 0.00 0.00 -0.78 0.11 -1.89 -3.46 132.00 124.41 2vak h PRO 411 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2vak h PRO 411 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2vak h PRO 411 CO 0.40 0.06 0.00 0.41 -0.21 0.00 0.00 178.00 178.66 2vak n GLY 412 N -0.12 2.08 1.41 -0.55 0.00 -1.26 -2.21 105.19 104.54 2vak n GLY 412 Ca -0.00 -0.34 -0.08 0.00 0.00 0.00 0.00 46.02 45.60 2vak n GLY 412 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vak n MET 413 N 13.23 1.40 -0.20 1.61 2.81 -1.26 -4.50 117.12 130.21 2vak n MET 413 Ca 0.00 -0.94 -0.06 0.00 -1.81 0.00 0.00 57.70 54.89 2vak n MET 413 Cb 0.00 -1.37 0.04 0.00 -0.71 0.00 0.00 33.22 31.18 2vak n MET 413 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2vak h THR 414 N 0.36 1.14 0.08 2.03 2.02 -1.60 -1.81 112.91 115.13 2vak h THR 414 Ca 0.20 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 67.13 2vak h THR 414 Cb 1.53 0.30 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 2vak h THR 414 CO 0.35 0.14 -0.53 0.00 0.37 0.00 0.00 175.52 175.85 2vak h ALA 415 N 1.22 -0.98 -1.00 6.16 0.00 -1.84 0.75 119.26 123.56 2vak h ALA 415 Ca 0.22 -0.10 0.19 0.00 0.00 0.00 0.00 54.91 55.21 2vak h ALA 415 Cb -0.07 0.92 -0.10 0.00 0.00 0.00 0.00 17.79 18.53 2vak h ALA 415 CO -0.05 -1.12 0.61 1.96 0.00 0.00 0.00 179.25 180.65 2vak h GLN 416 N -0.73 0.72 -0.24 0.00 7.50 -1.85 0.13 115.11 120.64 2vak h GLN 416 Ca -0.00 -0.04 -0.19 0.00 0.50 0.00 0.00 58.65 58.91 2vak h GLN 416 Cb 0.74 -0.16 0.00 0.00 0.05 0.00 0.00 27.48 28.12 2vak h GLN 416 CO -0.31 0.47 -0.61 0.00 -1.50 0.00 0.00 178.83 176.88 2vak h ALA 417 N 1.64 0.45 -0.50 3.87 0.00 -0.81 -2.54 119.26 121.38 2vak h ALA 417 Ca 0.57 -0.54 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 2vak h ALA 417 Cb 0.93 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 2vak h ALA 417 CO -0.36 0.69 0.07 -0.07 0.00 0.00 0.00 179.25 179.58 2vak h LEU 418 N 0.61 0.79 -0.53 0.00 3.38 0.19 -0.49 115.31 119.26 2vak h LEU 418 Ca -0.00 -0.26 0.08 0.00 0.09 0.00 0.00 57.88 57.78 2vak h LEU 418 Cb 1.22 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 2vak h LEU 418 CO 0.13 0.86 0.17 0.00 0.09 0.00 0.00 178.44 179.69 2vak h ALA 419 N 0.97 0.65 -0.01 1.53 0.00 -0.79 -1.91 119.26 119.70 2vak h ALA 419 Ca 0.15 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2vak h ALA 419 Cb 0.41 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 2vak h ALA 419 CO 0.01 -0.23 -0.00 0.28 0.00 0.00 0.00 179.25 179.31 2vak h VAL 420 N 0.34 1.30 0.00 0.00 2.07 -1.14 -3.13 116.25 115.69 2vak h VAL 420 Ca 0.26 -0.89 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 2vak h VAL 420 Cb 0.31 1.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.98 2vak h VAL 420 CO -0.28 0.23 -0.05 -0.07 0.02 0.00 0.00 177.57 177.42 2vak h LEU 421 N -0.36 0.00 -0.86 2.57 3.38 -1.03 -0.97 115.31 118.03 2vak h LEU 421 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2vak h LEU 421 Cb 0.38 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.06 2vak h LEU 421 CO 0.00 0.05 0.51 0.00 0.09 0.00 0.00 178.44 179.09 2vak h ALA 422 N 1.95 1.23 0.00 1.53 0.00 -1.28 -2.79 119.26 119.89 2vak h ALA 422 Ca -0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2vak h ALA 422 Cb 0.10 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 2vak h ALA 422 CO 0.01 0.16 -0.04 1.79 0.00 0.00 0.00 179.25 181.16 2vak h THR 423 N 0.86 0.23 0.00 0.00 1.35 -1.22 -3.23 112.91 110.90 2vak h THR 423 Ca 0.41 -0.33 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 2vak h THR 423 Cb 0.34 1.26 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2vak h THR 423 CO -0.23 0.04 0.00 0.49 -0.25 0.00 0.00 175.52 175.57 2vak n PHE 424 N -3.32 0.00 -3.41 4.73 3.01 -1.05 -3.04 117.46 114.38 2vak n PHE 424 Ca -0.02 0.00 -0.26 0.00 1.01 0.00 0.00 57.45 58.18 2vak n PHE 424 Cb 0.19 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.58 2vak n PHE 424 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2vak n THR 425 N 0.22 1.60 -0.84 4.37 -1.04 -1.22 -4.88 114.28 112.49 2vak n THR 425 Ca 0.00 -4.91 0.00 0.00 -2.04 0.00 0.00 64.05 57.10 2vak n THR 425 Cb 0.00 -2.07 0.00 0.00 -1.82 0.00 0.00 70.33 66.44 2vak n THR 425 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43