#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vak s SER 5 N 0.00 7.07 0.50 4.38 0.15 -1.26 -4.98 113.70 119.56 2vak s SER 5 Ca 0.00 1.28 0.29 0.00 0.70 0.00 0.00 55.95 58.22 2vak s SER 5 Cb 0.00 -2.44 1.22 0.00 -1.71 0.00 0.00 66.02 63.09 2vak s SER 5 CO 0.00 -0.11 1.94 1.05 1.20 0.00 0.00 173.24 177.32 2vak h GLU 6 N 6.59 0.00 0.00 5.44 4.11 -2.04 -2.54 114.58 126.13 2vak h GLU 6 Ca -0.41 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 58.98 2vak h GLU 6 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2vak h GLU 6 CO 0.75 0.12 -1.13 1.19 0.07 0.00 0.00 179.01 180.01 2vak n PHE 7 N -3.30 0.95 -4.01 2.06 3.72 -1.26 -4.91 117.46 110.71 2vak n PHE 7 Ca -0.00 0.29 0.00 0.00 -0.05 0.00 0.00 57.45 57.69 2vak n PHE 7 Cb 0.34 -0.98 0.00 0.00 -0.94 0.00 0.00 39.48 37.90 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 1.23 -0.97 3.22 1.37 0.00 -0.96 -4.65 105.19 104.43 2vak n GLY 8 Ca -0.02 -1.22 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 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 5.91 0.00 1.61 0.01 -1.26 -4.88 113.70 111.09 2vak s SER 9 Ca 0.00 -2.42 0.19 0.00 1.31 0.00 0.00 55.95 55.03 2vak s SER 9 Cb 0.00 -2.04 -0.06 0.00 0.21 0.00 0.00 66.02 64.14 2vak s SER 9 CO 0.00 -0.57 0.92 0.35 0.41 0.00 0.00 173.24 174.35 2vak n THR 10 N 4.23 0.00 -2.95 1.44 -2.24 -1.26 -4.84 114.28 108.66 2vak n THR 10 Ca 0.03 -0.24 -0.40 0.00 -2.27 0.00 0.00 64.05 61.17 2vak n THR 10 Cb 0.42 1.17 -0.05 0.00 -2.10 0.00 0.00 70.33 69.77 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 -2.32 4.50 0.57 -0.78 -1.94 -1.26 -4.79 119.30 113.27 2vak s MET 11 Ca 0.13 1.08 -0.20 0.00 -1.71 0.00 0.00 55.69 54.99 2vak s MET 11 Cb 0.15 -3.41 -0.04 0.00 2.01 0.00 0.00 34.83 33.54 2vak s MET 11 CO 0.55 0.15 1.28 0.00 -0.01 0.00 0.00 175.02 177.00 2vak s ALA 12 N 0.41 2.65 0.17 3.03 0.00 -1.26 -0.40 121.76 126.37 2vak s ALA 12 Ca 0.41 1.18 -0.31 0.00 0.00 0.00 0.00 51.96 53.24 2vak s ALA 12 Cb -0.20 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.32 2vak s ALA 12 CO 0.22 -1.30 1.45 0.50 0.00 0.00 0.00 175.76 176.63 2vak s ARG 13 N -3.11 4.28 0.00 0.00 6.06 -0.90 -4.12 118.95 121.16 2vak s ARG 13 Ca 0.75 2.22 0.00 0.00 -2.50 0.00 0.00 55.73 56.20 2vak s ARG 13 Cb -0.36 -3.18 0.00 0.00 0.06 0.00 0.00 34.95 31.47 2vak s ARG 13 CO 0.40 -0.46 0.00 0.00 -2.50 0.00 0.00 175.30 172.74 2vak n ALA 14 N 3.40 1.39 -3.32 6.12 0.00 -1.26 -4.95 120.51 121.88 2vak n ALA 14 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.18 2vak n ALA 14 Cb 0.41 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.73 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 -0.92 3.67 -0.84 0.00 1.01 -1.26 -5.04 121.20 117.81 2vak s ILE 15 Ca 0.00 -0.78 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 2vak s ILE 15 Cb 0.00 -2.89 0.21 0.00 0.01 0.00 0.00 42.46 39.79 2vak s ILE 15 CO 0.00 0.11 0.72 -0.31 0.00 0.00 0.00 174.94 175.46 2vak s TYR 16 N 1.45 3.81 0.12 3.97 2.02 -1.26 -5.05 117.35 122.40 2vak s TYR 16 Ca 0.02 -2.98 -0.08 0.00 -0.37 0.00 0.00 57.07 53.65 2vak s TYR 16 Cb -0.17 -3.22 -0.06 0.00 -0.40 0.00 0.00 41.96 38.11 2vak s TYR 16 CO 0.01 -0.75 0.40 -0.51 -1.57 0.00 0.00 175.55 173.13 2vak s ASP 17 N -0.05 6.58 -0.04 2.29 1.01 -1.26 -1.49 116.67 123.71 2vak s ASP 17 Ca 0.26 0.73 0.04 0.00 0.71 0.00 0.00 52.55 54.28 2vak s ASP 17 Cb -0.09 -2.15 0.00 0.00 1.01 0.00 0.00 42.92 41.69 2vak s ASP 17 CO -0.11 0.11 -0.15 0.12 0.21 0.00 0.00 175.17 175.34 2vak s PHE 18 N -1.53 1.54 -0.14 4.23 5.36 0.06 -4.85 117.98 122.64 2vak s PHE 18 Ca 0.37 -0.45 0.01 0.00 -0.96 0.00 0.00 56.93 55.90 2vak s PHE 18 Cb -0.13 -1.06 0.00 0.00 -0.34 0.00 0.00 43.02 41.49 2vak s PHE 18 CO 0.21 -0.17 -0.18 0.12 -1.46 0.00 0.00 175.22 173.73 2vak s PHE 19 N 0.15 2.72 0.51 10.12 5.36 -1.26 -0.43 117.98 135.14 2vak s PHE 19 Ca -0.05 -1.08 -0.09 0.00 -0.96 0.00 0.00 56.93 54.75 2vak s PHE 19 Cb -0.12 -1.83 -0.05 0.00 -0.34 0.00 0.00 43.02 40.68 2vak s PHE 19 CO 0.02 -0.47 0.87 -1.54 -1.46 0.00 0.00 175.22 172.64 2vak s SER 20 N 0.68 6.34 0.16 6.13 1.04 0.11 -4.01 113.70 124.15 2vak s SER 20 Ca -0.09 1.18 -0.32 0.00 0.48 0.00 0.00 55.95 57.20 2vak s SER 20 Cb -0.16 -2.35 -0.10 0.00 0.10 0.00 0.00 66.02 63.51 2vak s SER 20 CO 0.02 -0.63 1.63 -0.89 0.98 0.00 0.00 173.24 174.35 2vak s THR 21 N -2.78 2.53 0.41 2.02 2.01 -1.26 -2.99 115.64 115.57 2vak s THR 21 Ca 0.51 0.33 -0.25 0.00 0.31 0.00 0.00 61.69 62.59 2vak s THR 21 Cb -0.10 -3.21 -0.08 0.00 0.01 0.00 0.00 72.50 69.11 2vak s THR 21 CO 0.43 0.02 1.17 -2.84 -0.69 0.00 0.00 174.62 172.72 2vak s PRO 22 N 1.42 4.02 0.26 4.92 0.02 -1.26 -2.84 135.00 141.54 2vak s PRO 22 Ca 0.72 1.84 -0.05 0.00 0.02 0.00 0.00 61.00 63.53 2vak s PRO 22 Cb -0.45 -2.65 -0.02 0.00 0.02 0.00 0.00 34.50 31.41 2vak s PRO 22 CO 0.32 -0.35 0.36 -0.59 -0.33 0.00 0.00 177.00 176.41 2vak s PHE 23 N -1.43 0.88 0.00 6.54 -0.71 -1.26 -4.88 117.98 117.13 2vak s PHE 23 Ca 0.58 -1.14 0.00 0.00 -1.04 0.00 0.00 56.93 55.33 2vak s PHE 23 Cb -0.31 -0.17 0.00 0.00 -1.21 0.00 0.00 43.02 41.33 2vak s PHE 23 CO 0.38 -0.91 0.00 0.41 -1.34 0.00 0.00 175.22 173.76 2vak n GLY 24 N -0.41 2.63 0.26 1.99 0.00 -1.26 -4.95 105.19 103.45 2vak n GLY 24 Ca 0.01 -1.93 0.13 0.00 0.00 0.00 0.00 46.02 44.22 2vak n GLY 24 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vak h ASN 25 N 0.00 0.00 -0.61 1.61 2.35 -2.02 -2.74 115.58 114.17 2vak h ASN 25 Ca 0.00 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.69 2vak h ASN 25 Cb 0.00 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 2vak h ASN 25 CO 0.00 0.13 0.07 0.54 -1.65 0.00 0.00 177.43 176.52 2vak n ARG 26 N -3.54 4.55 0.00 0.81 5.12 -1.26 -5.06 116.66 117.28 2vak n ARG 26 Ca -0.01 -3.15 0.00 0.00 -1.93 0.00 0.00 57.85 52.76 2vak n ARG 26 Cb 0.27 -2.25 0.00 0.00 -1.16 0.00 0.00 32.46 29.32 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 0.38 -2.28 3.70 -0.13 0.00 -1.03 -4.84 105.19 100.97 2vak n GLY 27 Ca 0.31 -1.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 2vak n GLY 27 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2vak n LEU 28 N 0.00 3.88 -2.69 0.99 7.94 -1.26 -4.24 117.00 121.62 2vak n LEU 28 Ca 0.00 1.02 -0.27 0.00 -1.11 0.00 0.00 56.01 55.66 2vak n LEU 28 Cb 0.00 -1.53 -0.08 0.00 0.53 0.00 0.00 43.42 42.33 2vak n LEU 28 CO 0.00 0.11 2.25 0.00 -1.11 0.00 0.00 177.39 178.63 2vak n ALA 29 N 4.82 6.81 -2.35 1.96 0.00 -1.26 -4.80 120.51 125.69 2vak n ALA 29 Ca 0.17 -2.88 -0.21 0.00 0.00 0.00 0.00 53.44 50.52 2vak n ALA 29 Cb 0.35 -2.66 -0.08 0.00 0.00 0.00 0.00 19.45 17.06 2vak n ALA 29 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2vak s THR 30 N 0.40 0.19 0.30 0.00 -1.32 -1.24 -1.09 115.64 112.88 2vak s THR 30 Ca 0.64 -2.00 -0.15 0.00 -1.21 0.00 0.00 61.69 58.98 2vak s THR 30 Cb 0.27 -2.45 0.02 0.00 -1.51 0.00 0.00 72.50 68.83 2vak s THR 30 CO -0.07 0.00 0.63 0.54 -2.21 0.00 0.00 174.62 173.50 2vak s ASN 31 N -3.43 0.00 0.42 8.08 2.20 -1.26 -4.58 114.94 116.38 2vak s ASN 31 Ca 0.35 -0.94 0.11 0.00 -0.94 0.00 0.00 52.86 51.44 2vak s ASN 31 Cb 0.03 0.70 0.95 0.00 -2.00 0.00 0.00 41.25 40.93 2vak s ASN 31 CO 0.22 -1.35 2.01 -0.09 -2.94 0.00 0.00 177.10 174.95 2vak h ARG 32 N 2.10 0.47 0.33 3.55 2.43 -1.95 -1.05 114.38 120.26 2vak h ARG 32 Ca -0.25 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 58.87 2vak h ARG 32 Cb 1.25 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 30.70 2vak h ARG 32 CO 0.33 0.31 -0.16 1.15 -1.51 0.00 0.00 179.97 180.09 2vak h THR 33 N 0.48 0.64 0.22 0.20 2.02 -1.96 -0.17 112.91 114.34 2vak h THR 33 Ca 0.22 -0.59 0.01 0.00 0.77 0.00 0.00 66.41 66.82 2vak h THR 33 Cb 0.27 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 2vak h THR 33 CO -0.06 0.11 -0.41 -0.61 0.37 0.00 0.00 175.52 174.92 2vak h GLN 34 N -0.80 -0.69 -1.00 6.66 4.15 -1.93 -2.12 115.11 119.39 2vak h GLN 34 Ca -0.05 0.05 0.17 0.00 0.77 0.00 0.00 58.65 59.59 2vak h GLN 34 Cb 0.52 0.16 -0.10 0.00 0.21 0.00 0.00 27.48 28.27 2vak h GLN 34 CO 0.07 -0.46 0.62 -0.07 -1.93 0.00 0.00 178.83 177.06 2vak h LEU 35 N -0.71 0.80 -0.87 -2.39 3.38 -1.18 -0.77 115.31 113.56 2vak h LEU 35 Ca 0.00 0.08 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 2vak h LEU 35 Cb 0.70 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2vak h LEU 35 CO -0.18 0.33 -0.56 0.28 0.09 0.00 0.00 178.44 178.41 2vak h SER 36 N 0.81 0.02 -0.59 -0.43 0.02 -0.77 -2.59 113.55 110.02 2vak h SER 36 Ca 0.55 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.49 2vak h SER 36 Cb 0.80 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.30 2vak h SER 36 CO -0.33 0.58 0.38 0.77 -1.14 0.00 0.00 176.83 177.08 2vak h SER 37 N 0.02 0.70 0.37 3.07 4.64 -0.46 -2.29 113.55 119.59 2vak h SER 37 Ca -0.01 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2vak h SER 37 Cb 0.99 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2vak h SER 37 CO 0.07 0.52 0.00 0.18 -0.87 0.00 0.00 176.83 176.74 2vak n LEU 38 N -4.43 0.00 -4.93 5.97 4.77 -0.97 -4.87 117.00 112.54 2vak n LEU 38 Ca 0.06 0.37 -0.25 0.00 -0.03 0.00 0.00 56.01 56.16 2vak n LEU 38 Cb 0.06 -0.37 -0.00 0.00 -2.33 0.00 0.00 43.42 40.78 2vak n LEU 38 CO 0.36 -0.18 0.28 -0.76 -1.33 0.00 0.00 177.39 175.76 2vak s LEU 39 N -2.74 3.82 0.57 2.23 1.43 -0.86 -4.87 118.68 118.26 2vak s LEU 39 Ca 0.12 0.58 -0.05 0.00 -1.03 0.00 0.00 54.13 53.74 2vak s LEU 39 Cb 0.10 -3.47 0.01 0.00 0.03 0.00 0.00 46.19 42.86 2vak s LEU 39 CO 0.25 -0.46 0.86 -0.94 0.23 0.00 0.00 176.35 176.29 2vak s SER 40 N -4.09 5.65 0.39 2.29 1.04 -0.97 -4.90 113.70 113.11 2vak s SER 40 Ca 0.44 0.66 0.17 0.00 0.48 0.00 0.00 55.95 57.70 2vak s SER 40 Cb -0.10 -1.70 1.08 0.00 0.10 0.00 0.00 66.02 65.40 2vak s SER 40 CO 0.39 -0.99 1.77 0.77 0.98 0.00 0.00 173.24 176.16 2vak h SER 41 N -0.08 0.47 -0.32 7.02 4.64 -1.99 0.77 113.55 124.07 2vak h SER 41 Ca -0.46 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2vak h SER 41 Cb 1.25 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 2vak h SER 41 CO 0.60 0.09 0.00 -1.54 -0.87 0.00 0.00 176.83 175.11 2vak n SER 42 N -4.65 2.79 -0.31 4.97 3.41 -1.26 -4.92 113.62 113.65 2vak n SER 42 Ca 0.25 -2.27 -0.04 0.00 -0.26 0.00 0.00 58.87 56.55 2vak n SER 42 Cb 0.86 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.34 2vak n SER 42 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2vak n ASN 43 N 0.43 -4.09 -4.68 4.04 3.02 0.27 -4.86 115.26 109.38 2vak n ASN 43 Ca 0.13 0.10 -0.42 0.00 -0.03 0.00 0.00 54.58 54.36 2vak n ASN 43 Cb 0.55 -1.95 -0.03 0.00 -0.61 0.00 0.00 39.78 37.74 2vak n ASN 43 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2vak s SER 44 N -2.45 7.11 0.00 6.41 0.15 -1.26 -0.88 113.70 122.78 2vak s SER 44 Ca 0.00 1.36 0.30 0.00 0.70 0.00 0.00 55.95 58.31 2vak s SER 44 Cb 0.00 -2.51 1.52 0.00 -1.71 0.00 0.00 66.02 63.33 2vak s SER 44 CO 0.00 -0.42 2.02 -0.81 1.20 0.00 0.00 173.24 175.23 2vak n PRO 45 N 5.10 0.91 -0.06 5.44 -0.04 -1.26 -2.28 135.00 142.81 2vak n PRO 45 Ca 0.07 -0.21 -0.03 0.00 -0.04 0.00 0.00 63.50 63.29 2vak n PRO 45 Cb 0.49 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.30 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 -0.86 0.00 -3.77 0.54 5.03 -1.26 -5.03 117.44 112.09 2vak n TRP 46 Ca 0.19 0.00 -0.36 0.00 3.03 0.00 0.00 57.50 60.36 2vak n TRP 46 Cb 0.22 -0.75 -0.12 0.00 -1.03 0.00 0.00 31.31 29.64 2vak n TRP 46 CO 0.00 0.00 0.00 -1.14 -0.03 0.00 0.00 177.69 176.52 2vak s GLN 47 N -2.76 2.02 -0.32 -0.99 -0.44 -1.26 -5.05 119.66 110.87 2vak s GLN 47 Ca -0.08 -1.81 -0.26 0.00 -2.50 0.00 0.00 55.36 50.71 2vak s GLN 47 Cb 0.08 -3.59 0.01 0.00 -1.64 0.00 0.00 33.01 27.87 2vak s GLN 47 CO 0.77 -1.07 0.90 0.42 0.50 0.00 0.00 175.29 176.81 2vak s ILE 61 N 1.15 4.68 -1.06 -2.34 1.09 -1.26 -4.94 121.20 118.51 2vak s ILE 61 Ca 0.08 1.38 -0.04 0.00 -1.10 0.00 0.00 60.65 60.96 2vak s ILE 61 Cb -0.23 -4.26 0.30 0.00 -1.06 0.00 0.00 42.46 37.21 2vak s ILE 61 CO -0.04 -0.36 1.36 0.55 -0.10 0.00 0.00 174.94 176.35 2vak n VAL 62 N 5.69 4.98 -1.49 2.92 3.14 -1.26 -5.06 118.33 127.25 2vak n VAL 62 Ca 0.07 -5.78 -0.40 0.00 -2.96 0.00 0.00 64.34 55.27 2vak n VAL 62 Cb 0.48 -2.18 0.02 0.00 -1.06 0.00 0.00 33.84 31.10 2vak n VAL 62 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 2vak n SER 63 N 1.57 -0.57 -4.42 6.55 7.64 -1.26 -4.98 113.62 118.14 2vak n SER 63 Ca 0.26 0.84 -0.22 0.00 1.01 0.00 0.00 58.87 60.76 2vak n SER 63 Cb 0.35 -1.19 -0.10 0.00 -1.01 0.00 0.00 64.21 62.26 2vak n SER 63 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2vak s THR 64 N -1.56 2.18 0.55 0.44 -4.23 -1.16 -4.99 115.64 106.87 2vak s THR 64 Ca 0.66 -2.33 0.23 0.00 -1.18 0.00 0.00 61.69 59.08 2vak s THR 64 Cb -0.51 -2.21 0.31 0.00 1.34 0.00 0.00 72.50 71.43 2vak s THR 64 CO 0.56 -0.47 2.20 -0.65 -0.54 0.00 0.00 174.62 175.72 2vak h PRO 65 N 2.38 0.00 0.00 3.99 0.11 -1.98 -2.16 132.00 134.35 2vak h PRO 65 Ca -0.39 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.50 2vak h PRO 65 Cb 1.24 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.32 2vak h PRO 65 CO 0.61 0.00 -1.08 0.93 -0.21 0.00 0.00 178.00 178.26 2vak h GLU 66 N 0.00 0.00 -2.32 1.05 4.39 -1.99 -3.38 114.58 112.32 2vak h GLU 66 Ca -0.00 0.00 -0.59 0.00 0.34 0.00 0.00 59.36 59.11 2vak h GLU 66 Cb 0.01 0.00 -0.40 0.00 -0.10 0.00 0.00 28.75 28.26 2vak h GLU 66 CO 0.00 0.89 -0.85 0.00 -1.16 0.00 0.00 179.01 177.89 2vak n ALA 67 N -2.37 3.13 0.26 3.43 0.00 -1.04 -4.76 120.51 119.17 2vak n ALA 67 Ca -0.02 -3.89 0.11 0.00 0.00 0.00 0.00 53.44 49.64 2vak n ALA 67 Cb 0.94 -0.86 0.73 0.00 0.00 0.00 0.00 19.45 20.26 2vak n ALA 67 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2vak h PRO 68 N 4.66 0.00 -5.56 0.00 0.13 -1.60 -3.08 132.00 126.55 2vak h PRO 68 Ca 0.16 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.85 2vak h PRO 68 Cb 0.81 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 31.74 2vak h PRO 68 CO 0.58 0.09 -0.78 0.71 -0.23 0.00 0.00 178.00 178.38 2vak s TYR 69 N -4.48 1.46 0.27 1.56 1.51 -1.26 -4.29 117.35 112.12 2vak s TYR 69 Ca -0.04 -0.50 -0.01 0.00 -1.01 0.00 0.00 57.07 55.50 2vak s TYR 69 Cb 0.15 -0.78 0.60 0.00 -0.11 0.00 0.00 41.96 41.82 2vak s TYR 69 CO 0.60 0.15 1.65 -1.35 -1.11 0.00 0.00 175.55 175.50 2vak h PRO 70 N 3.75 0.20 0.00 -1.71 0.10 -1.82 0.12 132.00 132.64 2vak h PRO 70 Ca -0.41 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.68 2vak h PRO 70 Cb 1.19 -0.05 0.00 0.00 0.10 0.00 0.00 31.00 32.25 2vak h PRO 70 CO 0.47 0.13 0.00 0.41 0.10 0.00 0.00 178.00 179.11 2vak n GLY 71 N -1.38 -0.80 0.17 -0.55 0.00 -0.44 -2.58 105.19 99.62 2vak n GLY 71 Ca 0.18 -0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 2vak n GLY 71 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2vak h SER 72 N 0.00 0.49 -0.42 1.61 0.02 -0.97 -3.26 113.55 111.03 2vak h SER 72 Ca 0.00 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.68 2vak h SER 72 Cb 0.13 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 2vak h SER 72 CO 0.00 0.60 0.15 -0.07 -1.14 0.00 0.00 176.83 176.37 2vak h LEU 73 N 0.36 0.64 0.16 5.07 3.38 -1.63 -1.59 115.31 121.69 2vak h LEU 73 Ca 0.10 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.99 2vak h LEU 73 Cb 0.30 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2vak h LEU 73 CO 0.00 0.61 -0.21 0.24 0.09 0.00 0.00 178.44 179.17 2vak h MET 74 N 0.68 -0.41 -0.64 1.13 2.86 -1.70 0.58 114.93 117.43 2vak h MET 74 Ca 0.16 0.03 -0.07 0.00 -2.06 0.00 0.00 59.70 57.75 2vak h MET 74 Cb 0.20 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.92 2vak h MET 74 CO -0.01 -0.27 0.11 -0.92 1.06 0.00 0.00 176.91 176.88 2vak h TYR 75 N -0.42 1.13 -0.28 -0.22 3.20 -1.56 -1.53 116.97 117.29 2vak h TYR 75 Ca 0.01 -0.15 -0.14 0.00 3.14 0.00 0.00 58.73 61.59 2vak h TYR 75 Cb 0.42 -0.31 -0.00 0.00 1.54 0.00 0.00 36.73 38.38 2vak h TYR 75 CO -0.18 0.95 -0.37 1.96 -1.64 0.00 0.00 178.16 178.88 2vak h GLN 76 N 0.98 0.74 0.00 1.82 4.20 -1.19 -1.94 115.11 119.71 2vak h GLN 76 Ca 0.20 -0.43 -0.05 0.00 0.06 0.00 0.00 58.65 58.43 2vak h GLN 76 Cb 0.43 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 2vak h GLN 76 CO 0.01 1.05 -0.24 0.93 -0.67 0.00 0.00 178.83 179.91 2vak h GLU 77 N 0.48 0.00 -0.41 1.46 5.08 -0.82 -2.16 114.58 118.21 2vak h GLU 77 Ca 0.03 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 2vak h GLU 77 Cb 0.96 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 2vak h GLU 77 CO 0.09 0.24 0.14 0.66 -1.00 0.00 0.00 179.01 179.14 2vak h SER 78 N 0.00 0.54 -0.22 1.42 4.64 -0.53 -1.55 113.55 117.85 2vak h SER 78 Ca -0.00 -0.06 -0.19 0.00 -0.47 0.00 0.00 61.79 61.07 2vak h SER 78 Cb 0.44 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 2vak h SER 78 CO 0.03 0.51 -0.60 0.24 -0.87 0.00 0.00 176.83 176.15 2vak h MET 79 N 0.59 0.79 0.07 4.77 2.86 -0.85 -1.45 114.93 121.70 2vak h MET 79 Ca 0.14 -0.56 0.02 0.00 -2.06 0.00 0.00 59.70 57.25 2vak h MET 79 Cb 0.16 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.87 2vak h MET 79 CO -0.01 1.18 -0.27 1.25 1.06 0.00 0.00 176.91 180.12 2vak h LEU 80 N 0.54 -0.78 -0.82 1.22 5.85 -1.32 0.84 115.31 120.83 2vak h LEU 80 Ca -0.01 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.88 2vak h LEU 80 Cb 1.21 0.31 -0.06 0.00 0.37 0.00 0.00 40.66 42.49 2vak h LEU 80 CO 0.13 -0.35 0.49 0.45 -0.34 0.00 0.00 178.44 178.82 2vak h HIS 81 N -0.45 0.91 -0.67 1.25 3.86 -1.31 -1.03 115.15 117.70 2vak h HIS 81 Ca 0.04 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.25 2vak h HIS 81 Cb 0.50 -0.29 -0.03 0.00 1.06 0.00 0.00 27.41 28.66 2vak h HIS 81 CO -0.27 0.43 0.28 0.77 0.86 0.00 0.00 177.93 180.00 2vak h SER 82 N 0.88 0.91 -0.27 2.45 0.02 -0.92 -2.17 113.55 114.44 2vak h SER 82 Ca 0.37 -0.16 -0.12 0.00 -0.84 0.00 0.00 61.79 61.04 2vak h SER 82 Cb 0.24 -0.24 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2vak h SER 82 CO -0.20 0.82 -0.29 0.00 -1.14 0.00 0.00 176.83 176.02 2vak h ALA 83 N 1.13 0.40 0.00 3.77 0.00 -0.71 -3.40 119.26 120.45 2vak h ALA 83 Ca 0.23 -0.40 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2vak h ALA 83 Cb 0.18 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 2vak h ALA 83 CO -0.02 0.42 -1.84 0.25 0.00 0.00 0.00 179.25 178.06 2vak n THR 84 N -4.27 0.01 -0.14 0.00 -2.24 -0.40 -4.65 114.28 102.58 2vak n THR 84 Ca -0.04 -0.42 -0.28 0.00 -2.27 0.00 0.00 64.05 61.04 2vak n THR 84 Cb 0.47 0.08 -0.10 0.00 -2.10 0.00 0.00 70.33 68.68 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 -2.14 1.52 -0.23 2.28 0.31 -0.82 -4.43 118.33 114.81 2vak n VAL 85 Ca -0.03 -0.42 0.08 0.00 -0.01 0.00 0.00 64.34 63.95 2vak n VAL 85 Cb 0.48 -1.80 0.34 0.00 -0.91 0.00 0.00 33.84 31.95 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 -0.82 0.77 0.00 5.55 0.11 -1.77 -2.70 132.00 133.14 2vak h PRO 86 Ca -0.68 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.38 2vak h PRO 86 Cb 1.67 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.60 2vak h PRO 86 CO -0.37 0.51 0.00 0.41 -0.21 0.00 0.00 178.00 178.34 2vak n GLY 87 N -1.43 -1.06 0.46 -0.55 0.00 -1.26 -2.89 105.19 98.46 2vak n GLY 87 Ca 0.13 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.17 2vak n GLY 87 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2vak n VAL 88 N -1.38 0.00 0.82 1.61 3.14 -1.02 -4.57 118.33 116.94 2vak n VAL 88 Ca 0.08 -0.30 0.13 0.00 -2.96 0.00 0.00 64.34 61.29 2vak n VAL 88 Cb 0.19 1.24 0.53 0.00 -1.06 0.00 0.00 33.84 34.74 2vak n VAL 88 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2vak n LEU 89 N -0.01 0.27 0.22 6.55 4.77 -1.14 -3.84 117.00 123.82 2vak n LEU 89 Ca 0.08 0.53 0.15 0.00 -0.03 0.00 0.00 56.01 56.75 2vak n LEU 89 Cb 0.42 -0.45 0.67 0.00 -2.33 0.00 0.00 43.42 41.73 2vak n LEU 89 CO 0.25 -0.10 0.95 1.23 -1.33 0.00 0.00 177.39 178.39 2vak h GLY 90 N 4.53 0.00 -2.31 -0.72 0.00 -1.82 -3.33 103.07 99.42 2vak h GLY 90 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 47.33 47.62 2vak h GLY 90 CO 0.00 0.00 0.77 -1.35 0.00 0.00 0.00 176.54 175.96 2vak s SER 91 N -4.96 -0.05 0.55 0.19 1.04 -1.25 -4.99 113.70 104.23 2vak s SER 91 Ca 0.01 -0.27 0.33 0.00 0.48 0.00 0.00 55.95 56.50 2vak s SER 91 Cb 0.09 0.25 1.50 0.00 0.10 0.00 0.00 66.02 67.96 2vak s SER 91 CO 0.44 -0.48 2.05 0.03 0.98 0.00 0.00 173.24 176.26 2vak h ARG 92 N 2.00 0.00 -0.06 4.02 3.08 -1.92 -3.18 114.38 118.33 2vak h ARG 92 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2vak h ARG 92 Cb 1.20 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.25 2vak h ARG 92 CO 0.30 0.07 0.00 -0.25 -1.07 0.00 0.00 179.97 179.01 2vak n ASP 93 N -3.26 1.83 -0.19 7.04 8.00 -1.26 -4.67 116.55 124.02 2vak n ASP 93 Ca -0.01 -1.45 0.13 0.00 0.71 0.00 0.00 54.79 54.17 2vak n ASP 93 Cb 0.27 -0.03 0.45 0.00 -0.02 0.00 0.00 41.12 41.79 2vak n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vak h ALA 94 N 1.44 1.99 -0.03 2.24 0.00 -1.83 -2.20 119.26 120.87 2vak h ALA 94 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.92 2vak h ALA 94 Cb 0.38 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2vak h ALA 94 CO 0.00 -0.19 0.06 0.11 0.00 0.00 0.00 179.25 179.23 2vak h TRP 95 N 0.53 0.00 0.16 0.00 5.08 -1.83 -1.57 115.95 118.32 2vak h TRP 95 Ca 0.38 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.35 2vak h TRP 95 Cb 0.75 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.91 2vak h TRP 95 CO -0.00 0.00 -0.08 0.00 -1.28 0.00 0.00 178.44 177.08 2vak h ARG 96 N 0.00 -0.20 -0.01 0.12 3.08 -1.73 -3.37 114.38 112.27 2vak h ARG 96 Ca 0.01 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 2vak h ARG 96 Cb 0.13 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.23 2vak h ARG 96 CO -0.00 0.11 -0.29 0.25 -1.07 0.00 0.00 179.97 178.97 2vak n THR 97 N -5.04 0.00 -1.67 2.04 -2.24 -1.20 -5.00 114.28 101.18 2vak n THR 97 Ca -0.09 -0.36 -0.51 0.00 -2.27 0.00 0.00 64.05 60.83 2vak n THR 97 Cb 0.22 1.11 -0.06 0.00 -2.10 0.00 0.00 70.33 69.50 2vak n THR 97 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 2vak n PHE 98 N -0.41 2.05 -3.88 4.78 7.35 -0.59 -4.34 117.46 122.42 2vak n PHE 98 Ca 0.04 0.35 -0.12 0.00 -0.76 0.00 0.00 57.45 56.97 2vak n PHE 98 Cb 0.23 -2.51 -0.13 0.00 0.35 0.00 0.00 39.48 37.42 2vak n PHE 98 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2vak s ASN 99 N 2.41 0.02 -0.10 -2.13 2.20 -1.26 -4.48 114.94 111.60 2vak s ASN 99 Ca 0.89 -0.04 -0.07 0.00 -0.94 0.00 0.00 52.86 52.70 2vak s ASN 99 Cb -0.85 0.04 0.03 0.00 -2.00 0.00 0.00 41.25 38.47 2vak s ASN 99 CO 0.51 -0.05 0.25 0.54 -2.94 0.00 0.00 177.10 175.42 2vak s VAL 100 N -0.19 -0.02 -1.31 3.54 0.11 -0.72 0.62 120.40 122.43 2vak s VAL 100 Ca -0.02 0.06 -0.11 0.00 -2.93 0.00 0.00 61.98 58.98 2vak s VAL 100 Cb -0.01 -0.37 0.09 0.00 -1.53 0.00 0.00 36.38 34.56 2vak s VAL 100 CO -0.00 0.03 0.51 0.49 -3.33 0.00 0.00 175.10 172.80 2vak n PHE 101 N 3.50 -1.76 -2.31 1.54 3.72 -1.26 -0.54 117.46 120.35 2vak n PHE 101 Ca -0.18 0.51 -0.16 0.00 -0.05 0.00 0.00 57.45 57.56 2vak n PHE 101 Cb 0.56 -2.77 -0.01 0.00 -0.94 0.00 0.00 39.48 36.32 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 -1.16 -0.29 3.37 1.37 0.00 -1.26 -4.30 105.19 102.91 2vak n GLY 102 Ca 0.01 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.58 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 -4.69 2.41 0.03 0.99 1.43 0.29 -1.66 118.68 117.48 2vak s LEU 103 Ca 0.00 -0.83 -0.07 0.00 -1.03 0.00 0.00 54.13 52.21 2vak s LEU 103 Cb 0.00 -1.03 -0.01 0.00 0.03 0.00 0.00 46.19 45.19 2vak s LEU 103 CO 0.00 0.07 0.12 -0.44 0.23 0.00 0.00 176.35 176.33 2vak s SER 104 N -2.50 0.11 0.47 2.29 0.01 -0.12 -1.75 113.70 112.21 2vak s SER 104 Ca 0.17 -0.42 -0.21 0.00 1.31 0.00 0.00 55.95 56.79 2vak s SER 104 Cb -0.08 0.23 -0.08 0.00 0.21 0.00 0.00 66.02 66.30 2vak s SER 104 CO 0.08 -0.48 1.06 0.26 0.41 0.00 0.00 173.24 174.57 2vak s TRP 105 N -2.26 3.02 -0.70 2.43 0.52 -1.26 -1.17 118.94 119.53 2vak s TRP 105 Ca -0.08 1.59 0.25 0.00 0.02 0.00 0.00 56.10 57.88 2vak s TRP 105 Cb -0.03 -3.13 0.62 0.00 -1.15 0.00 0.00 33.47 29.79 2vak s TRP 105 CO -0.03 -0.91 1.60 0.25 0.02 0.00 0.00 176.95 177.88 2vak n THR 106 N -0.73 0.51 -3.77 2.01 -2.24 -0.53 -4.87 114.28 104.65 2vak n THR 106 Ca 0.08 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.57 2vak n THR 106 Cb 0.51 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 2vak n THR 106 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2vak s ASP 107 N -4.42 -0.07 0.25 3.42 1.47 -1.26 -4.99 116.67 111.07 2vak s ASP 107 Ca 0.09 -0.34 0.03 0.00 1.18 0.00 0.00 52.55 53.50 2vak s ASP 107 Cb 0.13 0.32 0.31 0.00 -0.34 0.00 0.00 42.92 43.34 2vak s ASP 107 CO 0.65 -0.62 1.62 -0.08 0.68 0.00 0.00 175.17 177.42 2vak h GLU 108 N 2.00 0.37 0.00 2.11 4.81 -1.93 -2.41 114.58 119.52 2vak h GLU 108 Ca -0.27 -0.20 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2vak h GLU 108 Cb 1.21 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.60 2vak h GLU 108 CO 0.30 0.76 0.00 0.41 -0.73 0.00 0.00 179.01 179.74 2vak n GLY 109 N -0.01 -0.25 3.51 1.92 0.00 -1.26 -4.85 105.19 104.24 2vak n GLY 109 Ca -0.02 -0.04 -0.26 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.88 -2.34 0.07 0.99 4.77 -0.91 -4.90 117.00 113.81 2vak n LEU 110 Ca 0.05 -0.52 -0.04 0.00 -0.03 0.00 0.00 56.01 55.46 2vak n LEU 110 Cb 0.02 -2.56 0.16 0.00 -2.33 0.00 0.00 43.42 38.70 2vak n LEU 110 CO 0.03 0.33 0.56 -1.28 -1.33 0.00 0.00 177.39 175.71 2vak h SER 111 N -1.62 0.33 -5.02 -1.43 0.87 -1.89 -3.47 113.55 101.32 2vak h SER 111 Ca -0.52 -0.16 -0.05 0.00 -1.23 0.00 0.00 61.79 59.83 2vak h SER 111 Cb 1.35 -0.09 -0.15 0.00 -0.44 0.00 0.00 62.40 63.06 2vak h SER 111 CO 0.60 0.77 0.09 -0.83 -0.53 0.00 0.00 176.83 176.93 2vak s GLY 112 N -4.23 -0.48 -0.15 5.77 0.00 -1.26 -4.31 107.32 102.66 2vak s GLY 112 Ca -0.05 0.61 0.01 0.00 0.00 0.00 0.00 44.72 45.30 2vak s GLY 112 CO 0.79 0.30 -0.18 1.08 0.00 0.00 0.00 173.10 175.09 2vak s LEU 113 N -2.12 2.31 0.35 0.66 1.43 -0.06 -1.46 118.68 119.78 2vak s LEU 113 Ca -0.04 -0.54 0.04 0.00 -1.03 0.00 0.00 54.13 52.56 2vak s LEU 113 Cb -0.00 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.67 2vak s LEU 113 CO -0.04 0.07 0.14 0.68 0.23 0.00 0.00 176.35 177.43 2vak s VAL 114 N 0.87 0.55 0.60 -1.59 -7.23 -0.32 -4.81 120.40 108.46 2vak s VAL 114 Ca -0.05 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 57.93 2vak s VAL 114 Cb -0.15 -2.49 -0.03 0.00 0.56 0.00 0.00 36.38 34.27 2vak s VAL 114 CO -0.02 0.00 1.26 0.00 -0.31 0.00 0.00 175.10 176.03 2vak s ALA 115 N -3.40 2.55 0.38 1.32 0.00 -1.26 -0.95 121.76 120.40 2vak s ALA 115 Ca 0.31 1.12 -0.10 0.00 0.00 0.00 0.00 51.96 53.29 2vak s ALA 115 Cb 0.04 -3.50 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 2vak s ALA 115 CO 0.16 -1.31 0.74 0.00 0.00 0.00 0.00 175.76 175.35 2vak s ALA 116 N -1.48 3.38 0.05 0.00 0.00 -0.66 -4.39 121.76 118.65 2vak s ALA 116 Ca 0.78 -0.22 -0.30 0.00 0.00 0.00 0.00 51.96 52.21 2vak s ALA 116 Cb -0.34 -2.66 -0.09 0.00 0.00 0.00 0.00 23.12 20.03 2vak s ALA 116 CO 0.37 0.06 1.95 1.04 0.00 0.00 0.00 175.76 179.18 2vak n GLN 117 N -1.16 2.85 -4.67 0.00 6.02 -1.26 -4.92 117.38 114.24 2vak n GLN 117 Ca 0.02 1.04 -0.33 0.00 -0.01 0.00 0.00 57.00 57.72 2vak n GLN 117 Cb 0.54 -2.99 -0.14 0.00 1.02 0.00 0.00 30.24 28.67 2vak n GLN 117 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 177.06 176.21 2vak s ASP 118 N 4.18 4.13 0.58 1.08 -4.77 -1.26 -2.27 116.67 118.34 2vak s ASP 118 Ca 0.88 -0.31 -0.18 0.00 -3.30 0.00 0.00 52.55 49.65 2vak s ASP 118 Cb -0.45 -1.64 -0.04 0.00 -1.09 0.00 0.00 42.92 39.70 2vak s ASP 118 CO 0.42 0.15 1.10 -2.84 0.70 0.00 0.00 175.17 174.70 2vak s PRO 119 N 0.42 3.22 0.17 2.11 0.02 -1.26 -5.11 135.00 134.58 2vak s PRO 119 Ca -0.09 1.45 -0.28 0.00 0.02 0.00 0.00 61.00 62.11 2vak s PRO 119 Cb -0.16 -2.00 -0.08 0.00 0.02 0.00 0.00 34.50 32.29 2vak s PRO 119 CO 0.05 -0.93 0.87 -1.25 -0.33 0.00 0.00 177.00 175.41 2vak s PRO 120 N -3.66 4.70 0.00 5.54 0.04 -0.96 -4.92 135.00 135.73 2vak s PRO 120 Ca 0.69 1.33 0.02 0.00 0.04 0.00 0.00 61.00 63.08 2vak s PRO 120 Cb -0.21 -3.30 0.12 0.00 0.04 0.00 0.00 34.50 31.15 2vak s PRO 120 CO 0.32 0.46 0.94 -2.30 0.04 0.00 0.00 177.00 176.47 2vak n PRO 121 N 1.88 0.02 -4.08 0.56 -0.02 -1.26 -4.63 135.00 127.48 2vak n PRO 121 Ca -0.03 0.32 -0.14 0.00 -2.02 0.00 0.00 63.50 61.64 2vak n PRO 121 Cb 0.48 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.34 2vak n PRO 121 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2vak s ALA 122 N -2.69 0.45 0.26 3.55 0.00 -1.26 -5.08 121.76 116.98 2vak s ALA 122 Ca 0.02 -0.53 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 2vak s ALA 122 Cb 0.02 -0.00 -0.14 0.00 0.00 0.00 0.00 23.12 23.00 2vak s ALA 122 CO 0.04 0.01 1.28 0.00 0.00 0.00 0.00 175.76 177.09 2vak n ALA 123 N 2.07 0.65 -1.78 0.00 0.00 -1.26 -4.81 120.51 115.38 2vak n ALA 123 Ca -0.19 0.41 -0.41 0.00 0.00 0.00 0.00 53.44 53.25 2vak n ALA 123 Cb 0.56 -2.19 -0.01 0.00 0.00 0.00 0.00 19.45 17.81 2vak n ALA 123 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2vak s PRO 124 N -0.88 4.14 0.30 0.00 0.02 -1.26 -4.72 135.00 132.59 2vak s PRO 124 Ca 0.65 2.53 -0.30 0.00 0.02 0.00 0.00 61.00 63.91 2vak s PRO 124 Cb -0.67 -3.00 -0.11 0.00 0.02 0.00 0.00 34.50 30.74 2vak s PRO 124 CO 0.54 -0.53 1.56 -0.47 -0.33 0.00 0.00 177.00 177.77 2vak s TYR 125 N -0.77 2.77 -0.30 6.54 5.04 0.20 -5.00 117.35 125.83 2vak s TYR 125 Ca 0.56 0.87 -0.07 0.00 -2.44 0.00 0.00 57.07 55.99 2vak s TYR 125 Cb -0.46 -4.03 0.02 0.00 0.35 0.00 0.00 41.96 37.84 2vak s TYR 125 CO 0.57 -3.37 0.08 1.14 -1.34 0.00 0.00 175.55 172.63 2vak s GLN 126 N -0.69 2.99 0.36 4.97 -2.07 -1.26 -4.73 119.66 119.22 2vak s GLN 126 Ca 0.61 -0.93 -0.28 0.00 -1.82 0.00 0.00 55.36 52.94 2vak s GLN 126 Cb -0.47 -3.37 -0.12 0.00 -1.09 0.00 0.00 33.01 27.96 2vak s GLN 126 CO 0.49 -0.49 1.43 -2.30 -1.32 0.00 0.00 175.29 173.11 2vak n PRO 127 N 4.85 2.50 -3.88 9.60 -0.02 -1.26 -5.04 135.00 141.75 2vak n PRO 127 Ca -0.14 0.88 -0.32 0.00 -2.02 0.00 0.00 63.50 61.90 2vak n PRO 127 Cb 0.47 -2.57 -0.04 0.00 -0.02 0.00 0.00 33.50 31.34 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 -1.03 3.96 -0.09 3.55 0.00 -1.26 -4.87 121.76 122.02 2vak s ALA 128 Ca 0.55 -0.77 -0.27 0.00 0.00 0.00 0.00 51.96 51.47 2vak s ALA 128 Cb -0.51 -1.90 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 2vak s ALA 128 CO 0.62 0.77 0.89 0.45 0.00 0.00 0.00 175.76 178.50 2vak s SER 129 N -2.26 7.14 -1.16 0.00 0.15 -1.26 -4.46 113.70 111.86 2vak s SER 129 Ca 0.33 1.39 -0.19 0.00 0.70 0.00 0.00 55.95 58.18 2vak s SER 129 Cb -0.13 -2.50 -0.01 0.00 -1.71 0.00 0.00 66.02 61.67 2vak s SER 129 CO 0.24 -0.32 0.77 0.00 1.20 0.00 0.00 173.24 175.13 2vak n ALA 130 N 4.55 -2.50 -2.47 5.45 0.00 -1.13 -4.90 120.51 119.50 2vak n ALA 130 Ca 0.05 -0.23 -0.19 0.00 0.00 0.00 0.00 53.44 53.07 2vak n ALA 130 Cb 0.50 -3.97 -0.11 0.00 0.00 0.00 0.00 19.45 15.87 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 -5.98 1.10 -0.10 0.00 0.74 -1.25 -4.86 119.66 109.30 2vak s GLN 131 Ca 0.43 -1.30 -0.07 0.00 0.05 0.00 0.00 55.36 54.47 2vak s GLN 131 Cb -0.15 -1.01 -0.04 0.00 1.10 0.00 0.00 33.01 32.91 2vak s GLN 131 CO 0.86 0.19 0.16 -1.58 -0.55 0.00 0.00 175.29 174.38 2vak s TRP 132 N -2.18 3.61 0.05 1.67 0.52 -1.26 -0.72 118.94 120.63 2vak s TRP 132 Ca 0.11 0.56 0.06 0.00 0.02 0.00 0.00 56.10 56.85 2vak s TRP 132 Cb -0.05 -1.96 -0.02 0.00 -1.15 0.00 0.00 33.47 30.29 2vak s TRP 132 CO 0.04 0.73 -0.17 -1.12 0.02 0.00 0.00 176.95 176.44 2vak s SER 133 N -1.08 2.05 -0.44 2.95 0.01 0.42 -4.97 113.70 112.64 2vak s SER 133 Ca 0.16 -0.50 -0.17 0.00 1.31 0.00 0.00 55.95 56.75 2vak s SER 133 Cb -0.12 -0.15 0.03 0.00 0.21 0.00 0.00 66.02 65.99 2vak s SER 133 CO 0.05 0.09 0.44 -0.62 0.41 0.00 0.00 173.24 173.62 2vak s ASP 134 N -1.21 6.18 0.17 2.44 -1.08 -1.26 -0.76 116.67 121.15 2vak s ASP 134 Ca 0.04 -0.83 0.21 0.00 -0.52 0.00 0.00 52.55 51.46 2vak s ASP 134 Cb -0.08 -2.22 0.87 0.00 -1.46 0.00 0.00 42.92 40.03 2vak s ASP 134 CO 0.02 -0.62 1.65 0.18 0.52 0.00 0.00 175.17 176.92 2vak n LEU 135 N 5.58 0.46 0.00 -1.34 4.77 -0.56 -2.14 117.00 123.78 2vak n LEU 135 Ca -0.08 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 2vak n LEU 135 Cb 0.46 -0.53 0.57 0.00 -2.33 0.00 0.00 43.42 41.59 2vak n LEU 135 CO 0.47 -0.42 0.89 0.18 -1.33 0.00 0.00 177.39 177.18 2vak n LEU 136 N -1.99 0.00 0.16 2.23 4.77 -1.26 -2.53 117.00 118.38 2vak n LEU 136 Ca 0.03 0.36 0.13 0.00 -0.03 0.00 0.00 56.01 56.49 2vak n LEU 136 Cb 0.23 -0.36 0.55 0.00 -2.33 0.00 0.00 43.42 41.52 2vak n LEU 136 CO 0.19 -0.07 0.88 0.78 -1.33 0.00 0.00 177.39 177.84 2vak h ASN 137 N 0.00 0.00 -3.63 -1.43 2.35 -1.75 -3.39 115.58 107.73 2vak h ASN 137 Ca 0.00 0.00 -0.57 0.00 -0.55 0.00 0.00 56.30 55.18 2vak h ASN 137 Cb 0.28 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.58 2vak h ASN 137 CO 0.00 0.00 0.83 -0.47 -1.65 0.00 0.00 177.43 176.14 2vak s TYR 138 N -3.42 2.90 0.34 1.19 5.04 -1.05 -4.76 117.35 117.59 2vak s TYR 138 Ca 0.03 0.72 0.08 0.00 -2.44 0.00 0.00 57.07 55.46 2vak s TYR 138 Cb 0.09 -4.18 0.80 0.00 0.35 0.00 0.00 41.96 39.01 2vak s TYR 138 CO 0.39 -1.13 1.83 -1.35 -1.34 0.00 0.00 175.55 173.94 2vak h PRO 139 N 8.98 0.69 -0.14 4.97 0.11 -1.83 0.67 132.00 145.45 2vak h PRO 139 Ca -0.23 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.73 2vak h PRO 139 Cb 1.06 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.01 2vak h PRO 139 CO 1.08 0.46 -0.40 -0.09 -0.21 0.00 0.00 178.00 178.84 2vak h ARG 140 N 0.71 0.32 -0.02 1.05 2.43 -1.94 -2.21 114.38 114.73 2vak h ARG 140 Ca 0.51 -0.15 -0.20 0.00 -0.81 0.00 0.00 59.98 59.33 2vak h ARG 140 Cb 0.84 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 2vak h ARG 140 CO -0.27 0.68 -0.84 -1.49 -1.51 0.00 0.00 179.97 176.54 2vak h TRP 141 N 0.27 0.45 -0.72 2.20 6.55 -1.15 0.13 115.95 123.68 2vak h TRP 141 Ca 0.03 -0.23 -0.05 0.00 0.95 0.00 0.00 58.89 59.59 2vak h TRP 141 Cb 0.83 -0.06 -0.03 0.00 -0.86 0.00 0.00 29.16 29.04 2vak h TRP 141 CO 0.02 1.02 0.26 0.00 -1.05 0.00 0.00 178.44 178.69 2vak h ALA 142 N 0.91 1.10 0.07 1.49 0.00 -1.11 -2.94 119.26 118.78 2vak h ALA 142 Ca -0.05 -0.20 -0.32 0.00 0.00 0.00 0.00 54.91 54.34 2vak h ALA 142 Cb 1.44 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2vak h ALA 142 CO 0.14 0.63 -1.78 -0.91 0.00 0.00 0.00 179.25 177.33 2vak h ASN 143 N 1.06 0.23 -2.39 0.00 -0.26 -1.42 -3.39 115.58 109.40 2vak h ASN 143 Ca 0.24 -0.47 -0.63 0.00 -0.56 0.00 0.00 56.30 54.88 2vak h ASN 143 Cb 0.24 -0.07 -0.40 0.00 -1.06 0.00 0.00 38.32 37.02 2vak h ASN 143 CO -0.02 1.41 -0.41 0.54 -1.06 0.00 0.00 177.43 177.90 2vak n ARG 144 N -3.29 2.72 0.12 0.81 1.74 0.46 -4.93 116.66 114.30 2vak n ARG 144 Ca -0.22 -4.64 0.08 0.00 -0.77 0.00 0.00 57.85 52.29 2vak n ARG 144 Cb 1.05 -2.30 0.56 0.00 -1.02 0.00 0.00 32.46 30.75 2vak n ARG 144 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2vak h ARG 145 N 4.48 0.22 0.00 5.56 2.43 -1.73 -1.68 114.38 123.66 2vak h ARG 145 Ca 0.19 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.35 2vak h ARG 145 Cb 0.67 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.17 2vak h ARG 145 CO 0.89 0.15 -0.01 -0.09 -1.51 0.00 0.00 179.97 179.39 2vak h ARG 146 N 0.23 0.00 0.00 0.20 2.43 -1.91 0.21 114.38 115.53 2vak h ARG 146 Ca 0.09 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.16 2vak h ARG 146 Cb 0.10 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 2vak h ARG 146 CO -0.02 0.01 -0.48 0.93 -1.51 0.00 0.00 179.97 178.90 2vak h GLU 147 N 0.00 0.00 0.16 0.20 5.08 -1.66 -2.76 114.58 115.60 2vak h GLU 147 Ca -0.00 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.10 2vak h GLU 147 Cb 0.07 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.33 2vak h GLU 147 CO 0.00 0.48 -1.21 1.25 -1.00 0.00 0.00 179.01 178.54 2vak h LEU 148 N 0.00 0.52 -1.26 1.33 5.85 -1.12 -3.30 115.31 117.33 2vak h LEU 148 Ca -0.00 -0.91 -0.03 0.00 0.84 0.00 0.00 57.88 57.77 2vak h LEU 148 Cb 1.27 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.11 2vak h LEU 148 CO 0.06 1.56 0.12 1.56 -0.34 0.00 0.00 178.44 181.41 2vak h GLN 149 N -0.22 0.64 -0.40 1.25 4.20 -1.23 0.47 115.11 119.82 2vak h GLN 149 Ca -0.23 -0.10 -0.01 0.00 0.06 0.00 0.00 58.65 58.36 2vak h GLN 149 Cb 1.81 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 29.46 2vak h GLN 149 CO 0.15 0.57 0.18 1.03 -0.67 0.00 0.00 178.83 180.09 2vak h SER 150 N 0.63 0.49 0.38 1.46 0.87 -1.65 -3.08 113.55 112.66 2vak h SER 150 Ca 0.15 -0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.63 2vak h SER 150 Cb 0.21 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.03 2vak h SER 150 CO -0.01 0.43 -1.65 0.29 -0.53 0.00 0.00 176.83 175.36 2vak n LYS 151 N -4.40 0.64 -0.20 2.24 5.02 0.37 -4.55 118.16 117.27 2vak n LYS 151 Ca 0.03 -0.05 -0.03 0.00 -2.02 0.00 0.00 58.31 56.24 2vak n LYS 151 Cb 0.12 -1.64 0.17 0.00 -0.02 0.00 0.00 35.03 33.66 2vak n LYS 151 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 2vak h TYR 152 N 0.00 0.98 -0.93 2.13 3.20 -0.11 -2.71 116.97 119.53 2vak h TYR 152 Ca -0.05 -0.05 0.11 0.00 3.14 0.00 0.00 58.73 61.88 2vak h TYR 152 Cb 1.13 -0.30 -0.07 0.00 1.54 0.00 0.00 36.73 39.02 2vak h TYR 152 CO 0.00 0.74 0.60 -1.35 -1.64 0.00 0.00 178.16 176.51 2vak h PRO 153 N 0.97 0.87 -0.38 1.82 0.11 -1.80 0.43 132.00 134.01 2vak h PRO 153 Ca 0.23 -0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.24 2vak h PRO 153 Cb 0.16 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.06 2vak h PRO 153 CO -0.02 0.57 0.04 1.25 -0.21 0.00 0.00 178.00 179.63 2vak h LEU 154 N 0.89 0.61 -0.33 2.35 5.85 -1.80 -1.64 115.31 121.24 2vak h LEU 154 Ca 0.45 -0.27 -0.20 0.00 0.84 0.00 0.00 57.88 58.70 2vak h LEU 154 Cb 0.49 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 2vak h LEU 154 CO -0.21 0.73 -0.78 -0.07 -0.34 0.00 0.00 178.44 177.77 2vak h LEU 155 N 0.47 0.53 -0.72 2.25 3.38 -1.31 -2.93 115.31 116.98 2vak h LEU 155 Ca 0.11 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.65 2vak h LEU 155 Cb 0.39 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 2vak h LEU 155 CO 0.01 1.12 0.20 0.25 0.09 0.00 0.00 178.44 180.12 2vak h LEU 156 N 0.29 1.07 -1.80 1.67 5.85 -0.16 -1.13 115.31 121.10 2vak h LEU 156 Ca -0.04 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.43 2vak h LEU 156 Cb 1.37 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 2vak h LEU 156 CO 0.14 1.01 -0.15 0.08 -0.34 0.00 0.00 178.44 179.18 2vak h ARG 157 N 1.07 0.00 -0.07 1.25 0.11 -1.21 0.10 114.38 115.63 2vak h ARG 157 Ca 0.23 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.26 2vak h ARG 157 Cb 0.34 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.42 2vak h ARG 157 CO -0.00 0.15 -0.16 0.77 0.10 0.00 0.00 179.97 180.82 2vak h SER 158 N 0.00 0.26 -0.61 0.08 0.02 -1.43 -1.78 113.55 110.09 2vak h SER 158 Ca -0.00 -0.58 0.12 0.00 -0.84 0.00 0.00 61.79 60.49 2vak h SER 158 Cb 0.29 -0.08 -0.12 0.00 0.14 0.00 0.00 62.40 62.64 2vak h SER 158 CO 0.02 0.80 -0.18 0.74 -1.14 0.00 0.00 176.83 177.07 2vak h THR 159 N -0.26 0.34 -0.26 -2.27 2.02 -0.72 -0.46 112.91 111.31 2vak h THR 159 Ca -0.00 0.00 -0.18 0.00 0.77 0.00 0.00 66.41 66.99 2vak h THR 159 Cb 0.76 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 2vak h THR 159 CO 0.04 0.00 -0.57 -0.07 0.37 0.00 0.00 175.52 175.29 2vak h LEU 160 N -0.03 0.91 -1.03 2.58 3.38 -0.85 -1.10 115.31 119.17 2vak h LEU 160 Ca 0.29 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.74 2vak h LEU 160 Cb 0.47 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2vak h LEU 160 CO -0.65 1.28 0.35 0.25 0.09 0.00 0.00 178.44 179.77 2vak h LEU 161 N 0.62 0.94 -0.25 1.67 5.85 -0.99 -2.05 115.31 121.10 2vak h LEU 161 Ca 0.01 -0.10 -0.21 0.00 0.84 0.00 0.00 57.88 58.42 2vak h LEU 161 Cb 1.17 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 2vak h LEU 161 CO 0.12 0.79 -0.89 0.28 -0.34 0.00 0.00 178.44 178.41 2vak h SER 162 N 1.03 0.43 0.21 1.25 0.02 -0.90 -3.14 113.55 112.46 2vak h SER 162 Ca 0.25 -0.34 -0.10 0.00 -0.84 0.00 0.00 61.79 60.77 2vak h SER 162 Cb 0.10 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.50 2vak h SER 162 CO -0.03 1.13 -0.37 0.00 -1.14 0.00 0.00 176.83 176.41 2vak h ALA 163 N 0.85 1.17 -2.76 3.77 0.00 -1.14 -3.45 119.26 117.70 2vak h ALA 163 Ca -0.06 -0.38 -0.50 0.00 0.00 0.00 0.00 54.91 53.96 2vak h ALA 163 Cb 1.51 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.22 2vak h ALA 163 CO 0.15 0.56 0.44 -1.64 0.00 0.00 0.00 179.25 178.76 2vak s MET 164 N -4.22 4.69 0.22 0.00 1.00 -0.78 -0.19 119.30 120.01 2vak s MET 164 Ca -0.04 1.71 -0.01 0.00 0.00 0.00 0.00 55.69 57.35 2vak s MET 164 Cb 0.14 -3.23 0.19 0.00 0.00 0.00 0.00 34.83 31.93 2vak s MET 164 CO 0.76 0.26 1.56 -0.09 0.00 0.00 0.00 175.02 177.51 2vak h ARG 165 N 4.15 0.49 0.00 2.03 2.43 -1.85 -3.45 114.38 118.18 2vak h ARG 165 Ca -0.46 -0.28 0.00 0.00 -0.81 0.00 0.00 59.98 58.43 2vak h ARG 165 Cb 1.21 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 2vak h ARG 165 CO 0.68 0.88 0.00 0.00 -1.51 0.00 0.00 179.97 180.02 2vak n ALA 166 N -2.50 0.00 -1.95 2.80 0.00 -1.26 -4.98 120.51 112.62 2vak n ALA 166 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.13 2vak n ALA 166 Cb 0.57 0.00 0.18 0.00 0.00 0.00 0.00 19.45 20.20 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 1.79 0.54 0.00 0.00 0.20 -5.02 107.32 104.84 2vak s GLY 167 Ca 0.00 -1.39 -0.20 0.00 0.00 0.00 0.00 44.72 43.12 2vak s GLY 167 CO 0.00 -0.63 1.21 2.56 0.00 0.00 0.00 173.10 176.24 2vak s PRO 168 N -5.76 3.25 0.20 2.90 0.04 -1.26 -4.11 135.00 130.25 2vak s PRO 168 Ca 0.74 1.86 -0.17 0.00 0.04 0.00 0.00 61.00 63.47 2vak s PRO 168 Cb -0.03 -2.11 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 2vak s PRO 168 CO 0.52 -0.99 0.64 0.54 0.04 0.00 0.00 177.00 177.75 2vak s VAL 169 N -1.55 4.71 0.05 -0.36 0.11 -1.26 -2.67 120.40 119.42 2vak s VAL 169 Ca 0.72 1.04 0.05 0.00 -2.93 0.00 0.00 61.98 60.87 2vak s VAL 169 Cb -0.31 -3.78 -0.04 0.00 -1.53 0.00 0.00 36.38 30.72 2vak s VAL 169 CO 0.35 0.19 -0.07 -0.76 -3.33 0.00 0.00 175.10 171.48 2vak s LEU 170 N -2.05 3.14 -0.39 2.54 1.43 0.24 -4.67 118.68 118.91 2vak s LEU 170 Ca 0.42 -0.24 -0.19 0.00 -1.03 0.00 0.00 54.13 53.08 2vak s LEU 170 Cb -0.15 -1.86 0.01 0.00 0.03 0.00 0.00 46.19 44.22 2vak s LEU 170 CO 0.20 0.23 0.58 -0.47 0.23 0.00 0.00 176.35 177.12 2vak s TYR 171 N -1.11 3.13 -0.30 0.29 5.04 -1.26 -1.81 117.35 121.33 2vak s TYR 171 Ca 0.20 0.06 0.03 0.00 -2.44 0.00 0.00 57.07 54.92 2vak s TYR 171 Cb -0.11 -3.12 0.08 0.00 0.35 0.00 0.00 41.96 39.16 2vak s TYR 171 CO 0.11 -0.70 -0.03 0.08 -1.34 0.00 0.00 175.55 173.67 2vak s VAL 172 N 2.58 2.24 -0.09 3.14 1.01 0.18 -4.75 120.40 124.72 2vak s VAL 172 Ca 0.20 -1.99 0.01 0.00 0.00 0.00 0.00 61.98 60.20 2vak s VAL 172 Cb -0.15 -2.50 0.02 0.00 0.00 0.00 0.00 36.38 33.75 2vak s VAL 172 CO 0.16 -0.32 -0.08 -0.70 0.00 0.00 0.00 175.10 174.16 2vak s GLU 173 N 1.00 1.44 0.16 2.72 2.12 -1.26 -0.36 118.70 124.52 2vak s GLU 173 Ca 0.01 -0.27 0.10 0.00 0.36 0.00 0.00 54.97 55.18 2vak s GLU 173 Cb -0.20 -1.40 -0.04 0.00 0.26 0.00 0.00 34.13 32.76 2vak s GLU 173 CO -0.06 -0.15 -0.20 0.95 -0.54 0.00 0.00 175.26 175.25 2vak s THR 174 N 1.28 2.62 0.07 -1.70 -4.23 -0.48 -4.68 115.64 108.52 2vak s THR 174 Ca -0.03 -1.78 -0.11 0.00 -1.18 0.00 0.00 61.69 58.59 2vak s THR 174 Cb -0.14 -2.23 0.01 0.00 1.34 0.00 0.00 72.50 71.48 2vak s THR 174 CO -0.03 -0.02 0.23 -1.66 -0.54 0.00 0.00 174.62 172.60 2vak s TRP 175 N -1.43 0.03 0.33 3.99 -2.14 -1.26 0.30 118.94 118.76 2vak s TRP 175 Ca 0.20 -0.32 -0.28 0.00 2.66 0.00 0.00 56.10 58.36 2vak s TRP 175 Cb -0.09 0.01 -0.13 0.00 -3.10 0.00 0.00 33.47 30.16 2vak s TRP 175 CO 0.10 -0.51 1.16 -2.30 -2.66 0.00 0.00 176.95 172.74 2vak n PRO 176 N 0.30 1.76 -3.05 3.25 -0.02 -1.26 -2.35 135.00 133.64 2vak n PRO 176 Ca -0.17 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2vak n PRO 176 Cb 0.61 -2.12 0.00 0.00 -0.02 0.00 0.00 33.50 31.96 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 0.89 0.00 -0.30 2.55 6.94 -1.26 -4.88 115.26 119.20 2vak n ASN 177 Ca 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 54.58 54.59 2vak n ASN 177 Cb 0.35 0.00 0.10 0.00 -2.36 0.00 0.00 39.78 37.87 2vak n ASN 177 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2vak h MET 178 N 2.31 1.19 -3.99 -3.83 -0.00 -1.86 -3.34 114.93 105.42 2vak h MET 178 Ca 0.00 -0.17 -0.76 0.00 -0.00 0.00 0.00 59.70 58.77 2vak h MET 178 Cb 0.00 -0.22 -0.26 0.00 -0.00 0.00 0.00 31.60 31.12 2vak h MET 178 CO 0.00 0.91 -0.13 0.42 -0.00 0.00 0.00 176.91 178.11 2vak s ILE 179 N -5.70 5.16 0.18 -0.10 1.01 -1.26 -4.87 121.20 115.61 2vak s ILE 179 Ca -0.12 -2.00 -0.19 0.00 0.00 0.00 0.00 60.65 58.34 2vak s ILE 179 Cb 0.16 -4.27 0.04 0.00 0.01 0.00 0.00 42.46 38.41 2vak s ILE 179 CO 0.83 -0.92 0.53 -0.94 0.00 0.00 0.00 174.94 174.44 2vak s SER 180 N 2.76 -0.34 0.51 3.58 1.04 -1.26 -4.67 113.70 115.33 2vak s SER 180 Ca 0.10 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.20 2vak s SER 180 Cb -0.21 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.48 2vak s SER 180 CO -0.02 -1.01 0.00 0.61 0.98 0.00 0.00 173.24 173.79 2vak n GLY 181 N -0.34 1.57 0.37 7.32 0.00 -1.26 -2.46 105.19 110.39 2vak n GLY 181 Ca -0.13 -0.66 0.10 0.00 0.00 0.00 0.00 46.02 45.33 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 0.77 -0.56 1.61 2.47 -2.00 -2.33 114.38 114.34 2vak h ARG 182 Ca 0.00 -0.05 -0.01 0.00 -1.26 0.00 0.00 59.98 58.66 2vak h ARG 182 Cb 0.00 -0.17 -0.03 0.00 -1.65 0.00 0.00 29.97 28.12 2vak h ARG 182 CO 0.00 0.51 0.31 1.25 0.56 0.00 0.00 179.97 182.60 2vak h LEU 183 N 0.79 0.69 -1.02 3.04 5.85 -1.85 0.71 115.31 123.52 2vak h LEU 183 Ca 0.46 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 59.06 2vak h LEU 183 Cb 0.63 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2vak h LEU 183 CO -0.22 0.58 0.31 0.00 -0.34 0.00 0.00 178.44 178.77 2vak h ALA 184 N 1.14 1.23 -0.01 1.25 0.00 -1.22 -1.47 119.26 120.17 2vak h ALA 184 Ca 0.20 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2vak h ALA 184 Cb 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2vak h ALA 184 CO -0.03 0.58 -0.48 -0.44 0.00 0.00 0.00 179.25 178.87 2vak h ASP 185 N 0.99 0.03 0.20 0.00 3.32 -0.92 -1.70 116.42 118.34 2vak h ASP 185 Ca 0.24 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 2vak h ASP 185 Cb 0.14 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.68 2vak h ASP 185 CO -0.03 0.51 -0.09 -0.25 -1.72 0.00 0.00 179.24 177.66 2vak h TRP 186 N 0.02 -0.25 -0.90 4.55 7.01 -0.30 -1.84 115.95 124.26 2vak h TRP 186 Ca -0.00 -0.01 0.07 0.00 2.11 0.00 0.00 58.89 61.06 2vak h TRP 186 Cb 0.86 0.08 -0.06 0.00 -2.10 0.00 0.00 29.16 27.95 2vak h TRP 186 CO 0.00 0.04 0.58 0.74 -2.79 0.00 0.00 178.44 177.02 2vak h PHE 187 N -0.53 1.02 -0.11 2.65 0.04 -1.32 -2.25 116.94 116.45 2vak h PHE 187 Ca -0.03 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 2vak h PHE 187 Cb 0.40 -0.33 -0.01 0.00 2.20 0.00 0.00 35.95 38.21 2vak h PHE 187 CO 0.01 0.52 -0.16 1.98 -0.60 0.00 0.00 178.31 180.05 2vak h MET 188 N 0.99 0.17 0.00 1.51 4.05 -1.24 -2.22 114.93 118.17 2vak h MET 188 Ca 0.39 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.77 2vak h MET 188 Cb 0.25 -0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.03 2vak h MET 188 CO -0.15 0.34 0.00 0.66 0.23 0.00 0.00 176.91 177.98 2vak h SER 189 N 0.16 0.00 -0.68 1.39 4.64 -0.71 -2.77 113.55 115.58 2vak h SER 189 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2vak h SER 189 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2vak h SER 189 CO 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 2vak n GLN 190 N -2.97 2.69 -1.58 4.77 1.13 -0.84 -5.00 117.38 115.58 2vak n GLN 190 Ca 0.00 -2.61 -0.53 0.00 -1.94 0.00 0.00 57.00 51.92 2vak n GLN 190 Cb 0.27 -1.57 -0.06 0.00 0.11 0.00 0.00 30.24 28.99 2vak n GLN 190 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 2vak n TYR 191 N 1.65 1.38 -0.66 1.08 9.36 -1.05 -0.25 117.16 128.67 2vak n TYR 191 Ca 0.24 0.70 0.00 0.00 3.32 0.00 0.00 57.90 62.16 2vak n TYR 191 Cb 0.63 -2.30 0.00 0.00 -0.63 0.00 0.00 39.34 37.04 2vak n TYR 191 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2vak n GLY 192 N 2.37 1.22 3.82 2.98 0.00 0.12 -5.00 105.19 110.70 2vak n GLY 192 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 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 -3.01 5.88 0.09 1.61 0.01 0.65 -4.65 114.94 115.52 2vak s ASN 193 Ca 0.00 1.67 -0.23 0.00 -0.71 0.00 0.00 52.86 53.59 2vak s ASN 193 Cb 0.00 -2.51 -0.07 0.00 0.41 0.00 0.00 41.25 39.08 2vak s ASN 193 CO 0.00 -1.10 0.69 0.21 -1.51 0.00 0.00 177.10 175.39 2vak s ASN 194 N -3.27 7.21 0.20 -1.22 3.84 -1.26 -0.82 114.94 119.63 2vak s ASN 194 Ca 0.60 1.44 -0.10 0.00 0.21 0.00 0.00 52.86 55.01 2vak s ASN 194 Cb -0.14 -2.44 0.25 0.00 -0.55 0.00 0.00 41.25 38.38 2vak s ASN 194 CO 0.43 0.17 1.76 0.15 -2.79 0.00 0.00 177.10 176.82 2vak h PHE 195 N 4.85 0.47 -0.53 0.43 3.57 -1.12 -1.26 116.94 123.34 2vak h PHE 195 Ca -0.47 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 60.95 2vak h PHE 195 Cb 1.21 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.81 2vak h PHE 195 CO 0.66 0.16 -0.08 0.28 -2.23 0.00 0.00 178.31 177.09 2vak h VAL 196 N 0.48 1.27 -0.64 1.41 2.07 -1.93 -1.18 116.25 117.72 2vak h VAL 196 Ca 0.30 -1.22 0.01 0.00 0.82 0.00 0.00 66.70 66.60 2vak h VAL 196 Cb 0.31 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 2vak h VAL 196 CO -0.26 0.43 0.42 0.44 0.02 0.00 0.00 177.57 178.63 2vak h ASP 197 N 0.88 0.73 -0.46 0.57 3.45 -1.89 -0.80 116.42 118.90 2vak h ASP 197 Ca 0.14 -0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.56 2vak h ASP 197 Cb 0.63 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 39.20 2vak h ASP 197 CO 0.04 0.53 0.16 0.24 -1.57 0.00 0.00 179.24 178.64 2vak h MET 198 N 0.86 0.70 -0.91 3.56 2.86 -0.89 -0.98 114.93 120.13 2vak h MET 198 Ca 0.24 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 57.74 2vak h MET 198 Cb -0.09 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.42 2vak h MET 198 CO -0.06 0.65 0.56 0.00 1.06 0.00 0.00 176.91 179.13 2vak h ALA 200 N 1.37 0.56 -0.64 0.00 0.00 -0.75 -0.24 119.26 119.57 2vak h ALA 200 Ca 0.33 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2vak h ALA 200 Cb -0.08 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 2vak h ALA 200 CO -0.06 0.40 0.34 -0.09 0.00 0.00 0.00 179.25 179.83 2vak h ARG 201 N 0.58 0.90 -0.78 0.00 2.43 -1.17 -1.93 114.38 114.42 2vak h ARG 201 Ca 0.11 -0.12 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 2vak h ARG 201 Cb 0.57 -0.17 -0.03 0.00 -0.42 0.00 0.00 29.97 29.92 2vak h ARG 201 CO 0.03 0.70 0.28 -0.07 -1.51 0.00 0.00 179.97 179.40 2vak h LEU 202 N 0.88 1.10 -0.68 3.80 3.38 -1.14 -1.58 115.31 121.07 2vak h LEU 202 Ca 0.22 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.06 2vak h LEU 202 Cb 0.07 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.48 2vak h LEU 202 CO -0.03 1.00 0.39 0.74 0.09 0.00 0.00 178.44 180.62 2vak h THR 203 N 1.14 0.99 -0.57 0.22 2.02 -0.79 -2.19 112.91 113.74 2vak h THR 203 Ca 0.25 -0.25 -0.10 0.00 0.77 0.00 0.00 66.41 67.09 2vak h THR 203 Cb 0.27 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 2vak h THR 203 CO -0.01 0.13 -0.02 -0.61 0.37 0.00 0.00 175.52 175.38 2vak h GLN 204 N 0.72 1.03 0.00 6.66 4.15 -1.18 -3.18 115.11 123.31 2vak h GLN 204 Ca 0.30 -0.34 -0.03 0.00 0.77 0.00 0.00 58.65 59.35 2vak h GLN 204 Cb 0.16 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 2vak h GLN 204 CO -0.17 1.03 -0.13 0.77 -1.93 0.00 0.00 178.83 178.39 2vak h SER 205 N 0.92 0.00 1.22 -0.69 0.02 -0.99 -2.21 113.55 111.82 2vak h SER 205 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2vak h SER 205 Cb 0.57 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.11 2vak h SER 205 CO 0.03 0.13 -0.06 0.00 -1.14 0.00 0.00 176.83 175.79 2vak h SER 207 N 0.00 0.08 0.00 0.00 0.02 -1.39 -1.14 113.55 111.12 2vak h SER 207 Ca 0.00 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2vak h SER 207 Cb 0.64 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.35 2vak h SER 207 CO 0.00 -0.00 0.15 -0.46 -1.14 0.00 0.00 176.83 175.37 2vak n ASN 208 N -5.12 0.00 0.00 3.07 6.94 -1.26 -4.93 115.26 113.96 2vak n ASN 208 Ca 0.14 0.35 0.00 0.00 -0.02 0.00 0.00 54.58 55.05 2vak n ASN 208 Cb 0.45 -0.35 0.00 0.00 -2.36 0.00 0.00 39.78 37.51 2vak n ASN 208 CO 0.00 0.00 0.00 0.80 -1.03 0.00 0.00 177.26 177.03 2vak n MET 209 N -1.35 0.00 0.00 -3.83 0.00 -0.43 -5.01 117.12 106.50 2vak n MET 209 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.70 57.70 2vak n MET 209 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.37 2vak n MET 209 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 2vak n PRO 210 N 0.00 0.00 -2.97 2.12 -0.02 -1.26 -4.85 135.00 128.02 2vak n PRO 210 Ca 0.00 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2vak n PRO 210 Cb 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2vak n PRO 210 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2vak n VAL 211 N 0.00 -6.74 -3.81 -1.45 0.31 -1.26 -5.04 118.33 100.35 2vak n VAL 211 Ca 0.00 1.15 -0.34 0.00 -0.01 0.00 0.00 64.34 65.13 2vak n VAL 211 Cb 0.00 -4.84 -0.05 0.00 -0.91 0.00 0.00 33.84 28.04 2vak n VAL 211 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2vak s GLU 212 N -1.26 3.53 0.19 5.55 8.01 -1.26 -4.81 118.70 128.65 2vak s GLU 212 Ca -0.01 -0.14 -0.33 0.00 0.01 0.00 0.00 54.97 54.50 2vak s GLU 212 Cb 0.00 -3.09 -0.13 0.00 -4.31 0.00 0.00 34.13 26.60 2vak s GLU 212 CO 0.37 0.66 1.63 -2.30 0.01 0.00 0.00 175.26 175.63 2vak n PRO 213 N 1.11 2.42 -0.91 0.39 -0.02 -1.26 -1.55 135.00 135.18 2vak n PRO 213 Ca -0.12 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2vak n PRO 213 Cb 0.53 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 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 3.51 -0.97 -3.73 2.55 10.43 -1.26 -5.03 116.55 122.05 2vak n ASP 214 Ca 0.16 0.00 -0.30 0.00 2.57 0.00 0.00 54.79 57.22 2vak n ASP 214 Cb 0.32 -0.16 0.25 0.00 1.84 0.00 0.00 41.12 43.36 2vak n ASP 214 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 2vak s GLY 215 N -1.94 1.59 0.10 0.44 0.00 -0.60 -4.76 107.32 102.15 2vak s GLY 215 Ca 0.00 -1.01 -0.26 0.00 0.00 0.00 0.00 44.72 43.45 2vak s GLY 215 CO 0.00 -0.10 1.67 3.43 0.00 0.00 0.00 173.10 178.10 2vak h ASN 216 N -2.64 -0.50 -0.92 1.64 2.35 -1.96 -1.82 115.58 111.73 2vak h ASN 216 Ca -0.44 0.06 0.11 0.00 -0.55 0.00 0.00 56.30 55.47 2vak h ASN 216 Cb 1.29 0.19 -0.08 0.00 0.05 0.00 0.00 38.32 39.77 2vak h ASN 216 CO 0.32 -0.26 0.56 1.88 -1.65 0.00 0.00 177.43 178.27 2vak h TYR 217 N -0.36 1.02 -0.03 1.19 0.05 -1.93 -0.79 116.97 116.11 2vak h TYR 217 Ca 0.02 0.03 -0.23 0.00 0.05 0.00 0.00 58.73 58.60 2vak h TYR 217 Cb 0.37 -0.32 0.01 0.00 1.01 0.00 0.00 36.73 37.80 2vak h TYR 217 CO -0.17 0.41 -0.92 0.22 -1.05 0.00 0.00 178.16 176.65 2vak h ASP 218 N 0.91 0.69 -0.29 3.88 3.58 -1.78 -2.29 116.42 121.13 2vak h ASP 218 Ca 0.45 -0.53 -0.14 0.00 0.42 0.00 0.00 57.03 57.23 2vak h ASP 218 Cb 0.41 -0.21 -0.00 0.00 1.72 0.00 0.00 39.33 41.25 2vak h ASP 218 CO -0.25 1.32 -0.38 1.56 -2.88 0.00 0.00 179.24 178.60 2vak h GLN 219 N 0.33 0.76 -0.20 0.28 4.20 -0.89 -1.76 115.11 117.84 2vak h GLN 219 Ca -0.08 -0.44 0.05 0.00 0.06 0.00 0.00 58.65 58.24 2vak h GLN 219 Cb 1.55 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 29.31 2vak h GLN 219 CO 0.17 1.06 -0.13 1.96 -0.67 0.00 0.00 178.83 181.22 2vak h GLN 220 N 0.52 -0.12 -0.21 1.46 4.20 -1.18 -1.47 115.11 118.31 2vak h GLN 220 Ca 0.03 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 2vak h GLN 220 Cb 0.97 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.77 2vak h GLN 220 CO 0.09 -0.08 0.08 0.52 -0.67 0.00 0.00 178.83 178.77 2vak h MET 221 N -0.13 0.32 -0.68 1.46 2.86 -1.29 0.12 114.93 117.59 2vak h MET 221 Ca 0.11 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.63 2vak h MET 221 Cb 0.30 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 2vak h MET 221 CO -0.28 0.37 0.15 0.00 1.06 0.00 0.00 176.91 178.22 2vak h ARG 222 N 0.19 1.09 -0.36 1.72 3.08 -1.32 -1.76 114.38 117.02 2vak h ARG 222 Ca 0.07 -0.27 -0.16 0.00 0.07 0.00 0.00 59.98 59.69 2vak h ARG 222 Cb 0.18 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.08 2vak h ARG 222 CO -0.01 0.98 -0.41 0.00 -1.07 0.00 0.00 179.97 179.47 2vak h ALA 223 N 1.07 0.53 -0.30 0.04 0.00 -1.14 -2.81 119.26 116.65 2vak h ALA 223 Ca 0.21 -0.46 0.07 0.00 0.00 0.00 0.00 54.91 54.72 2vak h ALA 223 Cb 0.39 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.00 2vak h ALA 223 CO 0.00 0.65 -0.13 1.25 0.00 0.00 0.00 179.25 181.03 2vak h LEU 224 N 0.72 -0.45 0.35 0.00 5.85 -0.68 0.49 115.31 121.59 2vak h LEU 224 Ca 0.05 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 2vak h LEU 224 Cb 1.00 0.25 0.00 0.00 0.37 0.00 0.00 40.66 42.29 2vak h LEU 224 CO 0.10 -0.16 -0.18 0.40 -0.34 0.00 0.00 178.44 178.25 2vak h ILE 225 N -0.08 0.63 0.00 4.05 2.04 -1.30 -2.15 117.51 120.69 2vak h ILE 225 Ca 0.16 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.91 2vak h ILE 225 Cb 0.31 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2vak h ILE 225 CO -0.36 0.00 -0.50 0.77 0.00 0.00 0.00 178.15 178.06 2vak h SER 226 N -0.49 0.00 0.09 1.72 4.64 -1.47 0.51 113.55 118.55 2vak h SER 226 Ca -0.04 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2vak h SER 226 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2vak h SER 226 CO 0.06 0.50 -0.04 0.25 -0.87 0.00 0.00 176.83 176.73 2vak h LEU 227 N 0.00 -0.10 0.49 5.97 5.85 -0.86 -2.31 115.31 124.34 2vak h LEU 227 Ca -0.00 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 2vak h LEU 227 Cb 1.01 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 2vak h LEU 227 CO 0.06 0.18 -0.39 -0.25 -0.34 0.00 0.00 178.44 177.71 2vak h TRP 228 N -0.39 -1.05 -0.90 1.25 7.01 -1.25 -1.79 115.95 118.83 2vak h TRP 228 Ca -0.01 -0.00 0.16 0.00 2.11 0.00 0.00 58.89 61.15 2vak h TRP 228 Cb 0.33 0.39 -0.10 0.00 -2.10 0.00 0.00 29.16 27.68 2vak h TRP 228 CO 0.02 -0.56 0.49 1.25 -2.79 0.00 0.00 178.44 176.84 2vak h LEU 229 N -0.87 0.60 -1.07 0.65 5.85 -0.96 0.35 115.31 119.87 2vak h LEU 229 Ca -0.05 0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.68 2vak h LEU 229 Cb 0.74 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 2vak h LEU 229 CO -0.01 0.24 -0.42 -0.07 -0.34 0.00 0.00 178.44 177.84 2vak h LEU 230 N 0.67 0.00 -0.30 2.25 3.38 -1.32 -1.80 115.31 118.18 2vak h LEU 230 Ca 0.50 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.28 2vak h LEU 230 Cb 0.73 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 2vak h LEU 230 CO -0.37 0.42 -0.54 0.28 0.09 0.00 0.00 178.44 178.31 2vak h SER 231 N 0.00 0.98 -0.51 -0.43 0.02 0.23 -1.68 113.55 112.16 2vak h SER 231 Ca -0.00 -0.52 -0.02 0.00 -0.84 0.00 0.00 61.79 60.41 2vak h SER 231 Cb 0.83 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 2vak h SER 231 CO 0.05 1.32 0.27 0.22 -1.14 0.00 0.00 176.83 177.55 2vak h TYR 232 N 0.68 0.75 -0.01 3.45 3.20 0.00 -1.75 116.97 123.29 2vak h TYR 232 Ca 0.02 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2vak h TYR 232 Cb 1.15 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.18 2vak h TYR 232 CO 0.07 0.55 -0.03 0.44 -1.64 0.00 0.00 178.16 177.56 2vak n ILE 233 N -4.37 0.00 0.00 1.81 -5.35 -0.72 -4.68 119.36 106.05 2vak n ILE 233 Ca 0.05 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 2vak n ILE 233 Cb 0.12 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.55 2vak n ILE 233 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2vak n GLY 234 N 1.20 1.87 0.12 3.28 0.00 -0.66 -3.92 105.19 107.07 2vak n GLY 234 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 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 1.52 -3.78 1.61 -1.51 -1.73 -3.40 116.25 108.97 2vak h VAL 235 Ca 0.00 -2.53 -0.65 0.00 -1.23 0.00 0.00 66.70 62.29 2vak h VAL 235 Cb 0.00 2.37 -0.19 0.00 -2.13 0.00 0.00 31.29 31.34 2vak h VAL 235 CO 0.00 0.73 -0.56 -0.69 -1.23 0.00 0.00 177.57 175.82 2vak s VAL 236 N -3.32 4.91 0.00 7.19 1.01 -0.66 -4.86 120.40 124.66 2vak s VAL 236 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.95 2vak s VAL 236 Cb 0.12 -3.35 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2vak s VAL 236 CO 0.79 0.25 0.00 -0.46 0.00 0.00 0.00 175.10 175.67 2vak n ASN 237 N 5.01 0.00 0.21 3.32 0.23 -0.38 -3.96 115.26 119.69 2vak n ASN 237 Ca -0.15 -0.39 0.08 0.00 -0.53 0.00 0.00 54.58 53.59 2vak n ASN 237 Cb 0.51 0.00 0.43 0.00 -2.08 0.00 0.00 39.78 38.64 2vak n ASN 237 CO 0.00 0.00 0.00 -0.61 -0.93 0.00 0.00 177.26 175.72 2vak h GLN 238 N 0.00 0.00 -0.07 -3.83 4.15 -1.96 -1.83 115.11 111.57 2vak h GLN 238 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2vak h GLN 238 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 2vak h GLN 238 CO 0.00 0.30 0.00 0.25 -1.93 0.00 0.00 178.83 177.45 2vak n THR 239 N -3.56 0.08 -3.13 2.39 -2.24 -1.26 -4.68 114.28 101.89 2vak n THR 239 Ca -0.01 -0.27 0.01 0.00 -2.27 0.00 0.00 64.05 61.52 2vak n THR 239 Cb 0.44 0.38 -0.01 0.00 -2.10 0.00 0.00 70.33 69.04 2vak n THR 239 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2vak s ASN 240 N -1.82 -1.34 0.45 3.42 2.47 -0.69 -3.50 114.94 113.92 2vak s ASN 240 Ca 0.36 -0.71 0.07 0.00 0.42 0.00 0.00 52.86 53.00 2vak s ASN 240 Cb 0.19 1.72 -0.02 0.00 -1.45 0.00 0.00 41.25 41.69 2vak s ASN 240 CO 0.30 -0.14 0.33 0.42 -3.72 0.00 0.00 177.10 174.29 2vak s THR 241 N 1.84 2.32 -0.27 -5.21 -4.23 0.45 -1.25 115.64 109.28 2vak s THR 241 Ca 0.16 -1.48 -0.03 0.00 -1.18 0.00 0.00 61.69 59.17 2vak s THR 241 Cb -0.03 -2.80 0.03 0.00 1.34 0.00 0.00 72.50 71.05 2vak s THR 241 CO -0.08 0.00 -0.01 -0.63 -0.54 0.00 0.00 174.62 173.35 2vak s ILE 242 N -2.58 3.11 -1.39 2.99 1.01 -0.45 -1.21 121.20 122.68 2vak s ILE 242 Ca 0.43 -1.09 -0.15 0.00 0.00 0.00 0.00 60.65 59.84 2vak s ILE 242 Cb -0.01 -2.65 0.14 0.00 0.01 0.00 0.00 42.46 39.94 2vak s ILE 242 CO 0.25 0.07 0.53 -1.20 0.00 0.00 0.00 174.94 174.58 2vak n SER 243 N 4.69 -2.62 0.00 3.58 7.64 -1.26 -1.01 113.62 124.64 2vak n SER 243 Ca -0.15 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.05 2vak n SER 243 Cb 0.46 -2.21 0.00 0.00 -1.01 0.00 0.00 64.21 61.45 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 -1.09 3.35 3.89 0.23 0.00 -1.26 -4.97 105.19 105.34 2vak n GLY 244 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.72 3.46 0.05 1.61 0.08 -0.18 -0.87 117.98 119.41 2vak s PHE 245 Ca 0.00 0.67 -0.27 0.00 0.12 0.00 0.00 56.93 57.45 2vak s PHE 245 Cb 0.00 -2.09 0.07 0.00 -0.57 0.00 0.00 43.02 40.43 2vak s PHE 245 CO 0.00 0.38 0.65 1.52 -0.10 0.00 0.00 175.22 177.67 2vak s TYR 246 N -1.71 -0.60 0.04 0.36 1.13 -1.02 -1.34 117.35 114.22 2vak s TYR 246 Ca 0.43 0.73 -0.05 0.00 -1.41 0.00 0.00 57.07 56.78 2vak s TYR 246 Cb -0.12 0.48 -0.05 0.00 -1.10 0.00 0.00 41.96 41.18 2vak s TYR 246 CO 0.23 -0.72 0.28 -0.06 -2.51 0.00 0.00 175.55 172.77 2vak s PHE 247 N -2.42 3.55 0.06 -3.49 0.40 -1.26 -0.93 117.98 113.89 2vak s PHE 247 Ca -0.05 0.51 0.05 0.00 -0.60 0.00 0.00 56.93 56.84 2vak s PHE 247 Cb -0.00 -1.95 -0.03 0.00 0.51 0.00 0.00 43.02 41.55 2vak s PHE 247 CO -0.01 0.57 -0.14 0.45 0.70 0.00 0.00 175.22 176.79 2vak s SER 248 N -1.98 1.71 -0.02 1.36 0.15 0.36 -4.88 113.70 110.40 2vak s SER 248 Ca 0.31 -0.55 0.02 0.00 0.70 0.00 0.00 55.95 56.43 2vak s SER 248 Cb -0.13 -0.08 0.00 0.00 -1.71 0.00 0.00 66.02 64.11 2vak s SER 248 CO 0.20 -0.02 -0.06 -0.55 1.20 0.00 0.00 173.24 174.01 2vak s SER 249 N -1.49 0.79 0.11 5.45 0.15 -1.26 -0.81 113.70 116.65 2vak s SER 249 Ca -0.00 -0.12 -0.20 0.00 0.70 0.00 0.00 55.95 56.33 2vak s SER 249 Cb -0.09 -0.20 -0.09 0.00 -1.71 0.00 0.00 66.02 63.93 2vak s SER 249 CO 0.02 0.03 1.76 0.11 1.20 0.00 0.00 173.24 176.36 2vak h LYS 250 N 6.40 0.21 -6.18 5.44 1.57 -1.94 -3.43 116.57 118.64 2vak h LYS 250 Ca -0.32 -0.01 -0.50 0.00 -1.87 0.00 0.00 60.65 57.94 2vak h LYS 250 Cb 1.17 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 2vak h LYS 250 CO 0.49 0.15 -0.40 0.95 -0.57 0.00 0.00 179.45 180.07 2vak s THR 251 N -6.13 5.26 -0.14 -0.16 -4.23 -1.26 -5.12 115.64 103.86 2vak s THR 251 Ca -0.13 -0.74 -0.02 0.00 -1.18 0.00 0.00 61.69 59.62 2vak s THR 251 Cb 0.08 -3.80 0.04 0.00 1.34 0.00 0.00 72.50 70.16 2vak s THR 251 CO 0.69 -0.25 -0.00 -0.60 -0.54 0.00 0.00 174.62 173.91 2vak s ARG 252 N -3.67 0.84 0.00 3.99 6.06 -1.26 -4.60 118.95 120.30 2vak s ARG 252 Ca 0.35 -0.23 0.00 0.00 -2.50 0.00 0.00 55.73 53.35 2vak s ARG 252 Cb -0.10 -1.64 0.00 0.00 0.06 0.00 0.00 34.95 33.27 2vak s ARG 252 CO 0.30 -0.45 0.00 0.41 -2.50 0.00 0.00 175.30 173.05 2vak n GLY 253 N 5.05 0.99 3.41 8.12 0.00 -1.26 -4.55 105.19 116.95 2vak n GLY 253 Ca -0.09 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 2vak n GLY 253 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2vak s GLN 254 N -2.62 1.25 0.36 1.61 0.74 -1.26 -4.21 119.66 115.52 2vak s GLN 254 Ca 0.00 -1.07 0.03 0.00 0.05 0.00 0.00 55.36 54.37 2vak s GLN 254 Cb 0.00 0.43 0.67 0.00 1.10 0.00 0.00 33.01 35.21 2vak s GLN 254 CO 0.00 -0.49 2.00 0.00 -0.55 0.00 0.00 175.29 176.26 2vak h ALA 255 N 2.42 1.59 -0.01 1.58 0.00 -1.94 -2.82 119.26 120.07 2vak h ALA 255 Ca -0.30 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2vak h ALA 255 Cb 1.24 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2vak h ALA 255 CO 0.44 0.37 -0.16 1.28 0.00 0.00 0.00 179.25 181.18 2vak n LEU 256 N -4.45 0.66 -4.45 0.00 4.77 -1.26 -4.95 117.00 107.33 2vak n LEU 256 Ca 0.07 -0.08 -0.59 0.00 -0.03 0.00 0.00 56.01 55.38 2vak n LEU 256 Cb 0.08 -0.16 -0.08 0.00 -2.33 0.00 0.00 43.42 40.93 2vak n LEU 256 CO 0.35 0.12 0.60 0.47 -1.33 0.00 0.00 177.39 177.61 2vak n ASP 257 N -0.84 0.08 -3.66 -1.43 10.43 -1.07 -4.84 116.55 115.22 2vak n ASP 257 Ca 0.14 1.14 -0.07 0.00 2.57 0.00 0.00 54.79 58.57 2vak n ASP 257 Cb 0.30 -0.90 -0.08 0.00 1.84 0.00 0.00 41.12 42.28 2vak n ASP 257 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 2vak s SER 258 N 0.22 -0.83 -0.31 -2.24 0.15 -1.26 -5.05 113.70 104.38 2vak s SER 258 Ca 0.91 1.34 -0.10 0.00 0.70 0.00 0.00 55.95 58.80 2vak s SER 258 Cb -1.27 1.42 -0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2vak s SER 258 CO 0.58 -0.23 0.16 0.26 1.20 0.00 0.00 173.24 175.21 2vak s TRP 259 N 1.90 3.18 -0.12 3.44 0.52 -1.26 -4.06 118.94 122.55 2vak s TRP 259 Ca -0.08 -0.56 -0.02 0.00 0.02 0.00 0.00 56.10 55.46 2vak s TRP 259 Cb -0.08 -2.36 -0.03 0.00 -1.15 0.00 0.00 33.47 29.85 2vak s TRP 259 CO -0.18 -0.45 -0.04 0.99 0.02 0.00 0.00 176.95 177.29 2vak s THR 260 N 1.62 3.94 -0.15 2.01 2.01 0.01 -0.42 115.64 124.66 2vak s THR 260 Ca 0.05 -0.37 -0.29 0.00 0.31 0.00 0.00 61.69 61.39 2vak s THR 260 Cb -0.17 -2.68 -0.01 0.00 0.01 0.00 0.00 72.50 69.65 2vak s THR 260 CO 0.06 0.55 1.17 -0.22 -0.69 0.00 0.00 174.62 175.50 2vak s LEU 261 N -0.24 4.19 0.00 4.42 2.96 0.00 -0.49 118.68 129.53 2vak s LEU 261 Ca 0.04 1.63 0.00 0.00 -0.22 0.00 0.00 54.13 55.59 2vak s LEU 261 Cb -0.13 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.02 2vak s LEU 261 CO 0.02 -0.67 0.00 0.49 -1.32 0.00 0.00 176.35 174.88 2vak n PHE 262 N 6.07 0.99 -3.69 5.38 3.72 -0.10 0.15 117.46 129.97 2vak n PHE 262 Ca 0.12 -2.14 -0.14 0.00 -0.05 0.00 0.00 57.45 55.25 2vak n PHE 262 Cb 0.46 -0.28 -0.09 0.00 -0.94 0.00 0.00 39.48 38.63 2vak n PHE 262 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 2vak s TYR 263 N -2.57 -0.57 -0.01 1.38 5.04 -1.26 -2.44 117.35 116.92 2vak s TYR 263 Ca 0.00 1.38 0.01 0.00 -2.44 0.00 0.00 57.07 56.03 2vak s TYR 263 Cb 0.00 0.20 0.00 0.00 0.35 0.00 0.00 41.96 42.52 2vak s TYR 263 CO 0.00 -0.29 -0.05 0.99 -1.34 0.00 0.00 175.55 174.87 2vak s THR 264 N 0.20 0.42 -0.07 4.34 2.01 -0.05 -5.01 115.64 117.49 2vak s THR 264 Ca -0.01 -0.18 0.09 0.00 0.31 0.00 0.00 61.69 61.91 2vak s THR 264 Cb -0.04 -0.39 -0.24 0.00 0.01 0.00 0.00 72.50 71.84 2vak s THR 264 CO 0.01 0.15 0.56 0.41 -0.69 0.00 0.00 174.62 175.05 2vak n THR 265 N 3.30 1.63 0.77 -0.82 -1.04 -1.26 -4.44 114.28 112.42 2vak n THR 265 Ca -0.17 -0.77 0.08 0.00 -2.04 0.00 0.00 64.05 61.15 2vak n THR 265 Cb 0.56 -1.15 -0.06 0.00 -1.82 0.00 0.00 70.33 67.85 2vak n THR 265 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 2vak n ASN 266 N -3.12 1.12 -4.92 8.00 6.94 -1.26 -5.00 115.26 117.01 2vak n ASN 266 Ca -0.21 -1.06 -0.19 0.00 -0.02 0.00 0.00 54.58 53.10 2vak n ASN 266 Cb 1.06 0.80 -0.02 0.00 -2.36 0.00 0.00 39.78 39.26 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 -2.34 3.03 0.46 5.53 -4.23 -1.26 -5.06 115.64 111.77 2vak s THR 267 Ca 0.09 -1.21 -0.24 0.00 -1.18 0.00 0.00 61.69 59.16 2vak s THR 267 Cb 0.13 -3.07 -0.09 0.00 1.34 0.00 0.00 72.50 70.82 2vak s THR 267 CO 0.58 -0.04 1.20 -3.20 -0.54 0.00 0.00 174.62 172.62 2vak n ASN 268 N -1.62 2.11 -4.01 3.99 5.15 -1.23 -4.83 115.26 114.81 2vak n ASN 268 Ca 0.04 1.04 -0.30 0.00 -0.60 0.00 0.00 54.58 54.76 2vak n ASN 268 Cb 0.60 -1.47 -0.17 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 -2.34 2.24 0.68 1.20 0.52 -1.26 -0.41 118.95 119.58 2vak s ARG 269 Ca 0.65 -0.54 -0.16 0.00 -0.52 0.00 0.00 55.73 55.16 2vak s ARG 269 Cb -0.49 -2.05 0.01 0.00 0.52 0.00 0.00 34.95 32.93 2vak s ARG 269 CO 0.55 -0.23 1.21 0.14 0.02 0.00 0.00 175.30 176.99 2vak s VAL 270 N 1.47 2.45 -0.36 3.52 -7.23 -0.35 -4.92 120.40 114.97 2vak s VAL 270 Ca 0.04 0.24 0.01 0.00 -1.81 0.00 0.00 61.98 60.46 2vak s VAL 270 Cb -0.13 -2.91 0.10 0.00 0.56 0.00 0.00 36.38 34.00 2vak s VAL 270 CO -0.10 -0.10 0.10 -1.10 -0.31 0.00 0.00 175.10 173.59 2vak s GLN 271 N -3.71 1.84 -0.35 4.82 -0.21 -1.26 -4.67 119.66 116.13 2vak s GLN 271 Ca 0.75 -1.76 -0.29 0.00 0.02 0.00 0.00 55.36 54.09 2vak s GLN 271 Cb -0.30 -3.34 0.02 0.00 1.00 0.00 0.00 33.01 30.39 2vak s GLN 271 CO 0.41 -0.94 1.09 0.42 -2.12 0.00 0.00 175.29 174.15 2vak s ILE 272 N 1.05 4.45 -0.08 1.08 1.01 -1.26 -4.53 121.20 122.92 2vak s ILE 272 Ca 0.07 1.64 0.14 0.00 0.00 0.00 0.00 60.65 62.50 2vak s ILE 272 Cb -0.21 -4.45 -0.23 0.00 0.01 0.00 0.00 42.46 37.58 2vak s ILE 272 CO -0.06 -0.58 0.54 0.41 0.00 0.00 0.00 174.94 175.26 2vak n THR 273 N 6.06 1.55 -4.02 2.92 -1.04 0.56 -3.99 114.28 116.31 2vak n THR 273 Ca 0.12 -0.81 -0.09 0.00 -2.04 0.00 0.00 64.05 61.24 2vak n THR 273 Cb 0.47 -0.91 -0.09 0.00 -1.82 0.00 0.00 70.33 67.99 2vak n THR 273 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2vak s GLN 274 N -2.59 0.84 0.32 -2.82 -2.07 -1.23 -4.82 119.66 107.29 2vak s GLN 274 Ca -0.06 -1.20 -0.29 0.00 -1.82 0.00 0.00 55.36 51.99 2vak s GLN 274 Cb 0.08 0.28 -0.11 0.00 -1.09 0.00 0.00 33.01 32.17 2vak s GLN 274 CO 0.83 -0.24 1.52 0.50 -1.32 0.00 0.00 175.29 176.58 2vak s ARG 275 N -3.94 4.15 -0.01 9.60 3.52 -1.26 -4.33 118.95 126.67 2vak s ARG 275 Ca 0.12 2.52 0.05 0.00 -0.13 0.00 0.00 55.73 58.30 2vak s ARG 275 Cb 0.06 -3.01 -0.01 0.00 -1.56 0.00 0.00 34.95 30.42 2vak s ARG 275 CO -0.06 -0.54 -0.17 -1.01 -0.81 0.00 0.00 175.30 172.71 2vak s HIS 276 N -0.49 1.49 -0.04 5.12 3.76 0.15 -4.64 115.29 120.63 2vak s HIS 276 Ca 0.58 -0.29 -0.02 0.00 -0.15 0.00 0.00 55.06 55.18 2vak s HIS 276 Cb -0.46 -0.95 0.02 0.00 1.11 0.00 0.00 32.58 32.30 2vak s HIS 276 CO 0.53 -0.02 0.09 0.12 -0.85 0.00 0.00 174.74 174.62 2vak s PHE 277 N -0.42 -0.09 0.01 1.40 5.36 -1.26 -1.38 117.98 121.59 2vak s PHE 277 Ca 0.06 0.29 -0.04 0.00 -0.96 0.00 0.00 56.93 56.28 2vak s PHE 277 Cb -0.06 -0.05 -0.01 0.00 -0.34 0.00 0.00 43.02 42.55 2vak s PHE 277 CO -0.00 -0.09 0.07 0.00 -1.46 0.00 0.00 175.22 173.74 2vak s ALA 278 N 0.59 -0.15 -0.13 11.12 0.00 0.51 -4.92 121.76 128.79 2vak s ALA 278 Ca -0.05 -0.30 -0.15 0.00 0.00 0.00 0.00 51.96 51.47 2vak s ALA 278 Cb -0.06 0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.13 2vak s ALA 278 CO -0.02 -0.19 0.34 0.71 0.00 0.00 0.00 175.76 176.61 2vak s TYR 279 N -1.37 3.52 -0.05 0.00 2.02 -1.25 -0.65 117.35 119.56 2vak s TYR 279 Ca -0.15 0.72 -0.01 0.00 -0.37 0.00 0.00 57.07 57.26 2vak s TYR 279 Cb -0.08 -2.36 0.03 0.00 -0.40 0.00 0.00 41.96 39.14 2vak s TYR 279 CO 0.01 0.30 0.01 0.08 -1.57 0.00 0.00 175.55 174.38 2vak s VAL 280 N 0.21 0.23 0.26 0.71 1.01 -0.75 -0.72 120.40 121.35 2vak s VAL 280 Ca 0.20 0.18 0.09 0.00 0.00 0.00 0.00 61.98 62.44 2vak s VAL 280 Cb -0.14 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 2vak s VAL 280 CO 0.07 0.22 0.06 0.00 0.00 0.00 0.00 175.10 175.44 2vak s ALA 282 N -2.24 3.66 0.03 0.00 0.00 -1.09 -0.68 121.76 121.43 2vak s ALA 282 Ca 0.32 0.13 -0.20 0.00 0.00 0.00 0.00 51.96 52.20 2vak s ALA 282 Cb -0.07 -3.56 -0.16 0.00 0.00 0.00 0.00 23.12 19.33 2vak s ALA 282 CO 0.21 -1.12 1.28 -0.09 0.00 0.00 0.00 175.76 176.05 2vak h ARG 283 N 7.56 0.36 -6.13 0.00 2.43 -1.52 0.58 114.38 117.67 2vak h ARG 283 Ca -0.19 -0.23 -0.55 0.00 -0.81 0.00 0.00 59.98 58.20 2vak h ARG 283 Cb 1.06 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.61 2vak h ARG 283 CO 0.98 0.82 -0.39 -1.54 -1.51 0.00 0.00 179.97 178.33 2vak s SER 284 N -6.25 6.38 0.20 -3.80 1.04 -1.24 -4.46 113.70 105.57 2vak s SER 284 Ca -0.14 0.33 0.23 0.00 0.48 0.00 0.00 55.95 56.84 2vak s SER 284 Cb 0.05 -1.98 0.91 0.00 0.10 0.00 0.00 66.02 65.10 2vak s SER 284 CO 0.76 0.02 1.69 -2.65 0.98 0.00 0.00 173.24 174.05 2vak n PRO 285 N -0.46 0.17 0.14 4.02 -0.02 -1.26 -2.52 135.00 135.07 2vak n PRO 285 Ca -0.05 0.35 0.09 0.00 -2.02 0.00 0.00 63.50 61.87 2vak n PRO 285 Cb 0.53 -1.79 0.49 0.00 -0.02 0.00 0.00 33.50 32.71 2vak n PRO 285 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2vak n ASP 286 N -2.11 0.47 -0.12 2.55 5.68 -1.26 -2.06 116.55 119.70 2vak n ASP 286 Ca 0.03 0.71 0.27 0.00 -0.50 0.00 0.00 54.79 55.30 2vak n ASP 286 Cb 0.25 -0.77 0.72 0.00 -1.14 0.00 0.00 41.12 40.18 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 0.00 -0.08 2.11 5.08 -1.87 -0.59 115.95 120.60 2vak h TRP 287 Ca 0.00 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.99 2vak h TRP 287 Cb 0.03 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.18 2vak h TRP 287 CO 0.00 0.00 0.15 -0.91 -1.28 0.00 0.00 178.44 176.40 2vak h ASN 288 N 0.00 0.00 0.00 0.11 2.35 -1.70 -1.75 115.58 114.58 2vak h ASN 288 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 2vak h ASN 288 Cb 1.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.97 2vak h ASN 288 CO -0.00 0.00 -0.48 0.55 -1.65 0.00 0.00 177.43 175.84 2vak n VAL 289 N -3.42 0.00 -2.60 2.81 3.14 -0.24 -1.32 118.33 116.70 2vak n VAL 289 Ca -0.01 -0.26 -0.42 0.00 -2.96 0.00 0.00 64.34 60.69 2vak n VAL 289 Cb 0.24 1.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.98 2vak n VAL 289 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2vak s ASP 290 N -1.96 6.25 0.32 6.55 -1.08 -0.66 -4.88 116.67 121.21 2vak s ASP 290 Ca 0.04 -0.33 0.11 0.00 -0.52 0.00 0.00 52.55 51.85 2vak s ASP 290 Cb 0.08 -2.54 0.55 0.00 -1.46 0.00 0.00 42.92 39.54 2vak s ASP 290 CO 0.42 -1.68 1.73 0.11 0.52 0.00 0.00 175.17 176.27 2vak h LYS 291 N 9.82 0.04 0.17 4.34 1.57 -1.91 -2.06 116.57 128.55 2vak h LYS 291 Ca -0.27 -0.02 -0.25 0.00 -1.87 0.00 0.00 60.65 58.24 2vak h LYS 291 Cb 1.05 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.39 2vak h LYS 291 CO 1.24 0.50 -1.12 0.77 -0.57 0.00 0.00 179.45 180.27 2vak h SER 292 N 0.03 0.57 -0.51 0.86 0.02 -1.96 -1.24 113.55 111.32 2vak h SER 292 Ca -0.00 -0.93 0.05 0.00 -0.84 0.00 0.00 61.79 60.07 2vak h SER 292 Cb 0.84 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 63.15 2vak h SER 292 CO 0.06 1.53 0.24 -0.25 -1.14 0.00 0.00 176.83 177.27 2vak h TRP 293 N -0.20 0.44 -0.38 3.45 2.91 -1.92 0.93 115.95 121.18 2vak h TRP 293 Ca -0.20 0.02 -0.10 0.00 1.13 0.00 0.00 58.89 59.74 2vak h TRP 293 Cb 1.83 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 30.34 2vak h TRP 293 CO 0.17 0.20 -0.16 0.82 -1.03 0.00 0.00 178.44 178.43 2vak h ILE 294 N 0.47 1.26 -0.31 2.65 2.04 -1.36 -0.22 117.51 122.03 2vak h ILE 294 Ca 0.23 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 64.81 2vak h ILE 294 Cb 0.17 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 2vak h ILE 294 CO -0.18 0.41 -0.04 0.00 0.00 0.00 0.00 178.15 178.33 2vak h ALA 295 N 1.19 0.42 -0.18 1.87 0.00 -0.94 -1.44 119.26 120.18 2vak h ALA 295 Ca 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2vak h ALA 295 Cb 0.63 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2vak h ALA 295 CO 0.04 0.22 0.06 0.00 0.00 0.00 0.00 179.25 179.58 2vak h ALA 296 N 0.81 1.78 -0.02 0.00 0.00 -0.48 -2.34 119.26 119.01 2vak h ALA 296 Ca 0.08 -0.06 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 2vak h ALA 296 Cb 0.51 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2vak h ALA 296 CO 0.02 0.18 -0.74 0.00 0.00 0.00 0.00 179.25 178.71 2vak h ALA 297 N 1.82 0.72 -0.32 0.00 0.00 -0.80 -1.87 119.26 118.82 2vak h ALA 297 Ca 0.06 -0.65 -0.15 0.00 0.00 0.00 0.00 54.91 54.18 2vak h ALA 297 Cb 0.07 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2vak h ALA 297 CO -0.01 0.86 -0.38 -0.91 0.00 0.00 0.00 179.25 178.82 2vak h ASN 298 N 0.08 0.88 -0.78 0.00 2.35 -0.94 -2.93 115.58 114.25 2vak h ASN 298 Ca -0.02 -0.49 -0.03 0.00 -0.55 0.00 0.00 56.30 55.21 2vak h ASN 298 Cb 1.31 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 39.40 2vak h ASN 298 CO 0.11 1.19 0.36 -0.07 -1.65 0.00 0.00 177.43 177.37 2vak h LEU 299 N 0.59 1.04 -0.68 1.61 3.38 -1.43 -2.98 115.31 116.84 2vak h LEU 299 Ca 0.04 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2vak h LEU 299 Cb 0.97 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 2vak h LEU 299 CO 0.09 0.89 0.41 0.74 0.09 0.00 0.00 178.44 180.66 2vak h THR 300 N 1.12 1.05 -0.94 0.22 2.02 -1.32 0.19 112.91 115.25 2vak h THR 300 Ca 0.27 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 67.19 2vak h THR 300 Cb 0.14 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 66.70 2vak h THR 300 CO -0.03 0.14 0.62 0.00 0.37 0.00 0.00 175.52 176.63 2vak h ALA 301 N 1.31 1.34 -0.02 6.16 0.00 -1.39 0.14 119.26 126.80 2vak h ALA 301 Ca 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2vak h ALA 301 Cb 0.08 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2vak h ALA 301 CO -0.13 0.60 -0.01 0.82 0.00 0.00 0.00 179.25 180.53 2vak h ILE 302 N 1.26 1.33 -0.30 0.00 2.04 -1.07 -1.09 117.51 119.68 2vak h ILE 302 Ca 0.35 -1.00 0.07 0.00 1.00 0.00 0.00 64.86 65.28 2vak h ILE 302 Cb -0.12 1.97 -0.07 0.00 -0.74 0.00 0.00 36.82 37.86 2vak h ILE 302 CO -0.08 0.26 -0.17 0.58 0.00 0.00 0.00 178.15 178.74 2vak h VAL 303 N -0.37 0.49 0.00 1.67 2.07 -0.52 -2.79 116.25 116.81 2vak h VAL 303 Ca 0.00 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 2vak h VAL 303 Cb 0.43 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 2vak h VAL 303 CO 0.00 0.00 -0.39 0.24 0.02 0.00 0.00 177.57 177.44 2vak h MET 304 N -0.14 0.00 -0.33 1.57 2.86 -0.75 -3.28 114.93 114.87 2vak h MET 304 Ca 0.16 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.73 2vak h MET 304 Cb 0.38 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.02 2vak h MET 304 CO -0.39 0.39 -0.09 0.00 1.06 0.00 0.00 176.91 177.89 2vak h ALA 305 N 1.61 1.23 0.00 6.32 0.00 -0.91 -3.07 119.26 124.44 2vak h ALA 305 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2vak h ALA 305 Cb 0.78 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2vak h ALA 305 CO 0.05 0.50 -0.06 0.00 0.00 0.00 0.00 179.25 179.74 2vak s ARG 307 N -3.04 1.56 -0.52 0.00 1.70 -1.16 -2.13 118.95 115.36 2vak s ARG 307 Ca 0.12 -1.85 -0.22 0.00 -0.47 0.00 0.00 55.73 53.31 2vak s ARG 307 Cb 0.16 -0.74 0.04 0.00 -0.57 0.00 0.00 34.95 33.84 2vak s ARG 307 CO 0.58 -0.18 0.81 -0.65 -1.08 0.00 0.00 175.30 174.78 2vak s GLN 308 N -3.90 3.28 0.73 3.89 -1.52 0.47 -4.08 119.66 118.52 2vak s GLN 308 Ca 0.35 -0.43 -0.08 0.00 -1.95 0.00 0.00 55.36 53.25 2vak s GLN 308 Cb 0.08 -4.05 0.07 0.00 -0.22 0.00 0.00 33.01 28.90 2vak s GLN 308 CO 0.14 -1.33 1.05 -1.25 -0.25 0.00 0.00 175.29 173.65 2vak s PRO 309 N 3.41 2.07 0.37 2.91 0.04 -1.26 -4.69 135.00 137.85 2vak s PRO 309 Ca 0.25 -0.25 -0.25 0.00 0.04 0.00 0.00 61.00 60.79 2vak s PRO 309 Cb -0.15 -2.13 -0.12 0.00 0.04 0.00 0.00 34.50 32.14 2vak s PRO 309 CO 0.17 -1.35 0.92 -2.30 0.04 0.00 0.00 177.00 174.48 2vak n PRO 310 N -3.01 1.19 -2.74 0.56 -0.02 -1.26 -4.96 135.00 124.76 2vak n PRO 310 Ca 0.09 0.42 -0.43 0.00 -2.02 0.00 0.00 63.50 61.56 2vak n PRO 310 Cb 0.60 -1.86 -0.03 0.00 -0.02 0.00 0.00 33.50 32.19 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 -1.23 4.72 0.51 -1.45 1.01 -1.26 -4.95 120.40 117.75 2vak s VAL 311 Ca 0.62 1.86 -0.23 0.00 0.00 0.00 0.00 61.98 64.23 2vak s VAL 311 Cb -0.62 -4.25 -0.06 0.00 0.00 0.00 0.00 36.38 31.45 2vak s VAL 311 CO 0.58 -0.16 1.32 0.49 0.00 0.00 0.00 175.10 177.33 2vak n PHE 312 N 6.24 2.22 -1.92 5.22 3.72 0.02 -0.38 117.46 132.58 2vak n PHE 312 Ca 0.10 0.45 -0.41 0.00 -0.05 0.00 0.00 57.45 57.53 2vak n PHE 312 Cb 0.47 -2.36 -0.02 0.00 -0.94 0.00 0.00 39.48 36.63 2vak n PHE 312 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2vak s ALA 313 N -1.27 3.62 0.47 4.37 0.00 -0.18 -1.13 121.76 127.63 2vak s ALA 313 Ca 0.68 1.44 0.18 0.00 0.00 0.00 0.00 51.96 54.25 2vak s ALA 313 Cb -0.44 -3.58 1.17 0.00 0.00 0.00 0.00 23.12 20.27 2vak s ALA 313 CO 0.52 -0.86 2.00 -0.91 0.00 0.00 0.00 175.76 176.51 2vak h ASN 314 N 4.17 0.21 0.82 0.00 2.35 -1.64 -1.44 115.58 120.05 2vak h ASN 314 Ca -0.48 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.28 2vak h ASN 314 Cb 1.23 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.56 2vak h ASN 314 CO 0.72 0.13 -0.08 1.67 -1.65 0.00 0.00 177.43 178.22 2vak n GLN 315 N -4.45 0.10 0.00 0.81 7.27 -1.26 -2.82 117.38 117.04 2vak n GLN 315 Ca 0.08 -0.02 0.12 0.00 0.07 0.00 0.00 57.00 57.26 2vak n GLN 315 Cb 0.41 -1.50 0.19 0.00 2.41 0.00 0.00 30.24 31.75 2vak n GLN 315 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2vak n GLY 316 N 1.46 -0.50 3.57 1.69 0.00 -0.55 -4.91 105.19 105.95 2vak n GLY 316 Ca 0.08 -0.50 -0.25 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.59 2.58 0.69 1.61 -7.23 -1.13 -4.60 120.40 109.73 2vak s VAL 317 Ca 0.19 -2.13 -0.15 0.00 -1.81 0.00 0.00 61.98 58.09 2vak s VAL 317 Cb 0.18 -2.65 0.02 0.00 0.56 0.00 0.00 36.38 34.49 2vak s VAL 317 CO 0.59 -0.27 1.13 0.27 -0.31 0.00 0.00 175.10 176.52 2vak s ILE 318 N -2.52 2.99 0.30 -0.62 -4.36 0.73 -4.88 121.20 112.84 2vak s ILE 318 Ca 0.33 0.46 0.01 0.00 -0.26 0.00 0.00 60.65 61.18 2vak s ILE 318 Cb -0.01 -2.97 0.39 0.00 1.25 0.00 0.00 42.46 41.12 2vak s ILE 318 CO 0.18 -0.29 1.58 0.78 0.24 0.00 0.00 174.94 177.43 2vak h ASN 319 N -0.14 -0.43 0.82 4.36 2.35 -1.92 0.98 115.58 121.61 2vak h ASN 319 Ca -0.47 0.27 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2vak h ASN 319 Cb 1.26 0.46 0.00 0.00 0.05 0.00 0.00 38.32 40.09 2vak h ASN 319 CO 0.53 -0.33 0.00 1.56 -1.65 0.00 0.00 177.43 177.54 2vak h GLN 320 N 0.03 0.00 -0.15 0.81 7.50 -1.91 -2.84 115.11 118.55 2vak h GLN 320 Ca 0.58 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.73 2vak h GLN 320 Cb 1.19 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.72 2vak h GLN 320 CO -0.88 0.00 0.00 0.00 -1.50 0.00 0.00 178.83 176.45 2vak n ALA 321 N -2.05 2.51 -2.09 3.87 0.00 0.34 -4.94 120.51 118.15 2vak n ALA 321 Ca 0.00 -0.59 -0.33 0.00 0.00 0.00 0.00 53.44 52.52 2vak n ALA 321 Cb 0.26 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.81 4.08 -1.35 0.00 -0.21 -1.07 -4.14 119.66 115.16 2vak s GLN 322 Ca 0.34 0.76 -0.05 0.00 0.02 0.00 0.00 55.36 56.43 2vak s GLN 322 Cb 0.19 -2.48 0.01 0.00 1.00 0.00 0.00 33.01 31.72 2vak s GLN 322 CO 0.29 0.18 0.67 0.09 -2.12 0.00 0.00 175.29 174.39 2vak n ASN 323 N -0.20 -5.72 -4.52 5.90 3.02 -1.26 -4.98 115.26 107.50 2vak n ASN 323 Ca 0.03 -0.31 -0.43 0.00 -0.03 0.00 0.00 54.58 53.84 2vak n ASN 323 Cb 0.53 -4.50 -0.08 0.00 -0.61 0.00 0.00 39.78 35.12 2vak n ASN 323 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2vak s ARG 324 N -5.72 3.30 -0.14 3.52 6.06 -1.19 -4.92 118.95 119.86 2vak s ARG 324 Ca 0.33 -0.45 -0.39 0.00 -2.50 0.00 0.00 55.73 52.72 2vak s ARG 324 Cb -0.15 -3.92 -0.16 0.00 0.06 0.00 0.00 34.95 30.78 2vak s ARG 324 CO 0.41 -0.88 1.57 -2.30 -2.50 0.00 0.00 175.30 171.60 2vak n PRO 325 N 5.93 1.09 0.00 5.12 -0.02 -1.26 -0.13 135.00 145.73 2vak n PRO 325 Ca -0.04 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2vak n PRO 325 Cb 0.48 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.90 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 3.48 1.78 1.12 -1.23 0.00 -1.26 -4.83 105.19 104.26 2vak n GLY 326 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.01 -3.99 1.61 7.35 0.81 -4.67 117.46 116.55 2vak n PHE 327 Ca 0.00 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.61 2vak n PHE 327 Cb 0.00 0.06 -0.10 0.00 0.35 0.00 0.00 39.48 39.79 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 -5.04 0.30 -0.02 -2.13 1.04 -0.10 -0.80 113.70 106.95 2vak s SER 328 Ca 0.00 -0.68 -0.28 0.00 0.48 0.00 0.00 55.95 55.46 2vak s SER 328 Cb 0.00 0.19 0.10 0.00 0.10 0.00 0.00 66.02 66.41 2vak s SER 328 CO 0.00 -0.49 0.85 0.00 0.98 0.00 0.00 173.24 174.58 2vak s MET 329 N -2.79 0.86 -0.00 4.02 0.23 -0.29 -3.19 119.30 118.14 2vak s MET 329 Ca -0.04 -0.18 -0.30 0.00 -1.03 0.00 0.00 55.69 54.14 2vak s MET 329 Cb -0.00 0.40 -0.06 0.00 -1.53 0.00 0.00 34.83 33.63 2vak s MET 329 CO -0.06 -0.35 1.56 -0.80 -2.03 0.00 0.00 175.02 173.35 2vak s ASN 330 N -2.13 6.71 0.00 -1.18 0.01 -1.26 -1.57 114.94 115.53 2vak s ASN 330 Ca 0.02 2.26 0.00 0.00 -0.71 0.00 0.00 52.86 54.42 2vak s ASN 330 Cb -0.01 -2.55 0.00 0.00 0.41 0.00 0.00 41.25 39.10 2vak s ASN 330 CO -0.06 -0.85 0.00 0.61 -1.51 0.00 0.00 177.10 175.30 2vak n GLY 331 N 3.92 0.65 1.09 0.66 0.00 -1.26 -5.00 105.19 105.26 2vak n GLY 331 Ca 0.15 -0.63 -0.08 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.54 -1.15 3.68 -0.02 0.00 -1.18 -4.95 105.19 99.04 2vak n GLY 332 Ca 0.00 -1.69 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 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 -1.78 3.89 0.64 2.61 2.01 0.49 -4.11 115.64 119.40 2vak s THR 333 Ca 0.21 1.24 -0.18 0.00 0.31 0.00 0.00 61.69 63.27 2vak s THR 333 Cb -0.01 -3.80 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 2vak s THR 333 CO 0.15 -0.02 1.25 -2.84 -0.69 0.00 0.00 174.62 172.47 2vak s PRO 334 N 2.51 2.64 -0.48 4.92 0.02 -1.26 -1.01 135.00 142.34 2vak s PRO 334 Ca 0.61 1.93 -0.15 0.00 0.02 0.00 0.00 61.00 63.41 2vak s PRO 334 Cb -0.29 -1.87 0.08 0.00 0.02 0.00 0.00 34.50 32.43 2vak s PRO 334 CO 0.24 -1.49 0.40 0.08 -0.33 0.00 0.00 177.00 175.90 2vak s VAL 335 N -1.56 5.19 0.52 3.83 1.01 -1.26 -3.96 120.40 124.17 2vak s VAL 335 Ca 0.79 -1.11 -0.19 0.00 0.00 0.00 0.00 61.98 61.47 2vak s VAL 335 Cb -0.34 -4.12 -0.07 0.00 0.00 0.00 0.00 36.38 31.85 2vak s VAL 335 CO 0.38 -0.60 1.05 -1.00 0.00 0.00 0.00 175.10 174.93 2vak s HIS 336 N 1.63 2.98 0.08 5.22 3.76 0.10 -4.89 115.29 124.17 2vak s HIS 336 Ca 0.04 1.55 0.08 0.00 -0.15 0.00 0.00 55.06 56.58 2vak s HIS 336 Cb -0.25 -3.06 -0.03 0.00 1.11 0.00 0.00 32.58 30.35 2vak s HIS 336 CO 0.06 -0.96 -0.21 -1.83 -0.85 0.00 0.00 174.74 170.95 2vak s GLU 337 N -3.52 1.23 -0.12 1.40 -1.05 -1.26 -0.38 118.70 115.00 2vak s GLU 337 Ca 0.66 -1.09 0.01 0.00 -0.15 0.00 0.00 54.97 54.40 2vak s GLU 337 Cb -0.17 -1.45 0.02 0.00 -0.44 0.00 0.00 34.13 32.09 2vak s GLU 337 CO 0.26 0.35 -0.13 -0.51 0.95 0.00 0.00 175.26 176.18 2vak s LEU 338 N -1.64 1.56 -0.22 1.83 1.43 0.14 -3.61 118.68 118.16 2vak s LEU 338 Ca 0.07 -0.40 -0.29 0.00 -1.03 0.00 0.00 54.13 52.48 2vak s LEU 338 Cb -0.10 -1.03 -0.02 0.00 0.03 0.00 0.00 46.19 45.08 2vak s LEU 338 CO 0.03 -0.04 1.41 0.21 0.23 0.00 0.00 176.35 178.19 2vak s ASN 339 N 1.31 6.67 0.36 2.29 3.84 -1.26 -1.27 114.94 126.89 2vak s ASN 339 Ca -0.00 1.54 0.09 0.00 0.21 0.00 0.00 52.86 54.70 2vak s ASN 339 Cb -0.14 -2.54 0.70 0.00 -0.55 0.00 0.00 41.25 38.72 2vak s ASN 339 CO -0.06 -1.03 1.86 -0.07 -2.79 0.00 0.00 177.10 175.02 2vak h LEU 340 N 10.72 0.24 -0.03 3.21 3.38 -1.95 -0.53 115.31 130.35 2vak h LEU 340 Ca -0.29 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 2vak h LEU 340 Cb 1.12 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.81 2vak h LEU 340 CO 1.00 0.45 -0.11 0.25 0.09 0.00 0.00 178.44 180.11 2vak h LEU 341 N 0.23 0.15 -1.63 1.67 5.85 -1.97 -1.41 115.31 118.20 2vak h LEU 341 Ca 0.04 -0.65 0.24 0.00 0.84 0.00 0.00 57.88 58.36 2vak h LEU 341 Cb 0.48 -0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.40 2vak h LEU 341 CO 0.03 0.77 0.64 0.74 -0.34 0.00 0.00 178.44 180.28 2vak h THR 342 N -0.46 0.60 0.01 1.05 2.02 -1.93 -1.06 112.91 113.14 2vak h THR 342 Ca -0.01 -0.10 -0.20 0.00 0.77 0.00 0.00 66.41 66.88 2vak h THR 342 Cb 0.76 0.29 0.02 0.00 -1.74 0.00 0.00 68.15 67.48 2vak h THR 342 CO 0.02 0.05 -0.78 0.74 0.37 0.00 0.00 175.52 175.92 2vak h THR 343 N 0.28 1.38 -0.46 3.16 2.02 -1.03 -1.08 112.91 117.18 2vak h THR 343 Ca 0.49 -2.17 0.04 0.00 0.77 0.00 0.00 66.41 65.54 2vak h THR 343 Cb 1.45 2.56 -0.04 0.00 -1.74 0.00 0.00 68.15 70.38 2vak h THR 343 CO -0.15 0.65 0.23 0.00 0.37 0.00 0.00 175.52 176.61 2vak h ALA 344 N 0.33 0.58 -0.52 6.16 0.00 -0.57 0.32 119.26 125.56 2vak h ALA 344 Ca -0.10 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 2vak h ALA 344 Cb 1.48 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 2vak h ALA 344 CO 0.15 -0.12 0.11 1.96 0.00 0.00 0.00 179.25 181.35 2vak h GLN 345 N 0.46 0.84 -0.81 0.00 4.20 -1.24 -1.34 115.11 117.23 2vak h GLN 345 Ca 0.20 -0.21 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2vak h GLN 345 Cb 0.11 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.74 2vak h GLN 345 CO -0.14 0.82 0.51 0.93 -0.67 0.00 0.00 178.83 180.27 2vak h GLU 346 N 0.73 1.08 -0.36 1.46 4.39 -0.88 -2.06 114.58 118.95 2vak h GLU 346 Ca 0.16 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.78 2vak h GLU 346 Cb 0.36 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 2vak h GLU 346 CO 0.01 0.74 0.24 0.00 -1.16 0.00 0.00 179.01 178.83 2vak h ILE 348 N 0.48 1.08 0.00 0.00 2.04 -1.14 -1.90 117.51 118.08 2vak h ILE 348 Ca 0.13 -0.22 -0.11 0.00 1.00 0.00 0.00 64.86 65.66 2vak h ILE 348 Cb -0.05 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 2vak h ILE 348 CO -0.03 0.09 -0.51 -0.09 0.00 0.00 0.00 178.15 177.61 2vak h ARG 349 N 0.34 0.00 -0.21 2.37 2.43 -1.07 -2.67 114.38 115.57 2vak h ARG 349 Ca 0.09 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 59.05 2vak h ARG 349 Cb 0.02 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2vak h ARG 349 CO -0.01 0.51 -0.68 1.96 -1.51 0.00 0.00 179.97 180.23 2vak h GLN 350 N 0.00 0.83 0.00 0.20 1.08 -0.76 -2.15 115.11 114.31 2vak h GLN 350 Ca -0.01 -0.61 -0.03 0.00 -1.45 0.00 0.00 58.65 56.55 2vak h GLN 350 Cb 1.24 0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 28.78 2vak h GLN 350 CO 0.07 1.23 -0.16 -1.49 -0.95 0.00 0.00 178.83 177.52 2vak h TRP 351 N 0.59 0.00 0.02 2.96 6.55 -1.29 -1.47 115.95 123.31 2vak h TRP 351 Ca -0.03 0.00 -0.17 0.00 0.95 0.00 0.00 58.89 59.64 2vak h TRP 351 Cb 1.31 0.00 0.01 0.00 -0.86 0.00 0.00 29.16 29.62 2vak h TRP 351 CO 0.08 0.16 -0.68 0.28 -1.05 0.00 0.00 178.44 177.24 2vak h VAL 352 N 0.00 1.42 -0.30 1.49 2.07 -1.34 0.46 116.25 120.06 2vak h VAL 352 Ca -0.00 -2.16 -0.04 0.00 0.82 0.00 0.00 66.70 65.32 2vak h VAL 352 Cb 0.32 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.74 2vak h VAL 352 CO 0.02 0.63 0.01 0.24 0.02 0.00 0.00 177.57 178.49 2vak h MET 353 N -0.10 0.45 -0.06 1.57 2.86 -1.24 -1.57 114.93 116.84 2vak h MET 353 Ca -0.09 -0.08 0.00 0.00 -2.06 0.00 0.00 59.70 57.47 2vak h MET 353 Cb 1.40 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.99 2vak h MET 353 CO 0.13 0.47 0.00 0.00 1.06 0.00 0.00 176.91 178.57 2vak n ALA 354 N -2.48 2.58 -1.49 6.32 0.00 -0.57 -4.87 120.51 120.00 2vak n ALA 354 Ca 0.01 -0.26 -0.15 0.00 0.00 0.00 0.00 53.44 53.04 2vak n ALA 354 Cb 0.22 -1.22 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 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 0.91 1.46 0.20 0.00 0.00 -0.59 -4.91 105.19 102.27 2vak n GLY 355 Ca 0.15 -0.30 0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 0.00 0.00 -8.09 0.99 3.38 -0.27 -3.44 115.31 107.87 2vak h LEU 356 Ca -0.32 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.47 2vak h LEU 356 Cb 1.01 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.57 2vak h LEU 356 CO 0.46 0.09 -0.70 0.68 0.09 0.00 0.00 178.44 179.06 2vak s VAL 357 N -3.17 0.25 0.60 1.22 -7.23 -1.09 -5.01 120.40 105.97 2vak s VAL 357 Ca 0.06 -1.17 -0.18 0.00 -1.81 0.00 0.00 61.98 58.87 2vak s VAL 357 Cb 0.06 -0.65 -0.03 0.00 0.56 0.00 0.00 36.38 36.32 2vak s VAL 357 CO 0.69 -0.59 1.17 -0.94 -0.31 0.00 0.00 175.10 175.12 2vak s SER 358 N -1.85 5.24 0.62 4.85 1.04 -1.26 -4.52 113.70 117.83 2vak s SER 358 Ca -0.09 2.27 0.29 0.00 0.48 0.00 0.00 55.95 58.90 2vak s SER 358 Cb -0.06 -2.59 1.56 0.00 0.10 0.00 0.00 66.02 65.04 2vak s SER 358 CO -0.03 -1.55 1.93 0.00 0.98 0.00 0.00 173.24 174.57 2vak h ALA 359 N 0.75 1.79 0.09 5.32 0.00 -1.98 -0.49 119.26 124.75 2vak h ALA 359 Ca -0.50 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.13 2vak h ALA 359 Cb 1.28 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 2vak h ALA 359 CO 0.55 -0.51 -1.34 0.00 0.00 0.00 0.00 179.25 177.95 2vak h ALA 360 N 1.45 0.25 -0.07 0.00 0.00 -2.00 -2.94 119.26 115.95 2vak h ALA 360 Ca 0.11 -1.01 -0.12 0.00 0.00 0.00 0.00 54.91 53.89 2vak h ALA 360 Cb 0.88 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2vak h ALA 360 CO -0.00 1.13 -0.49 -0.22 0.00 0.00 0.00 179.25 179.66 2vak h LYS 361 N 0.05 0.17 -0.14 0.00 3.64 -1.49 -2.42 116.57 116.39 2vak h LYS 361 Ca -0.16 -0.09 -0.12 0.00 -1.27 0.00 0.00 60.65 59.01 2vak h LYS 361 Cb 1.96 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.77 2vak h LYS 361 CO 0.17 0.63 -0.43 0.78 -2.27 0.00 0.00 179.45 178.32 2vak h GLY 362 N 1.38 0.35 0.88 5.01 0.00 -1.27 0.99 103.07 110.40 2vak h GLY 362 Ca 0.00 -0.35 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 2vak h GLY 362 CO 0.07 0.31 -0.30 1.46 0.00 0.00 0.00 176.54 178.09 2vak h GLN 363 N 0.26 0.56 0.43 4.80 4.20 -1.50 -1.68 115.11 122.19 2vak h GLN 363 Ca 0.02 -0.33 -0.01 0.00 0.06 0.00 0.00 58.65 58.39 2vak h GLN 363 Cb 0.87 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 2vak h GLN 363 CO 0.07 0.93 -0.37 0.00 -0.67 0.00 0.00 178.83 178.79 2vak h ALA 364 N 0.62 -0.84 -0.92 3.87 0.00 -1.09 -1.86 119.26 119.04 2vak h ALA 364 Ca 0.02 -0.14 0.14 0.00 0.00 0.00 0.00 54.91 54.92 2vak h ALA 364 Cb 0.88 0.51 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 2vak h ALA 364 CO 0.07 -1.00 0.53 -0.07 0.00 0.00 0.00 179.25 178.78 2vak h LEU 365 N -0.80 0.72 -1.06 0.00 3.38 -0.90 -0.96 115.31 115.69 2vak h LEU 365 Ca -0.04 0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 2vak h LEU 365 Cb 0.70 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2vak h LEU 365 CO -0.03 0.34 -0.24 0.74 0.09 0.00 0.00 178.44 179.34 2vak h THR 366 N 0.79 1.25 -0.02 0.22 2.02 -1.12 -2.50 112.91 113.56 2vak h THR 366 Ca 0.48 -1.19 -0.21 0.00 0.77 0.00 0.00 66.41 66.26 2vak h THR 366 Cb 0.59 1.37 0.02 0.00 -1.74 0.00 0.00 68.15 68.39 2vak h THR 366 CO -0.31 0.37 -0.82 -0.61 0.37 0.00 0.00 175.52 174.51 2vak h GLN 367 N 0.33 0.59 0.00 6.66 5.75 -0.50 -1.80 115.11 126.14 2vak h GLN 367 Ca 0.05 -0.61 -0.04 0.00 -0.15 0.00 0.00 58.65 57.90 2vak h GLN 367 Cb 0.61 0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 2vak h GLN 367 CO 0.04 1.22 -0.19 0.93 -2.65 0.00 0.00 178.83 178.19 2vak h GLU 368 N 0.20 0.00 0.01 1.69 5.08 -1.14 0.50 114.58 120.92 2vak h GLU 368 Ca -0.10 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2vak h GLU 368 Cb 1.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.75 2vak h GLU 368 CO 0.16 0.19 -0.00 0.00 -1.00 0.00 0.00 179.01 178.36 2vak h ALA 369 N 1.81 -0.01 -0.90 3.43 0.00 -1.38 -1.90 119.26 120.31 2vak h ALA 369 Ca -0.00 -0.42 0.21 0.00 0.00 0.00 0.00 54.91 54.71 2vak h ALA 369 Cb 0.35 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.03 2vak h ALA 369 CO 0.02 -0.05 0.41 -0.91 0.00 0.00 0.00 179.25 178.73 2vak h ASN 370 N -0.93 0.37 -0.04 0.00 2.35 -1.25 -0.40 115.58 115.67 2vak h ASN 370 Ca -0.00 0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.89 2vak h ASN 370 Cb 0.84 0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.32 2vak h ASN 370 CO 0.00 0.02 -0.01 0.44 -1.65 0.00 0.00 177.43 176.24 2vak h ASP 371 N 0.43 0.08 -0.15 5.81 3.45 -0.91 -2.24 116.42 122.88 2vak h ASP 371 Ca 0.55 -0.36 -0.04 0.00 0.43 0.00 0.00 57.03 57.61 2vak h ASP 371 Cb 1.03 -0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.76 2vak h ASP 371 CO -0.51 0.43 -0.01 0.15 -1.57 0.00 0.00 179.24 177.72 2vak h PHE 372 N -0.26 0.41 0.05 4.55 3.57 -1.11 -2.71 116.94 121.43 2vak h PHE 372 Ca 0.01 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.47 2vak h PHE 372 Cb 0.39 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.01 2vak h PHE 372 CO 0.05 0.43 -0.03 1.03 -2.23 0.00 0.00 178.31 177.56 2vak h SER 373 N 0.39 -0.06 -0.74 0.41 0.87 -1.01 -1.94 113.55 111.46 2vak h SER 373 Ca 0.09 -0.29 0.17 0.00 -1.23 0.00 0.00 61.79 60.52 2vak h SER 373 Cb 0.28 0.02 -0.12 0.00 -0.44 0.00 0.00 62.40 62.14 2vak h SER 373 CO 0.01 0.26 0.12 -1.13 -0.53 0.00 0.00 176.83 175.55 2vak h ASN 374 N -0.39 -0.12 -0.03 6.23 -1.24 -1.25 0.43 115.58 119.21 2vak h ASN 374 Ca -0.01 0.17 0.01 0.00 0.71 0.00 0.00 56.30 57.17 2vak h ASN 374 Cb 0.35 0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.64 2vak h ASN 374 CO 0.01 -0.10 -0.01 0.25 -1.29 0.00 0.00 177.43 176.30 2vak h LEU 375 N 0.20 -0.03 -0.67 0.34 6.46 -1.38 -1.72 115.31 118.51 2vak h LEU 375 Ca 0.42 0.01 -0.13 0.00 -0.12 0.00 0.00 57.88 58.05 2vak h LEU 375 Cb 0.73 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 2vak h LEU 375 CO -0.57 -0.01 -0.43 0.40 -0.62 0.00 0.00 178.44 177.21 2vak h ILE 376 N -0.00 1.31 -0.08 4.05 1.08 -0.51 -1.81 117.51 121.55 2vak h ILE 376 Ca 0.01 -1.61 -0.11 0.00 -0.39 0.00 0.00 64.86 62.76 2vak h ILE 376 Cb 0.02 1.61 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 2vak h ILE 376 CO -0.03 0.50 -0.45 -0.61 -0.69 0.00 0.00 178.15 176.87 2vak h GLN 377 N 0.43 0.20 -0.33 2.37 4.15 -0.14 0.11 115.11 121.91 2vak h GLN 377 Ca 0.03 -0.10 -0.16 0.00 0.77 0.00 0.00 58.65 59.19 2vak h GLN 377 Cb 0.93 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.62 2vak h GLN 377 CO 0.08 0.62 -0.43 0.00 -1.93 0.00 0.00 178.83 177.17 2vak h ALA 378 N 1.37 0.50 0.14 3.38 0.00 -1.08 -1.34 119.26 122.23 2vak h ALA 378 Ca 0.01 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 2vak h ALA 378 Cb 0.86 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.56 2vak h ALA 378 CO 0.07 0.63 -0.07 0.22 0.00 0.00 0.00 179.25 180.10 2vak h ASP 379 N 0.67 -0.16 -0.72 0.00 1.82 -1.04 -2.58 116.42 114.40 2vak h ASP 379 Ca 0.04 -0.27 -0.06 0.00 -0.39 0.00 0.00 57.03 56.35 2vak h ASP 379 Cb 1.03 0.04 -0.03 0.00 0.68 0.00 0.00 39.33 41.05 2vak h ASP 379 CO 0.10 0.19 0.22 -0.07 -1.61 0.00 0.00 179.24 178.07 2vak h LEU 380 N -0.54 1.07 -1.73 2.28 3.38 -0.88 -2.61 115.31 116.28 2vak h LEU 380 Ca -0.02 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 57.83 2vak h LEU 380 Cb 0.42 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 2vak h LEU 380 CO 0.03 1.00 0.35 1.23 0.09 0.00 0.00 178.44 181.14 2vak h GLY 381 N 1.11 0.43 0.45 0.83 0.00 -1.23 -0.15 103.07 104.51 2vak h GLY 381 Ca 0.23 -0.13 -0.15 0.00 0.00 0.00 0.00 47.33 47.28 2vak h GLY 381 CO -0.01 0.08 -0.72 -1.61 0.00 0.00 0.00 176.54 174.29 2vak h GLN 382 N 0.32 0.20 -0.83 4.80 4.15 -1.15 -0.95 115.11 121.63 2vak h GLN 382 Ca 0.24 -0.34 0.16 0.00 0.77 0.00 0.00 58.65 59.48 2vak h GLN 382 Cb 0.52 0.13 -0.16 0.00 0.21 0.00 0.00 27.48 28.17 2vak h GLN 382 CO -0.05 1.16 -0.23 0.82 -1.93 0.00 0.00 178.83 178.59 2vak h ILE 383 N -0.56 0.15 0.48 2.39 2.04 -1.43 0.39 117.51 120.97 2vak h ILE 383 Ca -0.14 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.70 2vak h ILE 383 Cb 1.48 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.71 2vak h ILE 383 CO 0.08 0.00 -0.23 0.50 0.00 0.00 0.00 178.15 178.50 2vak h LYS 384 N -0.01 -0.63 -0.58 2.37 3.64 -1.03 -0.17 116.57 120.16 2vak h LYS 384 Ca 0.39 0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.88 2vak h LYS 384 Cb 0.61 0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.48 2vak h LYS 384 CO -0.86 -0.37 -0.55 0.00 -2.27 0.00 0.00 179.45 175.40 2vak h ALA 385 N -0.26 -0.66 0.00 5.00 0.00 -0.82 0.13 119.26 122.65 2vak h ALA 385 Ca -0.07 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2vak h ALA 385 Cb 0.54 1.16 0.00 0.00 0.00 0.00 0.00 17.79 19.50 2vak h ALA 385 CO 0.11 -1.00 0.00 -0.56 0.00 0.00 0.00 179.25 177.80 2vak h GLN 386 N -0.28 0.00 -0.03 0.00 3.07 -0.95 -1.92 115.11 115.01 2vak h GLN 386 Ca 0.11 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.71 2vak h GLN 386 Cb 0.55 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.12 2vak h GLN 386 CO -0.70 0.00 -0.52 -0.44 0.09 0.00 0.00 178.83 177.26 2vak h ASP 387 N 0.00 0.51 -0.37 0.06 5.19 -0.54 -2.26 116.42 119.01 2vak h ASP 387 Ca 0.00 -0.73 0.00 0.00 -0.62 0.00 0.00 57.03 55.69 2vak h ASP 387 Cb 0.76 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 40.10 2vak h ASP 387 CO 0.00 1.16 0.24 0.44 -3.12 0.00 0.00 179.24 177.96 2vak h ASP 388 N -0.10 0.43 0.48 6.45 3.45 -0.59 -0.11 116.42 126.43 2vak h ASP 388 Ca -0.06 -0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.36 2vak h ASP 388 Cb 1.22 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 39.88 2vak h ASP 388 CO 0.10 0.33 -0.23 0.00 -1.57 0.00 0.00 179.24 177.87 2vak h ALA 389 N 1.12 -0.64 -0.11 3.45 0.00 -1.48 -2.97 119.26 118.63 2vak h ALA 389 Ca 0.14 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2vak h ALA 389 Cb -0.04 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2vak h ALA 389 CO -0.03 -0.78 -0.13 -0.07 0.00 0.00 0.00 179.25 178.24 2vak h LEU 390 N -0.80 0.16 -0.41 0.00 3.38 -1.36 -0.57 115.31 115.70 2vak h LEU 390 Ca -0.07 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 2vak h LEU 390 Cb 0.56 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2vak h LEU 390 CO 0.11 0.31 0.00 0.22 0.09 0.00 0.00 178.44 179.17 2vak h TYR 391 N 0.16 0.79 0.06 1.13 5.03 -1.09 -1.20 116.97 121.85 2vak h TYR 391 Ca 0.03 -0.14 -0.00 0.00 2.58 0.00 0.00 58.73 61.20 2vak h TYR 391 Cb 0.34 -0.21 0.00 0.00 1.55 0.00 0.00 36.73 38.42 2vak h TYR 391 CO 0.00 0.79 -0.03 -0.91 -1.32 0.00 0.00 178.16 176.70 2vak h ASN 392 N 0.56 -0.07 0.65 -2.11 2.35 -1.30 -3.36 115.58 112.30 2vak h ASN 392 Ca 0.12 -0.06 -0.27 0.00 -0.55 0.00 0.00 56.30 55.54 2vak h ASN 392 Cb 0.48 0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 2vak h ASN 392 CO 0.02 0.01 -1.41 1.56 -1.65 0.00 0.00 177.43 175.96 2vak h GLN 393 N -0.15 0.08 -4.75 0.81 7.50 -1.14 -3.45 115.11 114.01 2vak h GLN 393 Ca -0.01 -0.14 -0.68 0.00 0.50 0.00 0.00 58.65 58.32 2vak h GLN 393 Cb 0.13 0.05 -0.34 0.00 0.05 0.00 0.00 27.48 27.36 2vak h GLN 393 CO 0.01 0.87 -0.71 -1.14 -1.50 0.00 0.00 178.83 176.37 2vak s GLN 394 N -2.64 2.26 0.07 1.46 0.74 -0.46 -5.08 119.66 116.01 2vak s GLN 394 Ca -0.04 -1.40 -0.37 0.00 0.05 0.00 0.00 55.36 53.60 2vak s GLN 394 Cb 0.08 -3.17 -0.18 0.00 1.10 0.00 0.00 33.01 30.85 2vak s GLN 394 CO 0.83 -0.69 1.25 -2.30 -0.55 0.00 0.00 175.29 173.84 2vak n PRO 395 N 4.55 0.83 -0.98 1.67 -0.02 -1.26 -2.50 135.00 137.29 2vak n PRO 395 Ca -0.11 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2vak n PRO 395 Cb 0.43 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 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 2.22 0.46 3.70 -1.23 0.00 -1.26 -5.02 105.19 104.05 2vak n GLY 396 Ca 0.19 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.00 2.83 -0.44 1.61 5.04 -1.04 -4.62 117.35 118.72 2vak s TYR 397 Ca 0.00 0.70 -0.20 0.00 -2.44 0.00 0.00 57.07 55.13 2vak s TYR 397 Cb 0.00 -3.76 0.03 0.00 0.35 0.00 0.00 41.96 38.57 2vak s TYR 397 CO 0.00 -2.88 0.63 0.00 -1.34 0.00 0.00 175.55 171.96 2vak s ALA 398 N 2.11 3.35 0.51 3.97 0.00 -1.26 -3.73 121.76 126.72 2vak s ALA 398 Ca 0.67 -1.28 -0.21 0.00 0.00 0.00 0.00 51.96 51.14 2vak s ALA 398 Cb -0.36 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.42 2vak s ALA 398 CO 0.29 -1.79 1.22 1.03 0.00 0.00 0.00 175.76 176.50 2vak s ARG 399 N 2.76 3.42 -0.07 0.00 0.52 -0.25 -4.96 118.95 120.37 2vak s ARG 399 Ca 0.21 1.88 0.19 0.00 -0.52 0.00 0.00 55.73 57.49 2vak s ARG 399 Cb -0.15 -2.24 -0.24 0.00 0.52 0.00 0.00 34.95 32.84 2vak s ARG 399 CO 0.18 -0.86 0.43 0.54 0.02 0.00 0.00 175.30 175.61 2vak n ARG 400 N -0.91 0.66 -3.83 3.54 1.74 -1.26 -4.94 116.66 111.66 2vak n ARG 400 Ca 0.10 -0.01 -0.09 0.00 -0.77 0.00 0.00 57.85 57.08 2vak n ARG 400 Cb 0.48 -1.60 -0.07 0.00 -1.02 0.00 0.00 32.46 30.24 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 -2.96 0.13 0.29 0.55 -4.36 -1.26 -4.48 121.20 109.11 2vak s ILE 401 Ca -0.07 -1.10 -0.30 0.00 -0.26 0.00 0.00 60.65 58.92 2vak s ILE 401 Cb 0.09 -1.28 -0.11 0.00 1.25 0.00 0.00 42.46 42.41 2vak s ILE 401 CO 0.85 -0.61 1.61 -0.75 0.24 0.00 0.00 174.94 176.29 2vak s LYS 402 N -3.73 4.11 0.42 0.37 2.20 -1.26 -4.94 119.74 116.91 2vak s LYS 402 Ca 0.04 2.60 -0.25 0.00 -0.36 0.00 0.00 55.97 58.00 2vak s LYS 402 Cb 0.04 -3.02 -0.10 0.00 -1.51 0.00 0.00 37.83 33.24 2vak s LYS 402 CO -0.10 -0.66 1.19 -2.30 -0.36 0.00 0.00 175.35 173.12 2vak n PRO 403 N 2.23 1.73 -4.16 4.03 -0.02 -1.26 -5.02 135.00 132.53 2vak n PRO 403 Ca 0.09 0.62 -0.13 0.00 -2.02 0.00 0.00 63.50 62.05 2vak n PRO 403 Cb 0.37 -2.28 -0.08 0.00 -0.02 0.00 0.00 33.50 31.49 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 -1.22 1.12 0.12 6.00 -0.71 -1.26 -5.00 117.98 117.02 2vak s PHE 404 Ca 0.62 -1.31 0.08 0.00 -1.04 0.00 0.00 56.93 55.29 2vak s PHE 404 Cb -0.52 -0.38 -0.04 0.00 -1.21 0.00 0.00 43.02 40.87 2vak s PHE 404 CO 0.57 -0.83 -0.12 0.14 -1.34 0.00 0.00 175.22 173.64 2vak s VAL 405 N -3.81 3.17 0.59 -2.49 -7.23 -1.26 -5.04 120.40 104.33 2vak s VAL 405 Ca 0.35 -1.41 0.29 0.00 -1.81 0.00 0.00 61.98 59.40 2vak s VAL 405 Cb 0.03 -2.49 0.35 0.00 0.56 0.00 0.00 36.38 34.84 2vak s VAL 405 CO 0.16 0.07 2.19 0.78 -0.31 0.00 0.00 175.10 177.99 2vak h ASN 406 N 3.53 0.00 0.59 4.85 2.35 -2.03 -2.39 115.58 122.48 2vak h ASN 406 Ca -0.49 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.26 2vak h ASN 406 Cb 1.17 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.54 2vak h ASN 406 CO 0.50 0.00 0.00 1.23 -1.65 0.00 0.00 177.43 177.51 2vak h GLY 407 N 0.00 0.00 2.00 2.83 0.00 -1.99 -2.78 103.07 103.12 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 -0.55 0.00 0.00 0.00 176.54 175.99 2vak h ASP 408 N 0.00 0.00 0.63 0.19 3.32 -1.74 -2.37 116.42 116.45 2vak h ASP 408 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2vak h ASP 408 Cb 0.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.85 2vak h ASP 408 CO 0.00 0.00 -0.15 0.79 -1.72 0.00 0.00 179.24 178.16 2vak n TRP 409 N -2.50 0.00 -2.16 4.55 7.02 -1.05 -3.72 117.44 119.58 2vak n TRP 409 Ca -0.01 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.16 2vak n TRP 409 Cb 0.10 -0.32 -0.01 0.00 -2.42 0.00 0.00 31.31 28.67 2vak n TRP 409 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 2vak s THR 410 N -2.78 4.68 0.34 -0.99 -4.23 -0.90 -4.99 115.64 106.78 2vak s THR 410 Ca 0.20 0.89 0.06 0.00 -1.18 0.00 0.00 61.69 61.66 2vak s THR 410 Cb 0.19 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.52 2vak s THR 410 CO 0.54 -0.95 1.89 -0.65 -0.54 0.00 0.00 174.62 174.92 2vak h PRO 411 N 0.19 0.77 0.00 3.99 0.11 -1.89 -3.46 132.00 131.72 2vak h PRO 411 Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2vak h PRO 411 Cb 1.19 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.12 2vak h PRO 411 CO 0.62 0.51 0.00 0.41 -0.21 0.00 0.00 178.00 179.33 2vak n GLY 412 N -1.42 3.74 1.19 -0.55 0.00 -1.26 -2.12 105.19 104.77 2vak n GLY 412 Ca 0.16 0.16 0.07 0.00 0.00 0.00 0.00 46.02 46.41 2vak n GLY 412 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2vak n MET 413 N 14.00 3.42 -0.31 1.61 1.56 -1.26 -4.62 117.12 131.52 2vak n MET 413 Ca 0.00 -2.95 0.08 0.00 -0.27 0.00 0.00 57.70 54.56 2vak n MET 413 Cb 0.00 -1.97 0.18 0.00 2.15 0.00 0.00 33.22 33.59 2vak n MET 413 CO 0.00 0.00 0.00 1.15 -0.73 0.00 0.00 175.97 176.39 2vak h THR 414 N 2.36 0.14 -0.64 1.12 2.02 -1.49 -2.56 112.91 113.87 2vak h THR 414 Ca 0.01 -0.01 0.06 0.00 0.77 0.00 0.00 66.41 67.25 2vak h THR 414 Cb 1.62 0.10 -0.06 0.00 -1.74 0.00 0.00 68.15 68.07 2vak h THR 414 CO 0.31 0.01 0.33 0.00 0.37 0.00 0.00 175.52 176.54 2vak h ALA 415 N 1.88 0.85 -0.65 6.16 0.00 -1.85 0.13 119.26 125.78 2vak h ALA 415 Ca 0.48 0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.37 2vak h ALA 415 Cb 0.86 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 2vak h ALA 415 CO -0.86 -0.01 0.19 1.96 0.00 0.00 0.00 179.25 180.53 2vak h GLN 416 N 0.61 0.99 -0.34 0.00 7.50 -1.84 -0.83 115.11 121.21 2vak h GLN 416 Ca 0.29 -0.20 -0.14 0.00 0.50 0.00 0.00 58.65 59.10 2vak h GLN 416 Cb 0.22 -0.15 -0.01 0.00 0.05 0.00 0.00 27.48 27.60 2vak h GLN 416 CO -0.20 0.86 -0.33 0.00 -1.50 0.00 0.00 178.83 177.66 2vak h ALA 417 N 1.25 0.50 -0.82 3.87 0.00 -0.76 -2.64 119.26 120.66 2vak h ALA 417 Ca 0.21 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2vak h ALA 417 Cb 0.29 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 2vak h ALA 417 CO -0.01 0.55 0.45 -0.07 0.00 0.00 0.00 179.25 180.18 2vak h LEU 418 N 0.61 1.02 -0.54 0.00 3.38 -0.48 -1.91 115.31 117.39 2vak h LEU 418 Ca 0.06 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 2vak h LEU 418 Cb 0.91 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 2vak h LEU 418 CO 0.08 0.82 -0.09 0.00 0.09 0.00 0.00 178.44 179.34 2vak h ALA 419 N 1.35 0.74 -0.30 1.53 0.00 -1.10 -2.44 119.26 119.04 2vak h ALA 419 Ca 0.29 -0.34 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 2vak h ALA 419 Cb 0.02 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2vak h ALA 419 CO -0.05 0.65 -0.50 0.28 0.00 0.00 0.00 179.25 179.63 2vak h VAL 420 N 0.90 1.28 0.00 0.00 2.07 -1.29 -3.19 116.25 116.01 2vak h VAL 420 Ca 0.14 -1.69 -0.12 0.00 0.82 0.00 0.00 66.70 65.85 2vak h VAL 420 Cb 0.66 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 2vak h VAL 420 CO 0.05 0.55 -0.57 -0.07 0.02 0.00 0.00 177.57 177.54 2vak h LEU 421 N 0.66 0.00 -2.05 2.57 3.38 -1.31 -2.65 115.31 115.92 2vak h LEU 421 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 2vak h LEU 421 Cb 1.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2vak h LEU 421 CO 0.11 0.57 -0.04 0.00 0.09 0.00 0.00 178.44 179.18 2vak h ALA 422 N 1.43 1.81 -0.01 1.53 0.00 -1.42 -1.83 119.26 120.76 2vak h ALA 422 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2vak h ALA 422 Cb 1.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2vak h ALA 422 CO 0.07 0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.62 2vak n THR 423 N -4.30 0.02 0.92 0.00 -2.24 -1.00 -4.08 114.28 103.60 2vak n THR 423 Ca -0.03 -0.02 0.12 0.00 -2.27 0.00 0.00 64.05 61.86 2vak n THR 423 Cb 0.12 -0.10 0.32 0.00 -2.10 0.00 0.00 70.33 68.57 2vak n THR 423 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2vak n PHE 424 N -0.57 0.11 -0.62 4.78 3.01 -0.69 -2.81 117.46 120.67 2vak n PHE 424 Ca 0.06 0.03 0.10 0.00 1.01 0.00 0.00 57.45 58.65 2vak n PHE 424 Cb 0.04 -0.39 0.36 0.00 -0.01 0.00 0.00 39.48 39.48 2vak n PHE 424 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2vak n THR 425 N -1.62 1.82 1.09 4.37 -2.24 -1.26 -4.80 114.28 111.64 2vak n THR 425 Ca 0.05 -1.20 0.12 0.00 -2.27 0.00 0.00 64.05 60.76 2vak n THR 425 Cb 0.36 0.14 0.17 0.00 -2.10 0.00 0.00 70.33 68.90 2vak n THR 425 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50