#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vak s ALA 12 N 0.00 0.15 0.28 -5.12 0.00 -1.26 -1.86 121.76 113.94 2vak s ALA 12 Ca 0.00 -0.00 -0.22 0.00 0.00 0.00 0.00 51.96 51.74 2vak s ALA 12 Cb 0.00 -3.27 -0.09 0.00 0.00 0.00 0.00 23.12 19.76 2vak s ALA 12 CO 0.00 -3.46 0.81 0.50 0.00 0.00 0.00 175.76 173.61 2vak s ARG 13 N -4.57 4.35 0.00 0.00 3.52 -1.24 -3.73 118.95 117.27 2vak s ARG 13 Ca 0.67 1.02 0.00 0.00 -0.13 0.00 0.00 55.73 57.30 2vak s ARG 13 Cb -0.24 -2.78 0.00 0.00 -1.56 0.00 0.00 34.95 30.37 2vak s ARG 13 CO 0.62 0.31 0.00 0.00 -0.81 0.00 0.00 175.30 175.43 2vak n ALA 14 N 0.51 1.98 -3.83 6.12 0.00 -1.26 -4.97 120.51 119.07 2vak n ALA 14 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 2vak n ALA 14 Cb 0.51 0.41 -0.15 0.00 0.00 0.00 0.00 19.45 20.22 2vak n ALA 14 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2vak s ILE 15 N -1.93 2.68 -1.03 0.00 1.01 -1.26 -5.05 121.20 115.61 2vak s ILE 15 Ca 0.00 -0.76 -0.08 0.00 0.00 0.00 0.00 60.65 59.82 2vak s ILE 15 Cb 0.00 -2.19 0.26 0.00 0.01 0.00 0.00 42.46 40.54 2vak s ILE 15 CO 0.00 0.46 1.00 -0.31 0.00 0.00 0.00 174.94 176.09 2vak s TYR 16 N 1.37 4.14 0.05 3.97 2.02 -1.26 -5.03 117.35 122.61 2vak s TYR 16 Ca 0.05 -2.73 -0.11 0.00 -0.37 0.00 0.00 57.07 53.91 2vak s TYR 16 Cb -0.14 -3.69 -0.06 0.00 -0.40 0.00 0.00 41.96 37.68 2vak s TYR 16 CO -0.08 -0.90 0.39 -0.51 -1.57 0.00 0.00 175.55 172.87 2vak s ASP 17 N 1.01 6.67 -0.05 2.29 1.01 -1.26 -0.42 116.67 125.93 2vak s ASP 17 Ca 0.29 0.81 0.05 0.00 0.71 0.00 0.00 52.55 54.41 2vak s ASP 17 Cb -0.10 -2.19 -0.01 0.00 1.01 0.00 0.00 42.92 41.64 2vak s ASP 17 CO -0.09 0.22 -0.19 0.12 0.21 0.00 0.00 175.17 175.44 2vak s PHE 18 N -1.30 1.92 -0.16 4.23 5.36 0.86 -4.84 117.98 124.05 2vak s PHE 18 Ca 0.30 -0.56 0.00 0.00 -0.96 0.00 0.00 56.93 55.71 2vak s PHE 18 Cb -0.15 -1.28 -0.00 0.00 -0.34 0.00 0.00 43.02 41.25 2vak s PHE 18 CO 0.16 -0.18 -0.15 0.12 -1.46 0.00 0.00 175.22 173.71 2vak s PHE 19 N -0.01 2.79 0.38 10.12 5.36 -1.26 -0.73 117.98 134.63 2vak s PHE 19 Ca -0.04 -1.02 -0.12 0.00 -0.96 0.00 0.00 56.93 54.78 2vak s PHE 19 Cb -0.12 -1.90 -0.07 0.00 -0.34 0.00 0.00 43.02 40.59 2vak s PHE 19 CO 0.03 -0.47 0.76 -1.54 -1.46 0.00 0.00 175.22 172.54 2vak s SER 20 N 0.83 6.62 0.11 6.13 1.04 -0.36 -4.23 113.70 123.83 2vak s SER 20 Ca -0.05 1.20 -0.35 0.00 0.48 0.00 0.00 55.95 57.23 2vak s SER 20 Cb -0.15 -2.35 -0.15 0.00 0.10 0.00 0.00 66.02 63.48 2vak s SER 20 CO -0.00 -0.33 1.52 0.41 0.98 0.00 0.00 173.24 175.82 2vak n THR 21 N -0.95 0.04 -2.37 2.02 -1.04 -1.26 -2.56 114.28 108.15 2vak n THR 21 Ca 0.03 -0.01 -0.37 0.00 -2.04 0.00 0.00 64.05 61.66 2vak n THR 21 Cb 0.54 -1.30 -0.02 0.00 -1.82 0.00 0.00 70.33 67.72 2vak n THR 21 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2vak s PRO 22 N 1.00 3.93 0.18 -2.82 0.02 -1.26 -2.76 135.00 133.29 2vak s PRO 22 Ca 0.82 1.68 -0.09 0.00 0.02 0.00 0.00 61.00 63.42 2vak s PRO 22 Cb -0.78 -2.47 -0.01 0.00 0.02 0.00 0.00 34.50 31.26 2vak s PRO 22 CO 0.42 -0.38 0.31 -0.59 -0.33 0.00 0.00 177.00 176.43 2vak s PHE 23 N -1.59 0.41 0.00 6.54 -0.71 -1.26 -4.90 117.98 116.47 2vak s PHE 23 Ca 0.61 -0.77 0.00 0.00 -1.04 0.00 0.00 56.93 55.73 2vak s PHE 23 Cb -0.26 -0.04 0.00 0.00 -1.21 0.00 0.00 43.02 41.51 2vak s PHE 23 CO 0.32 -0.75 0.00 0.41 -1.34 0.00 0.00 175.22 173.86 2vak n GLY 24 N -0.24 1.63 0.00 1.99 0.00 -1.26 -4.90 105.19 102.40 2vak n GLY 24 Ca -0.06 -1.70 0.12 0.00 0.00 0.00 0.00 46.02 44.38 2vak n GLY 24 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vak n ASN 25 N 0.00 0.00 -1.00 1.61 5.03 -1.26 -3.32 115.26 116.32 2vak n ASN 25 Ca 0.00 -0.16 0.01 0.00 0.87 0.00 0.00 54.58 55.30 2vak n ASN 25 Cb 0.00 -0.25 0.22 0.00 -1.02 0.00 0.00 39.78 38.73 2vak n ASN 25 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2vak n ARG 26 N -1.25 2.19 0.00 3.52 5.12 -1.26 -5.09 116.66 119.89 2vak n ARG 26 Ca 0.13 -3.02 0.00 0.00 -1.93 0.00 0.00 57.85 53.03 2vak n ARG 26 Cb 0.19 -1.81 0.00 0.00 -1.16 0.00 0.00 32.46 29.68 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 -0.93 -2.10 3.75 -0.13 0.00 -1.21 -4.83 105.19 99.74 2vak n GLY 27 Ca 0.28 -1.48 -0.41 0.00 0.00 0.00 0.00 46.02 44.41 2vak n GLY 27 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vak s LEU 28 N 0.00 4.41 -1.08 0.99 2.96 -1.26 -4.33 118.68 120.37 2vak s LEU 28 Ca 0.00 2.53 -0.04 0.00 -0.22 0.00 0.00 54.13 56.40 2vak s LEU 28 Cb 0.00 -3.62 0.14 0.00 0.50 0.00 0.00 46.19 43.20 2vak s LEU 28 CO 0.00 -0.57 2.40 0.00 -1.32 0.00 0.00 176.35 176.86 2vak n ALA 29 N 2.15 6.65 -3.49 5.97 0.00 -1.26 -4.83 120.51 125.69 2vak n ALA 29 Ca 0.05 -3.91 -0.09 0.00 0.00 0.00 0.00 53.44 49.49 2vak n ALA 29 Cb 0.42 -2.54 -0.03 0.00 0.00 0.00 0.00 19.45 17.30 2vak n ALA 29 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2vak n THR 30 N 1.27 0.00 -3.82 0.00 5.66 -1.24 -1.23 114.28 114.92 2vak n THR 30 Ca 0.58 -0.89 -0.06 0.00 -3.05 0.00 0.00 64.05 60.62 2vak n THR 30 Cb 0.32 0.44 -0.00 0.00 -1.55 0.00 0.00 70.33 69.53 2vak n THR 30 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2vak s ASN 31 N -1.86 -0.13 0.26 1.09 2.20 -1.26 -4.56 114.94 110.69 2vak s ASN 31 Ca 0.14 -0.71 -0.03 0.00 -0.94 0.00 0.00 52.86 51.32 2vak s ASN 31 Cb 0.01 0.66 0.41 0.00 -2.00 0.00 0.00 41.25 40.33 2vak s ASN 31 CO 0.10 -1.27 1.86 -0.09 -2.94 0.00 0.00 177.10 174.76 2vak h ARG 32 N 2.00 1.04 0.18 3.55 2.43 -1.95 -0.54 114.38 121.09 2vak h ARG 32 Ca -0.25 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.85 2vak h ARG 32 Cb 1.24 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 2vak h ARG 32 CO 0.30 0.69 -0.09 1.15 -1.51 0.00 0.00 179.97 180.51 2vak h THR 33 N 1.07 0.84 -0.69 0.20 2.02 -1.96 -1.64 112.91 112.74 2vak h THR 33 Ca 0.43 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.54 2vak h THR 33 Cb 0.23 0.88 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 2vak h THR 33 CO -0.19 0.02 0.43 -0.61 0.37 0.00 0.00 175.52 175.53 2vak h GLN 34 N -0.28 0.93 -0.13 6.66 4.15 -1.80 -2.77 115.11 121.87 2vak h GLN 34 Ca -0.03 -0.08 -0.11 0.00 0.77 0.00 0.00 58.65 59.21 2vak h GLN 34 Cb 0.21 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.69 2vak h GLN 34 CO 0.04 0.64 -0.42 -0.07 -1.93 0.00 0.00 178.83 177.10 2vak h LEU 35 N 0.94 0.32 -1.05 -2.39 3.38 -0.95 -2.60 115.31 112.96 2vak h LEU 35 Ca 0.25 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.99 2vak h LEU 35 Cb -0.05 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2vak h LEU 35 CO -0.05 0.71 -0.31 0.28 0.09 0.00 0.00 178.44 179.16 2vak h SER 36 N 0.25 0.29 0.34 -0.43 0.02 -1.15 -2.49 113.55 110.39 2vak h SER 36 Ca 0.02 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2vak h SER 36 Cb 0.85 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2vak h SER 36 CO 0.07 0.60 0.00 0.77 -1.14 0.00 0.00 176.83 177.13 2vak h SER 37 N 0.26 0.00 0.41 3.07 4.64 -1.18 -2.76 113.55 117.99 2vak h SER 37 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2vak h SER 37 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2vak h SER 37 CO 0.05 0.00 -0.40 0.18 -0.87 0.00 0.00 176.83 175.79 2vak n LEU 38 N -2.40 0.68 -4.85 5.97 4.77 -0.94 -4.94 117.00 115.29 2vak n LEU 38 Ca -0.00 -0.09 -0.34 0.00 -0.03 0.00 0.00 56.01 55.55 2vak n LEU 38 Cb 0.13 -0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 40.96 2vak n LEU 38 CO 0.16 0.15 0.33 -0.76 -1.33 0.00 0.00 177.39 175.93 2vak s LEU 39 N -2.81 4.20 1.08 2.23 1.43 -1.04 -4.81 118.68 118.95 2vak s LEU 39 Ca 0.16 1.17 -0.16 0.00 -1.03 0.00 0.00 54.13 54.27 2vak s LEU 39 Cb 0.18 -3.72 0.23 0.00 0.03 0.00 0.00 46.19 42.91 2vak s LEU 39 CO 0.63 -0.06 1.12 -0.94 0.23 0.00 0.00 176.35 177.33 2vak s SER 40 N -2.07 1.97 0.41 2.29 1.04 -0.27 -4.82 113.70 112.25 2vak s SER 40 Ca 0.47 0.83 0.11 0.00 0.48 0.00 0.00 55.95 57.84 2vak s SER 40 Cb -0.13 -1.25 0.92 0.00 0.10 0.00 0.00 66.02 65.66 2vak s SER 40 CO 0.19 -3.50 1.97 0.77 0.98 0.00 0.00 173.24 173.65 2vak h SER 41 N -2.15 0.48 -0.38 7.02 4.64 -1.97 0.67 113.55 121.86 2vak h SER 41 Ca -0.49 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2vak h SER 41 Cb 1.31 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2vak h SER 41 CO 0.46 0.29 0.00 -1.54 -0.87 0.00 0.00 176.83 175.18 2vak n SER 42 N -4.48 4.06 -0.00 4.97 3.41 -1.26 -4.90 113.62 115.41 2vak n SER 42 Ca 0.10 -2.59 -0.00 0.00 -0.26 0.00 0.00 58.87 56.12 2vak n SER 42 Cb 0.33 -0.61 -0.00 0.00 -0.26 0.00 0.00 64.21 63.66 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 0.42 -3.34 -4.69 4.04 3.02 0.23 -4.85 115.26 110.08 2vak n ASN 43 Ca 0.18 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.31 2vak n ASN 43 Cb 0.86 -0.85 -0.03 0.00 -0.61 0.00 0.00 39.78 39.15 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 -2.02 7.10 0.00 6.41 0.15 -1.26 -1.34 113.70 122.74 2vak s SER 44 Ca 0.00 1.82 0.29 0.00 0.70 0.00 0.00 55.95 58.76 2vak s SER 44 Cb 0.00 -2.56 1.28 0.00 -1.71 0.00 0.00 66.02 63.03 2vak s SER 44 CO 0.00 -0.53 1.89 -0.81 1.20 0.00 0.00 173.24 174.99 2vak n PRO 45 N 4.85 0.72 -0.01 5.44 -0.04 -1.26 -1.12 135.00 143.59 2vak n PRO 45 Ca 0.10 -0.23 0.11 0.00 -0.04 0.00 0.00 63.50 63.44 2vak n PRO 45 Cb 0.47 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.28 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 -0.94 0.00 -1.82 0.54 7.02 -1.26 -5.00 117.44 115.98 2vak n TRP 46 Ca 0.15 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.63 2vak n TRP 46 Cb 0.27 -0.33 0.00 0.00 -2.42 0.00 0.00 31.31 28.83 2vak n TRP 46 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 2vak n GLN 47 N -2.00 1.28 -4.19 -0.99 6.02 -1.26 -5.05 117.38 111.20 2vak n GLN 47 Ca -0.01 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.65 2vak n GLN 47 Cb 0.48 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.67 2vak n GLN 47 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 2vak s ILE 61 N 0.65 4.41 -0.51 5.09 -4.36 -1.26 -5.02 121.20 120.19 2vak s ILE 61 Ca 0.00 -0.54 -0.07 0.00 -0.26 0.00 0.00 60.65 59.77 2vak s ILE 61 Cb 0.00 -3.00 -0.21 0.00 1.25 0.00 0.00 42.46 40.50 2vak s ILE 61 CO 0.00 0.34 3.40 0.55 0.24 0.00 0.00 174.94 179.48 2vak n VAL 62 N 1.23 3.39 -1.33 8.37 3.14 -1.26 -4.96 118.33 126.92 2vak n VAL 62 Ca -0.13 -1.83 -0.32 0.00 -2.96 0.00 0.00 64.34 59.10 2vak n VAL 62 Cb 0.53 -2.19 0.09 0.00 -1.06 0.00 0.00 33.84 31.21 2vak n VAL 62 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2vak s SER 63 N 2.07 4.42 -0.06 6.55 0.01 -1.26 -5.07 113.70 120.35 2vak s SER 63 Ca 0.67 1.97 -0.15 0.00 1.31 0.00 0.00 55.95 59.74 2vak s SER 63 Cb 0.27 -2.54 0.03 0.00 0.21 0.00 0.00 66.02 63.99 2vak s SER 63 CO -0.02 -2.10 0.36 0.28 0.41 0.00 0.00 173.24 172.17 2vak s THR 64 N -2.64 0.04 0.30 1.44 -1.32 -0.95 -5.00 115.64 107.50 2vak s THR 64 Ca 0.65 -0.29 0.06 0.00 -1.21 0.00 0.00 61.69 60.89 2vak s THR 64 Cb -0.20 -0.62 0.29 0.00 -1.51 0.00 0.00 72.50 70.47 2vak s THR 64 CO 0.52 -0.16 1.75 -0.65 -2.21 0.00 0.00 174.62 173.87 2vak h PRO 65 N 4.33 0.65 0.00 7.08 0.11 -1.98 -0.56 132.00 141.64 2vak h PRO 65 Ca -0.28 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 2vak h PRO 65 Cb 1.18 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 2vak h PRO 65 CO 0.36 0.43 -0.11 0.93 -0.21 0.00 0.00 178.00 179.39 2vak h GLU 66 N 0.67 0.00 -2.01 1.05 3.07 -1.98 -3.35 114.58 112.03 2vak h GLU 66 Ca 0.58 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.88 2vak h GLU 66 Cb 0.97 0.00 -0.38 0.00 -0.84 0.00 0.00 28.75 28.49 2vak h GLU 66 CO -0.42 0.11 -1.08 0.00 -1.40 0.00 0.00 179.01 176.22 2vak n ALA 67 N -2.13 2.41 0.26 3.43 0.00 -0.85 -4.65 120.51 118.98 2vak n ALA 67 Ca 0.03 -3.32 0.15 0.00 0.00 0.00 0.00 53.44 50.30 2vak n ALA 67 Cb 0.53 -0.81 0.62 0.00 0.00 0.00 0.00 19.45 19.79 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 4.21 0.00 -5.82 0.00 0.13 -1.26 -2.52 132.00 126.74 2vak h PRO 68 Ca 0.09 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.73 2vak h PRO 68 Cb 0.89 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 31.81 2vak h PRO 68 CO 0.45 0.05 -0.80 0.71 -0.23 0.00 0.00 178.00 178.18 2vak s TYR 69 N -3.67 1.56 0.30 1.56 1.51 -1.26 -4.63 117.35 112.73 2vak s TYR 69 Ca 0.01 -0.45 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 2vak s TYR 69 Cb 0.09 -0.86 0.80 0.00 -0.11 0.00 0.00 41.96 41.89 2vak s TYR 69 CO 0.57 0.16 1.64 -1.35 -1.11 0.00 0.00 175.55 175.46 2vak h PRO 70 N 4.07 0.21 0.00 -1.71 0.10 -1.86 -0.39 132.00 132.42 2vak h PRO 70 Ca -0.44 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.65 2vak h PRO 70 Cb 1.19 -0.05 0.00 0.00 0.10 0.00 0.00 31.00 32.24 2vak h PRO 70 CO 0.41 0.14 0.00 0.41 0.10 0.00 0.00 178.00 179.06 2vak n GLY 71 N -1.36 -0.95 0.23 -0.55 0.00 -0.41 -3.07 105.19 99.08 2vak n GLY 71 Ca 0.24 0.09 -0.08 0.00 0.00 0.00 0.00 46.02 46.28 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 0.70 -0.50 1.61 0.02 -1.26 -2.97 113.55 111.15 2vak h SER 72 Ca 0.00 -0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.69 2vak h SER 72 Cb 0.15 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 2vak h SER 72 CO 0.00 0.65 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.14 2vak h LEU 73 N 0.70 0.99 -0.43 5.07 3.38 -1.69 -0.11 115.31 123.23 2vak h LEU 73 Ca 0.18 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.85 2vak h LEU 73 Cb 0.15 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 2vak h LEU 73 CO -0.02 1.11 0.21 0.24 0.09 0.00 0.00 178.44 180.07 2vak h MET 74 N 0.87 0.41 -0.28 1.13 2.86 -1.71 0.91 114.93 119.13 2vak h MET 74 Ca 0.13 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 2vak h MET 74 Cb 0.68 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2vak h MET 74 CO 0.05 0.27 0.02 -0.92 1.06 0.00 0.00 176.91 177.39 2vak h TYR 75 N 0.42 0.52 -0.25 -0.22 3.20 -1.33 -1.27 116.97 118.04 2vak h TYR 75 Ca 0.18 -0.08 -0.06 0.00 3.14 0.00 0.00 58.73 61.91 2vak h TYR 75 Cb 0.09 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 2vak h TYR 75 CO -0.10 0.61 -0.08 1.96 -1.64 0.00 0.00 178.16 178.90 2vak h GLN 76 N 0.28 0.50 -0.96 1.82 4.20 -0.83 -2.18 115.11 117.94 2vak h GLN 76 Ca 0.08 -0.20 0.09 0.00 0.06 0.00 0.00 58.65 58.68 2vak h GLN 76 Cb 0.38 -0.02 -0.07 0.00 0.30 0.00 0.00 27.48 28.07 2vak h GLN 76 CO 0.01 0.73 0.60 0.93 -0.67 0.00 0.00 178.83 180.44 2vak h GLU 77 N 0.23 1.00 -0.99 1.46 5.08 -0.83 -0.45 114.58 120.07 2vak h GLU 77 Ca 0.06 -0.06 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 2vak h GLU 77 Cb 0.56 -0.22 -0.09 0.00 0.50 0.00 0.00 28.75 29.50 2vak h GLU 77 CO 0.03 0.66 0.62 0.66 -1.00 0.00 0.00 179.01 179.98 2vak h SER 78 N 1.02 0.86 0.02 1.42 4.64 -0.63 -1.43 113.55 119.45 2vak h SER 78 Ca 0.45 0.06 -0.18 0.00 -0.47 0.00 0.00 61.79 61.65 2vak h SER 78 Cb 0.32 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2vak h SER 78 CO -0.22 0.42 -0.63 0.24 -0.87 0.00 0.00 176.83 175.77 2vak h MET 79 N 0.90 0.59 -0.47 4.77 2.86 -0.55 -1.51 114.93 121.52 2vak h MET 79 Ca 0.51 -0.41 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 2vak h MET 79 Cb 0.62 0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.30 2vak h MET 79 CO -0.28 1.03 0.24 1.25 1.06 0.00 0.00 176.91 180.21 2vak h LEU 80 N 0.43 0.35 -0.54 1.22 5.85 -0.71 -1.53 115.31 120.40 2vak h LEU 80 Ca -0.01 0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.60 2vak h LEU 80 Cb 1.20 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 2vak h LEU 80 CO 0.12 0.25 -0.25 0.45 -0.34 0.00 0.00 178.44 178.67 2vak h HIS 81 N 0.48 1.06 -0.32 1.25 3.86 -1.16 -1.90 115.15 118.41 2vak h HIS 81 Ca 0.20 -0.26 -0.09 0.00 -1.16 0.00 0.00 60.37 59.06 2vak h HIS 81 Cb 0.10 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.31 2vak h HIS 81 CO -0.10 1.06 -0.17 0.77 0.86 0.00 0.00 177.93 180.35 2vak h SER 82 N 0.79 0.57 -0.04 2.45 0.02 -1.10 -2.22 113.55 114.02 2vak h SER 82 Ca 0.10 -0.17 -0.23 0.00 -0.84 0.00 0.00 61.79 60.64 2vak h SER 82 Cb 0.81 -0.15 0.01 0.00 0.14 0.00 0.00 62.40 63.21 2vak h SER 82 CO 0.07 0.76 -0.86 0.00 -1.14 0.00 0.00 176.83 175.66 2vak h ALA 83 N 1.30 0.29 0.00 3.77 0.00 -1.19 -3.40 119.26 120.02 2vak h ALA 83 Ca 0.09 -0.64 -0.12 0.00 0.00 0.00 0.00 54.91 54.24 2vak h ALA 83 Cb 0.60 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2vak h ALA 83 CO 0.04 0.70 -1.93 0.25 0.00 0.00 0.00 179.25 178.31 2vak n THR 84 N -3.89 0.43 -0.10 0.00 -2.24 -0.72 -4.69 114.28 103.08 2vak n THR 84 Ca -0.08 -0.52 -0.16 0.00 -2.27 0.00 0.00 64.05 61.02 2vak n THR 84 Cb 0.79 -0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.79 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 -2.30 1.49 -0.25 2.28 0.31 -0.84 -4.37 118.33 114.64 2vak n VAL 85 Ca -0.12 -0.00 0.21 0.00 -0.01 0.00 0.00 64.34 64.41 2vak n VAL 85 Cb 0.68 -2.17 0.53 0.00 -0.91 0.00 0.00 33.84 31.97 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 -1.00 0.36 0.00 5.55 0.11 -1.78 -2.14 132.00 133.10 2vak h PRO 86 Ca -0.26 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.83 2vak h PRO 86 Cb 1.09 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2vak h PRO 86 CO -0.16 0.24 0.00 0.41 -0.21 0.00 0.00 178.00 178.28 2vak n GLY 87 N -1.53 -1.24 0.47 -0.55 0.00 -1.26 -3.04 105.19 98.04 2vak n GLY 87 Ca 0.20 -0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.66 0.00 0.48 1.61 3.14 -0.80 -4.61 118.33 116.49 2vak n VAL 88 Ca 0.05 -0.43 0.13 0.00 -2.96 0.00 0.00 64.34 61.12 2vak n VAL 88 Cb 0.25 1.24 0.37 0.00 -1.06 0.00 0.00 33.84 34.64 2vak n VAL 88 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2vak h LEU 89 N 2.29 0.00 -1.73 6.55 3.38 -1.62 -3.32 115.31 120.86 2vak h LEU 89 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vak h LEU 89 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2vak h LEU 89 CO 0.00 0.00 0.01 1.23 0.09 0.00 0.00 178.44 179.77 2vak h GLY 90 N 4.04 0.00 0.00 0.83 0.00 -1.81 -3.36 103.07 102.77 2vak h GLY 90 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vak h GLY 90 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 176.54 175.28 2vak n SER 91 N -2.42 0.00 0.29 0.19 2.88 -1.25 -5.00 113.62 108.32 2vak n SER 91 Ca -0.02 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.70 2vak n SER 91 Cb 0.05 0.00 0.84 0.00 -0.75 0.00 0.00 64.21 64.35 2vak n SER 91 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2vak h ARG 92 N 0.00 0.00 -0.09 -1.46 3.08 -1.90 -3.16 114.38 110.85 2vak h ARG 92 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2vak h ARG 92 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2vak h ARG 92 CO 0.00 0.03 0.00 -0.25 -1.07 0.00 0.00 179.97 178.68 2vak n ASP 93 N -3.19 1.96 0.26 7.04 8.00 -1.26 -4.60 116.55 124.76 2vak n ASP 93 Ca -0.01 -1.56 0.08 0.00 0.71 0.00 0.00 54.79 54.01 2vak n ASP 93 Cb 0.23 -0.06 0.65 0.00 -0.02 0.00 0.00 41.12 41.93 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 1.30 1.95 0.00 2.24 0.00 -1.83 -2.10 119.26 120.82 2vak h ALA 94 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2vak h ALA 94 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2vak h ALA 94 CO 0.00 0.02 0.00 0.11 0.00 0.00 0.00 179.25 179.38 2vak h TRP 95 N 0.00 0.00 0.21 0.00 5.08 -1.83 -2.26 115.95 117.15 2vak h TRP 95 Ca -0.00 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 2vak h TRP 95 Cb 0.02 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.18 2vak h TRP 95 CO 0.00 0.00 -0.10 0.00 -1.28 0.00 0.00 178.44 177.06 2vak h ARG 96 N 0.00 -0.28 -0.01 0.12 3.08 -1.72 -3.31 114.38 112.27 2vak h ARG 96 Ca 0.00 0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2vak h ARG 96 Cb 0.66 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.77 2vak h ARG 96 CO 0.00 -0.01 -0.33 0.25 -1.07 0.00 0.00 179.97 178.82 2vak n THR 97 N -5.11 0.00 -1.70 2.04 -2.24 -1.24 -5.01 114.28 101.02 2vak n THR 97 Ca -0.09 -0.34 -0.44 0.00 -2.27 0.00 0.00 64.05 60.91 2vak n THR 97 Cb 0.21 1.24 -0.03 0.00 -2.10 0.00 0.00 70.33 69.66 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 0.08 2.51 -3.82 4.78 7.35 -0.85 -4.55 117.46 122.95 2vak n PHE 98 Ca 0.08 0.25 -0.12 0.00 -0.76 0.00 0.00 57.45 56.90 2vak n PHE 98 Cb 0.40 -2.57 -0.09 0.00 0.35 0.00 0.00 39.48 37.57 2vak n PHE 98 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2vak s ASN 99 N 0.72 -0.06 -0.29 -2.13 2.20 -1.26 -4.48 114.94 109.65 2vak s ASN 99 Ca 0.72 -0.14 -0.14 0.00 -0.94 0.00 0.00 52.86 52.35 2vak s ASN 99 Cb -0.59 0.27 0.10 0.00 -2.00 0.00 0.00 41.25 39.03 2vak s ASN 99 CO 0.42 -0.45 0.68 0.54 -2.94 0.00 0.00 177.10 175.35 2vak s VAL 100 N -1.70 -0.33 -1.44 3.54 0.11 -0.55 -0.14 120.40 119.90 2vak s VAL 100 Ca -0.12 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.80 2vak s VAL 100 Cb -0.05 -1.00 0.11 0.00 -1.53 0.00 0.00 36.38 33.91 2vak s VAL 100 CO 0.01 0.00 0.63 0.49 -3.33 0.00 0.00 175.10 172.90 2vak n PHE 101 N 4.68 -1.79 -1.48 1.54 3.72 -1.26 -0.97 117.46 121.91 2vak n PHE 101 Ca -0.17 0.62 -0.07 0.00 -0.05 0.00 0.00 57.45 57.78 2vak n PHE 101 Cb 0.56 -2.89 -0.02 0.00 -0.94 0.00 0.00 39.48 36.19 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 -1.26 0.65 3.27 1.37 0.00 -1.26 -3.98 105.19 103.98 2vak n GLY 102 Ca 0.03 -0.70 -0.23 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.66 2.29 0.03 0.99 1.43 -0.14 -0.23 118.68 121.39 2vak s LEU 103 Ca 0.00 -0.67 -0.04 0.00 -1.03 0.00 0.00 54.13 52.39 2vak s LEU 103 Cb 0.00 -0.85 -0.02 0.00 0.03 0.00 0.00 46.19 45.36 2vak s LEU 103 CO 0.00 0.05 0.05 -0.44 0.23 0.00 0.00 176.35 176.24 2vak s SER 104 N -1.85 0.23 0.51 2.29 0.01 0.07 -1.48 113.70 113.49 2vak s SER 104 Ca 0.06 -0.57 -0.17 0.00 1.31 0.00 0.00 55.95 56.57 2vak s SER 104 Cb -0.10 0.19 -0.08 0.00 0.21 0.00 0.00 66.02 66.25 2vak s SER 104 CO 0.04 -0.47 0.99 0.26 0.41 0.00 0.00 173.24 174.47 2vak s TRP 105 N -2.47 3.33 -0.47 2.43 0.52 -1.26 -0.70 118.94 120.32 2vak s TRP 105 Ca -0.06 1.51 0.23 0.00 0.02 0.00 0.00 56.10 57.80 2vak s TRP 105 Cb -0.02 -2.85 0.19 0.00 -1.15 0.00 0.00 33.47 29.63 2vak s TRP 105 CO -0.04 -0.46 1.20 1.79 0.02 0.00 0.00 176.95 179.46 2vak h THR 106 N 1.07 0.00 -2.58 2.01 1.35 -1.69 -3.47 112.91 109.61 2vak h THR 106 Ca -0.47 -0.70 0.13 0.00 -0.55 0.00 0.00 66.41 64.82 2vak h THR 106 Cb 1.19 1.24 -0.06 0.00 -1.73 0.00 0.00 68.15 68.80 2vak h THR 106 CO 0.61 0.00 0.42 1.51 -0.25 0.00 0.00 175.52 177.81 2vak s ASP 107 N -4.71 -0.15 0.42 5.36 1.47 -1.26 -5.01 116.67 112.79 2vak s ASP 107 Ca 0.03 -0.56 0.14 0.00 1.18 0.00 0.00 52.55 53.34 2vak s ASP 107 Cb 0.12 0.58 0.92 0.00 -0.34 0.00 0.00 42.92 44.19 2vak s ASP 107 CO 0.75 -1.09 1.94 -0.08 0.68 0.00 0.00 175.17 177.37 2vak h GLU 108 N 2.00 0.00 0.00 2.11 4.81 -1.94 -1.98 114.58 119.58 2vak h GLU 108 Ca -0.24 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 2vak h GLU 108 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 2vak h GLU 108 CO 0.28 0.25 0.00 0.41 -0.73 0.00 0.00 179.01 179.22 2vak n GLY 109 N -0.80 -0.72 3.76 1.92 0.00 -1.26 -4.91 105.19 103.18 2vak n GLY 109 Ca -0.02 -0.12 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.08 -2.90 0.12 0.99 4.77 -0.74 -4.90 117.00 113.26 2vak n LEU 110 Ca 0.14 -0.89 0.10 0.00 -0.03 0.00 0.00 56.01 55.32 2vak n LEU 110 Cb 0.09 -2.52 0.02 0.00 -2.33 0.00 0.00 43.42 38.68 2vak n LEU 110 CO 0.12 0.41 0.14 0.77 -1.33 0.00 0.00 177.39 177.51 2vak h SER 111 N -1.84 0.00 -5.01 -1.43 4.64 -1.91 -3.47 113.55 104.53 2vak h SER 111 Ca -0.62 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.68 2vak h SER 111 Cb 1.36 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.33 2vak h SER 111 CO 0.57 0.09 0.19 -0.83 -0.87 0.00 0.00 176.83 175.98 2vak s GLY 112 N -4.39 -0.58 -0.05 -0.77 0.00 -1.26 -4.28 107.32 95.97 2vak s GLY 112 Ca 0.01 0.44 0.06 0.00 0.00 0.00 0.00 44.72 45.22 2vak s GLY 112 CO 0.77 0.12 -0.24 1.08 0.00 0.00 0.00 173.10 174.83 2vak s LEU 113 N -2.76 2.04 0.19 0.66 1.43 -0.45 -1.76 118.68 118.04 2vak s LEU 113 Ca 0.01 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.64 2vak s LEU 113 Cb -0.01 -1.30 -0.05 0.00 0.03 0.00 0.00 46.19 44.86 2vak s LEU 113 CO -0.13 0.23 0.03 0.68 0.23 0.00 0.00 176.35 177.40 2vak s VAL 114 N -0.15 0.61 0.22 -1.59 -7.23 0.12 -4.81 120.40 107.58 2vak s VAL 114 Ca -0.03 -1.98 -0.31 0.00 -1.81 0.00 0.00 61.98 57.85 2vak s VAL 114 Cb -0.13 -2.25 -0.15 0.00 0.56 0.00 0.00 36.38 34.41 2vak s VAL 114 CO 0.03 -0.34 1.16 0.00 -0.31 0.00 0.00 175.10 175.64 2vak n ALA 115 N -0.29 -0.26 -1.79 1.32 0.00 -1.26 -0.75 120.51 117.48 2vak n ALA 115 Ca -0.05 0.43 -0.35 0.00 0.00 0.00 0.00 53.44 53.48 2vak n ALA 115 Cb 0.64 -2.07 -0.05 0.00 0.00 0.00 0.00 19.45 17.98 2vak n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vak s ALA 116 N -0.45 3.00 0.36 0.00 0.00 0.68 -4.49 121.76 120.87 2vak s ALA 116 Ca 0.68 0.60 -0.28 0.00 0.00 0.00 0.00 51.96 52.95 2vak s ALA 116 Cb -0.77 -3.24 -0.12 0.00 0.00 0.00 0.00 23.12 19.00 2vak s ALA 116 CO 0.54 -0.16 1.40 0.94 0.00 0.00 0.00 175.76 178.48 2vak n GLN 117 N -0.48 2.43 -3.99 0.00 7.27 -1.26 -4.86 117.38 116.49 2vak n GLN 117 Ca 0.07 0.85 -0.19 0.00 0.07 0.00 0.00 57.00 57.81 2vak n GLN 117 Cb 0.52 -2.52 -0.16 0.00 2.41 0.00 0.00 30.24 30.48 2vak n GLN 117 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 2vak s ASP 118 N -0.21 0.72 0.42 1.69 -1.08 -1.26 -2.77 116.67 114.18 2vak s ASP 118 Ca 0.54 -0.06 -0.25 0.00 -0.52 0.00 0.00 52.55 52.26 2vak s ASP 118 Cb -0.52 -0.32 -0.08 0.00 -1.46 0.00 0.00 42.92 40.55 2vak s ASP 118 CO 0.63 -0.10 1.18 -2.16 0.52 0.00 0.00 175.17 175.25 2vak s PRO 119 N 1.09 3.96 0.08 4.34 0.04 -1.26 -5.09 135.00 138.17 2vak s PRO 119 Ca -0.09 1.86 -0.31 0.00 0.04 0.00 0.00 61.00 62.50 2vak s PRO 119 Cb -0.14 -2.61 -0.08 0.00 0.04 0.00 0.00 34.50 31.72 2vak s PRO 119 CO -0.01 -0.40 1.48 -1.25 0.04 0.00 0.00 177.00 176.85 2vak s PRO 120 N -2.40 4.27 0.58 0.56 0.04 -1.11 -4.92 135.00 132.00 2vak s PRO 120 Ca 0.59 2.15 0.28 0.00 0.04 0.00 0.00 61.00 64.06 2vak s PRO 120 Cb -0.31 -3.39 1.55 0.00 0.04 0.00 0.00 34.50 32.39 2vak s PRO 120 CO 0.39 -0.57 2.03 -1.35 0.04 0.00 0.00 177.00 177.54 2vak h PRO 121 N 7.40 0.00 -6.60 0.56 0.11 -1.92 -3.42 132.00 128.14 2vak h PRO 121 Ca -0.41 0.00 -0.70 0.00 0.11 0.00 0.00 66.00 65.00 2vak h PRO 121 Cb 1.20 0.00 -0.27 0.00 0.11 0.00 0.00 31.00 32.04 2vak h PRO 121 CO 0.90 0.00 -0.86 0.00 -0.21 0.00 0.00 178.00 177.83 2vak s ALA 122 N -4.71 2.33 0.23 -0.75 0.00 -1.26 -5.11 121.76 112.48 2vak s ALA 122 Ca -0.05 -1.15 -0.30 0.00 0.00 0.00 0.00 51.96 50.47 2vak s ALA 122 Cb 0.16 -0.62 -0.15 0.00 0.00 0.00 0.00 23.12 22.50 2vak s ALA 122 CO 0.58 0.54 0.94 0.00 0.00 0.00 0.00 175.76 177.83 2vak n ALA 123 N 2.10 -1.11 -1.77 0.00 0.00 -1.26 -4.84 120.51 113.63 2vak n ALA 123 Ca -0.16 0.43 -0.41 0.00 0.00 0.00 0.00 53.44 53.30 2vak n ALA 123 Cb 0.52 -1.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.05 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 -1.05 4.05 0.32 0.00 0.02 -1.26 -4.71 135.00 132.36 2vak s PRO 124 Ca 0.65 2.48 -0.29 0.00 0.02 0.00 0.00 61.00 63.86 2vak s PRO 124 Cb -0.81 -2.91 -0.12 0.00 0.02 0.00 0.00 34.50 30.67 2vak s PRO 124 CO 0.57 -0.54 1.33 0.98 -0.33 0.00 0.00 177.00 179.00 2vak n TYR 125 N 0.36 2.31 -3.62 6.54 9.36 0.80 -5.00 117.16 127.92 2vak n TYR 125 Ca 0.02 0.52 -0.40 0.00 3.32 0.00 0.00 57.90 61.35 2vak n TYR 125 Cb 0.40 -2.44 -0.11 0.00 -0.63 0.00 0.00 39.34 36.57 2vak n TYR 125 CO 0.00 0.00 0.00 -0.65 0.22 0.00 0.00 176.86 176.43 2vak s GLN 126 N -1.59 2.70 0.57 2.98 -1.52 -1.26 -4.79 119.66 116.75 2vak s GLN 126 Ca 0.58 -1.26 -0.19 0.00 -1.95 0.00 0.00 55.36 52.53 2vak s GLN 126 Cb -0.57 -3.72 -0.06 0.00 -0.22 0.00 0.00 33.01 28.43 2vak s GLN 126 CO 0.60 -0.81 0.89 -2.30 -0.25 0.00 0.00 175.29 173.41 2vak n PRO 127 N 4.94 0.89 -4.25 2.91 -0.02 -1.26 -5.03 135.00 133.19 2vak n PRO 127 Ca -0.11 0.34 -0.35 0.00 -2.02 0.00 0.00 63.50 61.36 2vak n PRO 127 Cb 0.44 -2.06 -0.09 0.00 -0.02 0.00 0.00 33.50 31.78 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 -1.52 3.40 -0.00 3.55 0.00 -1.26 -4.90 121.76 121.03 2vak s ALA 128 Ca 0.72 -0.77 -0.30 0.00 0.00 0.00 0.00 51.96 51.62 2vak s ALA 128 Cb -0.44 -1.62 -0.03 0.00 0.00 0.00 0.00 23.12 21.03 2vak s ALA 128 CO 0.50 0.55 0.96 0.45 0.00 0.00 0.00 175.76 178.22 2vak s SER 129 N -0.76 7.35 -1.41 0.00 0.15 -1.26 -4.31 113.70 113.46 2vak s SER 129 Ca 0.12 1.63 -0.09 0.00 0.70 0.00 0.00 55.95 58.31 2vak s SER 129 Cb -0.12 -2.56 0.04 0.00 -1.71 0.00 0.00 66.02 61.67 2vak s SER 129 CO 0.02 -0.25 1.05 0.00 1.20 0.00 0.00 173.24 175.27 2vak n ALA 130 N 3.88 -1.42 -2.54 5.45 0.00 -1.06 -4.89 120.51 119.92 2vak n ALA 130 Ca 0.06 0.23 -0.30 0.00 0.00 0.00 0.00 53.44 53.43 2vak n ALA 130 Cb 0.51 -4.55 -0.11 0.00 0.00 0.00 0.00 19.45 15.31 2vak n ALA 130 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2vak s GLN 131 N -6.33 2.03 0.13 0.00 -2.07 -1.26 -4.84 119.66 107.31 2vak s GLN 131 Ca 0.52 -1.06 -0.17 0.00 -1.82 0.00 0.00 55.36 52.83 2vak s GLN 131 Cb -0.24 -2.24 -0.07 0.00 -1.09 0.00 0.00 33.01 29.36 2vak s GLN 131 CO 0.78 0.50 0.58 -1.58 -1.32 0.00 0.00 175.29 174.25 2vak s TRP 132 N -1.17 3.69 0.06 9.60 0.52 -1.26 -1.23 118.94 129.16 2vak s TRP 132 Ca 0.20 1.19 0.06 0.00 0.02 0.00 0.00 56.10 57.56 2vak s TRP 132 Cb -0.11 -2.45 -0.03 0.00 -1.15 0.00 0.00 33.47 29.73 2vak s TRP 132 CO 0.12 0.48 -0.16 -1.12 0.02 0.00 0.00 176.95 176.30 2vak s SER 133 N -1.46 1.86 -0.33 2.95 0.01 0.09 -4.97 113.70 111.86 2vak s SER 133 Ca 0.35 -0.55 -0.10 0.00 1.31 0.00 0.00 55.95 56.95 2vak s SER 133 Cb -0.17 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.96 2vak s SER 133 CO 0.19 0.01 0.18 -0.62 0.41 0.00 0.00 173.24 173.41 2vak s ASP 134 N -1.46 5.65 0.27 2.44 2.15 -1.26 -0.10 116.67 124.36 2vak s ASP 134 Ca 0.01 -0.64 0.26 0.00 0.43 0.00 0.00 52.55 52.61 2vak s ASP 134 Cb -0.09 -2.02 0.83 0.00 -0.30 0.00 0.00 42.92 41.34 2vak s ASP 134 CO 0.02 -0.25 1.75 -0.07 -0.17 0.00 0.00 175.17 176.46 2vak h LEU 135 N 8.39 0.00 -0.22 -1.34 3.38 -1.10 -2.77 115.31 121.65 2vak h LEU 135 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 2vak h LEU 135 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2vak h LEU 135 CO 0.63 0.00 0.00 0.18 0.09 0.00 0.00 178.44 179.34 2vak n LEU 136 N -2.41 0.42 -0.08 1.67 4.77 -1.26 -2.50 117.00 117.61 2vak n LEU 136 Ca 0.04 0.57 0.26 0.00 -0.03 0.00 0.00 56.01 56.85 2vak n LEU 136 Cb 0.38 -0.48 0.71 0.00 -2.33 0.00 0.00 43.42 41.71 2vak n LEU 136 CO 0.28 -0.28 1.23 0.78 -1.33 0.00 0.00 177.39 178.07 2vak h ASN 137 N 0.00 0.00 -2.99 -1.43 2.35 -1.82 -3.38 115.58 108.31 2vak h ASN 137 Ca 0.00 0.00 -0.55 0.00 -0.55 0.00 0.00 56.30 55.20 2vak h ASN 137 Cb 0.46 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.77 2vak h ASN 137 CO 0.00 0.00 1.07 -0.47 -1.65 0.00 0.00 177.43 176.38 2vak s TYR 138 N -4.79 2.36 0.28 1.19 5.04 -1.04 -4.78 117.35 115.61 2vak s TYR 138 Ca -0.05 0.52 0.01 0.00 -2.44 0.00 0.00 57.07 55.12 2vak s TYR 138 Cb 0.19 -4.39 0.66 0.00 0.35 0.00 0.00 41.96 38.76 2vak s TYR 138 CO 0.66 -1.90 1.69 -1.35 -1.34 0.00 0.00 175.55 173.31 2vak h PRO 139 N 10.76 0.33 -0.65 4.97 0.11 -1.86 0.24 132.00 145.90 2vak h PRO 139 Ca -0.27 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.86 2vak h PRO 139 Cb 1.09 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 2vak h PRO 139 CO 1.16 0.22 0.43 -0.09 -0.21 0.00 0.00 178.00 179.51 2vak h ARG 140 N 0.34 0.73 0.22 1.05 2.43 -1.93 -0.52 114.38 116.70 2vak h ARG 140 Ca 0.52 -0.04 -0.32 0.00 -0.81 0.00 0.00 59.98 59.32 2vak h ARG 140 Cb 0.98 -0.16 0.03 0.00 -0.42 0.00 0.00 29.97 30.39 2vak h ARG 140 CO -0.54 0.48 -1.45 -1.49 -1.51 0.00 0.00 179.97 175.46 2vak h TRP 141 N 0.75 0.86 -0.96 2.20 6.55 -0.82 0.85 115.95 125.37 2vak h TRP 141 Ca 0.26 -0.62 0.08 0.00 0.95 0.00 0.00 58.89 59.56 2vak h TRP 141 Cb 0.11 -0.03 -0.07 0.00 -0.86 0.00 0.00 29.16 28.31 2vak h TRP 141 CO -0.00 1.50 0.62 0.00 -1.05 0.00 0.00 178.44 179.51 2vak h ALA 142 N 0.26 1.50 0.00 1.49 0.00 -1.01 -2.25 119.26 119.24 2vak h ALA 142 Ca -0.23 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.48 2vak h ALA 142 Cb 2.12 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 19.62 2vak h ALA 142 CO 0.25 0.33 -1.19 -0.91 0.00 0.00 0.00 179.25 177.73 2vak h ASN 143 N 1.05 0.00 -2.59 0.00 2.35 -1.10 -3.39 115.58 111.90 2vak h ASN 143 Ca 0.43 0.00 -0.60 0.00 -0.55 0.00 0.00 56.30 55.58 2vak h ASN 143 Cb 0.29 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 38.26 2vak h ASN 143 CO -0.19 0.71 -0.82 0.54 -1.65 0.00 0.00 177.43 176.02 2vak n ARG 144 N -3.07 0.95 -0.29 0.81 1.74 0.29 -4.97 116.66 112.11 2vak n ARG 144 Ca -0.07 -3.74 0.19 0.00 -0.77 0.00 0.00 57.85 53.47 2vak n ARG 144 Cb 0.87 -1.90 0.48 0.00 -1.02 0.00 0.00 32.46 30.90 2vak n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2vak h ARG 145 N 5.35 0.45 0.00 5.56 -0.00 -1.62 -1.66 114.38 122.46 2vak h ARG 145 Ca 0.21 -0.03 -0.01 0.00 -0.50 0.00 0.00 59.98 59.65 2vak h ARG 145 Cb 0.84 -0.10 -0.00 0.00 0.00 0.00 0.00 29.97 30.70 2vak h ARG 145 CO 0.53 0.30 -0.07 -0.09 0.00 0.00 0.00 179.97 180.63 2vak h ARG 146 N 0.46 0.00 0.00 0.04 2.43 -1.93 0.21 114.38 115.58 2vak h ARG 146 Ca 0.53 0.00 -0.10 0.00 -0.81 0.00 0.00 59.98 59.61 2vak h ARG 146 Cb 1.25 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.79 2vak h ARG 146 CO -0.25 0.07 -0.46 0.93 -1.51 0.00 0.00 179.97 178.76 2vak h GLU 147 N 0.00 0.00 0.20 0.20 5.08 -1.65 -2.04 114.58 116.38 2vak h GLU 147 Ca -0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.07 2vak h GLU 147 Cb 0.13 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.41 2vak h GLU 147 CO 0.01 0.46 -1.34 1.25 -1.00 0.00 0.00 179.01 178.39 2vak h LEU 148 N 0.00 0.67 -1.47 1.33 5.85 -1.19 -3.32 115.31 117.19 2vak h LEU 148 Ca -0.00 -0.93 -0.04 0.00 0.84 0.00 0.00 57.88 57.75 2vak h LEU 148 Cb 1.06 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 2vak h LEU 148 CO 0.06 1.63 -0.03 1.56 -0.34 0.00 0.00 178.44 181.32 2vak h GLN 149 N -0.04 0.31 -0.81 1.25 4.20 -0.64 0.41 115.11 119.78 2vak h GLN 149 Ca -0.25 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.37 2vak h GLN 149 Cb 1.98 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 29.68 2vak h GLN 149 CO 0.21 0.36 0.33 0.77 -0.67 0.00 0.00 178.83 179.83 2vak h SER 150 N 0.30 1.11 0.79 1.46 0.02 -1.51 -3.30 113.55 112.42 2vak h SER 150 Ca 0.07 -0.17 -0.16 0.00 -0.84 0.00 0.00 61.79 60.69 2vak h SER 150 Cb 0.26 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 2vak h SER 150 CO 0.01 0.98 -1.31 0.11 -1.14 0.00 0.00 176.83 175.48 2vak h LYS 151 N 1.18 0.00 -0.90 3.45 1.57 -1.49 -3.42 116.57 116.97 2vak h LYS 151 Ca 0.27 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 59.15 2vak h LYS 151 Cb 0.20 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.44 2vak h LYS 151 CO -0.02 0.31 0.54 -0.92 -0.57 0.00 0.00 179.45 178.79 2vak h TYR 152 N 0.00 0.98 -1.02 -1.35 3.20 -0.27 -2.40 116.97 116.11 2vak h TYR 152 Ca -0.14 0.03 0.26 0.00 3.14 0.00 0.00 58.73 62.02 2vak h TYR 152 Cb 1.56 -0.31 -0.07 0.00 1.54 0.00 0.00 36.73 39.45 2vak h TYR 152 CO 0.00 0.41 0.68 -1.35 -1.64 0.00 0.00 178.16 176.26 2vak h PRO 153 N 0.89 0.28 0.20 1.82 0.11 -1.81 0.16 132.00 133.66 2vak h PRO 153 Ca 0.43 -0.02 -0.33 0.00 0.11 0.00 0.00 66.00 66.19 2vak h PRO 153 Cb 0.38 -0.06 0.02 0.00 0.11 0.00 0.00 31.00 31.45 2vak h PRO 153 CO -0.25 0.19 -1.57 1.25 -0.21 0.00 0.00 178.00 177.41 2vak h LEU 154 N 0.29 0.67 -0.60 2.35 5.85 -1.76 -1.54 115.31 120.56 2vak h LEU 154 Ca 0.55 -0.83 -0.14 0.00 0.84 0.00 0.00 57.88 58.29 2vak h LEU 154 Cb 1.58 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 2vak h LEU 154 CO -0.19 1.68 -0.41 -0.07 -0.34 0.00 0.00 178.44 179.10 2vak h LEU 155 N 0.12 0.69 -0.14 2.25 3.38 -1.33 -2.68 115.31 117.60 2vak h LEU 155 Ca -0.28 -0.31 -0.23 0.00 0.09 0.00 0.00 57.88 57.15 2vak h LEU 155 Cb 2.11 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 42.68 2vak h LEU 155 CO 0.22 1.01 -0.84 0.25 0.09 0.00 0.00 178.44 179.17 2vak h LEU 156 N 0.53 0.91 -0.59 1.67 5.85 -0.72 -2.35 115.31 120.60 2vak h LEU 156 Ca 0.04 -0.63 0.12 0.00 0.84 0.00 0.00 57.88 58.25 2vak h LEU 156 Cb 0.93 -0.27 -0.11 0.00 0.37 0.00 0.00 40.66 41.58 2vak h LEU 156 CO 0.08 1.42 -0.15 -0.09 -0.34 0.00 0.00 178.44 179.37 2vak h ARG 157 N 0.49 0.00 -0.54 1.25 2.43 -1.31 0.44 114.38 117.13 2vak h ARG 157 Ca -0.07 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 2vak h ARG 157 Cb 1.48 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.98 2vak h ARG 157 CO 0.17 0.00 0.30 0.77 -1.51 0.00 0.00 179.97 179.70 2vak h SER 158 N 0.00 0.46 -0.01 -3.80 0.02 -1.47 -1.67 113.55 107.08 2vak h SER 158 Ca 0.29 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 61.27 2vak h SER 158 Cb 0.43 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.88 2vak h SER 158 CO -0.61 0.32 -0.09 0.74 -1.14 0.00 0.00 176.83 176.05 2vak h THR 159 N 0.59 0.76 -0.84 -2.27 2.02 -0.87 -0.53 112.91 111.77 2vak h THR 159 Ca 0.23 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.38 2vak h THR 159 Cb 0.09 0.76 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 2vak h THR 159 CO -0.13 0.00 0.40 -0.07 0.37 0.00 0.00 175.52 176.09 2vak h LEU 160 N -0.16 1.11 -0.66 2.58 3.38 -0.93 -0.31 115.31 120.32 2vak h LEU 160 Ca 0.04 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 2vak h LEU 160 Cb 0.21 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2vak h LEU 160 CO -0.10 0.94 -0.48 0.25 0.09 0.00 0.00 178.44 179.14 2vak h LEU 161 N 1.21 0.52 -0.08 1.67 5.85 -1.03 -1.75 115.31 121.70 2vak h LEU 161 Ca 0.29 -0.25 -0.25 0.00 0.84 0.00 0.00 57.88 58.51 2vak h LEU 161 Cb 0.13 -0.15 0.01 0.00 0.37 0.00 0.00 40.66 41.02 2vak h LEU 161 CO -0.04 0.92 -0.99 0.28 -0.34 0.00 0.00 178.44 178.27 2vak h SER 162 N 0.38 0.76 -0.37 1.25 0.02 -0.89 -3.28 113.55 111.42 2vak h SER 162 Ca 0.02 -0.60 -0.05 0.00 -0.84 0.00 0.00 61.79 60.31 2vak h SER 162 Cb 0.98 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 63.26 2vak h SER 162 CO 0.09 1.40 0.05 0.00 -1.14 0.00 0.00 176.83 177.23 2vak h ALA 163 N 0.55 1.25 -2.90 3.77 0.00 -1.02 -3.44 119.26 117.46 2vak h ALA 163 Ca -0.11 -0.22 -0.53 0.00 0.00 0.00 0.00 54.91 54.06 2vak h ALA 163 Cb 1.64 -0.19 0.10 0.00 0.00 0.00 0.00 17.79 19.34 2vak h ALA 163 CO 0.19 0.51 0.61 -1.64 0.00 0.00 0.00 179.25 178.92 2vak s MET 164 N -5.07 3.71 0.11 0.00 1.00 -0.66 0.39 119.30 118.78 2vak s MET 164 Ca -0.09 2.18 -0.05 0.00 0.00 0.00 0.00 55.69 57.73 2vak s MET 164 Cb 0.15 -2.59 -0.15 0.00 0.00 0.00 0.00 34.83 32.24 2vak s MET 164 CO 0.79 -0.71 1.25 -0.09 0.00 0.00 0.00 175.02 176.26 2vak h ARG 165 N 2.27 0.39 0.00 2.03 2.43 -1.85 -3.43 114.38 116.21 2vak h ARG 165 Ca -0.50 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.20 2vak h ARG 165 Cb 1.26 0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.96 2vak h ARG 165 CO 0.61 1.15 0.00 0.00 -1.51 0.00 0.00 179.97 180.22 2vak n ALA 166 N -2.55 0.00 -1.94 2.80 0.00 -1.26 -4.98 120.51 112.58 2vak n ALA 166 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.08 2vak n ALA 166 Cb 0.89 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.50 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 1.76 0.68 0.00 0.00 0.38 -5.02 107.32 105.12 2vak s GLY 167 Ca 0.00 -1.25 -0.15 0.00 0.00 0.00 0.00 44.72 43.32 2vak s GLY 167 CO 0.00 -0.56 1.15 2.56 0.00 0.00 0.00 173.10 176.26 2vak s PRO 168 N -5.69 2.55 0.05 2.90 0.04 -1.26 -4.04 135.00 129.56 2vak s PRO 168 Ca 0.71 1.57 -0.09 0.00 0.04 0.00 0.00 61.00 63.23 2vak s PRO 168 Cb -0.05 -1.90 -0.05 0.00 0.04 0.00 0.00 34.50 32.53 2vak s PRO 168 CO 0.51 -1.48 0.35 0.54 0.04 0.00 0.00 177.00 176.96 2vak s VAL 169 N -2.14 5.17 0.04 -0.36 0.11 -1.26 -2.39 120.40 119.57 2vak s VAL 169 Ca 0.71 0.34 0.04 0.00 -2.93 0.00 0.00 61.98 60.14 2vak s VAL 169 Cb -0.25 -3.62 -0.04 0.00 -1.53 0.00 0.00 36.38 30.95 2vak s VAL 169 CO 0.42 0.31 -0.05 -0.76 -3.33 0.00 0.00 175.10 171.69 2vak s LEU 170 N -1.87 3.24 -0.41 2.54 1.43 0.26 -4.68 118.68 119.19 2vak s LEU 170 Ca 0.31 -0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 53.06 2vak s LEU 170 Cb -0.14 -1.93 0.02 0.00 0.03 0.00 0.00 46.19 44.18 2vak s LEU 170 CO 0.18 0.24 0.38 -0.47 0.23 0.00 0.00 176.35 176.91 2vak s TYR 171 N -1.12 3.20 -0.33 0.29 5.04 -1.26 -2.08 117.35 121.08 2vak s TYR 171 Ca 0.20 -0.45 0.03 0.00 -2.44 0.00 0.00 57.07 54.42 2vak s TYR 171 Cb -0.11 -2.77 0.09 0.00 0.35 0.00 0.00 41.96 39.52 2vak s TYR 171 CO 0.11 -0.65 0.04 0.08 -1.34 0.00 0.00 175.55 173.79 2vak s VAL 172 N 1.96 2.39 -0.10 3.14 1.01 -0.00 -4.73 120.40 124.07 2vak s VAL 172 Ca 0.09 -2.19 0.03 0.00 0.00 0.00 0.00 61.98 59.91 2vak s VAL 172 Cb -0.18 -2.69 0.01 0.00 0.00 0.00 0.00 36.38 33.52 2vak s VAL 172 CO 0.12 -0.51 -0.20 -0.70 0.00 0.00 0.00 175.10 173.81 2vak s GLU 173 N 0.96 2.66 0.15 2.72 2.12 -1.26 -0.82 118.70 125.23 2vak s GLU 173 Ca 0.07 -0.74 0.10 0.00 0.36 0.00 0.00 54.97 54.77 2vak s GLU 173 Cb -0.20 -2.09 -0.04 0.00 0.26 0.00 0.00 34.13 32.06 2vak s GLU 173 CO -0.07 0.08 -0.20 0.95 -0.54 0.00 0.00 175.26 175.48 2vak s THR 174 N 0.59 2.65 0.13 -1.70 -4.23 -0.66 -4.65 115.64 107.77 2vak s THR 174 Ca -0.14 -1.71 -0.06 0.00 -1.18 0.00 0.00 61.69 58.60 2vak s THR 174 Cb -0.17 -2.24 -0.02 0.00 1.34 0.00 0.00 72.50 71.42 2vak s THR 174 CO 0.04 0.02 0.19 -1.66 -0.54 0.00 0.00 174.62 172.67 2vak s TRP 175 N -1.33 0.48 0.27 3.99 -2.14 -1.26 -0.01 118.94 118.94 2vak s TRP 175 Ca 0.19 -0.87 -0.31 0.00 2.66 0.00 0.00 56.10 57.77 2vak s TRP 175 Cb -0.10 -0.19 -0.12 0.00 -3.10 0.00 0.00 33.47 29.96 2vak s TRP 175 CO 0.10 -0.61 1.54 -2.30 -2.66 0.00 0.00 176.95 173.02 2vak n PRO 176 N -0.13 2.47 -3.79 3.25 -0.02 -1.26 -2.86 135.00 132.65 2vak n PRO 176 Ca -0.09 0.88 -0.24 0.00 -2.02 0.00 0.00 63.50 62.04 2vak n PRO 176 Cb 0.63 -2.63 0.02 0.00 -0.02 0.00 0.00 33.50 31.50 2vak n PRO 176 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2vak n ASN 177 N 2.31 -1.64 -0.07 2.55 4.13 -1.26 -4.91 115.26 116.37 2vak n ASN 177 Ca 0.10 -0.85 -0.15 0.00 1.68 0.00 0.00 54.58 55.36 2vak n ASN 177 Cb 0.35 -3.82 -0.05 0.00 -1.54 0.00 0.00 39.78 34.71 2vak n ASN 177 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2vak h MET 178 N -1.89 0.77 -3.96 3.52 -0.00 -1.93 -3.34 114.93 108.10 2vak h MET 178 Ca -0.61 -0.50 -0.77 0.00 -0.00 0.00 0.00 59.70 57.82 2vak h MET 178 Cb 1.36 0.06 -0.26 0.00 -0.00 0.00 0.00 31.60 32.77 2vak h MET 178 CO 0.60 1.13 -0.08 0.42 -0.00 0.00 0.00 176.91 178.97 2vak s ILE 179 N -4.07 5.30 0.13 -0.10 1.01 -1.26 -4.84 121.20 117.37 2vak s ILE 179 Ca -0.11 -2.04 -0.14 0.00 0.00 0.00 0.00 60.65 58.35 2vak s ILE 179 Cb 0.09 -4.34 0.02 0.00 0.01 0.00 0.00 42.46 38.24 2vak s ILE 179 CO 0.87 -0.94 0.36 -0.94 0.00 0.00 0.00 174.94 174.28 2vak s SER 180 N 2.74 -0.14 1.93 3.58 1.04 -1.26 -4.70 113.70 116.90 2vak s SER 180 Ca 0.11 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.09 2vak s SER 180 Cb -0.20 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.38 2vak s SER 180 CO -0.03 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 173.95 2vak n GLY 181 N -0.20 3.48 0.35 7.32 0.00 -1.26 -2.30 105.19 112.57 2vak n GLY 181 Ca -0.14 -0.13 0.02 0.00 0.00 0.00 0.00 46.02 45.76 2vak n GLY 181 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2vak h ARG 182 N 0.00 0.95 -0.41 1.61 2.43 -1.99 -1.73 114.38 115.23 2vak h ARG 182 Ca 0.00 -0.06 -0.14 0.00 -0.81 0.00 0.00 59.98 58.97 2vak h ARG 182 Cb 0.00 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 2vak h ARG 182 CO 0.00 0.63 -0.31 1.25 -1.51 0.00 0.00 179.97 180.03 2vak h LEU 183 N 0.98 0.98 -1.22 3.80 5.85 -1.82 -1.83 115.31 122.04 2vak h LEU 183 Ca 0.28 -0.44 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 2vak h LEU 183 Cb -0.06 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.68 2vak h LEU 183 CO -0.07 1.21 0.15 0.00 -0.34 0.00 0.00 178.44 179.39 2vak h ALA 184 N 0.80 1.38 -0.16 1.25 0.00 -1.11 -1.86 119.26 119.56 2vak h ALA 184 Ca 0.08 -0.16 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 2vak h ALA 184 Cb 0.89 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2vak h ALA 184 CO 0.08 0.46 -0.46 -0.44 0.00 0.00 0.00 179.25 178.88 2vak h ASP 185 N 0.68 0.42 0.50 0.00 3.32 -1.22 -1.96 116.42 118.15 2vak h ASP 185 Ca 0.16 -0.20 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 2vak h ASP 185 Cb 0.20 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.63 2vak h ASP 185 CO -0.01 0.83 -0.29 -0.25 -1.72 0.00 0.00 179.24 177.80 2vak h TRP 186 N 0.32 -0.76 -0.88 4.55 7.01 -0.63 -1.80 115.95 123.76 2vak h TRP 186 Ca 0.02 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.06 2vak h TRP 186 Cb 0.94 0.27 -0.05 0.00 -2.10 0.00 0.00 29.16 28.21 2vak h TRP 186 CO 0.03 -0.45 0.57 0.74 -2.79 0.00 0.00 178.44 176.54 2vak h PHE 187 N -0.75 1.02 -0.50 2.65 0.04 -1.31 -2.06 116.94 116.04 2vak h PHE 187 Ca -0.06 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.67 2vak h PHE 187 Cb 0.60 -0.34 -0.02 0.00 2.20 0.00 0.00 35.95 38.39 2vak h PHE 187 CO -0.08 0.56 0.03 1.98 -0.60 0.00 0.00 178.31 180.20 2vak h MET 188 N 1.03 0.82 0.00 1.51 4.05 -1.23 -1.59 114.93 119.52 2vak h MET 188 Ca 0.37 -0.21 0.00 0.00 -0.28 0.00 0.00 59.70 59.58 2vak h MET 188 Cb 0.14 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 2vak h MET 188 CO -0.13 0.80 0.00 -1.13 0.23 0.00 0.00 176.91 176.69 2vak n SER 189 N -4.23 0.04 -0.15 1.39 3.41 -0.69 -1.98 113.62 111.41 2vak n SER 189 Ca 0.03 0.51 0.06 0.00 -0.26 0.00 0.00 58.87 59.21 2vak n SER 189 Cb 0.29 -0.52 0.10 0.00 -0.26 0.00 0.00 64.21 63.81 2vak n SER 189 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 2vak n GLN 190 N -1.55 2.22 -1.59 4.33 -0.06 -0.61 -5.02 117.38 115.11 2vak n GLN 190 Ca 0.01 -2.14 -0.49 0.00 -2.00 0.00 0.00 57.00 52.38 2vak n GLN 190 Cb 0.07 -1.31 -0.04 0.00 -4.06 0.00 0.00 30.24 24.89 2vak n GLN 190 CO 0.00 0.00 0.00 0.98 -0.20 0.00 0.00 177.06 177.84 2vak n TYR 191 N -0.85 1.39 -0.54 3.69 9.36 -0.84 -1.71 117.16 127.66 2vak n TYR 191 Ca 0.10 0.66 0.00 0.00 3.32 0.00 0.00 57.90 61.97 2vak n TYR 191 Cb 0.49 -2.30 0.00 0.00 -0.63 0.00 0.00 39.34 36.90 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 2.15 1.80 3.87 2.98 0.00 0.18 -4.98 105.19 111.19 2vak n GLY 192 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 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 -3.38 6.30 0.10 1.61 0.02 -0.70 -4.66 114.94 114.23 2vak s ASN 193 Ca 0.00 1.38 -0.21 0.00 -1.02 0.00 0.00 52.86 53.01 2vak s ASN 193 Cb 0.00 -2.45 -0.07 0.00 0.02 0.00 0.00 41.25 38.75 2vak s ASN 193 CO 0.00 -0.78 0.63 0.21 0.02 0.00 0.00 177.10 177.18 2vak s ASN 194 N -3.99 7.16 0.20 -1.22 3.84 -1.26 -0.91 114.94 118.76 2vak s ASN 194 Ca 0.55 1.37 -0.11 0.00 0.21 0.00 0.00 52.86 54.88 2vak s ASN 194 Cb -0.11 -2.40 0.24 0.00 -0.55 0.00 0.00 41.25 38.43 2vak s ASN 194 CO 0.49 0.25 1.72 0.15 -2.79 0.00 0.00 177.10 176.92 2vak h PHE 195 N 4.52 0.20 -0.54 0.43 3.57 -1.06 -1.47 116.94 122.59 2vak h PHE 195 Ca -0.49 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.01 2vak h PHE 195 Cb 1.21 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.92 2vak h PHE 195 CO 0.67 -0.00 0.20 0.28 -2.23 0.00 0.00 178.31 177.23 2vak h VAL 196 N 0.26 1.22 -0.62 1.41 2.07 -1.93 -0.83 116.25 117.84 2vak h VAL 196 Ca 0.28 -0.72 -0.05 0.00 0.82 0.00 0.00 66.70 67.03 2vak h VAL 196 Cb 0.39 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 2vak h VAL 196 CO -0.35 0.27 0.18 0.44 0.02 0.00 0.00 177.57 178.13 2vak h ASP 197 N 0.74 0.88 -0.09 0.57 3.45 -1.89 -0.25 116.42 119.83 2vak h ASP 197 Ca 0.18 -0.16 -0.00 0.00 0.43 0.00 0.00 57.03 57.48 2vak h ASP 197 Cb 0.22 -0.23 -0.00 0.00 -0.56 0.00 0.00 39.33 38.76 2vak h ASP 197 CO -0.01 0.84 0.04 0.24 -1.57 0.00 0.00 179.24 178.78 2vak h MET 198 N 0.91 0.13 -0.80 3.56 2.86 -0.82 0.13 114.93 120.90 2vak h MET 198 Ca 0.20 -0.02 0.08 0.00 -2.06 0.00 0.00 59.70 57.91 2vak h MET 198 Cb 0.28 -0.02 -0.07 0.00 0.06 0.00 0.00 31.60 31.85 2vak h MET 198 CO -0.01 0.20 0.46 0.00 1.06 0.00 0.00 176.91 178.63 2vak h ALA 200 N 1.43 0.91 -0.16 0.00 0.00 -0.76 -0.32 119.26 120.35 2vak h ALA 200 Ca 0.38 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 2vak h ALA 200 Cb 0.31 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2vak h ALA 200 CO -0.23 0.68 -0.31 0.00 0.00 0.00 0.00 179.25 179.39 2vak h ARG 201 N 0.23 0.31 0.00 0.00 3.08 -0.72 -2.25 114.38 115.03 2vak h ARG 201 Ca 0.00 -0.12 -0.13 0.00 0.07 0.00 0.00 59.98 59.81 2vak h ARG 201 Cb 1.01 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 31.03 2vak h ARG 201 CO 0.09 0.59 -0.60 -0.07 -1.07 0.00 0.00 179.97 178.91 2vak h LEU 202 N 0.27 0.00 -0.33 3.04 3.38 -0.51 0.12 115.31 121.29 2vak h LEU 202 Ca 0.04 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 2vak h LEU 202 Cb 0.69 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2vak h LEU 202 CO 0.05 0.60 -0.07 0.74 0.09 0.00 0.00 178.44 179.85 2vak h THR 203 N 0.00 1.28 -0.90 0.22 2.02 -1.05 -2.73 112.91 111.75 2vak h THR 203 Ca -0.01 -1.12 0.08 0.00 0.77 0.00 0.00 66.41 66.14 2vak h THR 203 Cb 1.12 1.33 -0.06 0.00 -1.74 0.00 0.00 68.15 68.80 2vak h THR 203 CO 0.08 0.36 0.58 -0.61 0.37 0.00 0.00 175.52 176.30 2vak h GLN 204 N 0.41 0.92 -0.42 6.66 5.75 -1.20 -2.65 115.11 124.57 2vak h GLN 204 Ca 0.08 -0.06 -0.12 0.00 -0.15 0.00 0.00 58.65 58.41 2vak h GLN 204 Cb 0.57 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.90 2vak h GLN 204 CO 0.03 0.61 -0.20 0.77 -2.65 0.00 0.00 178.83 177.39 2vak h SER 205 N 0.94 0.84 -0.52 -0.69 0.02 -0.68 -3.06 113.55 110.40 2vak h SER 205 Ca 0.40 -0.30 -0.35 0.00 -0.84 0.00 0.00 61.79 60.71 2vak h SER 205 Cb 0.32 -0.23 -0.15 0.00 0.14 0.00 0.00 62.40 62.48 2vak h SER 205 CO -0.16 1.02 0.44 0.00 -1.14 0.00 0.00 176.83 176.99 2vak n SER 207 N 0.30 0.00 -4.55 0.00 7.64 -1.16 -4.61 113.62 111.24 2vak n SER 207 Ca 0.32 0.21 -0.21 0.00 1.01 0.00 0.00 58.87 60.20 2vak n SER 207 Cb 0.58 -0.27 -0.09 0.00 -1.01 0.00 0.00 64.21 63.43 2vak n SER 207 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2vak n ASN 208 N -1.48 1.44 0.00 6.43 6.94 -1.26 -4.82 115.26 122.50 2vak n ASN 208 Ca 0.00 -1.07 0.00 0.00 -0.02 0.00 0.00 54.58 53.49 2vak n ASN 208 Cb 0.00 -1.47 0.00 0.00 -2.36 0.00 0.00 39.78 35.95 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 8.42 0.00 -0.08 -3.83 1.56 -1.26 -4.88 117.12 117.05 2vak n MET 209 Ca 0.48 0.64 -0.03 0.00 -0.27 0.00 0.00 57.70 58.53 2vak n MET 209 Cb 0.40 -1.41 -0.01 0.00 2.15 0.00 0.00 33.22 34.35 2vak n MET 209 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 2vak n PRO 210 N -2.15 0.00 -3.70 2.12 -0.01 -1.26 -4.83 135.00 125.16 2vak n PRO 210 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 63.50 63.11 2vak n PRO 210 Cb 0.00 -0.08 -0.11 0.00 -0.01 0.00 0.00 33.50 33.30 2vak n PRO 210 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 175.50 175.57 2vak s VAL 211 N 0.44 3.79 -0.04 -1.45 1.01 -1.26 -5.08 120.40 117.81 2vak s VAL 211 Ca 0.07 -1.55 -0.25 0.00 0.00 0.00 0.00 61.98 60.26 2vak s VAL 211 Cb -0.07 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 2vak s VAL 211 CO 0.03 -0.48 0.76 -1.61 0.00 0.00 0.00 175.10 173.81 2vak s GLU 212 N 1.33 4.47 0.27 2.72 0.41 -1.26 -4.80 118.70 121.84 2vak s GLU 212 Ca 0.03 1.01 -0.30 0.00 -0.41 0.00 0.00 54.97 55.29 2vak s GLU 212 Cb -0.22 -3.44 -0.12 0.00 -1.78 0.00 0.00 34.13 28.57 2vak s GLU 212 CO 0.00 0.07 1.55 -0.35 -0.49 0.00 0.00 175.26 176.04 2vak n PRO 213 N 3.68 2.51 -0.87 0.39 -0.04 -1.26 -1.08 135.00 138.32 2vak n PRO 213 Ca 0.00 0.89 0.00 0.00 -0.04 0.00 0.00 63.50 64.35 2vak n PRO 213 Cb 0.51 -2.64 0.00 0.00 -0.04 0.00 0.00 33.50 31.33 2vak n PRO 213 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2vak n ASP 214 N 2.24 -2.34 -3.77 3.54 10.43 -1.26 -4.98 116.55 120.41 2vak n ASP 214 Ca 0.10 0.00 -0.30 0.00 2.57 0.00 0.00 54.79 57.16 2vak n ASP 214 Cb 0.35 -1.71 0.25 0.00 1.84 0.00 0.00 41.12 41.85 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 -2.00 1.55 0.12 0.44 0.00 -0.24 -4.77 107.32 102.41 2vak s GLY 215 Ca 0.00 -0.89 -0.14 0.00 0.00 0.00 0.00 44.72 43.69 2vak s GLY 215 CO 0.00 0.01 1.46 3.43 0.00 0.00 0.00 173.10 178.00 2vak h ASN 216 N -2.74 0.82 -0.66 1.64 2.35 -1.96 -1.93 115.58 113.11 2vak h ASN 216 Ca -0.45 -0.45 0.02 0.00 -0.55 0.00 0.00 56.30 54.87 2vak h ASN 216 Cb 1.30 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 39.41 2vak h ASN 216 CO 0.34 1.09 0.41 1.88 -1.65 0.00 0.00 177.43 179.51 2vak h TYR 217 N 0.55 0.78 -0.54 1.19 0.05 -1.93 -1.19 116.97 115.89 2vak h TYR 217 Ca 0.06 0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.89 2vak h TYR 217 Cb 0.84 -0.26 -0.04 0.00 1.01 0.00 0.00 36.73 38.28 2vak h TYR 217 CO 0.07 0.45 0.31 0.22 -1.05 0.00 0.00 178.16 178.16 2vak h ASP 218 N 0.82 0.50 -0.29 3.88 3.58 -1.75 -2.56 116.42 120.60 2vak h ASP 218 Ca 0.26 0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.65 2vak h ASP 218 Cb -0.00 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 2vak h ASP 218 CO -0.10 0.35 -0.09 1.56 -2.88 0.00 0.00 179.24 178.08 2vak h GLN 219 N 0.62 0.58 -0.87 0.28 4.20 -0.90 -2.60 115.11 116.41 2vak h GLN 219 Ca 0.22 -0.23 0.09 0.00 0.06 0.00 0.00 58.65 58.79 2vak h GLN 219 Cb 0.05 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.74 2vak h GLN 219 CO -0.11 0.79 0.52 1.96 -0.67 0.00 0.00 178.83 181.32 2vak h GLN 220 N 0.33 0.86 -0.08 1.46 4.20 -1.13 -1.47 115.11 119.28 2vak h GLN 220 Ca 0.07 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 2vak h GLN 220 Cb 0.59 -0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.18 2vak h GLN 220 CO 0.03 0.57 -0.25 0.52 -0.67 0.00 0.00 178.83 179.03 2vak h MET 221 N 0.89 0.31 -0.72 1.46 2.86 -1.38 0.48 114.93 118.83 2vak h MET 221 Ca 0.41 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 2vak h MET 221 Cb 0.32 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.99 2vak h MET 221 CO -0.23 0.85 0.38 0.00 1.06 0.00 0.00 176.91 178.98 2vak h ARG 222 N -0.17 1.01 -0.03 1.72 3.08 -1.38 -0.13 114.38 118.47 2vak h ARG 222 Ca -0.01 -0.13 -0.19 0.00 0.07 0.00 0.00 59.98 59.72 2vak h ARG 222 Cb 0.88 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 2vak h ARG 222 CO 0.05 0.76 -0.81 0.00 -1.07 0.00 0.00 179.97 178.90 2vak h ALA 223 N 1.19 0.54 -0.27 0.04 0.00 -1.22 -2.64 119.26 116.90 2vak h ALA 223 Ca 0.25 -0.66 0.01 0.00 0.00 0.00 0.00 54.91 54.51 2vak h ALA 223 Cb 0.06 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2vak h ALA 223 CO -0.04 0.82 0.15 1.25 0.00 0.00 0.00 179.25 181.42 2vak h LEU 224 N 0.21 0.23 0.56 0.00 5.85 0.19 -2.21 115.31 120.13 2vak h LEU 224 Ca -0.04 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 2vak h LEU 224 Cb 1.41 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.40 2vak h LEU 224 CO 0.13 0.17 -0.36 0.40 -0.34 0.00 0.00 178.44 178.45 2vak h ILE 225 N 0.30 0.27 0.00 4.05 2.04 -1.00 -2.67 117.51 120.50 2vak h ILE 225 Ca 0.11 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.82 2vak h ILE 225 Cb 0.01 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 2vak h ILE 225 CO -0.06 0.00 -0.70 0.77 0.00 0.00 0.00 178.15 178.15 2vak h SER 226 N -0.87 0.00 -0.41 1.72 4.64 -1.53 -1.12 113.55 115.98 2vak h SER 226 Ca -0.07 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.22 2vak h SER 226 Cb 0.72 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.79 2vak h SER 226 CO 0.06 0.70 0.12 0.25 -0.87 0.00 0.00 176.83 177.10 2vak h LEU 227 N 0.00 0.60 -0.22 5.97 5.85 -1.47 -1.69 115.31 124.34 2vak h LEU 227 Ca -0.01 -0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2vak h LEU 227 Cb 1.25 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 2vak h LEU 227 CO 0.09 0.65 0.14 -0.25 -0.34 0.00 0.00 178.44 178.73 2vak h TRP 228 N 0.52 0.28 -0.38 1.25 7.01 -1.33 -2.06 115.95 121.24 2vak h TRP 228 Ca 0.13 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.11 2vak h TRP 228 Cb 0.27 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.22 2vak h TRP 228 CO 0.01 0.18 0.14 1.25 -2.79 0.00 0.00 178.44 177.23 2vak h LEU 229 N 0.30 0.53 -1.46 0.65 5.85 -1.08 0.17 115.31 120.27 2vak h LEU 229 Ca 0.08 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.57 2vak h LEU 229 Cb -0.03 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 2vak h LEU 229 CO -0.02 0.57 -0.16 -0.07 -0.34 0.00 0.00 178.44 178.42 2vak h LEU 230 N 0.46 0.14 -0.46 2.25 3.38 -1.35 -0.05 115.31 119.69 2vak h LEU 230 Ca 0.12 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 2vak h LEU 230 Cb 0.22 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2vak h LEU 230 CO -0.01 0.32 0.13 0.28 0.09 0.00 0.00 178.44 179.25 2vak h SER 231 N 0.15 0.68 -0.54 -0.43 0.02 -0.55 0.21 113.55 113.08 2vak h SER 231 Ca 0.03 -0.22 -0.08 0.00 -0.84 0.00 0.00 61.79 60.68 2vak h SER 231 Cb 0.38 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2vak h SER 231 CO 0.02 0.72 0.05 0.22 -1.14 0.00 0.00 176.83 176.71 2vak h TYR 232 N 0.61 1.02 -0.01 3.45 3.20 0.35 -1.24 116.97 124.34 2vak h TYR 232 Ca 0.15 -0.14 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2vak h TYR 232 Cb 0.30 -0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.29 2vak h TYR 232 CO 0.02 0.89 -0.02 0.44 -1.64 0.00 0.00 178.16 177.84 2vak n ILE 233 N -4.21 0.00 0.00 1.81 -5.35 -0.13 -4.64 119.36 106.84 2vak n ILE 233 Ca 0.03 -0.20 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 2vak n ILE 233 Cb 0.30 0.35 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 1.17 3.24 0.19 3.28 0.00 -0.47 -3.66 105.19 108.93 2vak n GLY 234 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.22 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 1.30 -3.72 1.61 -1.51 -1.60 -3.39 116.25 108.94 2vak h VAL 235 Ca 0.00 -1.42 -0.63 0.00 -1.23 0.00 0.00 66.70 63.42 2vak h VAL 235 Cb 0.00 1.72 -0.15 0.00 -2.13 0.00 0.00 31.29 30.72 2vak h VAL 235 CO 0.00 0.41 -0.46 -0.69 -1.23 0.00 0.00 177.57 175.60 2vak s VAL 236 N -4.14 5.31 0.29 7.19 1.01 -0.01 -4.83 120.40 125.23 2vak s VAL 236 Ca -0.03 0.26 -0.05 0.00 0.00 0.00 0.00 61.98 62.15 2vak s VAL 236 Cb 0.14 -3.55 0.02 0.00 0.00 0.00 0.00 36.38 32.99 2vak s VAL 236 CO 0.74 0.28 0.48 -0.46 0.00 0.00 0.00 175.10 176.14 2vak n ASN 237 N 4.73 -1.37 -0.30 3.32 0.23 -0.98 -3.84 115.26 117.04 2vak n ASN 237 Ca -0.13 -2.41 0.15 0.00 -0.53 0.00 0.00 54.58 51.66 2vak n ASN 237 Cb 0.52 2.42 0.41 0.00 -2.08 0.00 0.00 39.78 41.05 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 0.60 -0.21 -3.83 4.15 -1.96 -1.25 115.11 112.61 2vak h GLN 238 Ca -0.24 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.15 2vak h GLN 238 Cb 0.96 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.52 2vak h GLN 238 CO 0.31 0.39 0.00 0.25 -1.93 0.00 0.00 178.83 177.86 2vak n THR 239 N -4.62 0.28 -2.72 2.39 -2.24 -1.26 -4.56 114.28 101.54 2vak n THR 239 Ca 0.21 -0.30 -0.04 0.00 -2.27 0.00 0.00 64.05 61.65 2vak n THR 239 Cb 0.61 0.15 0.03 0.00 -2.10 0.00 0.00 70.33 69.02 2vak n THR 239 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2vak n ASN 240 N 0.13 -2.56 -5.00 3.42 5.15 -0.47 -4.01 115.26 111.93 2vak n ASN 240 Ca 0.10 -2.20 -0.18 0.00 -0.60 0.00 0.00 54.58 51.70 2vak n ASN 240 Cb 0.21 1.34 0.02 0.00 -0.53 0.00 0.00 39.78 40.82 2vak n ASN 240 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2vak s THR 241 N 0.83 2.84 -0.37 -0.44 -4.23 -0.24 -2.33 115.64 111.70 2vak s THR 241 Ca 0.28 -0.92 -0.05 0.00 -1.18 0.00 0.00 61.69 59.82 2vak s THR 241 Cb 0.08 -2.92 0.07 0.00 1.34 0.00 0.00 72.50 71.08 2vak s THR 241 CO -0.09 0.00 0.15 -0.63 -0.54 0.00 0.00 174.62 173.50 2vak s ILE 242 N -2.48 3.55 -1.61 2.99 1.01 0.42 -1.73 121.20 123.34 2vak s ILE 242 Ca 0.56 -1.54 -0.13 0.00 0.00 0.00 0.00 60.65 59.55 2vak s ILE 242 Cb -0.10 -3.18 0.11 0.00 0.01 0.00 0.00 42.46 39.30 2vak s ILE 242 CO 0.35 -0.40 0.67 -1.20 0.00 0.00 0.00 174.94 174.36 2vak n SER 243 N 4.72 -2.42 0.00 3.58 7.64 -1.26 -2.04 113.62 123.84 2vak n SER 243 Ca -0.09 -1.01 0.00 0.00 1.01 0.00 0.00 58.87 58.78 2vak n SER 243 Cb 0.43 -2.85 0.00 0.00 -1.01 0.00 0.00 64.21 60.78 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 -1.61 2.97 3.82 0.23 0.00 -1.26 -4.98 105.19 104.36 2vak n GLY 244 Ca -0.04 -0.76 -0.35 0.00 0.00 0.00 0.00 46.02 44.87 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 -1.12 3.55 0.14 1.61 0.08 -0.87 -0.08 117.98 121.29 2vak s PHE 245 Ca 0.00 1.36 -0.23 0.00 0.12 0.00 0.00 56.93 58.18 2vak s PHE 245 Cb 0.00 -2.61 0.07 0.00 -0.57 0.00 0.00 43.02 39.90 2vak s PHE 245 CO 0.00 0.24 0.58 1.52 -0.10 0.00 0.00 175.22 177.46 2vak s TYR 246 N -1.70 -0.51 -0.01 0.36 1.13 -0.95 -0.44 117.35 115.23 2vak s TYR 246 Ca 0.48 0.35 -0.07 0.00 -1.41 0.00 0.00 57.07 56.42 2vak s TYR 246 Cb -0.14 0.51 -0.05 0.00 -1.10 0.00 0.00 41.96 41.18 2vak s TYR 246 CO 0.20 -0.81 0.25 -0.06 -2.51 0.00 0.00 175.55 172.62 2vak s PHE 247 N -3.51 3.59 0.03 -3.49 0.40 -1.26 -1.17 117.98 112.58 2vak s PHE 247 Ca 0.00 0.58 0.04 0.00 -0.60 0.00 0.00 56.93 56.96 2vak s PHE 247 Cb -0.01 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.51 2vak s PHE 247 CO -0.11 0.64 -0.13 0.45 0.70 0.00 0.00 175.22 176.77 2vak s SER 248 N -1.56 1.58 -0.05 1.36 0.15 0.10 -4.83 113.70 110.45 2vak s SER 248 Ca 0.25 -0.41 0.01 0.00 0.70 0.00 0.00 55.95 56.51 2vak s SER 248 Cb -0.13 -0.11 0.02 0.00 -1.71 0.00 0.00 66.02 64.09 2vak s SER 248 CO 0.14 0.05 -0.07 -0.55 1.20 0.00 0.00 173.24 174.01 2vak s SER 249 N -0.97 1.16 0.14 5.45 0.15 -1.25 -0.49 113.70 117.89 2vak s SER 249 Ca 0.02 -0.18 -0.18 0.00 0.70 0.00 0.00 55.95 56.31 2vak s SER 249 Cb -0.07 -0.55 0.02 0.00 -1.71 0.00 0.00 66.02 63.71 2vak s SER 249 CO 0.01 -0.03 1.71 0.11 1.20 0.00 0.00 173.24 176.24 2vak h LYS 250 N 7.09 0.08 -6.20 5.44 1.57 -1.91 -3.42 116.57 119.22 2vak h LYS 250 Ca -0.36 -0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 57.90 2vak h LYS 250 Cb 1.16 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.40 2vak h LYS 250 CO 0.48 0.05 -0.55 0.95 -0.57 0.00 0.00 179.45 179.81 2vak s THR 251 N -6.19 4.30 -0.09 -0.16 -4.23 -1.26 -5.11 115.64 102.90 2vak s THR 251 Ca -0.13 -1.47 -0.03 0.00 -1.18 0.00 0.00 61.69 58.87 2vak s THR 251 Cb 0.11 -3.32 0.05 0.00 1.34 0.00 0.00 72.50 70.68 2vak s THR 251 CO 0.70 -0.35 0.11 -0.60 -0.54 0.00 0.00 174.62 173.94 2vak s ARG 252 N -3.80 0.00 0.00 3.99 6.06 -1.26 -4.51 118.95 119.44 2vak s ARG 252 Ca 0.33 0.38 0.00 0.00 -2.50 0.00 0.00 55.73 53.93 2vak s ARG 252 Cb -0.08 -0.64 0.00 0.00 0.06 0.00 0.00 34.95 34.29 2vak s ARG 252 CO 0.24 -0.39 0.00 0.41 -2.50 0.00 0.00 175.30 173.06 2vak n GLY 253 N 5.31 1.50 3.45 8.12 0.00 -1.26 -4.52 105.19 117.79 2vak n GLY 253 Ca -0.04 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.53 1.37 0.54 1.61 0.74 -1.26 -4.25 119.66 116.88 2vak s GLN 254 Ca 0.00 -1.27 0.22 0.00 0.05 0.00 0.00 55.36 54.37 2vak s GLN 254 Cb 0.00 0.42 1.41 0.00 1.10 0.00 0.00 33.01 35.93 2vak s GLN 254 CO 0.00 -0.54 2.09 0.00 -0.55 0.00 0.00 175.29 176.29 2vak h ALA 255 N 2.39 2.13 -0.19 1.58 0.00 -1.97 -2.81 119.26 120.40 2vak h ALA 255 Ca -0.29 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2vak h ALA 255 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2vak h ALA 255 CO 0.42 -0.29 0.00 1.28 0.00 0.00 0.00 179.25 180.65 2vak n LEU 256 N -4.32 2.73 -4.57 0.00 4.77 -1.26 -4.97 117.00 109.38 2vak n LEU 256 Ca 0.02 -1.06 -0.54 0.00 -0.03 0.00 0.00 56.01 54.40 2vak n LEU 256 Cb 0.32 -0.11 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 2vak n LEU 256 CO 0.34 0.53 0.82 0.47 -1.33 0.00 0.00 177.39 178.22 2vak n ASP 257 N 1.06 1.20 -3.65 -1.43 10.43 -1.06 -4.71 116.55 118.38 2vak n ASP 257 Ca 0.17 1.13 -0.04 0.00 2.57 0.00 0.00 54.79 58.62 2vak n ASP 257 Cb 0.52 -1.11 -0.06 0.00 1.84 0.00 0.00 41.12 42.31 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 0.42 -0.86 -0.37 -2.24 0.15 -1.26 -5.04 113.70 104.49 2vak s SER 258 Ca 0.87 1.39 -0.15 0.00 0.70 0.00 0.00 55.95 58.76 2vak s SER 258 Cb -1.05 1.97 -0.00 0.00 -1.71 0.00 0.00 66.02 65.23 2vak s SER 258 CO 0.50 -0.22 0.31 0.26 1.20 0.00 0.00 173.24 175.29 2vak s TRP 259 N 2.75 3.22 -0.07 3.44 0.52 -1.26 -3.90 118.94 123.64 2vak s TRP 259 Ca -0.05 -0.28 -0.01 0.00 0.02 0.00 0.00 56.10 55.78 2vak s TRP 259 Cb -0.12 -2.61 -0.03 0.00 -1.15 0.00 0.00 33.47 29.56 2vak s TRP 259 CO -0.17 -0.48 -0.01 0.99 0.02 0.00 0.00 176.95 177.30 2vak s THR 260 N 1.84 4.19 -0.26 2.01 2.01 0.35 -0.34 115.64 125.44 2vak s THR 260 Ca 0.08 -0.33 -0.29 0.00 0.31 0.00 0.00 61.69 61.46 2vak s THR 260 Cb -0.18 -2.76 0.01 0.00 0.01 0.00 0.00 72.50 69.58 2vak s THR 260 CO 0.11 0.58 1.14 -0.22 -0.69 0.00 0.00 174.62 175.54 2vak s LEU 261 N -0.94 4.01 0.32 4.42 2.96 -0.08 -0.72 118.68 128.65 2vak s LEU 261 Ca 0.14 1.28 0.10 0.00 -0.22 0.00 0.00 54.13 55.43 2vak s LEU 261 Cb -0.11 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.98 2vak s LEU 261 CO 0.03 -0.83 -0.07 -0.36 -1.32 0.00 0.00 176.35 173.79 2vak s PHE 262 N 3.62 2.45 -0.07 5.38 0.08 -0.32 0.51 117.98 129.63 2vak s PHE 262 Ca 0.48 -0.42 0.01 0.00 0.12 0.00 0.00 56.93 57.12 2vak s PHE 262 Cb -0.15 -1.32 0.02 0.00 -0.57 0.00 0.00 43.02 41.00 2vak s PHE 262 CO 0.14 0.58 -0.06 -0.47 -0.10 0.00 0.00 175.22 175.30 2vak s TYR 263 N -2.53 1.11 0.14 0.36 5.04 -1.26 -2.25 117.35 117.96 2vak s TYR 263 Ca 0.33 -0.43 -0.08 0.00 -2.44 0.00 0.00 57.07 54.45 2vak s TYR 263 Cb -0.01 -0.94 -0.06 0.00 0.35 0.00 0.00 41.96 41.30 2vak s TYR 263 CO 0.17 -0.32 0.44 -0.08 -1.34 0.00 0.00 175.55 174.42 2vak s THR 264 N 1.25 5.07 -0.17 4.34 -1.32 0.88 -4.97 115.64 120.72 2vak s THR 264 Ca -0.05 0.31 0.19 0.00 -1.21 0.00 0.00 61.69 60.93 2vak s THR 264 Cb -0.14 -3.63 -0.26 0.00 -1.51 0.00 0.00 72.50 66.96 2vak s THR 264 CO -0.02 0.10 0.15 0.41 -2.21 0.00 0.00 174.62 173.05 2vak n THR 265 N 0.32 1.18 -0.17 5.08 -1.04 -1.26 -4.55 114.28 113.83 2vak n THR 265 Ca -0.04 -0.80 0.00 0.00 -2.04 0.00 0.00 64.05 61.17 2vak n THR 265 Cb 0.52 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 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 -2.68 1.26 -4.74 8.00 6.94 -1.26 -5.04 115.26 117.74 2vak n ASN 266 Ca -0.28 -1.43 -0.23 0.00 -0.02 0.00 0.00 54.58 52.62 2vak n ASN 266 Cb 1.06 0.00 -0.06 0.00 -2.36 0.00 0.00 39.78 38.42 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 -0.43 2.77 0.33 5.53 -4.23 -1.26 -5.08 115.64 113.27 2vak s THR 267 Ca 0.00 -1.69 -0.29 0.00 -1.18 0.00 0.00 61.69 58.54 2vak s THR 267 Cb 0.00 -2.97 -0.12 0.00 1.34 0.00 0.00 72.50 70.75 2vak s THR 267 CO 0.00 -0.12 1.35 -3.20 -0.54 0.00 0.00 174.62 172.11 2vak n ASN 268 N -1.19 2.95 -4.20 3.99 5.15 -1.26 -4.84 115.26 115.87 2vak n ASN 268 Ca -0.02 1.20 -0.32 0.00 -0.60 0.00 0.00 54.58 54.83 2vak n ASN 268 Cb 0.62 -1.50 -0.17 0.00 -0.53 0.00 0.00 39.78 38.21 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 -1.63 3.05 0.64 1.20 0.52 -1.26 -1.08 118.95 120.38 2vak s ARG 269 Ca 0.57 -0.85 -0.18 0.00 -0.52 0.00 0.00 55.73 54.75 2vak s ARG 269 Cb -0.56 -2.41 -0.01 0.00 0.52 0.00 0.00 34.95 32.48 2vak s ARG 269 CO 0.60 0.06 1.29 0.14 0.02 0.00 0.00 175.30 177.41 2vak s VAL 270 N 0.65 2.05 -0.42 3.52 -7.23 -0.71 -4.94 120.40 113.34 2vak s VAL 270 Ca -0.11 0.03 0.03 0.00 -1.81 0.00 0.00 61.98 60.13 2vak s VAL 270 Cb -0.16 -3.01 0.11 0.00 0.56 0.00 0.00 36.38 33.88 2vak s VAL 270 CO 0.02 -0.01 0.15 -1.10 -0.31 0.00 0.00 175.10 173.85 2vak s GLN 271 N -3.36 1.73 0.05 4.82 -0.21 -1.26 -4.72 119.66 116.71 2vak s GLN 271 Ca 0.82 -2.15 -0.30 0.00 0.02 0.00 0.00 55.36 53.75 2vak s GLN 271 Cb -0.37 -3.30 -0.05 0.00 1.00 0.00 0.00 33.01 30.29 2vak s GLN 271 CO 0.40 -1.02 1.22 0.42 -2.12 0.00 0.00 175.29 174.19 2vak s ILE 272 N 0.49 4.02 -0.30 1.08 1.01 -1.24 -4.53 121.20 121.73 2vak s ILE 272 Ca 0.13 1.44 0.12 0.00 0.00 0.00 0.00 60.65 62.34 2vak s ILE 272 Cb -0.22 -3.92 -0.16 0.00 0.01 0.00 0.00 42.46 38.17 2vak s ILE 272 CO -0.05 0.09 0.40 0.41 0.00 0.00 0.00 174.94 175.79 2vak n THR 273 N 4.04 0.00 -3.83 2.92 -1.04 -0.75 -4.30 114.28 111.32 2vak n THR 273 Ca 0.09 -0.25 -0.07 0.00 -2.04 0.00 0.00 64.05 61.79 2vak n THR 273 Cb 0.46 0.60 -0.02 0.00 -1.82 0.00 0.00 70.33 69.56 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 -2.52 1.67 0.03 -2.82 -2.07 -1.25 -4.89 119.66 107.82 2vak s GLN 274 Ca -0.00 -0.92 -0.30 0.00 -1.82 0.00 0.00 55.36 52.32 2vak s GLN 274 Cb 0.09 0.57 -0.04 0.00 -1.09 0.00 0.00 33.01 32.54 2vak s GLN 274 CO 0.51 -0.76 1.02 0.50 -1.32 0.00 0.00 175.29 175.24 2vak s ARG 275 N -3.80 4.56 -0.03 9.60 3.52 -1.26 -4.07 118.95 127.46 2vak s ARG 275 Ca 0.11 1.50 0.07 0.00 -0.13 0.00 0.00 55.73 57.28 2vak s ARG 275 Cb -0.05 -3.42 -0.01 0.00 -1.56 0.00 0.00 34.95 29.91 2vak s ARG 275 CO 0.06 -0.05 -0.23 -1.01 -0.81 0.00 0.00 175.30 173.25 2vak s HIS 276 N 0.83 2.19 -0.02 5.12 3.76 0.99 -5.00 115.29 123.16 2vak s HIS 276 Ca 0.52 -0.52 0.01 0.00 -0.15 0.00 0.00 55.06 54.93 2vak s HIS 276 Cb -0.23 -1.42 0.01 0.00 1.11 0.00 0.00 32.58 32.04 2vak s HIS 276 CO 0.29 -0.11 -0.04 0.12 -0.85 0.00 0.00 174.74 174.14 2vak s PHE 277 N -0.36 0.56 0.00 1.40 5.36 -1.26 -1.65 117.98 122.03 2vak s PHE 277 Ca 0.03 -0.12 -0.08 0.00 -0.96 0.00 0.00 56.93 55.80 2vak s PHE 277 Cb -0.11 -0.45 0.00 0.00 -0.34 0.00 0.00 43.02 42.13 2vak s PHE 277 CO 0.01 -0.08 0.16 0.00 -1.46 0.00 0.00 175.22 173.85 2vak s ALA 278 N 0.38 -0.39 -0.10 11.12 0.00 -0.00 -5.03 121.76 127.73 2vak s ALA 278 Ca -0.04 -0.07 -0.19 0.00 0.00 0.00 0.00 51.96 51.66 2vak s ALA 278 Cb -0.08 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 2vak s ALA 278 CO -0.00 -0.22 0.51 0.71 0.00 0.00 0.00 175.76 176.76 2vak s TYR 279 N -1.38 3.53 -0.06 0.00 2.02 -1.26 -0.82 117.35 119.39 2vak s TYR 279 Ca -0.15 0.95 -0.00 0.00 -0.37 0.00 0.00 57.07 57.50 2vak s TYR 279 Cb -0.07 -2.58 0.03 0.00 -0.40 0.00 0.00 41.96 38.93 2vak s TYR 279 CO 0.02 0.17 -0.01 0.08 -1.57 0.00 0.00 175.55 174.24 2vak s VAL 280 N 0.59 0.41 0.19 0.71 1.01 -0.88 -0.33 120.40 122.09 2vak s VAL 280 Ca 0.28 0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.38 2vak s VAL 280 Cb -0.16 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.67 2vak s VAL 280 CO 0.12 0.24 0.00 0.00 0.00 0.00 0.00 175.10 175.45 2vak s ALA 282 N -1.84 3.62 0.00 0.00 0.00 -1.01 -0.94 121.76 121.60 2vak s ALA 282 Ca 0.28 0.34 -0.20 0.00 0.00 0.00 0.00 51.96 52.38 2vak s ALA 282 Cb -0.09 -3.55 -0.23 0.00 0.00 0.00 0.00 23.12 19.25 2vak s ALA 282 CO 0.19 -1.00 1.10 -0.09 0.00 0.00 0.00 175.76 175.96 2vak h ARG 283 N 7.64 0.41 -6.50 0.00 2.43 -1.33 0.11 114.38 117.14 2vak h ARG 283 Ca -0.25 -0.43 -0.53 0.00 -0.81 0.00 0.00 59.98 57.96 2vak h ARG 283 Cb 1.10 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 30.74 2vak h ARG 283 CO 0.95 1.10 -0.04 -1.54 -1.51 0.00 0.00 179.97 178.93 2vak s SER 284 N -6.73 6.73 0.18 -3.80 1.04 -1.24 -4.50 113.70 105.38 2vak s SER 284 Ca -0.13 1.07 0.19 0.00 0.48 0.00 0.00 55.95 57.56 2vak s SER 284 Cb 0.04 -2.29 0.83 0.00 0.10 0.00 0.00 66.02 64.70 2vak s SER 284 CO 0.82 -0.07 1.57 -2.65 0.98 0.00 0.00 173.24 173.89 2vak n PRO 285 N 0.03 0.12 0.00 4.02 -0.02 -1.26 -2.26 135.00 135.62 2vak n PRO 285 Ca 0.00 0.43 0.05 0.00 -2.02 0.00 0.00 63.50 61.96 2vak n PRO 285 Cb 0.52 -1.76 0.28 0.00 -0.02 0.00 0.00 33.50 32.52 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 -1.99 0.00 -0.12 2.55 5.68 -1.26 -2.03 116.55 119.39 2vak n ASP 286 Ca 0.02 -0.21 0.06 0.00 -0.50 0.00 0.00 54.79 54.15 2vak n ASP 286 Cb 0.16 -0.06 0.38 0.00 -1.14 0.00 0.00 41.12 40.46 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 0.67 -0.95 2.11 5.08 -1.84 -2.14 115.95 118.89 2vak h TRP 287 Ca 0.00 0.02 0.28 0.00 1.08 0.00 0.00 58.89 60.26 2vak h TRP 287 Cb 0.02 -0.22 -0.04 0.00 -3.00 0.00 0.00 29.16 25.91 2vak h TRP 287 CO 0.00 0.38 0.70 -0.91 -1.28 0.00 0.00 178.44 177.33 2vak h ASN 288 N 0.69 0.00 -0.01 0.11 2.35 -1.69 -0.40 115.58 116.63 2vak h ASN 288 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2vak h ASN 288 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 2vak h ASN 288 CO -0.07 0.00 -0.57 0.55 -1.65 0.00 0.00 177.43 175.68 2vak n VAL 289 N -4.21 0.00 -2.85 2.81 3.14 -0.81 -1.29 118.33 115.11 2vak n VAL 289 Ca 0.20 -0.21 -0.43 0.00 -2.96 0.00 0.00 64.34 60.94 2vak n VAL 289 Cb 1.03 1.16 -0.04 0.00 -1.06 0.00 0.00 33.84 34.93 2vak n VAL 289 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2vak s ASP 290 N -2.44 6.19 0.23 6.55 -1.08 -0.16 -4.87 116.67 121.08 2vak s ASP 290 Ca 0.14 -0.93 0.07 0.00 -0.52 0.00 0.00 52.55 51.31 2vak s ASP 290 Cb 0.16 -2.42 0.20 0.00 -1.46 0.00 0.00 42.92 39.39 2vak s ASP 290 CO 0.60 -1.43 1.52 0.11 0.52 0.00 0.00 175.17 176.49 2vak h LYS 291 N 9.55 0.09 0.17 4.34 1.57 -1.90 -1.84 116.57 128.55 2vak h LYS 291 Ca -0.29 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.41 2vak h LYS 291 Cb 1.07 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.40 2vak h LYS 291 CO 1.17 0.76 -0.08 0.77 -0.57 0.00 0.00 179.45 181.50 2vak h SER 292 N 0.06 -0.20 -0.51 0.86 0.02 -1.96 -1.38 113.55 110.43 2vak h SER 292 Ca -0.01 -0.26 0.10 0.00 -0.84 0.00 0.00 61.79 60.78 2vak h SER 292 Cb 1.25 0.05 -0.08 0.00 0.14 0.00 0.00 62.40 63.76 2vak h SER 292 CO 0.10 0.17 0.02 -0.25 -1.14 0.00 0.00 176.83 175.73 2vak h TRP 293 N -0.59 0.00 -0.26 3.45 2.91 -1.92 -0.67 115.95 118.86 2vak h TRP 293 Ca -0.02 0.04 -0.05 0.00 1.13 0.00 0.00 58.89 59.98 2vak h TRP 293 Cb 0.44 0.08 -0.01 0.00 -0.51 0.00 0.00 29.16 29.16 2vak h TRP 293 CO 0.04 -0.10 -0.05 0.82 -1.03 0.00 0.00 178.44 178.11 2vak h ILE 294 N 0.13 1.19 -0.05 2.65 2.04 -1.32 0.17 117.51 122.32 2vak h ILE 294 Ca 0.26 -0.77 -0.13 0.00 1.00 0.00 0.00 64.86 65.21 2vak h ILE 294 Cb 0.39 1.05 0.01 0.00 -0.74 0.00 0.00 36.82 37.53 2vak h ILE 294 CO -0.41 0.26 -0.48 0.00 0.00 0.00 0.00 178.15 177.51 2vak h ALA 295 N 1.56 0.12 0.00 1.87 0.00 -0.80 -1.73 119.26 120.29 2vak h ALA 295 Ca 0.08 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.48 2vak h ALA 295 Cb 0.34 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2vak h ALA 295 CO 0.01 0.30 -0.01 0.00 0.00 0.00 0.00 179.25 179.56 2vak h ALA 296 N 0.39 1.60 0.00 0.00 0.00 -0.89 -2.46 119.26 117.90 2vak h ALA 296 Ca -0.05 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 2vak h ALA 296 Cb 1.16 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2vak h ALA 296 CO 0.10 0.01 -0.83 0.00 0.00 0.00 0.00 179.25 178.53 2vak h ALA 297 N 1.99 0.64 -0.16 0.00 0.00 -0.72 -2.20 119.26 118.80 2vak h ALA 297 Ca -0.00 -0.62 -0.10 0.00 0.00 0.00 0.00 54.91 54.18 2vak h ALA 297 Cb 0.03 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2vak h ALA 297 CO 0.00 0.78 -0.31 -0.91 0.00 0.00 0.00 179.25 178.81 2vak h ASN 298 N 0.00 0.55 -0.66 0.00 2.35 -1.05 -2.92 115.58 113.84 2vak h ASN 298 Ca -0.05 -0.55 -0.05 0.00 -0.55 0.00 0.00 56.30 55.09 2vak h ASN 298 Cb 1.48 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.67 2vak h ASN 298 CO 0.07 1.00 0.23 -0.07 -1.65 0.00 0.00 177.43 177.01 2vak h LEU 299 N 0.12 0.97 -0.58 1.61 3.38 -1.52 -2.83 115.31 116.46 2vak h LEU 299 Ca 0.01 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 57.92 2vak h LEU 299 Cb 0.91 -0.25 -0.08 0.00 0.09 0.00 0.00 40.66 41.32 2vak h LEU 299 CO 0.07 0.89 0.13 0.74 0.09 0.00 0.00 178.44 180.36 2vak h THR 300 N 1.01 0.66 -0.42 0.22 2.02 -1.46 -0.34 112.91 114.60 2vak h THR 300 Ca 0.23 -0.09 -0.03 0.00 0.77 0.00 0.00 66.41 67.28 2vak h THR 300 Cb 0.26 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 2vak h THR 300 CO -0.01 0.05 0.12 0.00 0.37 0.00 0.00 175.52 176.05 2vak h ALA 301 N 1.46 1.43 -0.01 6.16 0.00 -1.30 -0.72 119.26 126.27 2vak h ALA 301 Ca 0.30 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2vak h ALA 301 Cb 0.44 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2vak h ALA 301 CO -0.38 0.42 -0.01 0.82 0.00 0.00 0.00 179.25 180.10 2vak h ILE 302 N 0.60 1.40 -0.52 0.00 2.04 -1.12 0.03 117.51 119.94 2vak h ILE 302 Ca 0.14 -1.21 0.09 0.00 1.00 0.00 0.00 64.86 64.88 2vak h ILE 302 Cb 0.20 2.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.41 2vak h ILE 302 CO -0.01 0.32 0.13 0.58 0.00 0.00 0.00 178.15 179.17 2vak h VAL 303 N -0.48 0.73 0.00 1.67 2.07 -0.96 -2.42 116.25 116.86 2vak h VAL 303 Ca 0.00 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.35 2vak h VAL 303 Cb 0.53 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 2vak h VAL 303 CO 0.00 0.05 -0.36 0.24 0.02 0.00 0.00 177.57 177.52 2vak h MET 304 N 0.27 0.00 -0.29 1.57 2.86 -1.16 -3.28 114.93 114.90 2vak h MET 304 Ca 0.26 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.80 2vak h MET 304 Cb 0.35 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.00 2vak h MET 304 CO -0.33 0.36 -0.27 0.00 1.06 0.00 0.00 176.91 177.73 2vak h ALA 305 N 1.64 0.98 -0.04 6.32 0.00 -0.47 -3.26 119.26 124.43 2vak h ALA 305 Ca -0.00 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.53 2vak h ALA 305 Cb 0.86 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.52 2vak h ALA 305 CO 0.05 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.90 2vak s ARG 307 N -1.95 1.66 -0.52 0.00 1.70 -1.23 -3.69 118.95 114.91 2vak s ARG 307 Ca 0.37 -1.95 -0.18 0.00 -0.47 0.00 0.00 55.73 53.50 2vak s ARG 307 Cb 0.19 0.17 0.08 0.00 -0.57 0.00 0.00 34.95 34.82 2vak s ARG 307 CO 0.30 -0.56 0.56 -0.65 -1.08 0.00 0.00 175.30 173.86 2vak s GLN 308 N -3.64 3.04 0.84 3.89 -1.52 -0.78 -4.18 119.66 117.31 2vak s GLN 308 Ca 0.38 -1.25 -0.13 0.00 -1.95 0.00 0.00 55.36 52.42 2vak s GLN 308 Cb 0.03 -4.18 0.10 0.00 -0.22 0.00 0.00 33.01 28.75 2vak s GLN 308 CO 0.22 -1.26 1.20 -1.25 -0.25 0.00 0.00 175.29 173.96 2vak s PRO 309 N 2.19 1.74 0.21 2.91 0.04 -1.26 -4.90 135.00 135.93 2vak s PRO 309 Ca 0.09 0.05 -0.32 0.00 0.04 0.00 0.00 61.00 60.87 2vak s PRO 309 Cb -0.23 -1.93 -0.15 0.00 0.04 0.00 0.00 34.50 32.23 2vak s PRO 309 CO 0.08 -1.74 1.25 -2.30 0.04 0.00 0.00 177.00 174.32 2vak n PRO 310 N -3.40 1.54 -2.22 0.56 -0.02 -1.26 -4.93 135.00 125.26 2vak n PRO 310 Ca 0.09 0.55 -0.41 0.00 -2.02 0.00 0.00 63.50 61.71 2vak n PRO 310 Cb 0.61 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.96 2vak n PRO 310 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2vak s VAL 311 N -0.23 3.06 0.37 -1.45 1.01 -1.26 -4.90 120.40 117.00 2vak s VAL 311 Ca 0.70 0.97 -0.26 0.00 0.00 0.00 0.00 61.98 63.39 2vak s VAL 311 Cb -0.75 -3.62 -0.09 0.00 0.00 0.00 0.00 36.38 31.92 2vak s VAL 311 CO 0.52 0.19 1.08 -0.36 0.00 0.00 0.00 175.10 176.53 2vak s PHE 312 N -0.56 3.32 0.23 5.22 0.08 0.54 0.62 117.98 127.43 2vak s PHE 312 Ca 0.52 1.65 -0.32 0.00 0.12 0.00 0.00 56.93 58.90 2vak s PHE 312 Cb -0.37 -3.20 -0.12 0.00 -0.57 0.00 0.00 43.02 38.75 2vak s PHE 312 CO 0.44 -0.70 1.66 0.00 -0.10 0.00 0.00 175.22 176.53 2vak n ALA 313 N 0.28 2.58 -0.33 5.36 0.00 0.17 -1.57 120.51 127.00 2vak n ALA 313 Ca 0.03 0.40 0.24 0.00 0.00 0.00 0.00 53.44 54.11 2vak n ALA 313 Cb 0.48 -2.48 0.46 0.00 0.00 0.00 0.00 19.45 17.91 2vak n ALA 313 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2vak h ASN 314 N 6.00 0.08 0.75 0.00 2.35 -1.21 0.58 115.58 124.13 2vak h ASN 314 Ca -0.44 0.25 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 2vak h ASN 314 Cb 1.22 0.32 0.00 0.00 0.05 0.00 0.00 38.32 39.90 2vak h ASN 314 CO 0.89 -0.35 0.00 -0.61 -1.65 0.00 0.00 177.43 175.71 2vak h GLN 315 N 0.06 0.00 -0.01 0.81 4.15 -1.90 -2.95 115.11 115.28 2vak h GLN 315 Ca 0.74 0.00 0.00 0.00 0.77 0.00 0.00 58.65 60.16 2vak h GLN 315 Cb 1.78 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.47 2vak h GLN 315 CO -0.79 0.00 -0.02 0.41 -1.93 0.00 0.00 178.83 176.51 2vak n GLY 316 N -0.14 -0.43 3.22 2.39 0.00 0.20 -4.87 105.19 105.54 2vak n GLY 316 Ca 0.01 -0.35 -0.14 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.06 1.04 0.78 1.61 -7.23 -1.12 -4.62 120.40 108.81 2vak s VAL 317 Ca 0.40 -1.90 -0.14 0.00 -1.81 0.00 0.00 61.98 58.53 2vak s VAL 317 Cb 0.21 -1.66 0.06 0.00 0.56 0.00 0.00 36.38 35.55 2vak s VAL 317 CO 0.36 -0.69 1.15 2.30 -0.31 0.00 0.00 175.10 177.92 2vak n ILE 318 N 0.09 2.52 -0.31 -0.62 -5.35 0.16 -4.81 119.36 111.05 2vak n ILE 318 Ca -0.13 -0.27 0.02 0.00 -0.27 0.00 0.00 62.75 62.10 2vak n ILE 318 Cb 0.60 -1.21 0.09 0.00 -1.74 0.00 0.00 39.64 37.38 2vak n ILE 318 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2vak h ASN 319 N -0.62 -0.92 0.24 7.28 2.35 -1.91 0.57 115.58 122.58 2vak h ASN 319 Ca -0.47 0.26 -0.01 0.00 -0.55 0.00 0.00 56.30 55.54 2vak h ASN 319 Cb 1.31 0.57 -0.00 0.00 0.05 0.00 0.00 38.32 40.25 2vak h ASN 319 CO 0.47 -0.29 -0.03 1.56 -1.65 0.00 0.00 177.43 177.48 2vak h GLN 320 N -0.02 0.00 -0.11 0.81 7.50 -1.91 -2.32 115.11 119.07 2vak h GLN 320 Ca 0.39 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.54 2vak h GLN 320 Cb 0.62 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.15 2vak h GLN 320 CO -0.88 0.03 0.00 0.00 -1.50 0.00 0.00 178.83 176.48 2vak n ALA 321 N -2.19 2.52 -1.90 3.87 0.00 0.18 -4.94 120.51 118.06 2vak n ALA 321 Ca -0.02 -0.57 -0.35 0.00 0.00 0.00 0.00 53.44 52.49 2vak n ALA 321 Cb 0.15 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.49 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 -1.88 4.37 -1.17 0.00 -0.21 -0.87 -4.20 119.66 115.70 2vak s GLN 322 Ca 0.35 1.11 -0.05 0.00 0.02 0.00 0.00 55.36 56.79 2vak s GLN 322 Cb 0.20 -2.64 0.01 0.00 1.00 0.00 0.00 33.01 31.57 2vak s GLN 322 CO 0.30 0.22 0.72 0.09 -2.12 0.00 0.00 175.29 174.51 2vak n ASN 323 N 0.24 -5.37 -4.47 5.90 3.02 -1.25 -5.00 115.26 108.32 2vak n ASN 323 Ca 0.02 -0.33 -0.43 0.00 -0.03 0.00 0.00 54.58 53.81 2vak n ASN 323 Cb 0.51 -4.10 -0.07 0.00 -0.61 0.00 0.00 39.78 35.51 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 -5.76 3.13 0.02 3.52 6.06 -1.19 -4.97 118.95 119.77 2vak s ARG 324 Ca 0.36 -0.79 -0.38 0.00 -2.50 0.00 0.00 55.73 52.41 2vak s ARG 324 Cb -0.16 -4.03 -0.17 0.00 0.06 0.00 0.00 34.95 30.65 2vak s ARG 324 CO 0.44 -1.06 1.32 -2.30 -2.50 0.00 0.00 175.30 171.21 2vak n PRO 325 N 5.94 0.88 0.00 5.12 -0.02 -1.26 -0.99 135.00 144.67 2vak n PRO 325 Ca -0.06 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2vak n PRO 325 Cb 0.46 -1.93 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2vak n PRO 325 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vak n GLY 326 N 2.48 2.03 1.11 -1.23 0.00 -1.26 -4.79 105.19 103.52 2vak n GLY 326 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2vak n GLY 326 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2vak n PHE 327 N -2.00 -0.08 -4.05 1.61 7.35 -0.16 -4.67 117.46 115.46 2vak n PHE 327 Ca 0.00 0.01 -0.09 0.00 -0.76 0.00 0.00 57.45 56.62 2vak n PHE 327 Cb 0.00 0.05 -0.11 0.00 0.35 0.00 0.00 39.48 39.77 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 -5.31 0.46 -0.15 -2.13 1.04 -0.21 -0.34 113.70 107.06 2vak s SER 328 Ca 0.00 -0.75 -0.30 0.00 0.48 0.00 0.00 55.95 55.37 2vak s SER 328 Cb 0.00 0.14 0.13 0.00 0.10 0.00 0.00 66.02 66.39 2vak s SER 328 CO 0.00 -0.43 1.01 -0.32 0.98 0.00 0.00 173.24 174.48 2vak s MET 329 N -2.70 0.58 0.13 4.02 1.75 -0.61 -3.18 119.30 119.29 2vak s MET 329 Ca -0.04 0.09 -0.31 0.00 -1.25 0.00 0.00 55.69 54.18 2vak s MET 329 Cb -0.01 0.27 -0.09 0.00 2.84 0.00 0.00 34.83 37.84 2vak s MET 329 CO -0.05 -0.19 1.53 -0.80 -0.65 0.00 0.00 175.02 174.86 2vak s ASN 330 N -1.27 6.66 -0.15 1.11 0.01 -1.26 -0.63 114.94 119.41 2vak s ASN 330 Ca -0.00 2.49 0.00 0.00 -0.71 0.00 0.00 52.86 54.64 2vak s ASN 330 Cb -0.01 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.07 2vak s ASN 330 CO -0.00 -0.79 0.00 0.61 -1.51 0.00 0.00 177.10 175.41 2vak n GLY 331 N 3.72 0.52 3.19 0.66 0.00 -1.26 -4.96 105.19 107.06 2vak n GLY 331 Ca 0.14 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.59 -3.21 3.70 -0.02 0.00 -1.08 -4.91 105.19 97.07 2vak n GLY 332 Ca -0.01 -1.41 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 2vak n GLY 332 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vak s THR 333 N -2.56 3.53 0.73 2.61 2.01 0.20 -3.87 115.64 118.29 2vak s THR 333 Ca 0.66 0.98 -0.16 0.00 0.31 0.00 0.00 61.69 63.48 2vak s THR 333 Cb -0.08 -3.63 0.03 0.00 0.01 0.00 0.00 72.50 68.83 2vak s THR 333 CO 0.52 0.02 1.20 -0.81 -0.69 0.00 0.00 174.62 174.86 2vak n PRO 334 N 5.05 0.61 -3.66 4.92 -0.04 -1.26 0.42 135.00 141.04 2vak n PRO 334 Ca 0.13 0.27 -0.39 0.00 -0.04 0.00 0.00 63.50 63.47 2vak n PRO 334 Cb 0.43 -2.44 -0.11 0.00 -0.04 0.00 0.00 33.50 31.34 2vak n PRO 334 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2vak s VAL 335 N -1.77 4.08 0.73 0.52 1.01 -1.26 -4.15 120.40 119.56 2vak s VAL 335 Ca 0.77 -1.28 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 2vak s VAL 335 Cb -0.34 -3.42 0.03 0.00 0.00 0.00 0.00 36.38 32.65 2vak s VAL 335 CO 0.46 -0.37 1.07 -1.00 0.00 0.00 0.00 175.10 175.26 2vak s HIS 336 N 1.42 3.03 -0.01 5.22 3.76 0.55 -4.87 115.29 124.38 2vak s HIS 336 Ca 0.02 1.30 0.02 0.00 -0.15 0.00 0.00 55.06 56.25 2vak s HIS 336 Cb -0.21 -2.97 -0.00 0.00 1.11 0.00 0.00 32.58 30.50 2vak s HIS 336 CO 0.03 -1.42 -0.06 -1.83 -0.85 0.00 0.00 174.74 170.61 2vak s GLU 337 N -5.10 0.49 -0.17 1.40 -1.05 -1.26 -0.56 118.70 112.44 2vak s GLU 337 Ca 0.59 -0.20 0.01 0.00 -0.15 0.00 0.00 54.97 55.22 2vak s GLU 337 Cb -0.14 -0.48 0.02 0.00 -0.44 0.00 0.00 34.13 33.09 2vak s GLU 337 CO 0.55 0.11 -0.19 -0.51 0.95 0.00 0.00 175.26 176.16 2vak s LEU 338 N -0.06 2.06 -0.02 1.83 1.43 -0.12 -3.46 118.68 120.35 2vak s LEU 338 Ca 0.01 -0.62 -0.30 0.00 -1.03 0.00 0.00 54.13 52.19 2vak s LEU 338 Cb -0.03 -1.43 -0.05 0.00 0.03 0.00 0.00 46.19 44.70 2vak s LEU 338 CO -0.00 -0.00 1.49 0.21 0.23 0.00 0.00 176.35 178.28 2vak s ASN 339 N 1.28 6.78 0.36 2.29 3.84 -1.26 -0.85 114.94 127.37 2vak s ASN 339 Ca 0.04 2.16 0.13 0.00 0.21 0.00 0.00 52.86 55.40 2vak s ASN 339 Cb -0.13 -2.55 0.69 0.00 -0.55 0.00 0.00 41.25 38.71 2vak s ASN 339 CO -0.12 -0.80 1.80 -0.07 -2.79 0.00 0.00 177.10 175.12 2vak h LEU 340 N 9.01 0.00 0.00 3.21 3.38 -1.94 -1.85 115.31 127.12 2vak h LEU 340 Ca -0.38 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.53 2vak h LEU 340 Cb 1.17 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.93 2vak h LEU 340 CO 0.93 0.40 -0.25 0.25 0.09 0.00 0.00 178.44 179.86 2vak h LEU 341 N 0.00 0.21 -0.84 1.67 5.85 -1.97 -2.32 115.31 117.92 2vak h LEU 341 Ca -0.00 -0.79 0.21 0.00 0.84 0.00 0.00 57.88 58.14 2vak h LEU 341 Cb 0.72 -0.06 -0.14 0.00 0.37 0.00 0.00 40.66 41.55 2vak h LEU 341 CO 0.05 0.97 0.17 0.74 -0.34 0.00 0.00 178.44 180.03 2vak h THR 342 N -0.53 0.34 -0.34 1.05 2.02 -1.95 -1.83 112.91 111.67 2vak h THR 342 Ca -0.03 -0.06 -0.11 0.00 0.77 0.00 0.00 66.41 66.98 2vak h THR 342 Cb 1.01 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2vak h THR 342 CO 0.05 0.03 -0.22 0.74 0.37 0.00 0.00 175.52 176.49 2vak h THR 343 N 0.19 1.27 -0.14 3.16 2.02 -1.33 -1.94 112.91 116.14 2vak h THR 343 Ca 0.50 -1.30 -0.15 0.00 0.77 0.00 0.00 66.41 66.23 2vak h THR 343 Cb 0.97 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.62 2vak h THR 343 CO -0.65 0.43 -0.55 0.00 0.37 0.00 0.00 175.52 175.12 2vak h ALA 344 N 1.16 0.78 0.23 6.16 0.00 -0.87 0.18 119.26 126.89 2vak h ALA 344 Ca 0.08 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.47 2vak h ALA 344 Cb 0.70 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2vak h ALA 344 CO 0.05 0.69 -0.11 1.96 0.00 0.00 0.00 179.25 181.85 2vak h GLN 345 N 0.33 -0.29 -0.73 0.00 4.20 -1.14 -2.30 115.11 115.19 2vak h GLN 345 Ca 0.00 0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.79 2vak h GLN 345 Cb 1.07 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.86 2vak h GLN 345 CO 0.10 -0.08 0.43 0.93 -0.67 0.00 0.00 178.83 179.53 2vak h GLU 346 N -0.47 0.76 -0.85 1.46 4.39 -1.35 -1.37 114.58 117.16 2vak h GLU 346 Ca -0.03 -0.05 0.11 0.00 0.34 0.00 0.00 59.36 59.73 2vak h GLU 346 Cb 0.35 -0.17 -0.06 0.00 -0.10 0.00 0.00 28.75 28.77 2vak h GLU 346 CO 0.05 0.50 0.55 0.00 -1.16 0.00 0.00 179.01 178.96 2vak h ILE 348 N 0.78 1.32 -0.17 0.00 2.04 -0.96 -2.12 117.51 118.39 2vak h ILE 348 Ca 0.40 -2.23 -0.09 0.00 1.00 0.00 0.00 64.86 63.95 2vak h ILE 348 Cb 0.50 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 38.84 2vak h ILE 348 CO -0.17 0.68 -0.27 -0.09 0.00 0.00 0.00 178.15 178.30 2vak h ARG 349 N 0.37 0.32 -0.25 2.37 2.43 -0.88 -0.47 114.38 118.28 2vak h ARG 349 Ca -0.09 -0.12 -0.10 0.00 -0.81 0.00 0.00 59.98 58.87 2vak h ARG 349 Cb 1.56 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 31.08 2vak h ARG 349 CO 0.18 0.57 -0.25 1.96 -1.51 0.00 0.00 179.97 180.91 2vak h GLN 350 N 0.29 0.47 -0.01 0.20 1.08 -0.88 -2.13 115.11 114.12 2vak h GLN 350 Ca 0.04 -0.18 -0.26 0.00 -1.45 0.00 0.00 58.65 56.81 2vak h GLN 350 Cb 0.63 -0.03 0.02 0.00 -0.05 0.00 0.00 27.48 28.05 2vak h GLN 350 CO 0.05 0.69 -1.01 -1.49 -0.95 0.00 0.00 178.83 176.11 2vak h TRP 351 N 0.41 1.00 -0.76 2.96 6.55 -0.53 -1.01 115.95 124.58 2vak h TRP 351 Ca 0.06 -0.54 0.01 0.00 0.95 0.00 0.00 58.89 59.38 2vak h TRP 351 Cb 0.67 -0.12 -0.04 0.00 -0.86 0.00 0.00 29.16 28.81 2vak h TRP 351 CO 0.02 1.37 0.50 0.28 -1.05 0.00 0.00 178.44 179.56 2vak h VAL 352 N 0.39 1.17 -0.18 1.49 2.07 -1.16 0.61 116.25 120.64 2vak h VAL 352 Ca -0.12 -0.35 -0.10 0.00 0.82 0.00 0.00 66.70 66.96 2vak h VAL 352 Cb 1.66 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 2vak h VAL 352 CO 0.20 0.18 -0.27 0.24 0.02 0.00 0.00 177.57 177.94 2vak h MET 353 N 1.01 0.51 0.00 1.57 2.86 -1.33 -2.28 114.93 117.27 2vak h MET 353 Ca 0.29 -0.30 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2vak h MET 353 Cb -0.08 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.60 2vak h MET 353 CO -0.08 0.89 0.00 0.00 1.06 0.00 0.00 176.91 178.79 2vak h ALA 354 N 0.61 1.00 -0.75 6.32 0.00 -1.15 -3.45 119.26 121.83 2vak h ALA 354 Ca 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.91 2vak h ALA 354 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2vak h ALA 354 CO 0.06 0.00 -0.02 0.41 0.00 0.00 0.00 179.25 179.70 2vak n GLY 355 N -0.78 0.67 0.08 0.00 0.00 -0.66 -4.97 105.19 99.53 2vak n GLY 355 Ca -0.01 -0.73 0.08 0.00 0.00 0.00 0.00 46.02 45.36 2vak n GLY 355 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vak n LEU 356 N -0.45 0.53 -4.15 0.99 4.77 0.21 -4.87 117.00 114.03 2vak n LEU 356 Ca -0.00 0.21 -0.19 0.00 -0.03 0.00 0.00 56.01 56.00 2vak n LEU 356 Cb 0.50 0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.49 2vak n LEU 356 CO 0.02 -0.02 -0.46 0.68 -1.33 0.00 0.00 177.39 176.28 2vak s VAL 357 N -3.27 1.10 0.87 4.08 -7.23 -1.15 -5.00 120.40 109.80 2vak s VAL 357 Ca -0.04 -1.12 -0.11 0.00 -1.81 0.00 0.00 61.98 58.90 2vak s VAL 357 Cb 0.11 -1.02 0.12 0.00 0.56 0.00 0.00 36.38 36.14 2vak s VAL 357 CO 0.83 -0.10 1.10 -0.94 -0.31 0.00 0.00 175.10 175.69 2vak s SER 358 N -1.39 3.50 0.15 4.85 1.04 -1.26 -4.27 113.70 116.32 2vak s SER 358 Ca -0.00 1.84 0.14 0.00 0.48 0.00 0.00 55.95 58.40 2vak s SER 358 Cb -0.09 -2.44 0.66 0.00 0.10 0.00 0.00 66.02 64.26 2vak s SER 358 CO 0.02 -2.67 1.42 0.00 0.98 0.00 0.00 173.24 172.99 2vak n ALA 359 N -3.93 1.25 -0.09 5.32 0.00 -1.26 -1.20 120.51 120.59 2vak n ALA 359 Ca 0.09 0.07 -0.15 0.00 0.00 0.00 0.00 53.44 53.46 2vak n ALA 359 Cb 0.53 -1.21 -0.14 0.00 0.00 0.00 0.00 19.45 18.63 2vak n ALA 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vak n ALA 360 N -1.64 1.40 0.19 0.00 0.00 -1.26 -3.04 120.51 116.16 2vak n ALA 360 Ca 0.01 -1.09 0.07 0.00 0.00 0.00 0.00 53.44 52.42 2vak n ALA 360 Cb 0.08 -0.28 0.27 0.00 0.00 0.00 0.00 19.45 19.52 2vak n ALA 360 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2vak h LYS 361 N 0.01 0.00 0.00 0.00 3.64 -1.81 -1.77 116.57 116.64 2vak h LYS 361 Ca -0.52 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2vak h LYS 361 Cb 2.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.88 2vak h LYS 361 CO -0.01 0.32 -0.12 0.78 -2.27 0.00 0.00 179.45 178.15 2vak h GLY 362 N 2.73 0.00 0.58 5.01 0.00 -1.31 -2.15 103.07 107.93 2vak h GLY 362 Ca -0.00 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.14 2vak h GLY 362 CO 0.04 0.00 -0.85 1.46 0.00 0.00 0.00 176.54 177.19 2vak h GLN 363 N 0.00 0.25 -0.34 4.80 1.08 -1.44 -2.62 115.11 116.85 2vak h GLN 363 Ca 0.00 -0.43 0.07 0.00 -1.45 0.00 0.00 58.65 56.84 2vak h GLN 363 Cb 1.00 0.16 -0.08 0.00 -0.05 0.00 0.00 27.48 28.51 2vak h GLN 363 CO 0.00 1.21 -0.26 0.00 -0.95 0.00 0.00 178.83 178.82 2vak h ALA 364 N 0.04 -0.10 -0.33 3.87 0.00 -1.36 -1.45 119.26 119.93 2vak h ALA 364 Ca -0.16 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2vak h ALA 364 Cb 1.59 0.58 -0.02 0.00 0.00 0.00 0.00 17.79 19.94 2vak h ALA 364 CO 0.11 -0.67 0.20 -0.07 0.00 0.00 0.00 179.25 178.83 2vak h LEU 365 N -0.23 0.34 -2.28 0.00 3.38 -1.50 -0.31 115.31 114.71 2vak h LEU 365 Ca 0.16 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2vak h LEU 365 Cb 0.49 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 2vak h LEU 365 CO -0.47 0.25 -0.04 0.74 0.09 0.00 0.00 178.44 179.01 2vak h THR 366 N 0.42 0.56 0.13 0.22 2.02 -1.22 -1.72 112.91 113.33 2vak h THR 366 Ca 0.13 -0.17 -0.28 0.00 0.77 0.00 0.00 66.41 66.86 2vak h THR 366 Cb -0.02 1.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 2vak h THR 366 CO -0.05 0.04 -1.37 -0.61 0.37 0.00 0.00 175.52 173.90 2vak h GLN 367 N 0.00 0.28 -0.61 6.66 5.75 -0.32 -2.52 115.11 124.35 2vak h GLN 367 Ca -0.00 -0.48 0.10 0.00 -0.15 0.00 0.00 58.65 58.11 2vak h GLN 367 Cb 0.11 0.18 -0.07 0.00 1.07 0.00 0.00 27.48 28.76 2vak h GLN 367 CO 0.01 1.23 0.22 0.93 -2.65 0.00 0.00 178.83 178.56 2vak h GLU 368 N -0.24 0.38 0.27 1.69 5.08 -0.87 -2.28 114.58 118.60 2vak h GLU 368 Ca -0.28 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 2vak h GLU 368 Cb 1.80 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.96 2vak h GLU 368 CO 0.10 0.25 -0.17 0.00 -1.00 0.00 0.00 179.01 178.19 2vak h ALA 369 N 1.43 -0.41 -0.93 3.43 0.00 -1.39 -1.65 119.26 119.74 2vak h ALA 369 Ca 0.31 -0.08 0.11 0.00 0.00 0.00 0.00 54.91 55.26 2vak h ALA 369 Cb 0.40 0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.32 2vak h ALA 369 CO -0.32 -0.74 0.57 -0.91 0.00 0.00 0.00 179.25 177.84 2vak h ASN 370 N -0.42 0.82 1.19 0.00 2.35 -1.35 -0.34 115.58 117.82 2vak h ASN 370 Ca -0.02 0.05 -0.16 0.00 -0.55 0.00 0.00 56.30 55.62 2vak h ASN 370 Cb 0.36 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2vak h ASN 370 CO 0.02 0.44 -0.84 0.44 -1.65 0.00 0.00 177.43 175.85 2vak h ASP 371 N 0.91 0.00 -0.15 5.81 3.45 -1.34 -2.16 116.42 122.94 2vak h ASP 371 Ca 0.46 0.00 -0.17 0.00 0.43 0.00 0.00 57.03 57.75 2vak h ASP 371 Cb 0.45 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.23 2vak h ASP 371 CO -0.26 0.69 -0.57 0.15 -1.57 0.00 0.00 179.24 177.68 2vak h PHE 372 N 0.00 0.86 -0.57 4.55 3.57 -1.04 -2.59 116.94 121.73 2vak h PHE 372 Ca -0.04 -0.36 0.04 0.00 3.53 0.00 0.00 57.97 61.14 2vak h PHE 372 Cb 1.56 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 40.12 2vak h PHE 372 CO 0.00 1.16 0.32 1.03 -2.23 0.00 0.00 178.31 178.59 2vak h SER 373 N 0.31 0.49 -0.71 0.41 0.87 -1.03 -0.60 113.55 113.30 2vak h SER 373 Ca -0.03 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2vak h SER 373 Cb 1.20 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 63.05 2vak h SER 373 CO 0.12 0.34 0.46 0.78 -0.53 0.00 0.00 176.83 178.00 2vak h ASN 374 N 0.62 0.81 -0.96 6.23 2.35 -1.41 0.30 115.58 123.51 2vak h ASN 374 Ca 0.24 -0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.98 2vak h ASN 374 Cb 0.09 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.21 2vak h ASN 374 CO -0.14 0.60 0.64 0.25 -1.65 0.00 0.00 177.43 177.13 2vak h LEU 375 N 0.96 1.09 0.16 1.61 6.46 -1.01 -2.37 115.31 122.21 2vak h LEU 375 Ca 0.26 -0.02 -0.31 0.00 -0.12 0.00 0.00 57.88 57.68 2vak h LEU 375 Cb -0.10 -0.27 0.03 0.00 -0.73 0.00 0.00 40.66 39.60 2vak h LEU 375 CO -0.05 0.78 -1.31 0.40 -0.62 0.00 0.00 178.44 177.63 2vak h ILE 376 N 1.28 1.28 -0.77 4.05 1.08 -0.64 -2.87 117.51 120.93 2vak h ILE 376 Ca 0.36 -2.53 0.02 0.00 -0.39 0.00 0.00 64.86 62.32 2vak h ILE 376 Cb -0.10 2.82 -0.04 0.00 -3.07 0.00 0.00 36.82 36.42 2vak h ILE 376 CO -0.09 0.77 0.51 -0.61 -0.69 0.00 0.00 178.15 178.04 2vak h GLN 377 N 0.22 0.96 -0.11 2.37 4.15 -0.37 -0.83 115.11 121.50 2vak h GLN 377 Ca -0.21 -0.06 -0.23 0.00 0.77 0.00 0.00 58.65 58.92 2vak h GLN 377 Cb 1.99 -0.22 0.01 0.00 0.21 0.00 0.00 27.48 29.48 2vak h GLN 377 CO 0.25 0.63 -0.83 0.00 -1.93 0.00 0.00 178.83 176.96 2vak h ALA 378 N 1.54 0.32 0.39 3.38 0.00 -1.48 -1.23 119.26 122.16 2vak h ALA 378 Ca 0.30 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2vak h ALA 378 Cb -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2vak h ALA 378 CO -0.08 0.70 -0.19 -0.44 0.00 0.00 0.00 179.25 179.25 2vak h ASP 379 N 0.48 -0.44 -0.25 0.00 3.32 -1.30 -2.24 116.42 115.99 2vak h ASP 379 Ca -0.06 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 56.85 2vak h ASP 379 Cb 1.45 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 41.10 2vak h ASP 379 CO 0.16 -0.14 0.06 -0.07 -1.72 0.00 0.00 179.24 177.54 2vak h LEU 380 N -0.76 0.45 -0.74 1.55 3.38 -1.25 -1.73 115.31 116.21 2vak h LEU 380 Ca -0.05 -0.06 0.13 0.00 0.09 0.00 0.00 57.88 57.99 2vak h LEU 380 Cb 0.52 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 41.06 2vak h LEU 380 CO 0.09 0.47 0.30 1.23 0.09 0.00 0.00 178.44 180.61 2vak h GLY 381 N 0.73 1.11 0.81 0.83 0.00 -1.18 0.82 103.07 106.20 2vak h GLY 381 Ca 0.11 -0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 2vak h GLY 381 CO -0.00 -0.08 0.02 1.46 0.00 0.00 0.00 176.54 177.94 2vak h GLN 382 N 0.45 0.09 -0.01 4.80 1.08 -0.70 -0.73 115.11 120.09 2vak h GLN 382 Ca 0.40 -0.02 0.02 0.00 -1.45 0.00 0.00 58.65 57.60 2vak h GLN 382 Cb 0.58 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.97 2vak h GLN 382 CO -0.38 0.27 -0.14 0.82 -0.95 0.00 0.00 178.83 178.44 2vak h ILE 383 N -0.10 0.65 -0.44 2.54 2.04 -1.28 -1.02 117.51 119.90 2vak h ILE 383 Ca 0.02 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.91 2vak h ILE 383 Cb 0.22 0.65 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 2vak h ILE 383 CO -0.00 0.00 0.23 0.50 0.00 0.00 0.00 178.15 178.88 2vak h LYS 384 N -0.23 0.45 -0.38 2.37 3.64 -0.82 0.23 116.57 121.84 2vak h LYS 384 Ca 0.05 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.40 2vak h LYS 384 Cb 0.30 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2vak h LYS 384 CO -0.15 0.30 0.22 0.00 -2.27 0.00 0.00 179.45 177.55 2vak h ALA 385 N 1.23 0.48 -0.06 5.00 0.00 -0.90 0.21 119.26 125.22 2vak h ALA 385 Ca 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2vak h ALA 385 Cb 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2vak h ALA 385 CO -0.12 -0.01 -0.13 1.96 0.00 0.00 0.00 179.25 180.94 2vak h GLN 386 N 0.49 0.19 -0.58 0.00 4.20 -1.10 -2.71 115.11 115.60 2vak h GLN 386 Ca 0.13 -0.13 0.07 0.00 0.06 0.00 0.00 58.65 58.78 2vak h GLN 386 Cb 0.02 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 27.76 2vak h GLN 386 CO -0.02 0.73 0.27 -0.44 -0.67 0.00 0.00 178.83 178.69 2vak h ASP 387 N -0.31 0.35 -0.57 1.46 5.19 -0.47 0.11 116.42 122.17 2vak h ASP 387 Ca 0.00 0.05 -0.00 0.00 -0.62 0.00 0.00 57.03 56.46 2vak h ASP 387 Cb 0.73 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 40.20 2vak h ASP 387 CO 0.03 0.22 0.36 0.44 -3.12 0.00 0.00 179.24 177.17 2vak h ASP 388 N 0.50 0.68 -0.06 6.45 3.45 -0.61 0.29 116.42 127.12 2vak h ASP 388 Ca 0.27 -0.05 -0.11 0.00 0.43 0.00 0.00 57.03 57.58 2vak h ASP 388 Cb 0.25 -0.17 0.01 0.00 -0.56 0.00 0.00 39.33 38.85 2vak h ASP 388 CO -0.22 0.52 -0.38 0.00 -1.57 0.00 0.00 179.24 177.59 2vak h ALA 389 N 1.18 0.13 -0.34 3.45 0.00 -1.13 -2.32 119.26 120.24 2vak h ALA 389 Ca 0.21 -0.47 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 2vak h ALA 389 Cb -0.04 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2vak h ALA 389 CO -0.04 0.23 -0.19 -0.07 0.00 0.00 0.00 179.25 179.18 2vak h LEU 390 N -0.13 0.63 -0.66 0.00 3.38 -0.75 -2.29 115.31 115.49 2vak h LEU 390 Ca -0.03 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.74 2vak h LEU 390 Cb 1.04 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 2vak h LEU 390 CO 0.08 0.83 0.41 0.22 0.09 0.00 0.00 178.44 180.07 2vak h TYR 391 N 0.57 0.85 0.00 1.13 5.03 -0.42 -0.47 116.97 123.65 2vak h TYR 391 Ca 0.09 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.38 2vak h TYR 391 Cb 0.64 -0.28 -0.00 0.00 1.55 0.00 0.00 36.73 38.63 2vak h TYR 391 CO 0.03 0.56 -0.15 -0.97 -1.32 0.00 0.00 178.16 176.31 2vak h ASN 392 N 0.89 0.00 0.00 -2.11 -1.24 -1.02 -3.40 115.58 108.71 2vak h ASN 392 Ca 0.24 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.25 2vak h ASN 392 Cb -0.06 0.00 0.00 0.00 0.73 0.00 0.00 38.32 38.99 2vak h ASN 392 CO -0.05 0.15 -0.97 0.00 -1.29 0.00 0.00 177.43 175.27 2vak n GLN 393 N -3.53 0.71 -3.58 6.67 6.02 -0.90 -4.98 117.38 117.80 2vak n GLN 393 Ca -0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.57 2vak n GLN 393 Cb 0.30 -0.99 -0.11 0.00 1.02 0.00 0.00 30.24 30.46 2vak n GLN 393 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2vak s GLN 394 N -1.97 3.10 0.31 -1.09 2.00 -0.21 -5.07 119.66 116.73 2vak s GLN 394 Ca 0.00 -0.90 -0.29 0.00 -2.00 0.00 0.00 55.36 52.17 2vak s GLN 394 Cb 0.00 -3.74 -0.11 0.00 0.80 0.00 0.00 33.01 29.96 2vak s GLN 394 CO 0.00 -0.59 1.49 -2.14 -0.50 0.00 0.00 175.29 173.55 2vak s PRO 395 N 1.62 4.19 0.00 1.67 0.02 -1.26 -2.53 135.00 138.70 2vak s PRO 395 Ca 0.04 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.52 2vak s PRO 395 Cb -0.18 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.30 2vak s PRO 395 CO 0.08 -0.49 0.00 0.41 -0.33 0.00 0.00 177.00 176.67 2vak n GLY 396 N 1.49 0.50 3.70 0.52 0.00 -1.26 -5.03 105.19 105.12 2vak n GLY 396 Ca 0.05 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.00 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 3.36 -0.36 1.61 5.04 -1.05 -4.70 117.35 119.25 2vak s TYR 397 Ca 0.00 1.30 -0.13 0.00 -2.44 0.00 0.00 57.07 55.79 2vak s TYR 397 Cb 0.00 -3.40 -0.01 0.00 0.35 0.00 0.00 41.96 38.90 2vak s TYR 397 CO 0.00 -1.21 0.26 0.00 -1.34 0.00 0.00 175.55 173.26 2vak s ALA 398 N 1.47 3.50 0.49 3.97 0.00 -1.26 -3.62 121.76 126.31 2vak s ALA 398 Ca 0.57 -1.47 -0.22 0.00 0.00 0.00 0.00 51.96 50.84 2vak s ALA 398 Cb -0.27 -2.73 -0.06 0.00 0.00 0.00 0.00 23.12 20.05 2vak s ALA 398 CO 0.27 -1.10 1.23 1.03 0.00 0.00 0.00 175.76 177.19 2vak s ARG 399 N 1.72 3.55 0.01 0.00 0.52 -0.37 -4.95 118.95 119.43 2vak s ARG 399 Ca 0.06 1.93 0.21 0.00 -0.52 0.00 0.00 55.73 57.41 2vak s ARG 399 Cb -0.18 -2.35 -0.22 0.00 0.52 0.00 0.00 34.95 32.72 2vak s ARG 399 CO 0.10 -0.77 0.60 0.54 0.02 0.00 0.00 175.30 175.79 2vak n ARG 400 N -0.67 0.65 -4.06 3.54 1.74 -1.26 -4.93 116.66 111.66 2vak n ARG 400 Ca 0.08 -0.04 -0.10 0.00 -0.77 0.00 0.00 57.85 57.03 2vak n ARG 400 Cb 0.47 -1.63 -0.07 0.00 -1.02 0.00 0.00 32.46 30.21 2vak n ARG 400 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2vak s ILE 401 N -3.25 0.00 0.30 0.55 -4.36 -1.26 -4.39 121.20 108.79 2vak s ILE 401 Ca -0.06 -1.60 -0.29 0.00 -0.26 0.00 0.00 60.65 58.44 2vak s ILE 401 Cb 0.11 -2.30 -0.10 0.00 1.25 0.00 0.00 42.46 41.42 2vak s ILE 401 CO 0.86 0.00 1.27 -0.75 0.24 0.00 0.00 174.94 176.56 2vak s LYS 402 N -4.04 4.41 0.31 0.37 2.20 -1.26 -4.97 119.74 116.75 2vak s LYS 402 Ca 0.28 2.12 -0.28 0.00 -0.36 0.00 0.00 55.97 57.72 2vak s LYS 402 Cb 0.02 -3.11 -0.13 0.00 -1.51 0.00 0.00 37.83 33.10 2vak s LYS 402 CO 0.10 -0.13 1.19 -2.30 -0.36 0.00 0.00 175.35 173.86 2vak n PRO 403 N 1.16 1.79 -4.37 4.03 -0.02 -1.26 -5.02 135.00 131.32 2vak n PRO 403 Ca 0.01 0.63 -0.19 0.00 -2.02 0.00 0.00 63.50 61.93 2vak n PRO 403 Cb 0.42 -2.14 -0.10 0.00 -0.02 0.00 0.00 33.50 31.67 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 -0.95 1.67 0.21 6.00 -0.71 -1.26 -4.99 117.98 117.96 2vak s PHE 404 Ca 0.58 -1.16 0.10 0.00 -1.04 0.00 0.00 56.93 55.41 2vak s PHE 404 Cb -0.64 -1.01 -0.04 0.00 -1.21 0.00 0.00 43.02 40.12 2vak s PHE 404 CO 0.60 -0.27 -0.11 0.14 -1.34 0.00 0.00 175.22 174.24 2vak s VAL 405 N -3.59 3.03 0.17 -2.49 -7.23 -1.26 -5.05 120.40 103.99 2vak s VAL 405 Ca 0.36 -1.87 0.16 0.00 -1.81 0.00 0.00 61.98 58.83 2vak s VAL 405 Cb 0.07 -2.54 0.09 0.00 0.56 0.00 0.00 36.38 34.56 2vak s VAL 405 CO 0.15 -0.21 1.68 0.78 -0.31 0.00 0.00 175.10 177.19 2vak h ASN 406 N 2.63 0.00 -0.69 4.85 2.35 -2.02 -2.72 115.58 119.98 2vak h ASN 406 Ca -0.45 0.00 0.20 0.00 -0.55 0.00 0.00 56.30 55.50 2vak h ASN 406 Cb 1.22 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.56 2vak h ASN 406 CO 0.55 0.45 0.50 1.23 -1.65 0.00 0.00 177.43 178.51 2vak h GLY 407 N 2.11 0.00 1.48 2.83 0.00 -1.99 -1.89 103.07 105.61 2vak h GLY 407 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2vak h GLY 407 CO 0.06 0.00 0.15 1.22 0.00 0.00 0.00 176.54 177.97 2vak n ASP 408 N -4.31 0.12 0.06 0.19 8.00 -1.03 -1.63 116.55 117.96 2vak n ASP 408 Ca 0.14 0.45 0.12 0.00 0.71 0.00 0.00 54.79 56.20 2vak n ASP 408 Cb 0.77 -0.44 0.12 0.00 -0.02 0.00 0.00 41.12 41.55 2vak n ASP 408 CO 0.00 0.00 0.00 -0.50 -0.39 0.00 0.00 177.20 176.31 2vak h TRP 409 N 0.00 0.00 -4.24 1.24 4.06 -1.57 -3.30 115.95 112.14 2vak h TRP 409 Ca 0.00 0.00 -0.50 0.00 2.06 0.00 0.00 58.89 60.45 2vak h TRP 409 Cb 0.30 0.00 0.13 0.00 -1.00 0.00 0.00 29.16 28.59 2vak h TRP 409 CO 0.00 0.00 0.30 0.95 -3.56 0.00 0.00 178.44 176.13 2vak s THR 410 N -3.20 3.17 0.36 1.49 -4.23 -0.65 -4.95 115.64 107.63 2vak s THR 410 Ca 0.05 0.38 0.31 0.00 -1.18 0.00 0.00 61.69 61.25 2vak s THR 410 Cb 0.13 -2.90 0.33 0.00 1.34 0.00 0.00 72.50 71.40 2vak s THR 410 CO 0.74 -0.50 2.08 -0.65 -0.54 0.00 0.00 174.62 175.76 2vak h PRO 411 N -1.22 0.00 0.00 3.99 0.11 -1.89 -3.45 132.00 129.54 2vak h PRO 411 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2vak h PRO 411 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2vak h PRO 411 CO 0.53 0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.82 2vak n GLY 412 N -0.51 2.58 2.10 -0.55 0.00 -1.26 -1.56 105.19 105.99 2vak n GLY 412 Ca -0.01 0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 2vak n GLY 412 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vak n MET 413 N 14.00 2.41 -0.27 1.61 2.81 -1.26 -4.56 117.12 131.85 2vak n MET 413 Ca 0.00 -2.79 0.07 0.00 -1.81 0.00 0.00 57.70 53.18 2vak n MET 413 Cb 0.00 -2.10 0.22 0.00 -0.71 0.00 0.00 33.22 30.63 2vak n MET 413 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2vak h THR 414 N 1.21 0.59 -0.29 2.03 2.02 -1.31 -2.87 112.91 114.29 2vak h THR 414 Ca 0.53 -0.14 0.01 0.00 0.77 0.00 0.00 66.41 67.57 2vak h THR 414 Cb 2.64 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 69.18 2vak h THR 414 CO 0.96 0.08 0.18 0.00 0.37 0.00 0.00 175.52 177.11 2vak h ALA 415 N 1.60 0.36 -0.17 6.16 0.00 -1.85 -0.67 119.26 124.69 2vak h ALA 415 Ca 0.45 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.37 2vak h ALA 415 Cb 0.74 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 2vak h ALA 415 CO -0.45 -0.18 0.03 1.96 0.00 0.00 0.00 179.25 180.60 2vak h GLN 416 N 0.37 0.09 -0.95 0.00 7.50 -1.91 -1.78 115.11 118.43 2vak h GLN 416 Ca 0.11 -0.01 0.07 0.00 0.50 0.00 0.00 58.65 59.32 2vak h GLN 416 Cb -0.03 -0.02 -0.07 0.00 0.05 0.00 0.00 27.48 27.41 2vak h GLN 416 CO -0.03 0.06 0.61 0.00 -1.50 0.00 0.00 178.83 177.96 2vak h ALA 417 N 1.13 1.33 0.00 3.87 0.00 -1.23 0.88 119.26 125.24 2vak h ALA 417 Ca 0.08 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 2vak h ALA 417 Cb 0.07 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2vak h ALA 417 CO -0.11 0.36 -0.51 -0.07 0.00 0.00 0.00 179.25 178.93 2vak h LEU 418 N 1.08 0.00 0.05 0.00 3.38 -0.84 -0.89 115.31 118.10 2vak h LEU 418 Ca 0.42 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.32 2vak h LEU 418 Cb 0.20 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.96 2vak h LEU 418 CO -0.18 0.51 -0.29 0.00 0.09 0.00 0.00 178.44 178.56 2vak h ALA 419 N 1.49 -0.03 -0.53 1.53 0.00 -0.42 -2.07 119.26 119.24 2vak h ALA 419 Ca -0.01 -0.57 0.08 0.00 0.00 0.00 0.00 54.91 54.42 2vak h ALA 419 Cb 1.05 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 2vak h ALA 419 CO 0.07 0.13 -0.43 0.28 0.00 0.00 0.00 179.25 179.30 2vak h VAL 420 N -0.77 0.10 -0.04 0.00 2.07 -0.90 -2.88 116.25 113.83 2vak h VAL 420 Ca -0.05 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 2vak h VAL 420 Cb 1.23 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 2vak h VAL 420 CO 0.05 0.00 -0.17 -0.07 0.02 0.00 0.00 177.57 177.40 2vak h LEU 421 N -0.26 0.06 -1.72 2.57 3.38 -1.20 -2.00 115.31 116.14 2vak h LEU 421 Ca 0.17 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2vak h LEU 421 Cb 0.57 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.30 2vak h LEU 421 CO -0.65 0.24 -0.12 0.00 0.09 0.00 0.00 178.44 178.00 2vak h ALA 422 N 1.77 1.14 0.00 1.53 0.00 -1.14 -2.03 119.26 120.53 2vak h ALA 422 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2vak h ALA 422 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2vak h ALA 422 CO 0.02 0.15 0.00 0.25 0.00 0.00 0.00 179.25 179.67 2vak n THR 423 N -3.44 0.46 1.27 0.00 -2.24 -0.75 -3.95 114.28 105.62 2vak n THR 423 Ca -0.01 0.11 0.13 0.00 -2.27 0.00 0.00 64.05 62.02 2vak n THR 423 Cb 0.29 -0.79 0.68 0.00 -2.10 0.00 0.00 70.33 68.40 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 -1.33 0.00 0.81 4.78 3.01 -0.76 -2.26 117.46 121.71 2vak n PHE 424 Ca 0.08 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.65 2vak n PHE 424 Cb 0.17 -0.29 0.10 0.00 -0.01 0.00 0.00 39.48 39.46 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 -1.29 0.06 1.53 4.37 -2.24 -1.25 -4.81 114.28 110.65 2vak n THR 425 Ca 0.13 -0.53 0.14 0.00 -2.27 0.00 0.00 64.05 61.52 2vak n THR 425 Cb 0.21 1.38 0.55 0.00 -2.10 0.00 0.00 70.33 70.37 2vak n THR 425 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50