#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vdk s ILE 5 N 0.00 1.36 0.15 8.89 1.01 -1.26 -0.88 121.20 130.47 1vdk s ILE 5 Ca 0.00 -1.01 -0.10 0.00 0.00 0.00 0.00 60.65 59.55 1vdk s ILE 5 Cb 0.00 -1.61 -0.06 0.00 0.01 0.00 0.00 42.46 40.80 1vdk s ILE 5 CO 0.00 -0.03 0.47 -1.61 0.00 0.00 0.00 174.94 173.77 1vdk s GLU 6 N 1.49 3.79 -0.09 2.79 2.02 -0.51 -4.90 118.70 123.30 1vdk s GLU 6 Ca -0.03 0.22 0.02 0.00 0.02 0.00 0.00 54.97 55.20 1vdk s GLU 6 Cb -0.18 -2.86 0.01 0.00 0.10 0.00 0.00 34.13 31.21 1vdk s GLU 6 CO -0.07 0.46 -0.14 1.03 0.02 0.00 0.00 175.26 176.56 1vdk s ARG 7 N -2.30 1.96 0.36 1.61 0.52 -1.26 -1.34 118.95 118.50 1vdk s ARG 7 Ca 0.39 -0.48 0.07 0.00 -0.52 0.00 0.00 55.73 55.19 1vdk s ARG 7 Cb -0.13 -1.67 -0.03 0.00 0.52 0.00 0.00 34.95 33.65 1vdk s ARG 7 CO 0.20 -0.03 0.25 0.16 0.02 0.00 0.00 175.30 175.90 1vdk s ASP 8 N 0.89 2.02 0.13 0.23 1.47 -0.78 -5.01 116.67 115.62 1vdk s ASP 8 Ca -0.10 -1.76 0.10 0.00 1.18 0.00 0.00 52.55 51.98 1vdk s ASP 8 Cb -0.15 0.57 0.54 0.00 -0.34 0.00 0.00 42.92 43.54 1vdk s ASP 8 CO 0.01 -1.05 1.32 0.35 0.68 0.00 0.00 175.17 176.48 1vdk n THR 9 N -0.71 1.50 0.73 2.11 -2.24 -1.26 -1.02 114.28 113.38 1vdk n THR 9 Ca 0.04 0.55 0.11 0.00 -2.27 0.00 0.00 64.05 62.48 1vdk n THR 9 Cb 0.63 -1.53 0.07 0.00 -2.10 0.00 0.00 70.33 67.40 1vdk n THR 9 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1vdk n MET 10 N -1.82 0.18 0.00 -0.78 2.81 -1.26 -5.07 117.12 111.18 1vdk n MET 10 Ca -0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1vdk n MET 10 Cb 0.04 -1.56 0.00 0.00 -0.71 0.00 0.00 33.22 30.99 1vdk n MET 10 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1vdk n GLY 11 N 1.42 0.72 3.86 3.03 0.00 -0.19 -5.08 105.19 108.95 1vdk n GLY 11 Ca 0.03 -2.10 -0.37 0.00 0.00 0.00 0.00 46.02 43.59 1vdk n GLY 11 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vdk s GLU 12 N -1.08 3.41 0.02 1.61 2.02 -1.26 -1.87 118.70 121.56 1vdk s GLU 12 Ca 0.00 -0.16 0.04 0.00 0.02 0.00 0.00 54.97 54.87 1vdk s GLU 12 Cb 0.00 -3.16 -0.02 0.00 0.10 0.00 0.00 34.13 31.06 1vdk s GLU 12 CO 0.00 0.76 -0.11 0.08 0.02 0.00 0.00 175.26 176.01 1vdk s VAL 13 N -0.98 0.84 -0.23 2.63 1.01 -0.45 -4.99 120.40 118.23 1vdk s VAL 13 Ca 0.15 -0.73 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 1vdk s VAL 13 Cb -0.12 -0.76 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1vdk s VAL 13 CO 0.04 0.04 0.34 -0.13 0.00 0.00 0.00 175.10 175.39 1vdk s ARG 14 N -0.78 4.10 -0.01 2.72 0.52 -1.26 -1.42 118.95 122.83 1vdk s ARG 14 Ca 0.01 0.06 0.08 0.00 -0.52 0.00 0.00 55.73 55.35 1vdk s ARG 14 Cb -0.06 -3.57 -0.02 0.00 0.52 0.00 0.00 34.95 31.82 1vdk s ARG 14 CO 0.00 -0.09 -0.24 0.08 0.02 0.00 0.00 175.30 175.07 1vdk s VAL 15 N 1.49 1.90 -0.00 3.52 1.01 -0.06 -4.97 120.40 123.30 1vdk s VAL 15 Ca 0.15 -1.06 -0.37 0.00 0.00 0.00 0.00 61.98 60.70 1vdk s VAL 15 Cb -0.15 -1.59 -0.15 0.00 0.00 0.00 0.00 36.38 34.49 1vdk s VAL 15 CO 0.08 0.51 1.54 -2.65 0.00 0.00 0.00 175.10 174.57 1vdk n PRO 16 N 2.40 1.46 -0.08 2.72 -0.02 -1.26 0.49 135.00 140.71 1vdk n PRO 16 Ca -0.16 0.53 0.26 0.00 -2.02 0.00 0.00 63.50 62.11 1vdk n PRO 16 Cb 0.52 -2.23 0.71 0.00 -0.02 0.00 0.00 33.50 32.47 1vdk n PRO 16 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1vdk h ALA 17 N 5.95 2.56 0.00 3.55 0.00 -1.98 0.11 119.26 129.45 1vdk h ALA 17 Ca -0.47 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1vdk h ALA 17 Cb 1.31 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1vdk h ALA 17 CO 0.86 -1.03 -0.68 -0.40 0.00 0.00 0.00 179.25 178.00 1vdk n ASP 18 N -3.87 0.60 -4.82 0.00 5.68 -1.26 -4.83 116.55 108.05 1vdk n ASP 18 Ca 0.15 -0.19 -0.37 0.00 -0.50 0.00 0.00 54.79 53.88 1vdk n ASP 18 Cb 0.92 0.39 -0.06 0.00 -1.14 0.00 0.00 41.12 41.23 1vdk n ASP 18 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1vdk s LYS 19 N -3.09 4.13 0.00 0.11 -0.14 0.38 -5.00 119.74 116.14 1vdk s LYS 19 Ca 0.08 0.67 0.24 0.00 -1.36 0.00 0.00 55.97 55.60 1vdk s LYS 19 Cb 0.16 -3.06 0.39 0.00 -1.68 0.00 0.00 37.83 33.64 1vdk s LYS 19 CO 0.74 0.54 1.38 0.66 -0.76 0.00 0.00 175.35 177.90 1vdk n TYR 20 N 1.20 0.21 -1.87 3.18 4.02 -1.26 -4.82 117.16 117.81 1vdk n TYR 20 Ca -0.07 -0.11 -0.30 0.00 -0.01 0.00 0.00 57.90 57.41 1vdk n TYR 20 Cb 0.51 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.88 1vdk n TYR 20 CO 0.00 0.00 0.00 1.67 -1.01 0.00 0.00 176.86 177.52 1vdk s TRP 21 N -1.79 3.33 0.00 -0.72 -2.14 -1.26 -3.63 118.94 112.73 1vdk s TRP 21 Ca 0.33 1.07 0.00 0.00 2.66 0.00 0.00 56.10 60.16 1vdk s TRP 21 Cb 0.21 -3.04 0.00 0.00 -3.10 0.00 0.00 33.47 27.54 1vdk s TRP 21 CO 0.31 -1.16 0.00 0.41 -2.66 0.00 0.00 176.95 173.85 1vdk n GLY 22 N -2.96 2.13 0.28 3.67 0.00 -1.26 -4.91 105.19 102.14 1vdk n GLY 22 Ca 0.07 -2.07 -0.06 0.00 0.00 0.00 0.00 46.02 43.96 1vdk n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vdk h ALA 23 N -0.44 0.87 -0.52 4.61 0.00 -1.93 -1.75 119.26 120.10 1vdk h ALA 23 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1vdk h ALA 23 Cb 0.00 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1vdk h ALA 23 CO 0.00 0.37 0.33 1.96 0.00 0.00 0.00 179.25 181.91 1vdk h GLN 24 N 0.93 0.69 -0.40 0.00 4.20 -1.96 -0.68 115.11 117.89 1vdk h GLN 24 Ca 0.24 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.78 1vdk h GLN 24 Cb 0.01 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1vdk h GLN 24 CO -0.04 0.47 -0.22 1.15 -0.67 0.00 0.00 178.83 179.52 1vdk h THR 25 N 0.70 1.27 -0.64 -0.54 2.02 -1.86 -1.03 112.91 112.83 1vdk h THR 25 Ca 0.19 -1.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.01 1vdk h THR 25 Cb -0.05 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 1vdk h THR 25 CO -0.04 0.45 0.32 -0.61 0.37 0.00 0.00 175.52 176.01 1vdk h GLN 26 N 0.70 0.91 -0.43 6.66 5.75 -0.93 0.35 115.11 128.12 1vdk h GLN 26 Ca 0.10 -0.12 -0.06 0.00 -0.15 0.00 0.00 58.65 58.41 1vdk h GLN 26 Cb 0.74 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.11 1vdk h GLN 26 CO 0.06 0.71 0.02 0.00 -2.65 0.00 0.00 178.83 176.97 1vdk h ARG 27 N 0.87 0.74 -0.73 1.69 3.08 -0.96 -2.50 114.38 116.59 1vdk h ARG 27 Ca 0.22 -0.23 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1vdk h ARG 27 Cb 0.09 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.04 1vdk h ARG 27 CO -0.03 0.81 0.24 0.77 -1.07 0.00 0.00 179.97 180.68 1vdk h SER 28 N 0.59 1.04 -0.25 7.04 0.02 -0.73 -0.79 113.55 120.47 1vdk h SER 28 Ca 0.12 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 1vdk h SER 28 Cb 0.46 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1vdk h SER 28 CO 0.02 0.96 0.12 0.25 -1.14 0.00 0.00 176.83 177.04 1vdk h LEU 29 N 1.08 0.37 0.00 5.07 5.85 -0.14 -0.43 115.31 127.10 1vdk h LEU 29 Ca 0.24 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1vdk h LEU 29 Cb 0.29 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1vdk h LEU 29 CO -0.01 0.34 -0.53 -0.33 -0.34 0.00 0.00 178.44 177.58 1vdk h GLU 30 N 0.42 0.00 0.02 1.25 5.08 -0.94 -3.39 114.58 117.01 1vdk h GLU 30 Ca 0.11 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 58.09 1vdk h GLU 30 Cb 0.09 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 1vdk h GLU 30 CO -0.01 0.00 -2.37 0.09 -1.00 0.00 0.00 179.01 175.72 1vdk n ASN 31 N -2.65 1.51 -4.45 1.42 3.02 -0.36 -4.83 115.26 108.91 1vdk n ASN 31 Ca 0.02 -0.04 -0.44 0.00 -0.03 0.00 0.00 54.58 54.10 1vdk n ASN 31 Cb 0.51 -0.14 -0.05 0.00 -0.61 0.00 0.00 39.78 39.49 1vdk n ASN 31 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1vdk s PHE 32 N -2.52 2.91 -0.22 3.10 0.08 -0.23 -4.90 117.98 116.20 1vdk s PHE 32 Ca -0.27 -0.52 0.12 0.00 0.12 0.00 0.00 56.93 56.39 1vdk s PHE 32 Cb 0.08 -3.90 0.43 0.00 -0.57 0.00 0.00 43.02 39.06 1vdk s PHE 32 CO 0.68 -1.28 1.29 0.54 -0.10 0.00 0.00 175.22 176.36 1vdk n ARG 33 N 6.79 1.70 -3.41 0.44 5.12 -1.26 -4.77 116.66 121.26 1vdk n ARG 33 Ca -0.05 -3.13 -0.39 0.00 -1.93 0.00 0.00 57.85 52.35 1vdk n ARG 33 Cb 0.45 -1.67 -0.09 0.00 -1.16 0.00 0.00 32.46 29.98 1vdk n ARG 33 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1vdk s ILE 34 N -3.16 5.18 -1.17 0.55 1.01 -1.26 -4.37 121.20 117.98 1vdk s ILE 34 Ca 0.39 0.37 -0.06 0.00 0.00 0.00 0.00 60.65 61.36 1vdk s ILE 34 Cb 0.36 -3.72 0.01 0.00 0.01 0.00 0.00 42.46 39.12 1vdk s ILE 34 CO -0.02 0.09 0.75 0.61 0.00 0.00 0.00 174.94 176.37 1vdk n GLY 35 N 4.81 -0.27 0.35 6.18 0.00 -1.26 -4.53 105.19 110.46 1vdk n GLY 35 Ca -0.09 0.02 0.02 0.00 0.00 0.00 0.00 46.02 45.97 1vdk n GLY 35 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1vdk h THR 36 N -1.72 1.16 -0.17 2.61 1.35 -1.90 0.41 112.91 114.66 1vdk h THR 36 Ca -0.45 -0.32 -0.04 0.00 -0.55 0.00 0.00 66.41 65.05 1vdk h THR 36 Cb 1.30 0.13 -0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1vdk h THR 36 CO 0.45 0.17 -0.06 0.44 -0.25 0.00 0.00 175.52 176.27 1vdk h ASP 37 N 0.95 0.34 0.00 5.36 3.32 -1.95 -3.38 116.42 121.05 1vdk h ASP 37 Ca 0.27 -0.40 0.00 0.00 0.02 0.00 0.00 57.03 56.92 1vdk h ASP 37 Cb -0.06 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.39 1vdk h ASP 37 CO -0.06 0.66 -0.78 0.54 -1.72 0.00 0.00 179.24 177.87 1vdk n ARG 38 N -4.64 2.56 -1.83 3.56 1.74 -1.22 -4.75 116.66 112.09 1vdk n ARG 38 Ca -0.05 -0.03 -0.30 0.00 -0.77 0.00 0.00 57.85 56.70 1vdk n ARG 38 Cb 0.29 -1.09 0.04 0.00 -1.02 0.00 0.00 32.46 30.68 1vdk n ARG 38 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1vdk n PHE 39 N -1.43 3.04 -2.00 -1.55 3.01 0.13 -5.02 117.46 113.64 1vdk n PHE 39 Ca 0.01 -2.64 -0.40 0.00 1.01 0.00 0.00 57.45 55.43 1vdk n PHE 39 Cb 0.20 -0.79 -0.01 0.00 -0.01 0.00 0.00 39.48 38.87 1vdk n PHE 39 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1vdk s ARG 40 N -3.73 4.06 0.11 -1.08 6.06 -1.26 -0.64 118.95 122.48 1vdk s ARG 40 Ca 0.56 2.27 -0.35 0.00 -2.50 0.00 0.00 55.73 55.70 1vdk s ARG 40 Cb 0.45 -2.86 -0.15 0.00 0.06 0.00 0.00 34.95 32.44 1vdk s ARG 40 CO -0.06 -0.45 1.49 -0.12 -2.50 0.00 0.00 175.30 173.65 1vdk n MET 41 N 0.32 1.69 -1.65 5.12 0.00 -0.35 -4.66 117.12 117.60 1vdk n MET 41 Ca 0.02 0.61 -0.47 0.00 -0.00 0.00 0.00 57.70 57.86 1vdk n MET 41 Cb 0.42 -2.32 -0.04 0.00 0.00 0.00 0.00 33.22 31.28 1vdk n MET 41 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1vdk n PRO 42 N 3.16 1.83 0.29 2.12 -0.02 -1.26 -4.86 135.00 136.25 1vdk n PRO 42 Ca 0.18 0.66 0.16 0.00 -2.02 0.00 0.00 63.50 62.47 1vdk n PRO 42 Cb 0.24 -2.35 0.88 0.00 -0.02 0.00 0.00 33.50 32.26 1vdk n PRO 42 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1vdk h LEU 43 N 5.00 0.00 -1.45 2.45 3.38 -2.00 -1.33 115.31 121.37 1vdk h LEU 43 Ca -0.45 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.52 1vdk h LEU 43 Cb 1.28 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 1vdk h LEU 43 CO 0.82 0.05 0.32 -0.33 0.09 0.00 0.00 178.44 179.38 1vdk h GLU 44 N 0.00 0.69 -0.32 1.13 3.07 -1.96 0.14 114.58 117.32 1vdk h GLU 44 Ca -0.00 -0.05 -0.16 0.00 -0.50 0.00 0.00 59.36 58.64 1vdk h GLU 44 Cb 0.16 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1vdk h GLU 44 CO 0.01 0.48 -0.45 0.82 -1.40 0.00 0.00 179.01 178.46 1vdk h ILE 45 N 0.70 1.28 -0.19 3.13 2.04 -1.57 -1.90 117.51 121.01 1vdk h ILE 45 Ca 0.19 -1.63 -0.02 0.00 1.00 0.00 0.00 64.86 64.39 1vdk h ILE 45 Cb -0.04 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1vdk h ILE 45 CO -0.04 0.54 0.03 0.40 0.00 0.00 0.00 178.15 179.08 1vdk h ILE 46 N 0.67 1.23 -0.72 -0.67 1.08 -1.18 -0.03 117.51 117.89 1vdk h ILE 46 Ca 0.04 -0.74 0.01 0.00 -0.39 0.00 0.00 64.86 63.77 1vdk h ILE 46 Cb 1.03 1.36 -0.04 0.00 -3.07 0.00 0.00 36.82 36.10 1vdk h ILE 46 CO 0.10 0.23 0.47 0.03 -0.69 0.00 0.00 178.15 178.29 1vdk h ARG 47 N 0.10 0.95 -0.41 2.37 2.47 -0.76 -0.60 114.38 118.51 1vdk h ARG 47 Ca 0.06 -0.06 -0.07 0.00 -1.26 0.00 0.00 59.98 58.64 1vdk h ARG 47 Cb 0.32 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 28.41 1vdk h ARG 47 CO 0.00 0.64 -0.05 0.00 0.56 0.00 0.00 179.97 181.12 1vdk h ALA 48 N 1.26 1.15 -0.42 0.04 0.00 -1.20 -1.89 119.26 118.19 1vdk h ALA 48 Ca 0.26 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1vdk h ALA 48 Cb -0.10 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1vdk h ALA 48 CO -0.06 0.54 0.01 1.88 0.00 0.00 0.00 179.25 181.63 1vdk h TYR 49 N 0.64 0.70 -0.64 0.00 0.99 -0.11 -0.41 116.97 118.14 1vdk h TYR 49 Ca 0.12 -0.08 -0.03 0.00 2.00 0.00 0.00 58.73 60.74 1vdk h TYR 49 Cb 0.47 -0.20 -0.03 0.00 1.00 0.00 0.00 36.73 37.98 1vdk h TYR 49 CO 0.02 0.66 0.28 0.78 -0.00 0.00 0.00 178.16 179.90 1vdk h GLY 50 N 0.92 1.01 1.03 3.88 0.00 -0.39 0.65 103.07 110.16 1vdk h GLY 50 Ca 0.13 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 1vdk h GLY 50 CO 0.01 0.50 0.36 -0.33 0.00 0.00 0.00 176.54 177.08 1vdk h MET 51 N 0.89 1.12 -0.18 4.80 2.86 -0.65 -1.26 114.93 122.51 1vdk h MET 51 Ca 0.22 -0.17 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 1vdk h MET 51 Cb 0.17 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1vdk h MET 51 CO -0.02 0.88 0.02 1.25 1.06 0.00 0.00 176.91 180.10 1vdk h LEU 52 N 1.09 0.29 -1.32 1.22 6.46 -0.57 -1.70 115.31 120.79 1vdk h LEU 52 Ca 0.26 -0.27 -0.05 0.00 -0.12 0.00 0.00 57.88 57.70 1vdk h LEU 52 Cb 0.14 -0.08 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1vdk h LEU 52 CO -0.03 0.49 -0.10 0.11 -0.62 0.00 0.00 178.44 178.29 1vdk h LYS 53 N 0.07 0.34 -0.18 1.25 1.79 -0.75 0.13 116.57 119.23 1vdk h LYS 53 Ca 0.05 -0.08 -0.04 0.00 -2.18 0.00 0.00 60.65 58.40 1vdk h LYS 53 Cb 0.33 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 1vdk h LYS 53 CO 0.01 0.45 -0.06 -0.22 -1.08 0.00 0.00 179.45 178.54 1vdk h LYS 54 N 0.32 0.36 -0.29 3.15 3.64 -1.09 -1.18 116.57 121.48 1vdk h LYS 54 Ca 0.07 -0.15 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 1vdk h LYS 54 Cb 0.38 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1vdk h LYS 54 CO 0.02 0.64 -0.13 0.00 -2.27 0.00 0.00 179.45 177.71 1vdk h ALA 55 N 0.71 1.24 -0.33 5.00 0.00 -0.95 -2.37 119.26 122.55 1vdk h ALA 55 Ca 0.04 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1vdk h ALA 55 Cb 0.52 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1vdk h ALA 55 CO 0.02 0.49 -0.04 0.00 0.00 0.00 0.00 179.25 179.73 1vdk h ALA 56 N 1.41 0.45 -0.54 0.00 0.00 -0.58 -0.47 119.26 119.55 1vdk h ALA 56 Ca 0.08 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1vdk h ALA 56 Cb 0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1vdk h ALA 56 CO 0.03 0.25 0.28 0.00 0.00 0.00 0.00 179.25 179.81 1vdk h ALA 57 N 0.83 0.69 -0.36 0.00 0.00 -1.03 -0.12 119.26 119.26 1vdk h ALA 57 Ca 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1vdk h ALA 57 Cb 0.51 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1vdk h ALA 57 CO 0.02 0.23 0.15 -0.09 0.00 0.00 0.00 179.25 179.57 1vdk h ARG 58 N 0.72 0.54 -0.14 0.00 2.43 -1.33 -0.69 114.38 115.91 1vdk h ARG 58 Ca 0.19 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1vdk h ARG 58 Cb 0.08 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1vdk h ARG 58 CO -0.03 0.51 0.08 0.00 -1.51 0.00 0.00 179.97 179.02 1vdk h ALA 59 N 1.00 0.19 -0.77 2.80 0.00 -0.82 -0.93 119.26 120.73 1vdk h ALA 59 Ca 0.12 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1vdk h ALA 59 Cb 0.17 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1vdk h ALA 59 CO -0.01 -0.27 0.32 -0.91 0.00 0.00 0.00 179.25 178.38 1vdk h ASN 60 N 0.12 1.05 0.05 0.00 2.35 -0.94 -0.15 115.58 118.06 1vdk h ASN 60 Ca 0.05 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1vdk h ASN 60 Cb 0.09 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.19 1vdk h ASN 60 CO -0.01 0.92 -0.03 0.25 -1.65 0.00 0.00 177.43 176.92 1vdk h LEU 61 N 1.10 -0.06 -1.76 1.61 5.85 -0.94 0.71 115.31 121.82 1vdk h LEU 61 Ca 0.26 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.96 1vdk h LEU 61 Cb 0.20 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1vdk h LEU 61 CO -0.02 -0.04 -0.02 -0.08 -0.34 0.00 0.00 178.44 177.94 1vdk h GLU 62 N -0.08 0.13 -0.11 1.25 4.81 -0.92 -1.68 114.58 117.98 1vdk h GLU 62 Ca -0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1vdk h GLU 62 Cb 0.06 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1vdk h GLU 62 CO 0.01 0.16 0.00 1.28 -0.73 0.00 0.00 179.01 179.73 1vdk n LEU 63 N -4.44 2.08 -1.82 1.64 4.77 -0.09 -4.95 117.00 114.19 1vdk n LEU 63 Ca -0.02 -0.78 -0.09 0.00 -0.03 0.00 0.00 56.01 55.10 1vdk n LEU 63 Cb 0.15 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.21 1vdk n LEU 63 CO 0.35 0.39 0.09 0.61 -1.33 0.00 0.00 177.39 177.50 1vdk n GLY 64 N 1.24 0.29 0.10 -0.72 0.00 0.17 -4.95 105.19 101.32 1vdk n GLY 64 Ca 0.17 -0.28 0.04 0.00 0.00 0.00 0.00 46.02 45.94 1vdk n GLY 64 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vdk n GLU 65 N -2.32 3.26 -3.90 1.61 -0.58 0.23 -5.01 120.64 113.92 1vdk n GLU 65 Ca -0.03 -0.30 -0.11 0.00 -0.42 0.00 0.00 57.16 56.31 1vdk n GLU 65 Cb 0.54 -0.94 -0.12 0.00 -0.57 0.00 0.00 31.44 30.35 1vdk n GLU 65 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1vdk s LEU 66 N -1.85 1.87 0.45 -4.62 1.43 -1.22 -4.92 118.68 109.81 1vdk s LEU 66 Ca 0.05 -0.16 -0.25 0.00 -1.03 0.00 0.00 54.13 52.74 1vdk s LEU 66 Cb 0.06 0.29 -0.08 0.00 0.03 0.00 0.00 46.19 46.49 1vdk s LEU 66 CO 0.24 -0.20 1.39 -2.84 0.23 0.00 0.00 176.35 175.17 1vdk s PRO 67 N -0.79 3.72 0.11 1.29 0.02 -1.26 -4.61 135.00 133.48 1vdk s PRO 67 Ca -0.09 2.33 -0.32 0.00 0.02 0.00 0.00 61.00 62.94 1vdk s PRO 67 Cb -0.05 -2.65 -0.11 0.00 0.02 0.00 0.00 34.50 31.71 1vdk s PRO 67 CO 0.00 -0.75 1.58 1.49 -0.33 0.00 0.00 177.00 178.99 1vdk h GLU 68 N 2.35 -0.65 -0.19 5.54 4.81 -1.99 -0.79 114.58 123.67 1vdk h GLU 68 Ca -0.50 0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1vdk h GLU 68 Cb 1.26 0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.78 1vdk h GLU 68 CO 0.61 -0.43 0.11 0.93 -0.73 0.00 0.00 179.01 179.50 1vdk h GLU 69 N -0.67 0.26 -0.96 1.92 5.08 -1.99 -1.44 114.58 116.77 1vdk h GLU 69 Ca 0.02 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1vdk h GLU 69 Cb 0.70 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.85 1vdk h GLU 69 CO -0.27 0.23 0.64 0.82 -1.00 0.00 0.00 179.01 179.43 1vdk h ILE 70 N 0.22 1.23 -0.37 3.13 2.04 -1.94 -1.48 117.51 120.34 1vdk h ILE 70 Ca 0.07 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.46 1vdk h ILE 70 Cb 0.04 -0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 35.94 1vdk h ILE 70 CO -0.01 0.24 0.15 0.00 0.00 0.00 0.00 178.15 178.52 1vdk h ALA 71 N 1.36 0.48 -0.32 1.87 0.00 -0.89 -1.36 119.26 120.40 1vdk h ALA 71 Ca 0.36 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1vdk h ALA 71 Cb -0.13 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 1vdk h ALA 71 CO -0.08 0.09 0.05 0.87 0.00 0.00 0.00 179.25 180.17 1vdk h LYS 72 N 0.46 0.48 -0.25 0.00 1.57 -0.83 0.31 116.57 118.30 1vdk h LYS 72 Ca 0.12 -0.08 -0.16 0.00 -1.87 0.00 0.00 60.65 58.66 1vdk h LYS 72 Cb 0.19 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1vdk h LYS 72 CO -0.01 0.47 -0.50 0.00 -0.57 0.00 0.00 179.45 178.84 1vdk h ALA 73 N 1.59 0.65 -0.18 3.86 0.00 -0.96 -2.18 119.26 122.04 1vdk h ALA 73 Ca 0.11 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1vdk h ALA 73 Cb 0.23 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1vdk h ALA 73 CO 0.00 0.68 -0.01 0.82 0.00 0.00 0.00 179.25 180.74 1vdk h ILE 74 N 0.54 1.26 -0.95 0.00 2.04 -0.56 -0.88 117.51 118.97 1vdk h ILE 74 Ca 0.02 -0.88 0.12 0.00 1.00 0.00 0.00 64.86 65.12 1vdk h ILE 74 Cb 1.06 1.49 -0.08 0.00 -0.74 0.00 0.00 36.82 38.55 1vdk h ILE 74 CO 0.10 0.26 0.58 0.40 0.00 0.00 0.00 178.15 179.49 1vdk h ILE 75 N 0.06 0.90 -0.15 -0.67 2.04 -0.90 0.35 117.51 119.14 1vdk h ILE 75 Ca 0.05 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.55 1vdk h ILE 75 Cb 0.40 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.38 1vdk h ILE 75 CO 0.01 0.17 -0.09 -0.61 0.00 0.00 0.00 178.15 177.63 1vdk h GLN 76 N 0.92 0.33 -0.78 2.37 4.15 -1.17 -1.90 115.11 119.02 1vdk h GLN 76 Ca 0.47 -0.15 -0.03 0.00 0.77 0.00 0.00 58.65 59.71 1vdk h GLN 76 Cb 0.47 -0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.12 1vdk h GLN 76 CO -0.27 0.67 0.39 0.00 -1.93 0.00 0.00 178.83 177.69 1vdk h ALA 77 N 0.65 1.01 -0.27 3.38 0.00 -0.40 -2.30 119.26 121.33 1vdk h ALA 77 Ca 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1vdk h ALA 77 Cb 0.58 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1vdk h ALA 77 CO 0.03 0.56 0.12 0.00 0.00 0.00 0.00 179.25 179.96 1vdk h ALA 78 N 1.20 0.35 -0.52 0.00 0.00 -0.30 -2.40 119.26 117.60 1vdk h ALA 78 Ca 0.27 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1vdk h ALA 78 Cb 0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1vdk h ALA 78 CO -0.04 -0.07 0.35 1.49 0.00 0.00 0.00 179.25 180.98 1vdk h GLU 79 N 0.30 0.50 -0.57 0.00 4.57 -1.11 0.01 114.58 118.28 1vdk h GLU 79 Ca 0.09 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 1vdk h GLU 79 Cb 0.14 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 1vdk h GLU 79 CO -0.01 0.33 0.05 0.93 -1.18 0.00 0.00 179.01 179.13 1vdk h GLU 80 N 0.51 0.93 -0.35 1.92 5.08 -0.94 -1.05 114.58 120.69 1vdk h GLU 80 Ca 0.22 -0.25 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 1vdk h GLU 80 Cb 0.22 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1vdk h GLU 80 CO -0.06 0.89 0.08 0.28 -1.00 0.00 0.00 179.01 179.21 1vdk h VAL 81 N 0.87 1.22 -1.00 3.13 2.07 -0.63 -1.44 116.25 120.49 1vdk h VAL 81 Ca 0.17 -0.76 0.09 0.00 0.82 0.00 0.00 66.70 67.02 1vdk h VAL 81 Cb 0.44 1.05 -0.07 0.00 -1.52 0.00 0.00 31.29 31.19 1vdk h VAL 81 CO 0.02 0.26 0.63 0.58 0.02 0.00 0.00 177.57 179.08 1vdk h VAL 82 N 0.42 1.01 0.00 2.57 2.07 -0.80 0.21 116.25 121.73 1vdk h VAL 82 Ca 0.11 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.26 1vdk h VAL 82 Cb 0.31 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 1vdk h VAL 82 CO 0.00 0.20 0.00 0.00 0.02 0.00 0.00 177.57 177.79 1vdk n GLN 83 N -4.56 0.79 -1.33 1.57 1.13 -0.44 -4.87 117.38 109.68 1vdk n GLN 83 Ca 0.17 0.00 -0.07 0.00 -1.94 0.00 0.00 57.00 55.16 1vdk n GLN 83 Cb 0.26 -1.39 -0.03 0.00 0.11 0.00 0.00 30.24 29.19 1vdk n GLN 83 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1vdk n GLY 84 N 0.52 0.81 0.09 1.08 0.00 0.74 -4.92 105.19 103.51 1vdk n GLY 84 Ca 0.15 -0.71 0.12 0.00 0.00 0.00 0.00 46.02 45.58 1vdk n GLY 84 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vdk n LYS 85 N -2.65 0.19 -0.51 1.61 5.02 -0.58 -3.58 118.16 117.67 1vdk n LYS 85 Ca -0.07 0.25 0.07 0.00 -2.02 0.00 0.00 58.31 56.54 1vdk n LYS 85 Cb 0.28 -1.77 0.14 0.00 -0.02 0.00 0.00 35.03 33.66 1vdk n LYS 85 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1vdk n TRP 86 N -2.10 0.00 -0.23 2.13 7.02 -1.26 -4.83 117.44 118.17 1vdk n TRP 86 Ca 0.05 -1.03 0.15 0.00 -1.02 0.00 0.00 57.50 55.64 1vdk n TRP 86 Cb 0.34 -0.18 0.45 0.00 -2.42 0.00 0.00 31.31 29.50 1vdk n TRP 86 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1vdk h ASP 87 N 0.53 0.51 0.00 -0.99 3.32 -1.89 -0.81 116.42 117.08 1vdk h ASP 87 Ca -0.03 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.06 1vdk h ASP 87 Cb 1.15 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.64 1vdk h ASP 87 CO 0.01 0.25 0.00 0.47 -1.72 0.00 0.00 179.24 178.25 1vdk n ASP 88 N -4.52 0.00 -1.56 6.45 10.43 -1.26 -3.18 116.55 122.91 1vdk n ASP 88 Ca 0.17 -0.93 -0.02 0.00 2.57 0.00 0.00 54.79 56.57 1vdk n ASP 88 Cb 0.54 0.00 0.27 0.00 1.84 0.00 0.00 41.12 43.77 1vdk n ASP 88 CO 0.00 0.00 0.00 1.41 -1.07 0.00 0.00 177.20 177.54 1vdk n HIS 89 N -0.88 1.82 -3.57 1.24 8.25 -0.31 -4.73 115.22 117.05 1vdk n HIS 89 Ca 0.13 -1.22 -0.29 0.00 -0.26 0.00 0.00 57.72 56.08 1vdk n HIS 89 Cb 0.06 -0.56 -0.12 0.00 1.12 0.00 0.00 29.99 30.48 1vdk n HIS 89 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1vdk s PHE 90 N -3.02 1.23 -1.30 4.41 0.08 -1.19 -4.64 117.98 113.55 1vdk s PHE 90 Ca 0.50 -1.94 0.19 0.00 0.12 0.00 0.00 56.93 55.79 1vdk s PHE 90 Cb 0.41 -1.31 0.67 0.00 -0.57 0.00 0.00 43.02 42.22 1vdk s PHE 90 CO 0.10 -0.81 1.58 -0.35 -0.10 0.00 0.00 175.22 175.63 1vdk n PRO 91 N 3.85 3.41 -3.09 0.24 -0.04 -1.26 -4.89 135.00 133.22 1vdk n PRO 91 Ca 0.10 -2.78 -0.33 0.00 -0.04 0.00 0.00 63.50 60.46 1vdk n PRO 91 Cb 0.36 -1.77 -0.06 0.00 -0.04 0.00 0.00 33.50 31.99 1vdk n PRO 91 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1vdk s LEU 92 N -1.61 4.05 0.64 1.53 1.43 -1.26 -4.96 118.68 118.51 1vdk s LEU 92 Ca 0.49 1.35 -0.04 0.00 -1.03 0.00 0.00 54.13 54.89 1vdk s LEU 92 Cb 0.30 -4.14 0.04 0.00 0.03 0.00 0.00 46.19 42.42 1vdk s LEU 92 CO 0.26 -0.22 0.93 0.68 0.23 0.00 0.00 176.35 178.22 1vdk s VAL 93 N -2.00 2.67 0.20 -1.59 -7.23 -1.26 -1.21 120.40 109.97 1vdk s VAL 93 Ca 0.55 -0.32 -0.04 0.00 -1.81 0.00 0.00 61.98 60.36 1vdk s VAL 93 Cb -0.10 -3.10 -0.02 0.00 0.56 0.00 0.00 36.38 33.72 1vdk s VAL 93 CO 0.17 -0.09 1.55 0.58 -0.31 0.00 0.00 175.10 177.00 1vdk h VAL 94 N -0.34 1.29 -0.09 1.32 2.07 -1.14 -3.37 116.25 116.00 1vdk h VAL 94 Ca -0.44 -1.59 -0.71 0.00 0.82 0.00 0.00 66.70 64.79 1vdk h VAL 94 Cb 1.30 1.52 -0.03 0.00 -1.52 0.00 0.00 31.29 32.56 1vdk h VAL 94 CO 0.58 0.51 3.21 0.49 0.02 0.00 0.00 177.57 182.39 1vdk n PHE 95 N -4.03 3.28 -0.58 1.57 3.01 -1.26 -4.64 117.46 114.82 1vdk n PHE 95 Ca -0.02 -2.99 0.00 0.00 1.01 0.00 0.00 57.45 55.45 1vdk n PHE 95 Cb 0.53 -2.51 0.00 0.00 -0.01 0.00 0.00 39.48 37.50 1vdk n PHE 95 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1vdk n GLN 96 N 5.44 3.34 -2.32 -1.08 10.64 -1.26 -4.71 117.38 127.43 1vdk n GLN 96 Ca 0.57 0.00 -0.35 0.00 -1.83 0.00 0.00 57.00 55.39 1vdk n GLN 96 Cb 0.36 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.73 1vdk n GLN 96 CO 0.00 0.00 0.00 0.95 -1.83 0.00 0.00 177.06 176.18 1vdk s THR 97 N 3.62 3.28 -1.45 -0.39 -4.23 -1.26 -4.89 115.64 110.32 1vdk s THR 97 Ca 0.00 0.82 0.09 0.00 -1.18 0.00 0.00 61.69 61.42 1vdk s THR 97 Cb 0.00 -3.34 0.16 0.00 1.34 0.00 0.00 72.50 70.66 1vdk s THR 97 CO 0.00 -0.15 1.16 0.61 -0.54 0.00 0.00 174.62 175.70 1vdk n GLY 98 N 0.13 -0.58 0.24 3.99 0.00 -1.26 -1.34 105.19 106.37 1vdk n GLY 98 Ca 0.11 -0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.17 1vdk n GLY 98 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vdk n SER 99 N -1.27 1.40 -1.14 1.61 3.41 -1.26 -2.47 113.62 113.89 1vdk n SER 99 Ca 0.04 -1.20 -0.12 0.00 -0.26 0.00 0.00 58.87 57.34 1vdk n SER 99 Cb 0.07 0.71 -0.02 0.00 -0.26 0.00 0.00 64.21 64.70 1vdk n SER 99 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vdk n GLY 100 N 1.35 0.49 0.31 5.00 0.00 -0.45 -4.51 105.19 107.37 1vdk n GLY 100 Ca 0.06 -0.44 -0.00 0.00 0.00 0.00 0.00 46.02 45.64 1vdk n GLY 100 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1vdk h THR 101 N 0.00 1.05 -0.78 2.61 2.02 -1.89 -1.73 112.91 114.18 1vdk h THR 101 Ca -0.26 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 66.59 1vdk h THR 101 Cb 1.01 0.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.43 1vdk h THR 101 CO 0.34 0.17 0.45 1.56 0.37 0.00 0.00 175.52 178.40 1vdk h GLN 102 N 0.93 1.07 -0.25 6.66 7.50 -1.91 -1.40 115.11 127.70 1vdk h GLN 102 Ca 0.35 -0.11 -0.15 0.00 0.50 0.00 0.00 58.65 59.23 1vdk h GLN 102 Cb 0.14 -0.22 -0.01 0.00 0.05 0.00 0.00 27.48 27.44 1vdk h GLN 102 CO -0.16 0.77 -0.48 1.15 -1.50 0.00 0.00 178.83 178.61 1vdk h THR 103 N 1.07 1.30 -0.39 -0.54 2.02 -1.87 -0.46 112.91 114.04 1vdk h THR 103 Ca 0.28 -1.68 -0.00 0.00 0.77 0.00 0.00 66.41 65.78 1vdk h THR 103 Cb -0.01 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.00 1vdk h THR 103 CO -0.05 0.53 0.24 -1.13 0.37 0.00 0.00 175.52 175.48 1vdk h ASN 104 N 0.53 0.47 0.42 4.18 -1.24 -0.97 0.70 115.58 119.66 1vdk h ASN 104 Ca 0.03 -0.05 -0.08 0.00 0.71 0.00 0.00 56.30 56.91 1vdk h ASN 104 Cb 1.02 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.94 1vdk h ASN 104 CO 0.10 0.38 -0.38 0.24 -1.29 0.00 0.00 177.43 176.48 1vdk h MET 105 N 0.52 0.00 -0.39 6.67 2.86 -1.15 0.94 114.93 124.38 1vdk h MET 105 Ca 0.14 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.72 1vdk h MET 105 Cb -0.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1vdk h MET 105 CO -0.03 0.38 0.02 -0.97 1.06 0.00 0.00 176.91 177.38 1vdk h ASN 106 N 0.00 0.65 -0.41 1.22 -0.00 -0.32 0.95 115.58 117.67 1vdk h ASN 106 Ca -0.00 -0.29 -0.04 0.00 -0.00 0.00 0.00 56.30 55.96 1vdk h ASN 106 Cb 0.70 -0.18 -0.02 0.00 -0.00 0.00 0.00 38.32 38.82 1vdk h ASN 106 CO 0.05 0.78 0.08 0.58 -0.00 0.00 0.00 177.43 178.93 1vdk h VAL 107 N 0.50 1.24 -0.49 2.57 2.07 -0.35 -2.04 116.25 119.74 1vdk h VAL 107 Ca 0.11 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1vdk h VAL 107 Cb 0.44 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1vdk h VAL 107 CO 0.02 0.29 0.20 0.78 0.02 0.00 0.00 177.57 178.87 1vdk h ASN 108 N 0.53 0.68 -0.29 0.57 2.35 -0.59 -2.37 115.58 116.45 1vdk h ASN 108 Ca 0.13 -0.17 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1vdk h ASN 108 Cb 0.35 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1vdk h ASN 108 CO 0.01 0.67 -0.00 -0.33 -1.65 0.00 0.00 177.43 176.12 1vdk h GLU 109 N 0.66 0.51 -0.23 0.81 5.08 -0.73 0.11 114.58 120.79 1vdk h GLU 109 Ca 0.16 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1vdk h GLU 109 Cb 0.20 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1vdk h GLU 109 CO -0.01 0.67 0.12 0.28 -1.00 0.00 0.00 179.01 179.06 1vdk h VAL 110 N 0.30 1.13 -0.29 3.13 2.07 -1.37 -0.04 116.25 121.17 1vdk h VAL 110 Ca 0.08 -0.35 -0.10 0.00 0.82 0.00 0.00 66.70 67.16 1vdk h VAL 110 Cb 0.44 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 1vdk h VAL 110 CO 0.02 0.12 -0.23 0.40 0.02 0.00 0.00 177.57 177.90 1vdk h ILE 111 N 0.25 1.26 -0.06 4.57 2.04 -1.43 -1.94 117.51 122.21 1vdk h ILE 111 Ca 0.08 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1vdk h ILE 111 Cb 0.09 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.46 1vdk h ILE 111 CO -0.01 0.40 -0.01 0.00 0.00 0.00 0.00 178.15 178.53 1vdk h ALA 112 N 1.27 0.08 -0.71 1.87 0.00 -0.69 -0.27 119.26 120.82 1vdk h ALA 112 Ca 0.07 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1vdk h ALA 112 Cb 0.66 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1vdk h ALA 112 CO 0.05 -0.22 0.37 -0.91 0.00 0.00 0.00 179.25 178.53 1vdk h ASN 113 N -0.21 0.91 -0.36 0.00 2.35 -0.95 0.72 115.58 118.04 1vdk h ASN 113 Ca 0.02 -0.11 -0.11 0.00 -0.55 0.00 0.00 56.30 55.54 1vdk h ASN 113 Cb 0.38 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.50 1vdk h ASN 113 CO 0.00 0.76 -0.16 -0.09 -1.65 0.00 0.00 177.43 176.30 1vdk h ARG 114 N 0.98 0.83 -0.51 0.81 9.65 -1.34 -0.88 114.38 123.93 1vdk h ARG 114 Ca 0.25 -0.31 -0.05 0.00 -1.10 0.00 0.00 59.98 58.77 1vdk h ARG 114 Cb 0.08 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 1vdk h ARG 114 CO -0.04 0.93 0.13 0.00 2.80 0.00 0.00 179.97 183.80 1vdk h ALA 115 N 1.08 0.67 -0.79 2.80 0.00 -0.60 -1.14 119.26 121.29 1vdk h ALA 115 Ca 0.11 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1vdk h ALA 115 Cb 0.67 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.23 1vdk h ALA 115 CO 0.05 0.36 0.30 0.77 0.00 0.00 0.00 179.25 180.73 1vdk h SER 116 N 0.70 1.10 -0.41 0.00 0.02 -0.61 -1.67 113.55 112.68 1vdk h SER 116 Ca 0.16 -0.18 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1vdk h SER 116 Cb 0.33 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.57 1vdk h SER 116 CO 0.00 0.98 0.18 -0.08 -1.14 0.00 0.00 176.83 176.77 1vdk h GLU 117 N 1.15 0.60 -0.40 3.45 4.81 -0.86 0.32 114.58 123.65 1vdk h GLU 117 Ca 0.26 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.41 1vdk h GLU 117 Cb 0.23 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1vdk h GLU 117 CO -0.02 0.55 0.27 0.82 -0.73 0.00 0.00 179.01 179.90 1vdk h ILE 118 N 0.52 1.05 -0.20 2.32 2.04 -0.84 0.65 117.51 123.04 1vdk h ILE 118 Ca 0.14 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1vdk h ILE 118 Cb 0.16 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.79 1vdk h ILE 118 CO -0.01 0.08 0.00 0.18 0.00 0.00 0.00 178.15 178.40 1vdk n LEU 119 N -4.48 1.69 -1.37 1.44 4.77 -0.66 -4.87 117.00 113.52 1vdk n LEU 119 Ca 0.04 -0.85 -0.08 0.00 -0.03 0.00 0.00 56.01 55.09 1vdk n LEU 119 Cb 0.13 -0.32 0.02 0.00 -2.33 0.00 0.00 43.42 40.92 1vdk n LEU 119 CO 0.35 0.32 0.05 0.61 -1.33 0.00 0.00 177.39 177.39 1vdk n GLY 120 N 0.58 0.39 3.08 -0.72 0.00 0.22 -5.04 105.19 103.69 1vdk n GLY 120 Ca 0.08 -0.42 -0.24 0.00 0.00 0.00 0.00 46.02 45.44 1vdk n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vdk s LYS 121 N -5.21 1.52 0.65 1.61 -0.14 0.11 -4.99 119.74 113.29 1vdk s LYS 121 Ca 0.15 -0.49 -0.17 0.00 -1.36 0.00 0.00 55.97 54.10 1vdk s LYS 121 Cb -0.07 -1.33 -0.01 0.00 -1.68 0.00 0.00 37.83 34.74 1vdk s LYS 121 CO 0.19 0.17 1.23 -2.14 -0.76 0.00 0.00 175.35 174.04 1vdk s PRO 122 N 0.17 2.61 0.26 -1.68 0.02 -1.26 -2.55 135.00 132.57 1vdk s PRO 122 Ca -0.05 1.86 -0.31 0.00 0.02 0.00 0.00 61.00 62.52 1vdk s PRO 122 Cb -0.11 -1.88 -0.12 0.00 0.02 0.00 0.00 34.50 32.41 1vdk s PRO 122 CO 0.02 -1.49 1.65 -0.51 -0.33 0.00 0.00 177.00 176.33 1vdk s LEU 123 N -4.48 4.35 0.00 -5.54 1.43 -1.26 -2.53 118.68 110.64 1vdk s LEU 123 Ca 0.78 2.93 0.00 0.00 -1.03 0.00 0.00 54.13 56.80 1vdk s LEU 123 Cb -0.32 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.28 1vdk s LEU 123 CO 0.39 -0.94 0.00 0.61 0.23 0.00 0.00 176.35 176.63 1vdk n GLY 124 N 2.85 0.57 0.20 -3.19 0.00 -1.26 -4.95 105.19 99.41 1vdk n GLY 124 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 1vdk n GLY 124 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vdk h SER 125 N 0.00 0.32 -1.47 1.61 4.64 -1.86 -3.45 113.55 113.34 1vdk h SER 125 Ca 0.00 -0.14 -0.27 0.00 -0.47 0.00 0.00 61.79 60.91 1vdk h SER 125 Cb 0.00 -0.09 -0.04 0.00 -0.31 0.00 0.00 62.40 61.96 1vdk h SER 125 CO 0.00 0.71 -0.31 0.29 -0.87 0.00 0.00 176.83 176.65 1vdk n LYS 126 N -4.02 -1.02 -0.23 4.77 5.02 -1.26 -4.88 118.16 116.55 1vdk n LYS 126 Ca -0.02 0.75 -0.00 0.00 -2.02 0.00 0.00 58.31 57.03 1vdk n LYS 126 Cb 0.49 -4.93 0.11 0.00 -0.02 0.00 0.00 35.03 30.68 1vdk n LYS 126 CO 0.00 0.00 0.00 -0.92 -0.52 0.00 0.00 177.40 175.96 1vdk h TYR 127 N 0.00 0.61 -3.48 2.13 3.20 -1.91 -3.03 116.97 114.49 1vdk h TYR 127 Ca -0.30 0.03 -0.71 0.00 3.14 0.00 0.00 58.73 60.88 1vdk h TYR 127 Cb 1.11 -0.17 -0.20 0.00 1.54 0.00 0.00 36.73 39.01 1vdk h TYR 127 CO 0.36 0.24 -0.31 0.00 -1.64 0.00 0.00 178.16 176.81 1vdk s ALA 128 N -6.08 3.47 -0.03 1.82 0.00 -1.26 -5.04 121.76 114.64 1vdk s ALA 128 Ca -0.13 -1.69 -0.30 0.00 0.00 0.00 0.00 51.96 49.84 1vdk s ALA 128 Cb 0.17 -2.99 -0.03 0.00 0.00 0.00 0.00 23.12 20.26 1vdk s ALA 128 CO 0.76 -1.57 1.08 -1.58 0.00 0.00 0.00 175.76 174.45 1vdk s HIS 129 N 1.89 3.47 0.22 0.00 2.46 -1.15 -4.64 115.29 117.54 1vdk s HIS 129 Ca 0.08 1.48 -0.08 0.00 0.47 0.00 0.00 55.06 57.01 1vdk s HIS 129 Cb -0.19 -3.27 0.29 0.00 -0.13 0.00 0.00 32.58 29.28 1vdk s HIS 129 CO 0.11 -0.63 1.78 -1.35 -2.47 0.00 0.00 174.74 172.18 1vdk h PRO 130 N 7.02 0.55 0.02 2.88 0.11 -1.87 -0.42 132.00 140.28 1vdk h PRO 130 Ca -0.37 -0.03 -0.29 0.00 0.11 0.00 0.00 66.00 65.41 1vdk h PRO 130 Cb 1.19 -0.12 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 1vdk h PRO 130 CO 0.82 0.36 -1.60 -1.71 -0.21 0.00 0.00 178.00 175.66 1vdk n ASN 131 N -4.88 1.91 0.24 -2.05 5.15 -1.26 -1.27 115.26 113.10 1vdk n ASN 131 Ca 0.10 0.37 0.12 0.00 -0.60 0.00 0.00 54.58 54.57 1vdk n ASN 131 Cb 0.25 -0.92 0.48 0.00 -0.53 0.00 0.00 39.78 39.06 1vdk n ASN 131 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 1vdk h ASP 132 N -0.84 0.00 0.00 1.20 3.32 -1.90 -3.15 116.42 115.05 1vdk h ASP 132 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1vdk h ASP 132 Cb 1.47 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.02 1vdk h ASP 132 CO -0.21 0.13 -0.09 1.41 -1.72 0.00 0.00 179.24 178.77 1vdk n HIS 133 N -3.24 0.00 -0.03 4.55 8.25 -0.28 -4.36 115.22 120.11 1vdk n HIS 133 Ca 0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.50 1vdk n HIS 133 Cb 0.41 -0.04 0.37 0.00 1.12 0.00 0.00 29.99 31.85 1vdk n HIS 133 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1vdk h VAL 134 N -0.09 1.14 -0.52 1.59 2.07 -1.27 -2.22 116.25 116.95 1vdk h VAL 134 Ca 0.00 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1vdk h VAL 134 Cb 0.09 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1vdk h VAL 134 CO 0.00 0.14 0.00 -3.20 0.02 0.00 0.00 177.57 174.53 1vdk n ASN 135 N -4.43 5.43 -4.70 0.57 5.15 -0.40 -4.90 115.26 111.98 1vdk n ASN 135 Ca 0.04 -2.95 -0.42 0.00 -0.60 0.00 0.00 54.58 50.65 1vdk n ASN 135 Cb 0.09 -0.66 -0.03 0.00 -0.53 0.00 0.00 39.78 38.65 1vdk n ASN 135 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1vdk s ARG 136 N -2.77 4.13 -1.00 1.20 6.06 -0.84 -1.96 118.95 123.77 1vdk s ARG 136 Ca 0.53 2.61 0.00 0.00 -2.50 0.00 0.00 55.73 56.36 1vdk s ARG 136 Cb 0.40 -3.42 0.00 0.00 0.06 0.00 0.00 34.95 32.00 1vdk s ARG 136 CO 0.15 -0.81 0.00 0.41 -2.50 0.00 0.00 175.30 172.54 1vdk n GLY 137 N 4.15 1.08 3.38 8.12 0.00 -1.25 -4.99 105.19 115.67 1vdk n GLY 137 Ca 0.17 -0.37 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 1vdk n GLY 137 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vdk s GLN 138 N -2.62 1.43 0.12 1.61 -0.21 -0.83 -4.54 119.66 114.62 1vdk s GLN 138 Ca 0.00 -1.72 0.01 0.00 0.02 0.00 0.00 55.36 53.67 1vdk s GLN 138 Cb 0.00 -0.89 -0.04 0.00 1.00 0.00 0.00 33.01 33.07 1vdk s GLN 138 CO 0.00 -0.02 -0.03 0.45 -2.12 0.00 0.00 175.29 173.57 1vdk s SER 139 N -3.37 0.98 0.28 5.90 0.15 -1.26 -4.94 113.70 111.44 1vdk s SER 139 Ca 0.28 -1.08 0.11 0.00 0.70 0.00 0.00 55.95 55.97 1vdk s SER 139 Cb 0.04 0.14 0.38 0.00 -1.71 0.00 0.00 66.02 64.88 1vdk s SER 139 CO 0.10 -0.54 1.62 0.77 1.20 0.00 0.00 173.24 176.39 1vdk h SER 140 N 2.90 0.00 -0.91 5.45 4.64 -1.90 -2.29 113.55 121.44 1vdk h SER 140 Ca -0.35 0.00 0.07 0.00 -0.47 0.00 0.00 61.79 61.04 1vdk h SER 140 Cb 1.18 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 1vdk h SER 140 CO 0.64 0.60 0.57 0.78 -0.87 0.00 0.00 176.83 178.54 1vdk h ASN 141 N 0.00 0.89 0.03 4.97 4.21 -1.81 -1.43 115.58 122.43 1vdk h ASN 141 Ca -0.01 0.02 -0.29 0.00 1.21 0.00 0.00 56.30 57.23 1vdk h ASN 141 Cb 1.08 -0.16 -0.06 0.00 -1.12 0.00 0.00 38.32 38.06 1vdk h ASN 141 CO 0.08 0.55 -2.27 -0.90 -1.29 0.00 0.00 177.43 173.59 1vdk n ASP 142 N -4.60 0.04 0.07 5.81 5.75 -1.21 -4.39 116.55 118.02 1vdk n ASP 142 Ca 0.14 0.02 -0.13 0.00 -0.01 0.00 0.00 54.79 54.81 1vdk n ASP 142 Cb 0.21 1.14 -0.05 0.00 -1.03 0.00 0.00 41.12 41.39 1vdk n ASP 142 CO 0.00 0.00 0.00 0.71 -0.11 0.00 0.00 177.20 177.80 1vdk h THR 143 N 0.00 1.41 0.12 2.12 1.35 -1.38 -2.80 112.91 113.72 1vdk h THR 143 Ca -0.43 -2.51 -0.01 0.00 -0.55 0.00 0.00 66.41 62.92 1vdk h THR 143 Cb 1.99 2.47 0.00 0.00 -1.73 0.00 0.00 68.15 70.88 1vdk h THR 143 CO 0.03 0.75 -0.06 0.15 -0.25 0.00 0.00 175.52 176.14 1vdk h PHE 144 N 0.21 -0.14 0.00 4.73 3.57 -1.48 0.77 116.94 124.59 1vdk h PHE 144 Ca -0.08 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.38 1vdk h PHE 144 Cb 1.61 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 40.39 1vdk h PHE 144 CO 0.06 0.03 -0.15 -1.00 -2.23 0.00 0.00 178.31 175.02 1vdk h PRO 145 N -0.30 0.00 -0.14 6.41 0.13 -1.77 0.36 132.00 136.70 1vdk h PRO 145 Ca -0.02 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.08 1vdk h PRO 145 Cb 0.24 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.37 1vdk h PRO 145 CO 0.03 0.15 -0.05 1.15 -0.23 0.00 0.00 178.00 179.05 1vdk h THR 146 N 0.00 1.30 -0.77 1.56 2.02 -1.18 -1.17 112.91 114.67 1vdk h THR 146 Ca -0.00 -1.04 -0.02 0.00 0.77 0.00 0.00 66.41 66.12 1vdk h THR 146 Cb 0.30 1.69 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 1vdk h THR 146 CO 0.02 0.30 0.41 0.00 0.37 0.00 0.00 175.52 176.63 1vdk h ALA 147 N 0.69 0.98 -0.17 6.16 0.00 -0.21 -2.20 119.26 124.51 1vdk h ALA 147 Ca 0.03 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1vdk h ALA 147 Cb 0.49 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1vdk h ALA 147 CO 0.02 0.50 -0.49 0.00 0.00 0.00 0.00 179.25 179.28 1vdk h MET 148 N 1.07 0.46 -0.53 0.00 -0.00 -0.86 0.15 114.93 115.23 1vdk h MET 148 Ca 0.27 -0.26 -0.08 0.00 -0.00 0.00 0.00 59.70 59.63 1vdk h MET 148 Cb 0.05 0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 31.65 1vdk h MET 148 CO -0.04 0.85 0.01 1.88 -0.00 0.00 0.00 176.91 179.61 1vdk h TYR 149 N 0.36 1.00 -0.46 -0.10 -1.99 -1.03 -0.88 116.97 113.87 1vdk h TYR 149 Ca 0.02 -0.17 -0.08 0.00 2.00 0.00 0.00 58.73 60.50 1vdk h TYR 149 Cb 0.99 -0.26 -0.02 0.00 2.00 0.00 0.00 36.73 39.45 1vdk h TYR 149 CO 0.03 0.91 -0.02 0.28 -0.00 0.00 0.00 178.16 179.37 1vdk h VAL 150 N 0.79 1.26 -0.37 -2.88 2.07 -1.26 -1.95 116.25 113.92 1vdk h VAL 150 Ca 0.15 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.60 1vdk h VAL 150 Cb 0.51 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.31 1vdk h VAL 150 CO 0.02 0.37 0.23 0.00 0.02 0.00 0.00 177.57 178.22 1vdk h ALA 151 N 0.90 0.47 -0.24 1.67 0.00 -0.71 -0.85 119.26 120.50 1vdk h ALA 151 Ca 0.13 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1vdk h ALA 151 Cb 0.53 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1vdk h ALA 151 CO 0.03 -0.11 0.01 0.28 0.00 0.00 0.00 179.25 179.46 1vdk h VAL 152 N 0.46 1.25 -0.59 0.00 2.07 -1.11 -0.71 116.25 117.63 1vdk h VAL 152 Ca 0.14 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.82 1vdk h VAL 152 Cb -0.02 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.06 1vdk h VAL 152 CO -0.05 0.28 0.33 0.00 0.02 0.00 0.00 177.57 178.14 1vdk h ALA 153 N 0.81 0.77 -0.45 1.67 0.00 -1.17 -1.01 119.26 119.89 1vdk h ALA 153 Ca 0.07 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.87 1vdk h ALA 153 Cb 0.40 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1vdk h ALA 153 CO 0.01 0.02 -0.19 -0.07 0.00 0.00 0.00 179.25 179.03 1vdk h LEU 154 N 0.64 0.89 -1.39 0.00 3.38 -1.07 -2.86 115.31 114.90 1vdk h LEU 154 Ca 0.25 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1vdk h LEU 154 Cb 0.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1vdk h LEU 154 CO -0.14 1.06 -0.00 0.00 0.09 0.00 0.00 178.44 179.44 1vdk h ALA 155 N 1.01 1.51 -0.01 1.53 0.00 -0.53 0.19 119.26 122.96 1vdk h ALA 155 Ca 0.11 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1vdk h ALA 155 Cb 0.72 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1vdk h ALA 155 CO 0.06 0.36 0.00 -0.07 0.00 0.00 0.00 179.25 179.59 1vdk h LEU 156 N 0.38 0.01 -0.44 0.00 3.38 -0.98 -0.57 115.31 117.08 1vdk h LEU 156 Ca 0.09 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 1vdk h LEU 156 Cb 0.26 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1vdk h LEU 156 CO 0.01 0.19 -0.19 0.45 0.09 0.00 0.00 178.44 178.99 1vdk h HIS 157 N -0.17 1.04 -0.12 1.13 3.86 -1.29 0.30 115.15 119.91 1vdk h HIS 157 Ca 0.00 -0.25 -0.19 0.00 -1.16 0.00 0.00 60.37 58.78 1vdk h HIS 157 Cb 0.18 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 28.40 1vdk h HIS 157 CO -0.02 1.04 -0.69 0.37 0.86 0.00 0.00 177.93 179.49 1vdk h GLN 158 N 0.75 0.51 0.00 2.45 5.75 -0.62 -3.39 115.11 120.56 1vdk h GLN 158 Ca 0.10 -0.39 0.00 0.00 -0.15 0.00 0.00 58.65 58.21 1vdk h GLN 158 Cb 0.75 0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.38 1vdk h GLN 158 CO 0.06 1.02 -0.83 0.54 -2.65 0.00 0.00 178.83 176.97 1vdk n ARG 159 N -3.88 0.00 0.05 1.69 1.74 -0.23 -4.77 116.66 111.26 1vdk n ARG 159 Ca -0.05 0.00 -0.13 0.00 -0.77 0.00 0.00 57.85 56.91 1vdk n ARG 159 Cb 0.69 -0.44 -0.09 0.00 -1.02 0.00 0.00 32.46 31.61 1vdk n ARG 159 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1vdk h LEU 160 N 0.00 -0.11 -0.19 0.55 5.85 -1.38 -2.98 115.31 117.05 1vdk h LEU 160 Ca 0.00 -0.27 0.01 0.00 0.84 0.00 0.00 57.88 58.46 1vdk h LEU 160 Cb 0.83 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 1vdk h LEU 160 CO 0.00 0.22 0.08 1.88 -0.34 0.00 0.00 178.44 180.27 1vdk h TYR 161 N -0.45 0.14 -0.96 1.25 0.99 -1.18 -1.03 116.97 115.72 1vdk h TYR 161 Ca -0.01 0.01 0.06 0.00 2.00 0.00 0.00 58.73 60.78 1vdk h TYR 161 Cb 0.37 -0.04 -0.06 0.00 1.00 0.00 0.00 36.73 38.01 1vdk h TYR 161 CO 0.03 0.08 0.62 -1.35 -0.00 0.00 0.00 178.16 177.53 1vdk h PRO 162 N 0.17 1.11 -0.08 4.88 0.11 -1.75 0.20 132.00 136.65 1vdk h PRO 162 Ca 0.08 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 1vdk h PRO 162 Cb 0.03 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 30.89 1vdk h PRO 162 CO -0.07 0.74 -0.01 0.00 -0.21 0.00 0.00 178.00 178.45 1vdk h ALA 163 N 1.43 0.11 -0.35 -0.75 0.00 -1.30 -1.29 119.26 117.10 1vdk h ALA 163 Ca 0.41 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 1vdk h ALA 163 Cb 0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1vdk h ALA 163 CO -0.16 -0.20 -0.24 0.28 0.00 0.00 0.00 179.25 178.94 1vdk h VAL 164 N -0.16 1.29 -0.49 0.00 2.07 -0.96 -2.26 116.25 115.74 1vdk h VAL 164 Ca 0.02 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.15 1vdk h VAL 164 Cb 0.37 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 1vdk h VAL 164 CO 0.01 0.45 0.29 -0.33 0.02 0.00 0.00 177.57 178.01 1vdk h GLU 165 N 0.56 0.66 -0.35 1.57 5.08 -0.63 -0.45 114.58 121.01 1vdk h GLU 165 Ca 0.07 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 1vdk h GLU 165 Cb 0.80 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1vdk h GLU 165 CO 0.06 0.47 0.04 0.78 -1.00 0.00 0.00 179.01 179.36 1vdk h GLY 166 N 0.72 0.65 1.50 -3.84 0.00 -0.95 -1.82 103.07 99.33 1vdk h GLY 166 Ca 0.18 -0.45 -0.09 0.00 0.00 0.00 0.00 47.33 46.97 1vdk h GLY 166 CO -0.03 0.41 -0.19 -2.00 0.00 0.00 0.00 176.54 174.72 1vdk h LEU 167 N 0.43 0.58 -0.56 3.11 5.85 -0.82 -1.74 115.31 122.16 1vdk h LEU 167 Ca 0.11 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1vdk h LEU 167 Cb 0.39 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1vdk h LEU 167 CO 0.01 0.78 0.30 0.40 -0.34 0.00 0.00 178.44 179.59 1vdk h ILE 168 N 0.52 1.19 -0.69 4.05 2.04 -0.91 -0.17 117.51 123.55 1vdk h ILE 168 Ca 0.08 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 1vdk h ILE 168 Cb 0.63 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 1vdk h ILE 168 CO 0.04 0.21 0.35 0.03 0.00 0.00 0.00 178.15 178.78 1vdk h ARG 169 N 0.75 0.97 0.23 2.37 3.08 -0.93 0.23 114.38 121.08 1vdk h ARG 169 Ca 0.20 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.10 1vdk h ARG 169 Cb 0.07 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.94 1vdk h ARG 169 CO -0.03 0.75 -0.11 1.15 -1.07 0.00 0.00 179.97 180.67 1vdk h THR 170 N 0.95 0.79 -0.73 2.04 2.02 -0.90 -0.54 112.91 116.54 1vdk h THR 170 Ca 0.24 -0.09 -0.02 0.00 0.77 0.00 0.00 66.41 67.31 1vdk h THR 170 Cb 0.09 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 1vdk h THR 170 CO -0.03 0.02 0.37 -0.26 0.37 0.00 0.00 175.52 175.99 1vdk h PHE 171 N -0.35 1.01 -0.62 3.16 0.05 -0.88 -0.98 116.94 118.33 1vdk h PHE 171 Ca -0.03 -0.03 -0.04 0.00 3.82 0.00 0.00 57.97 61.69 1vdk h PHE 171 Cb 0.27 -0.32 -0.03 0.00 2.00 0.00 0.00 35.95 37.87 1vdk h PHE 171 CO -0.05 0.72 0.25 1.15 -0.18 0.00 0.00 178.31 180.20 1vdk h THR 172 N 1.02 1.23 -0.53 -1.55 2.02 -0.73 0.97 112.91 115.35 1vdk h THR 172 Ca 0.25 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.67 1vdk h THR 172 Cb 0.07 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.00 1vdk h THR 172 CO -0.04 0.28 0.16 0.00 0.37 0.00 0.00 175.52 176.29 1vdk h ALA 173 N 1.10 0.69 -0.52 6.16 0.00 -0.55 -1.99 119.26 124.15 1vdk h ALA 173 Ca 0.21 -0.20 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1vdk h ALA 173 Cb 0.20 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1vdk h ALA 173 CO -0.02 0.36 -0.05 0.87 0.00 0.00 0.00 179.25 180.41 1vdk h LYS 174 N 0.73 0.93 -0.73 0.00 1.79 -0.93 -2.03 116.57 116.32 1vdk h LYS 174 Ca 0.17 -0.30 -0.03 0.00 -2.18 0.00 0.00 60.65 58.31 1vdk h LYS 174 Cb 0.29 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 30.82 1vdk h LYS 174 CO -0.00 0.95 0.35 0.00 -1.08 0.00 0.00 179.45 179.67 1vdk h ALA 175 N 1.09 0.94 -0.35 3.86 0.00 -0.55 -0.84 119.26 123.41 1vdk h ALA 175 Ca 0.15 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1vdk h ALA 175 Cb 0.57 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1vdk h ALA 175 CO 0.03 0.51 -0.28 1.96 0.00 0.00 0.00 179.25 181.48 1vdk h GLN 176 N 1.03 0.81 -0.09 0.00 4.20 -1.23 -2.44 115.11 117.38 1vdk h GLN 176 Ca 0.25 -0.40 -0.08 0.00 0.06 0.00 0.00 58.65 58.48 1vdk h GLN 176 Cb 0.12 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.90 1vdk h GLN 176 CO -0.03 1.03 -0.30 0.00 -0.67 0.00 0.00 178.83 178.86 1vdk h ALA 177 N 0.76 1.33 -0.43 3.87 0.00 -1.11 -3.13 119.26 120.55 1vdk h ALA 177 Ca 0.06 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1vdk h ALA 177 Cb 0.85 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1vdk h ALA 177 CO 0.07 0.47 0.00 1.19 0.00 0.00 0.00 179.25 180.98 1vdk n PHE 178 N -4.13 1.11 0.75 0.00 3.72 -0.34 -4.61 117.46 113.94 1vdk n PHE 178 Ca -0.01 -0.69 0.08 0.00 -0.05 0.00 0.00 57.45 56.77 1vdk n PHE 178 Cb 0.39 -0.25 0.40 0.00 -0.94 0.00 0.00 39.48 39.08 1vdk n PHE 178 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1vdk n ASP 179 N 0.33 0.00 -0.76 4.37 2.03 -0.92 -1.93 116.55 119.66 1vdk n ASP 179 Ca 0.21 0.11 0.11 0.00 0.52 0.00 0.00 54.79 55.73 1vdk n ASP 179 Cb 0.81 -0.31 0.06 0.00 -0.72 0.00 0.00 41.12 40.97 1vdk n ASP 179 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1vdk n GLN 180 N -1.31 1.86 -3.12 -0.67 1.13 -1.26 -4.76 117.38 109.25 1vdk n GLN 180 Ca 0.07 -1.56 -0.44 0.00 -1.94 0.00 0.00 57.00 53.13 1vdk n GLN 180 Cb 0.14 -1.43 -0.06 0.00 0.11 0.00 0.00 30.24 29.00 1vdk n GLN 180 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1vdk s ILE 181 N -2.00 4.82 0.26 5.09 1.01 -0.97 -5.03 121.20 124.38 1vdk s ILE 181 Ca 0.23 -0.39 -0.29 0.00 0.00 0.00 0.00 60.65 60.21 1vdk s ILE 181 Cb 0.18 -4.32 -0.09 0.00 0.01 0.00 0.00 42.46 38.24 1vdk s ILE 181 CO 0.36 -0.83 0.94 -0.69 0.00 0.00 0.00 174.94 174.71 1vdk s VAL 182 N 2.78 4.11 0.31 2.92 1.01 -1.26 -0.69 120.40 129.58 1vdk s VAL 182 Ca 0.17 2.01 -0.07 0.00 0.00 0.00 0.00 61.98 64.09 1vdk s VAL 182 Cb -0.18 -4.24 0.00 0.00 0.00 0.00 0.00 36.38 31.96 1vdk s VAL 182 CO 0.13 0.40 0.50 -1.59 0.00 0.00 0.00 175.10 174.54 1vdk s LYS 183 N -1.43 1.80 0.20 2.72 -2.85 0.14 -4.82 119.74 115.49 1vdk s LYS 183 Ca 0.44 -1.55 -0.30 0.00 -1.00 0.00 0.00 55.97 53.56 1vdk s LYS 183 Cb -0.24 0.47 -0.08 0.00 -2.06 0.00 0.00 37.83 35.92 1vdk s LYS 183 CO 0.30 -0.76 1.14 0.08 0.10 0.00 0.00 175.35 176.21 1vdk s VAL 184 N -3.33 3.69 0.11 1.79 1.01 -1.26 -1.37 120.40 121.05 1vdk s VAL 184 Ca 0.26 1.48 0.02 0.00 0.00 0.00 0.00 61.98 63.74 1vdk s VAL 184 Cb -0.01 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1vdk s VAL 184 CO 0.15 0.26 0.21 -0.83 0.00 0.00 0.00 175.10 174.89 1vdk s GLY 185 N -0.13 1.92 -0.02 4.51 0.00 -0.18 -4.76 107.32 108.66 1vdk s GLY 185 Ca 0.50 -0.99 0.02 0.00 0.00 0.00 0.00 44.72 44.25 1vdk s GLY 185 CO 0.37 -0.98 -0.07 0.50 0.00 0.00 0.00 173.10 172.92 1vdk s ARG 186 N -2.85 0.77 -0.03 2.90 0.52 -1.26 -0.69 118.95 118.30 1vdk s ARG 186 Ca 0.33 -0.21 0.03 0.00 -0.52 0.00 0.00 55.73 55.36 1vdk s ARG 186 Cb -0.12 -0.74 0.00 0.00 0.52 0.00 0.00 34.95 34.61 1vdk s ARG 186 CO 0.27 0.06 -0.11 0.95 0.02 0.00 0.00 175.30 176.49 1vdk s THR 187 N 0.33 0.92 -0.71 0.02 -4.23 -0.39 -4.65 115.64 106.93 1vdk s THR 187 Ca -0.04 -0.42 0.00 0.00 -1.18 0.00 0.00 61.69 60.04 1vdk s THR 187 Cb -0.09 -0.82 0.00 0.00 1.34 0.00 0.00 72.50 72.94 1vdk s THR 187 CO 0.00 0.28 0.00 1.41 -0.54 0.00 0.00 174.62 175.78 1vdk n HIS 188 N 3.34 0.00 -0.99 3.99 8.25 -1.26 -0.72 115.22 127.83 1vdk n HIS 188 Ca -0.19 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.27 1vdk n HIS 188 Cb 0.54 -1.90 0.00 0.00 1.12 0.00 0.00 29.99 29.75 1vdk n HIS 188 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1vdk n LEU 189 N -0.76 0.05 -4.82 2.41 4.77 -1.26 -5.03 117.00 112.36 1vdk n LEU 189 Ca -0.07 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.64 1vdk n LEU 189 Cb 0.40 -0.37 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 1vdk n LEU 189 CO 0.10 -0.04 -0.21 -0.04 -1.33 0.00 0.00 177.39 175.87 1vdk s MET 190 N -0.08 3.00 0.05 3.23 -1.94 0.10 -5.03 119.30 118.63 1vdk s MET 190 Ca 0.00 -0.78 -0.33 0.00 -1.71 0.00 0.00 55.69 52.87 1vdk s MET 190 Cb 0.00 -2.72 -0.12 0.00 2.01 0.00 0.00 34.83 34.00 1vdk s MET 190 CO 0.00 0.51 1.78 -0.25 -0.01 0.00 0.00 175.02 177.05 1vdk n ASP 191 N -0.20 3.52 0.00 3.03 8.00 -1.26 -1.26 116.55 128.38 1vdk n ASP 191 Ca -0.08 1.01 0.00 0.00 0.71 0.00 0.00 54.79 56.43 1vdk n ASP 191 Cb 0.54 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.20 1vdk n ASP 191 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vdk n ALA 192 N 5.42 0.10 -2.23 2.24 0.00 0.13 -4.83 120.51 121.34 1vdk n ALA 192 Ca 0.20 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.51 1vdk n ALA 192 Cb 0.32 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.67 1vdk n ALA 192 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1vdk s VAL 193 N 0.84 0.41 0.58 0.00 -7.23 -1.25 -4.79 120.40 108.96 1vdk s VAL 193 Ca 0.00 -1.97 -0.19 0.00 -1.81 0.00 0.00 61.98 58.01 1vdk s VAL 193 Cb 0.00 -2.28 -0.04 0.00 0.56 0.00 0.00 36.38 34.62 1vdk s VAL 193 CO 0.00 -0.29 1.18 -2.84 -0.31 0.00 0.00 175.10 172.84 1vdk s PRO 194 N -4.01 3.08 0.35 4.82 0.02 -1.26 -1.01 135.00 136.98 1vdk s PRO 194 Ca 0.30 1.75 -0.03 0.00 0.02 0.00 0.00 61.00 63.04 1vdk s PRO 194 Cb 0.07 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.64 1vdk s PRO 194 CO 0.07 -1.10 0.49 0.96 -0.33 0.00 0.00 177.00 177.09 1vdk s ILE 195 N -1.67 0.00 0.19 2.83 -4.36 -0.47 -4.16 121.20 113.56 1vdk s ILE 195 Ca 0.76 -1.58 0.08 0.00 -0.26 0.00 0.00 60.65 59.65 1vdk s ILE 195 Cb -0.28 -2.65 -0.04 0.00 1.25 0.00 0.00 42.46 40.74 1vdk s ILE 195 CO 0.31 0.00 -0.02 0.42 0.24 0.00 0.00 174.94 175.89 1vdk s THR 196 N -3.01 3.54 0.46 8.37 -4.23 -1.26 0.24 115.64 119.75 1vdk s THR 196 Ca 0.30 -1.57 0.13 0.00 -1.18 0.00 0.00 61.69 59.37 1vdk s THR 196 Cb -0.01 -2.79 0.23 0.00 1.34 0.00 0.00 72.50 71.28 1vdk s THR 196 CO 0.20 -0.16 2.06 0.25 -0.54 0.00 0.00 174.62 176.44 1vdk h LEU 197 N 2.61 0.13 -0.78 4.79 5.85 -1.00 -1.59 115.31 125.32 1vdk h LEU 197 Ca -0.46 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.15 1vdk h LEU 197 Cb 1.21 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1vdk h LEU 197 CO 0.57 0.16 -0.08 1.23 -0.34 0.00 0.00 178.44 179.99 1vdk h GLY 198 N 0.33 0.90 1.07 3.75 0.00 -1.57 -1.06 103.07 106.50 1vdk h GLY 198 Ca 0.04 -0.67 -0.10 0.00 0.00 0.00 0.00 47.33 46.59 1vdk h GLY 198 CO 0.00 0.62 -0.07 1.46 0.00 0.00 0.00 176.54 178.55 1vdk h GLN 199 N 0.76 0.99 -0.08 4.80 4.20 -1.58 0.58 115.11 124.78 1vdk h GLN 199 Ca 0.13 -0.35 -0.00 0.00 0.06 0.00 0.00 58.65 58.48 1vdk h GLN 199 Cb 0.57 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 1vdk h GLN 199 CO 0.04 1.03 0.03 1.49 -0.67 0.00 0.00 178.83 180.75 1vdk h GLU 200 N 0.87 0.13 -0.12 1.46 4.81 -1.13 -2.09 114.58 118.50 1vdk h GLU 200 Ca 0.14 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.24 1vdk h GLU 200 Cb 0.63 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 1vdk h GLU 200 CO 0.04 0.25 -0.42 0.82 -0.73 0.00 0.00 179.01 178.97 1vdk h ILE 201 N -0.02 1.31 -0.05 2.32 2.04 -1.16 -2.74 117.51 119.21 1vdk h ILE 201 Ca 0.03 -1.55 -0.04 0.00 1.00 0.00 0.00 64.86 64.29 1vdk h ILE 201 Cb 0.17 1.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.93 1vdk h ILE 201 CO -0.00 0.47 -0.17 1.23 0.00 0.00 0.00 178.15 179.67 1vdk h GLY 202 N 1.22 0.08 1.55 5.37 0.00 -0.67 -2.11 103.07 108.51 1vdk h GLY 202 Ca 0.02 -0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.24 1vdk h GLY 202 CO 0.07 0.04 -0.09 1.48 0.00 0.00 0.00 176.54 178.04 1vdk h SER 203 N 0.07 0.53 -0.24 0.19 4.64 -1.06 -1.14 113.55 116.54 1vdk h SER 203 Ca 0.01 -0.13 -0.02 0.00 -0.47 0.00 0.00 61.79 61.18 1vdk h SER 203 Cb 0.35 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1vdk h SER 203 CO 0.02 0.66 0.08 -0.50 -0.87 0.00 0.00 176.83 176.22 1vdk h TRP 204 N 0.51 0.38 -0.96 4.77 6.55 -1.43 -1.34 115.95 124.42 1vdk h TRP 204 Ca 0.10 -0.04 0.03 0.00 0.95 0.00 0.00 58.89 59.93 1vdk h TRP 204 Cb 0.47 -0.11 -0.06 0.00 -0.86 0.00 0.00 29.16 28.60 1vdk h TRP 204 CO 0.02 0.43 0.63 0.00 -1.05 0.00 0.00 178.44 178.47 1vdk h ALA 205 N 0.91 1.27 -0.54 1.49 0.00 -1.25 -2.25 119.26 118.89 1vdk h ALA 205 Ca 0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1vdk h ALA 205 Cb 0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1vdk h ALA 205 CO -0.00 0.52 0.25 0.00 0.00 0.00 0.00 179.25 180.01 1vdk h ALA 206 N 1.39 0.69 -0.84 0.00 0.00 -0.84 -1.04 119.26 118.63 1vdk h ALA 206 Ca 0.38 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1vdk h ALA 206 Cb -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.53 1vdk h ALA 206 CO -0.12 0.26 0.55 1.96 0.00 0.00 0.00 179.25 181.90 1vdk h GLN 207 N 0.72 1.11 -0.47 0.00 4.20 -0.80 -0.12 115.11 119.75 1vdk h GLN 207 Ca 0.18 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.72 1vdk h GLN 207 Cb 0.13 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 1vdk h GLN 207 CO -0.02 0.75 -0.11 -0.07 -0.67 0.00 0.00 178.83 178.71 1vdk h LEU 208 N 1.14 0.84 -0.38 1.46 3.38 -1.09 -0.35 115.31 120.31 1vdk h LEU 208 Ca 0.31 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1vdk h LEU 208 Cb -0.11 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.40 1vdk h LEU 208 CO -0.06 0.96 0.03 0.11 0.09 0.00 0.00 178.44 179.57 1vdk h LYS 209 N 0.76 0.64 -0.04 1.13 1.57 -0.69 0.45 116.57 120.39 1vdk h LYS 209 Ca 0.13 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1vdk h LYS 209 Cb 0.61 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1vdk h LYS 209 CO 0.04 0.72 0.02 1.15 -0.57 0.00 0.00 179.45 180.81 1vdk h THR 210 N 0.47 1.14 -0.20 -0.16 2.02 -0.83 -1.21 112.91 114.15 1vdk h THR 210 Ca 0.11 -0.42 -0.15 0.00 0.77 0.00 0.00 66.41 66.72 1vdk h THR 210 Cb 0.41 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 1vdk h THR 210 CO 0.01 0.12 -0.50 0.71 0.37 0.00 0.00 175.52 176.23 1vdk h THR 211 N -0.09 1.32 -0.71 3.16 1.35 -1.06 -2.80 112.91 114.07 1vdk h THR 211 Ca 0.01 -1.72 -0.06 0.00 -0.55 0.00 0.00 66.41 64.09 1vdk h THR 211 Cb 0.17 1.70 -0.03 0.00 -1.73 0.00 0.00 68.15 68.26 1vdk h THR 211 CO -0.00 0.54 0.19 0.25 -0.25 0.00 0.00 175.52 176.25 1vdk h LEU 212 N 0.42 1.05 -1.16 3.87 5.85 -0.85 -2.28 115.31 122.21 1vdk h LEU 212 Ca 0.02 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 1vdk h LEU 212 Cb 1.02 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 1vdk h LEU 212 CO 0.09 0.99 0.45 0.00 -0.34 0.00 0.00 178.44 179.64 1vdk h ALA 213 N 1.14 1.37 -0.51 1.25 0.00 -1.07 -1.40 119.26 120.05 1vdk h ALA 213 Ca 0.23 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 1vdk h ALA 213 Cb 0.34 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1vdk h ALA 213 CO -0.00 0.54 -0.13 0.00 0.00 0.00 0.00 179.25 179.66 1vdk h ALA 214 N 1.45 0.82 -0.48 0.00 0.00 -1.19 -1.58 119.26 118.29 1vdk h ALA 214 Ca 0.27 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1vdk h ALA 214 Cb -0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1vdk h ALA 214 CO -0.05 0.66 0.22 0.28 0.00 0.00 0.00 179.25 180.36 1vdk h VAL 215 N 0.85 1.19 0.00 0.00 2.07 -0.87 -0.55 116.25 118.95 1vdk h VAL 215 Ca 0.13 -0.56 -0.05 0.00 0.82 0.00 0.00 66.70 67.04 1vdk h VAL 215 Cb 0.67 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1vdk h VAL 215 CO 0.05 0.22 -0.22 0.11 0.02 0.00 0.00 177.57 177.75 1vdk h LYS 216 N 0.63 0.00 -0.02 1.57 1.57 -1.05 0.38 116.57 119.65 1vdk h LYS 216 Ca 0.16 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.82 1vdk h LYS 216 Cb 0.14 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.46 1vdk h LYS 216 CO -0.02 0.22 -0.46 1.49 -0.57 0.00 0.00 179.45 180.10 1vdk h GLU 217 N 0.00 0.34 -0.05 3.15 4.57 -0.82 -3.20 114.58 118.57 1vdk h GLU 217 Ca -0.00 -0.35 -0.04 0.00 -1.18 0.00 0.00 59.36 57.79 1vdk h GLU 217 Cb 0.38 0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 29.06 1vdk h GLU 217 CO 0.03 1.03 -0.16 0.52 -1.18 0.00 0.00 179.01 179.24 1vdk h MET 218 N -0.20 0.08 -0.91 1.92 2.86 -0.79 -2.37 114.93 115.52 1vdk h MET 218 Ca -0.05 -0.02 0.19 0.00 -2.06 0.00 0.00 59.70 57.76 1vdk h MET 218 Cb 1.17 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.75 1vdk h MET 218 CO 0.09 0.25 0.59 1.49 1.06 0.00 0.00 176.91 180.39 1vdk h GLU 219 N 0.08 0.50 -0.15 1.72 4.81 -0.92 -0.64 114.58 119.99 1vdk h GLU 219 Ca 0.02 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1vdk h GLU 219 Cb 0.34 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.60 1vdk h GLU 219 CO 0.02 0.33 0.17 0.87 -0.73 0.00 0.00 179.01 179.68 1vdk h LYS 220 N 0.52 0.00 0.00 1.92 1.57 -1.51 0.22 116.57 119.29 1vdk h LYS 220 Ca 0.48 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.21 1vdk h LYS 220 Cb 1.03 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.34 1vdk h LYS 220 CO -0.21 0.00 -0.24 0.78 -0.57 0.00 0.00 179.45 179.21 1vdk h GLY 221 N 0.00 0.00 2.00 3.86 0.00 -1.28 -2.45 103.07 105.20 1vdk h GLY 221 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1vdk h GLY 221 CO -0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 1vdk n LEU 222 N -3.78 0.07 0.19 3.11 4.77 0.07 -2.75 117.00 118.69 1vdk n LEU 222 Ca -0.01 0.51 0.14 0.00 -0.03 0.00 0.00 56.01 56.62 1vdk n LEU 222 Cb 0.34 -0.50 0.51 0.00 -2.33 0.00 0.00 43.42 41.44 1vdk n LEU 222 CO 0.34 -0.21 0.91 1.88 -1.33 0.00 0.00 177.39 178.98 1vdk h TYR 223 N 0.00 0.00 -3.17 -1.77 0.99 -1.55 -3.41 116.97 108.05 1vdk h TYR 223 Ca 0.00 0.00 -0.63 0.00 2.00 0.00 0.00 58.73 60.10 1vdk h TYR 223 Cb 0.33 0.00 -0.14 0.00 1.00 0.00 0.00 36.73 37.92 1vdk h TYR 223 CO 0.00 0.00 0.40 -0.80 -0.00 0.00 0.00 178.16 177.76 1vdk s ASN 224 N -5.07 6.29 0.16 3.88 0.01 -1.11 -0.58 114.94 118.52 1vdk s ASN 224 Ca 0.04 -0.58 -0.02 0.00 -0.71 0.00 0.00 52.86 51.59 1vdk s ASN 224 Cb 0.09 -2.39 -0.05 0.00 0.41 0.00 0.00 41.25 39.31 1vdk s ASN 224 CO 0.51 -1.14 0.36 -0.76 -1.51 0.00 0.00 177.10 174.57 1vdk s LEU 225 N 3.54 4.26 0.20 0.60 1.43 0.42 -4.61 118.68 124.51 1vdk s LEU 225 Ca 0.25 0.45 0.25 0.00 -1.03 0.00 0.00 54.13 54.06 1vdk s LEU 225 Cb -0.15 -3.20 0.67 0.00 0.03 0.00 0.00 46.19 43.54 1vdk s LEU 225 CO 0.16 0.02 1.66 0.00 0.23 0.00 0.00 176.35 178.42 1vdk h ALA 226 N 2.44 0.90 -1.48 4.21 0.00 -1.85 0.12 119.26 123.61 1vdk h ALA 226 Ca -0.47 0.00 -0.72 0.00 0.00 0.00 0.00 54.91 53.72 1vdk h ALA 226 Cb 1.18 0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.02 1vdk h ALA 226 CO 0.71 0.00 0.40 1.51 0.00 0.00 0.00 179.25 181.87 1vdk n ILE 227 N -2.28 0.03 0.00 0.00 0.13 -1.25 -2.20 119.36 113.78 1vdk n ILE 227 Ca 0.05 -0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.69 1vdk n ILE 227 Cb 0.44 -0.64 0.00 0.00 -0.84 0.00 0.00 39.64 38.60 1vdk n ILE 227 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1vdk n GLY 228 N 2.45 2.56 0.05 4.50 0.00 -1.26 -4.60 105.19 108.89 1vdk n GLY 228 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 1vdk n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vdk n GLY 229 N -1.25 -1.18 7.00 -0.02 0.00 -0.93 -3.89 105.19 104.91 1vdk n GLY 229 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1vdk n GLY 229 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vdk n THR 230 N -1.27 0.00 0.09 2.61 -2.24 -1.26 0.00 114.28 112.21 1vdk n THR 230 Ca 0.09 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.74 1vdk n THR 230 Cb 0.32 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.47 1vdk n THR 230 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vdk h ALA 231 N -0.54 -0.14 0.00 6.98 0.00 -1.92 -3.27 119.26 120.37 1vdk h ALA 231 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vdk h ALA 231 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1vdk h ALA 231 CO 0.00 -0.57 0.00 1.33 0.00 0.00 0.00 179.25 180.01 1vdk n VAL 232 N -5.15 0.00 0.00 0.00 0.24 -1.24 -4.87 118.33 107.31 1vdk n VAL 232 Ca -0.08 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 1vdk n VAL 232 Cb 0.09 1.15 0.00 0.00 -1.47 0.00 0.00 33.84 33.61 1vdk n VAL 232 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vdk n GLY 233 N 0.26 1.16 0.20 7.63 0.00 0.10 -4.64 105.19 109.90 1vdk n GLY 233 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1vdk n GLY 233 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1vdk h THR 234 N 0.00 0.45 0.00 2.61 1.35 -1.85 -3.41 112.91 112.05 1vdk h THR 234 Ca 0.00 -1.35 0.00 0.00 -0.55 0.00 0.00 66.41 64.51 1vdk h THR 234 Cb 0.00 1.99 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1vdk h THR 234 CO 0.00 0.22 0.00 0.61 -0.25 0.00 0.00 175.52 176.10 1vdk n GLY 235 N 0.69 0.69 3.70 5.82 0.00 -0.88 -4.97 105.19 110.24 1vdk n GLY 235 Ca 0.02 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1vdk n GLY 235 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1vdk n LEU 236 N 0.00 3.68 0.00 0.99 7.94 -1.26 -1.93 117.00 126.41 1vdk n LEU 236 Ca 0.00 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.04 1vdk n LEU 236 Cb 0.00 -1.50 0.00 0.00 0.53 0.00 0.00 43.42 42.45 1vdk n LEU 236 CO 0.00 -0.18 0.00 0.59 -1.11 0.00 0.00 177.39 176.69 1vdk n ASN 237 N 2.28 -2.12 -4.27 1.96 3.02 -1.26 -4.68 115.26 110.20 1vdk n ASN 237 Ca 0.11 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.42 1vdk n ASN 237 Cb 0.34 -0.35 -0.13 0.00 -0.61 0.00 0.00 39.78 39.03 1vdk n ASN 237 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vdk s ALA 238 N -2.45 1.73 0.37 5.41 0.00 -0.81 -3.80 121.76 122.20 1vdk s ALA 238 Ca 0.00 -1.19 -0.27 0.00 0.00 0.00 0.00 51.96 50.49 1vdk s ALA 238 Cb 0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 23.12 22.79 1vdk s ALA 238 CO 0.00 0.34 1.29 -1.58 0.00 0.00 0.00 175.76 175.82 1vdk s HIS 239 N -1.13 2.95 0.57 0.00 2.46 -1.26 -4.88 115.29 114.01 1vdk s HIS 239 Ca 0.06 1.42 0.32 0.00 0.47 0.00 0.00 55.06 57.33 1vdk s HIS 239 Cb -0.10 -3.65 1.43 0.00 -0.13 0.00 0.00 32.58 30.13 1vdk s HIS 239 CO 0.04 -1.91 1.77 -1.35 -2.47 0.00 0.00 174.74 170.81 1vdk h PRO 240 N 3.02 0.00 -0.27 2.88 0.11 -1.98 0.50 132.00 136.25 1vdk h PRO 240 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1vdk h PRO 240 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1vdk h PRO 240 CO 0.64 0.00 0.00 0.54 -0.21 0.00 0.00 178.00 178.97 1vdk n ARG 241 N -3.85 2.05 0.21 1.05 1.74 -1.26 -4.67 116.66 111.94 1vdk n ARG 241 Ca 0.18 -1.86 -0.15 0.00 -0.77 0.00 0.00 57.85 55.25 1vdk n ARG 241 Cb 1.05 -1.33 -0.08 0.00 -1.02 0.00 0.00 32.46 31.08 1vdk n ARG 241 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1vdk h PHE 242 N 2.81 -0.49 -0.24 -1.55 3.04 -1.25 -2.32 116.94 116.95 1vdk h PHE 242 Ca 0.00 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 61.99 1vdk h PHE 242 Cb 0.73 0.17 -0.04 0.00 2.56 0.00 0.00 35.95 39.37 1vdk h PHE 242 CO 0.17 -0.30 -0.02 0.78 -2.02 0.00 0.00 178.31 176.93 1vdk h GLY 243 N -0.49 0.22 0.30 2.40 0.00 -1.81 -1.31 103.07 102.37 1vdk h GLY 243 Ca -0.04 0.04 0.06 0.00 0.00 0.00 0.00 47.33 47.39 1vdk h GLY 243 CO 0.06 -0.06 -0.15 -2.09 0.00 0.00 0.00 176.54 174.30 1vdk h GLU 244 N 0.05 -0.12 -0.52 4.80 4.81 -1.84 -1.26 114.58 120.50 1vdk h GLU 244 Ca 0.12 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1vdk h GLU 244 Cb 0.16 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 1vdk h GLU 244 CO -0.21 -0.08 0.08 -0.07 -0.73 0.00 0.00 179.01 178.00 1vdk h LEU 245 N -0.12 0.83 -0.56 1.64 3.38 -1.20 -1.66 115.31 117.63 1vdk h LEU 245 Ca 0.14 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.87 1vdk h LEU 245 Cb 0.33 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.83 1vdk h LEU 245 CO -0.34 0.89 0.35 0.58 0.09 0.00 0.00 178.44 180.01 1vdk h VAL 246 N 0.75 1.09 -0.53 1.22 2.07 -0.93 -0.60 116.25 119.31 1vdk h VAL 246 Ca 0.16 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1vdk h VAL 246 Cb 0.41 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 1vdk h VAL 246 CO 0.01 0.13 0.32 0.00 0.02 0.00 0.00 177.57 178.05 1vdk h ALA 247 N 1.24 0.67 -0.44 1.67 0.00 -1.08 -0.60 119.26 120.72 1vdk h ALA 247 Ca 0.22 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1vdk h ALA 247 Cb -0.01 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1vdk h ALA 247 CO -0.08 0.16 0.24 -0.22 0.00 0.00 0.00 179.25 179.34 1vdk h LYS 248 N 0.71 0.46 -0.30 0.00 3.64 -0.63 -0.58 116.57 119.87 1vdk h LYS 248 Ca 0.19 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.44 1vdk h LYS 248 Cb -0.02 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.68 1vdk h LYS 248 CO -0.04 0.30 -0.24 1.88 -2.27 0.00 0.00 179.45 179.08 1vdk h TYR 249 N 0.47 0.67 -0.65 1.91 0.99 -0.85 -0.97 116.97 118.54 1vdk h TYR 249 Ca 0.18 -0.15 -0.08 0.00 2.00 0.00 0.00 58.73 60.68 1vdk h TYR 249 Cb 0.06 -0.16 -0.02 0.00 1.00 0.00 0.00 36.73 37.60 1vdk h TYR 249 CO -0.09 0.78 0.08 -0.07 -0.00 0.00 0.00 178.16 178.86 1vdk h LEU 250 N 0.52 1.06 -0.68 3.88 3.38 -0.71 -1.30 115.31 121.46 1vdk h LEU 250 Ca 0.07 -0.27 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 1vdk h LEU 250 Cb 0.70 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1vdk h LEU 250 CO 0.05 1.06 0.17 0.00 0.09 0.00 0.00 178.44 179.82 1vdk h ALA 251 N 1.03 0.90 -0.36 1.53 0.00 -0.74 -1.21 119.26 120.41 1vdk h ALA 251 Ca 0.19 -0.24 -0.11 0.00 0.00 0.00 0.00 54.91 54.76 1vdk h ALA 251 Cb 0.47 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1vdk h ALA 251 CO 0.02 0.61 -0.21 0.93 0.00 0.00 0.00 179.25 180.60 1vdk h GLU 252 N 1.02 0.70 -0.00 0.00 5.08 -0.89 0.12 114.58 120.60 1vdk h GLU 252 Ca 0.21 -0.27 -0.17 0.00 -1.00 0.00 0.00 59.36 58.13 1vdk h GLU 252 Cb 0.36 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1vdk h GLU 252 CO 0.00 0.86 -0.81 1.49 -1.00 0.00 0.00 179.01 179.55 1vdk h GLU 253 N 0.62 0.06 0.00 2.33 4.81 -0.99 -3.34 114.58 118.06 1vdk h GLU 253 Ca 0.09 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 59.07 1vdk h GLU 253 Cb 0.70 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.06 1vdk h GLU 253 CO 0.05 0.83 -2.13 0.25 -0.73 0.00 0.00 179.01 177.29 1vdk n THR 254 N -3.62 0.78 -0.69 0.32 -2.24 -0.48 -4.98 114.28 103.37 1vdk n THR 254 Ca -0.01 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 61.08 1vdk n THR 254 Cb 0.77 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1vdk n THR 254 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vdk n GLY 255 N 1.51 0.72 3.70 3.38 0.00 0.41 -5.04 105.19 109.86 1vdk n GLY 255 Ca -0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 1vdk n GLY 255 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vdk s LEU 256 N 0.00 3.61 -0.66 0.99 1.43 -1.21 -5.02 118.68 117.83 1vdk s LEU 256 Ca 0.00 0.10 -0.05 0.00 -1.03 0.00 0.00 54.13 53.15 1vdk s LEU 256 Cb 0.00 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.20 1vdk s LEU 256 CO 0.00 0.34 2.19 -0.81 0.23 0.00 0.00 176.35 178.30 1vdk n PRO 257 N 1.79 1.85 -1.94 1.29 -0.04 -1.26 -4.25 135.00 132.44 1vdk n PRO 257 Ca -0.17 -1.21 -0.36 0.00 -0.04 0.00 0.00 63.50 61.72 1vdk n PRO 257 Cb 0.53 -2.26 0.04 0.00 -0.04 0.00 0.00 33.50 31.78 1vdk n PRO 257 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1vdk s PHE 258 N 2.90 2.32 0.27 0.54 0.08 -1.26 -4.88 117.98 117.94 1vdk s PHE 258 Ca 0.40 1.51 -0.21 0.00 0.12 0.00 0.00 56.93 58.75 1vdk s PHE 258 Cb 0.13 -3.52 0.02 0.00 -0.57 0.00 0.00 43.02 39.08 1vdk s PHE 258 CO -0.02 -2.37 0.71 -0.98 -0.10 0.00 0.00 175.22 172.46 1vdk s ARG 259 N -3.37 1.75 0.13 0.44 1.70 0.25 -4.61 118.95 115.24 1vdk s ARG 259 Ca 0.78 -0.95 -0.30 0.00 -0.47 0.00 0.00 55.73 54.79 1vdk s ARG 259 Cb -0.32 0.61 -0.06 0.00 -0.57 0.00 0.00 34.95 34.61 1vdk s ARG 259 CO 0.35 -0.80 0.99 0.08 -1.08 0.00 0.00 175.30 174.84 1vdk s VAL 260 N -3.90 4.36 0.32 4.99 1.01 -1.26 -0.44 120.40 125.48 1vdk s VAL 260 Ca 0.10 1.97 -0.29 0.00 0.00 0.00 0.00 61.98 63.77 1vdk s VAL 260 Cb -0.06 -4.26 -0.12 0.00 0.00 0.00 0.00 36.38 31.94 1vdk s VAL 260 CO 0.06 0.31 1.46 0.00 0.00 0.00 0.00 175.10 176.92 1vdk n ALA 261 N 2.71 1.96 -0.33 5.51 0.00 0.42 -4.69 120.51 126.09 1vdk n ALA 261 Ca 0.02 0.37 0.15 0.00 0.00 0.00 0.00 53.44 53.98 1vdk n ALA 261 Cb 0.48 -2.37 0.37 0.00 0.00 0.00 0.00 19.45 17.94 1vdk n ALA 261 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1vdk h GLU 262 N 3.58 0.65 -4.65 0.00 4.81 -1.94 -3.31 114.58 113.73 1vdk h GLU 262 Ca -0.48 -0.04 -0.65 0.00 -0.13 0.00 0.00 59.36 58.06 1vdk h GLU 262 Cb 1.25 -0.15 -0.38 0.00 0.63 0.00 0.00 28.75 30.10 1vdk h GLU 262 CO 0.70 0.43 -0.77 1.21 -0.73 0.00 0.00 179.01 179.85 1vdk s ASN 263 N -5.46 4.41 0.45 1.04 3.84 -1.26 -4.99 114.94 112.97 1vdk s ASN 263 Ca -0.10 -1.60 0.24 0.00 0.21 0.00 0.00 52.86 51.61 1vdk s ASN 263 Cb 0.24 -1.47 0.96 0.00 -0.55 0.00 0.00 41.25 40.43 1vdk s ASN 263 CO 0.80 -0.27 1.84 0.03 -2.79 0.00 0.00 177.10 176.71 1vdk h ARG 264 N 7.77 0.00 -0.11 0.43 3.08 -1.86 -2.87 114.38 120.81 1vdk h ARG 264 Ca -0.14 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 59.87 1vdk h ARG 264 Cb 1.04 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.09 1vdk h ARG 264 CO 0.47 0.22 -0.08 0.74 -1.07 0.00 0.00 179.97 180.25 1vdk h PHE 265 N 0.00 0.30 0.00 3.04 0.04 -1.82 -2.98 116.94 115.51 1vdk h PHE 265 Ca -0.00 -0.08 -0.05 0.00 2.80 0.00 0.00 57.97 60.64 1vdk h PHE 265 Cb 0.72 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.80 1vdk h PHE 265 CO 0.00 0.63 -0.25 0.00 -0.60 0.00 0.00 178.31 178.09 1vdk h ALA 266 N 0.62 1.46 0.00 2.45 0.00 -1.92 -1.02 119.26 120.85 1vdk h ALA 266 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1vdk h ALA 266 Cb 0.56 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1vdk h ALA 266 CO 0.02 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.58 1vdk h ALA 267 N 1.75 1.00 0.00 0.00 0.00 -1.36 -1.76 119.26 118.88 1vdk h ALA 267 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 1vdk h ALA 267 Cb 0.48 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 1vdk h ALA 267 CO 0.03 0.00 -2.25 1.28 0.00 0.00 0.00 179.25 178.32 1vdk n LEU 268 N -2.59 2.04 0.11 0.00 4.32 -0.76 -4.52 117.00 115.60 1vdk n LEU 268 Ca 0.01 -0.08 0.13 0.00 -0.02 0.00 0.00 56.01 56.05 1vdk n LEU 268 Cb 0.25 -0.40 0.43 0.00 -1.62 0.00 0.00 43.42 42.08 1vdk n LEU 268 CO 0.22 0.74 0.88 0.00 -1.22 0.00 0.00 177.39 178.01 1vdk n ALA 269 N -2.99 2.11 -3.54 -1.18 0.00 -0.46 -1.77 120.51 112.69 1vdk n ALA 269 Ca -0.36 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 52.99 1vdk n ALA 269 Cb 0.97 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.94 1vdk n ALA 269 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vdk s ALA 270 N -3.16 -1.25 -0.34 0.00 0.00 -0.67 -3.69 121.76 112.65 1vdk s ALA 270 Ca 0.09 -0.02 0.16 0.00 0.00 0.00 0.00 51.96 52.19 1vdk s ALA 270 Cb 0.11 0.87 0.44 0.00 0.00 0.00 0.00 23.12 24.54 1vdk s ALA 270 CO 0.54 -0.88 0.94 0.72 0.00 0.00 0.00 175.76 177.08 1vdk n HIS 271 N -0.40 1.27 0.10 0.00 -0.00 -1.26 -4.45 115.22 110.49 1vdk n HIS 271 Ca -0.10 -2.95 0.11 0.00 -0.00 0.00 0.00 57.72 54.78 1vdk n HIS 271 Cb 0.62 -0.36 0.60 0.00 -0.00 0.00 0.00 29.99 30.85 1vdk n HIS 271 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.34 175.90 1vdk h ASP 272 N 2.96 0.13 -0.49 0.41 3.45 -1.91 -1.21 116.42 119.77 1vdk h ASP 272 Ca -0.04 -0.00 -0.09 0.00 0.43 0.00 0.00 57.03 57.33 1vdk h ASP 272 Cb 1.12 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 39.84 1vdk h ASP 272 CO 0.53 0.09 -0.01 -0.33 -1.57 0.00 0.00 179.24 177.95 1vdk h GLU 273 N 0.15 0.92 -0.32 3.56 3.07 -1.91 -1.62 114.58 118.43 1vdk h GLU 273 Ca 0.13 -0.27 -0.16 0.00 -0.50 0.00 0.00 59.36 58.56 1vdk h GLU 273 Cb 0.33 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1vdk h GLU 273 CO -0.02 0.92 -0.43 1.25 -1.40 0.00 0.00 179.01 179.33 1vdk h LEU 274 N 0.85 0.88 -0.62 1.33 5.85 -1.61 -2.16 115.31 119.84 1vdk h LEU 274 Ca 0.16 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.48 1vdk h LEU 274 Cb 0.51 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 1vdk h LEU 274 CO 0.03 1.19 0.38 0.58 -0.34 0.00 0.00 178.44 180.27 1vdk h VAL 275 N 0.66 1.07 -0.20 1.05 2.07 -1.09 -0.67 116.25 119.16 1vdk h VAL 275 Ca 0.04 -0.26 -0.09 0.00 0.82 0.00 0.00 66.70 67.22 1vdk h VAL 275 Cb 1.01 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1vdk h VAL 275 CO 0.10 0.14 -0.27 0.78 0.02 0.00 0.00 177.57 178.33 1vdk h ASN 276 N 0.75 0.38 -0.30 0.57 2.35 -1.13 -0.25 115.58 117.95 1vdk h ASN 276 Ca 0.25 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.83 1vdk h ASN 276 Cb 0.02 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1vdk h ASN 276 CO -0.10 0.65 0.02 0.58 -1.65 0.00 0.00 177.43 176.92 1vdk h VAL 277 N 0.33 1.25 -0.70 2.81 2.07 -0.77 -1.90 116.25 119.34 1vdk h VAL 277 Ca 0.05 -0.89 -0.03 0.00 0.82 0.00 0.00 66.70 66.64 1vdk h VAL 277 Cb 0.66 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1vdk h VAL 277 CO 0.05 0.29 0.30 -0.03 0.02 0.00 0.00 177.57 178.20 1vdk h MET 278 N 0.32 1.02 -0.75 1.57 1.85 -0.86 -1.67 114.93 116.40 1vdk h MET 278 Ca 0.09 -0.16 -0.01 0.00 -0.61 0.00 0.00 59.70 59.01 1vdk h MET 278 Cb 0.40 -0.18 -0.04 0.00 0.43 0.00 0.00 31.60 32.22 1vdk h MET 278 CO 0.01 0.81 0.45 0.78 -0.40 0.00 0.00 176.91 178.56 1vdk h GLY 279 N 1.07 1.10 1.77 1.39 0.00 -0.79 0.23 103.07 107.83 1vdk h GLY 279 Ca 0.24 -0.46 -0.10 0.00 0.00 0.00 0.00 47.33 47.00 1vdk h GLY 279 CO -0.02 0.45 -0.39 0.00 0.00 0.00 0.00 176.54 176.57 1vdk h ALA 280 N 1.23 1.12 -0.45 3.60 0.00 -0.90 -1.92 119.26 121.94 1vdk h ALA 280 Ca 0.27 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.67 1vdk h ALA 280 Cb -0.02 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1vdk h ALA 280 CO -0.05 0.58 -0.14 0.82 0.00 0.00 0.00 179.25 180.45 1vdk h ILE 281 N 0.22 1.26 -0.72 0.00 2.04 -0.64 -1.66 117.51 118.02 1vdk h ILE 281 Ca 0.02 -1.25 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 1vdk h ILE 281 Cb 0.79 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 1vdk h ILE 281 CO 0.06 0.43 0.41 -0.09 0.00 0.00 0.00 178.15 178.97 1vdk h ARG 282 N 0.76 0.99 -0.57 2.37 2.43 -0.44 -0.20 114.38 119.72 1vdk h ARG 282 Ca 0.12 -0.10 -0.07 0.00 -0.81 0.00 0.00 59.98 59.12 1vdk h ARG 282 Cb 0.66 -0.20 -0.02 0.00 -0.42 0.00 0.00 29.97 29.99 1vdk h ARG 282 CO 0.05 0.72 0.09 1.15 -1.51 0.00 0.00 179.97 180.47 1vdk h THR 283 N 0.99 1.24 -0.66 0.20 2.02 -0.99 -0.53 112.91 115.19 1vdk h THR 283 Ca 0.26 -0.94 -0.03 0.00 0.77 0.00 0.00 66.41 66.47 1vdk h THR 283 Cb 0.00 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.09 1vdk h THR 283 CO -0.04 0.34 0.30 0.25 0.37 0.00 0.00 175.52 176.75 1vdk h LEU 284 N 0.86 0.87 -0.91 2.58 5.85 -0.76 -1.83 115.31 121.97 1vdk h LEU 284 Ca 0.18 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 1vdk h LEU 284 Cb 0.38 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.15 1vdk h LEU 284 CO 0.01 0.77 0.41 0.00 -0.34 0.00 0.00 178.44 179.28 1vdk h ALA 285 N 1.14 1.15 -0.73 1.25 0.00 -0.36 -1.32 119.26 120.38 1vdk h ALA 285 Ca 0.22 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1vdk h ALA 285 Cb 0.14 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 1vdk h ALA 285 CO -0.03 0.65 0.36 0.78 0.00 0.00 0.00 179.25 181.01 1vdk h GLY 286 N 1.20 1.11 1.37 0.00 0.00 -0.54 -0.99 103.07 105.22 1vdk h GLY 286 Ca 0.29 -0.53 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 1vdk h GLY 286 CO -0.04 0.50 -0.25 0.00 0.00 0.00 0.00 176.54 176.75 1vdk h ALA 287 N 1.36 0.89 -0.16 3.60 0.00 -0.75 -1.83 119.26 122.38 1vdk h ALA 287 Ca 0.25 -0.38 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1vdk h ALA 287 Cb 0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1vdk h ALA 287 CO -0.03 0.63 -0.24 -0.07 0.00 0.00 0.00 179.25 179.53 1vdk h LEU 288 N 0.62 0.28 -0.23 0.00 3.38 -0.58 -0.10 115.31 118.68 1vdk h LEU 288 Ca 0.08 -0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1vdk h LEU 288 Cb 0.76 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 1vdk h LEU 288 CO 0.06 0.53 -0.23 -0.03 0.09 0.00 0.00 178.44 178.86 1vdk h MET 289 N 0.26 0.56 0.06 1.13 4.05 -0.87 0.22 114.93 120.35 1vdk h MET 289 Ca 0.04 -0.30 0.01 0.00 -0.28 0.00 0.00 59.70 59.18 1vdk h MET 289 Cb 0.56 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.36 1vdk h MET 289 CO 0.04 0.88 -0.11 -0.22 0.23 0.00 0.00 176.91 177.74 1vdk h LYS 290 N 0.26 -0.21 0.00 0.39 3.11 -0.96 0.11 116.57 119.28 1vdk h LYS 290 Ca 0.04 0.01 0.00 0.00 -2.81 0.00 0.00 60.65 57.89 1vdk h LYS 290 Cb 0.78 0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 32.06 1vdk h LYS 290 CO 0.06 -0.14 -0.00 0.82 -2.81 0.00 0.00 179.45 177.37 1vdk h ILE 291 N -0.22 0.99 -0.62 2.00 2.04 -1.01 -0.99 117.51 119.71 1vdk h ILE 291 Ca 0.02 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.95 1vdk h ILE 291 Cb 0.23 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 37.24 1vdk h ILE 291 CO -0.06 0.00 0.30 1.23 0.00 0.00 0.00 178.15 179.62 1vdk h GLY 292 N -0.01 0.90 1.01 5.37 0.00 -0.27 -0.78 103.07 109.28 1vdk h GLY 292 Ca 0.00 -0.19 -0.07 0.00 0.00 0.00 0.00 47.33 47.07 1vdk h GLY 292 CO -0.00 0.08 0.06 3.43 0.00 0.00 0.00 176.54 180.11 1vdk h ASN 293 N 0.55 0.86 -0.61 0.19 2.35 -0.56 -1.86 115.58 116.49 1vdk h ASN 293 Ca 0.29 -0.27 0.07 0.00 -0.55 0.00 0.00 56.30 55.84 1vdk h ASN 293 Cb 0.26 -0.23 -0.06 0.00 0.05 0.00 0.00 38.32 38.35 1vdk h ASN 293 CO -0.23 0.91 0.30 0.44 -1.65 0.00 0.00 177.43 177.21 1vdk h ASP 294 N 0.77 0.41 0.07 5.81 5.19 -0.55 -0.12 116.42 127.99 1vdk h ASP 294 Ca 0.16 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 1vdk h ASP 294 Cb 0.44 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.91 1vdk h ASP 294 CO 0.01 0.26 -0.07 0.58 -3.12 0.00 0.00 179.24 176.90 1vdk h VAL 295 N 0.55 0.83 0.00 -1.35 2.07 -0.79 0.98 116.25 118.54 1vdk h VAL 295 Ca 0.29 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.72 1vdk h VAL 295 Cb 0.25 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1vdk h VAL 295 CO -0.22 0.00 -0.43 0.08 0.02 0.00 0.00 177.57 177.02 1vdk h ARG 296 N -0.16 0.00 -0.21 1.57 0.11 -1.01 -1.35 114.38 113.33 1vdk h ARG 296 Ca 0.01 0.00 -0.17 0.00 0.10 0.00 0.00 59.98 59.92 1vdk h ARG 296 Cb 0.16 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.24 1vdk h ARG 296 CO -0.02 0.43 -0.53 -1.49 0.10 0.00 0.00 179.97 178.45 1vdk h TRP 297 N 0.00 0.94 0.00 4.08 4.06 -0.76 -0.63 115.95 123.64 1vdk h TRP 297 Ca -0.00 -0.36 -0.06 0.00 2.06 0.00 0.00 58.89 60.52 1vdk h TRP 297 Cb 0.78 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.77 1vdk h TRP 297 CO 0.00 1.16 -0.30 -0.07 -3.56 0.00 0.00 178.44 175.67 1vdk h LEU 298 N 0.44 0.00 -0.72 -4.49 3.38 -0.62 -2.52 115.31 110.78 1vdk h LEU 298 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1vdk h LEU 298 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1vdk h LEU 298 CO 0.12 0.30 -0.22 0.00 0.09 0.00 0.00 178.44 178.72 1vdk n ALA 299 N -2.47 3.02 -1.72 1.53 0.00 -0.53 0.09 120.51 120.44 1vdk n ALA 299 Ca -0.02 -0.46 -0.43 0.00 0.00 0.00 0.00 53.44 52.53 1vdk n ALA 299 Cb 0.35 -1.08 -0.02 0.00 0.00 0.00 0.00 19.45 18.70 1vdk n ALA 299 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1vdk n SER 300 N -0.31 3.32 0.00 0.00 3.41 -0.25 -4.50 113.62 115.29 1vdk n SER 300 Ca 0.13 1.16 0.00 0.00 -0.26 0.00 0.00 58.87 59.90 1vdk n SER 300 Cb 0.38 -1.52 0.00 0.00 -0.26 0.00 0.00 64.21 62.80 1vdk n SER 300 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vdk n GLY 301 N 1.83 -0.67 0.24 5.00 0.00 -1.26 -0.17 105.19 110.15 1vdk n GLY 301 Ca 0.08 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.77 1vdk n GLY 301 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vdk h PRO 302 N 0.00 0.21 0.00 1.61 0.13 -1.75 -3.43 132.00 128.77 1vdk h PRO 302 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1vdk h PRO 302 Cb 0.00 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.10 1vdk h PRO 302 CO 0.00 0.37 -0.26 0.66 -0.23 0.00 0.00 178.00 178.54 1vdk n TYR 303 N -4.26 0.00 -0.54 1.56 4.02 -1.26 -4.76 117.16 111.92 1vdk n TYR 303 Ca -0.01 0.00 0.09 0.00 -0.01 0.00 0.00 57.90 57.98 1vdk n TYR 303 Cb 0.28 0.00 0.32 0.00 -0.02 0.00 0.00 39.34 39.92 1vdk n TYR 303 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1vdk n ALA 304 N -0.95 2.82 -3.00 -0.72 0.00 -1.26 -4.96 120.51 112.45 1vdk n ALA 304 Ca 0.00 -1.53 0.00 0.00 0.00 0.00 0.00 53.44 51.91 1vdk n ALA 304 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1vdk n ALA 304 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vdk n GLY 305 N 1.08 5.32 0.07 0.00 0.00 -1.26 -4.92 105.19 105.48 1vdk n GLY 305 Ca 0.24 -1.42 -0.05 0.00 0.00 0.00 0.00 46.02 44.79 1vdk n GLY 305 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vdk n ILE 306 N 0.00 1.39 -3.63 -0.61 2.08 -0.97 -4.91 119.36 112.71 1vdk n ILE 306 Ca 0.00 0.21 -0.24 0.00 0.56 0.00 0.00 62.75 63.27 1vdk n ILE 306 Cb 0.00 -2.36 0.07 0.00 -0.75 0.00 0.00 39.64 36.61 1vdk n ILE 306 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1vdk n GLY 307 N 1.58 -0.54 0.03 7.39 0.00 0.76 -4.91 105.19 109.50 1vdk n GLY 307 Ca -0.09 0.25 0.13 0.00 0.00 0.00 0.00 46.02 46.31 1vdk n GLY 307 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vdk n GLU 308 N -4.96 0.11 -4.18 1.61 1.02 0.11 -4.71 120.64 109.65 1vdk n GLU 308 Ca 0.00 0.05 -0.11 0.00 -0.02 0.00 0.00 57.16 57.08 1vdk n GLU 308 Cb 0.56 -1.59 -0.10 0.00 -0.02 0.00 0.00 31.44 30.29 1vdk n GLU 308 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1vdk s ILE 309 N -3.06 0.47 0.14 -3.67 -4.36 -1.11 -0.80 121.20 108.81 1vdk s ILE 309 Ca 0.10 -1.93 0.09 0.00 -0.26 0.00 0.00 60.65 58.66 1vdk s ILE 309 Cb 0.16 -1.89 -0.04 0.00 1.25 0.00 0.00 42.46 41.94 1vdk s ILE 309 CO 0.65 -0.66 -0.21 0.42 0.24 0.00 0.00 174.94 175.38 1vdk s THR 310 N -3.78 1.91 0.14 8.37 -4.23 0.51 -4.24 115.64 114.32 1vdk s THR 310 Ca 0.18 -1.78 0.11 0.00 -1.18 0.00 0.00 61.69 59.02 1vdk s THR 310 Cb 0.06 -1.80 -0.04 0.00 1.34 0.00 0.00 72.50 72.07 1vdk s THR 310 CO -0.01 -0.14 -0.26 0.27 -0.54 0.00 0.00 174.62 173.93 1vdk s ILE 311 N -1.55 2.26 0.56 2.99 -4.36 -1.26 -2.16 121.20 117.68 1vdk s ILE 311 Ca 0.13 -1.81 -0.21 0.00 -0.26 0.00 0.00 60.65 58.50 1vdk s ILE 311 Cb -0.08 -2.01 -0.04 0.00 1.25 0.00 0.00 42.46 41.57 1vdk s ILE 311 CO 0.06 0.05 1.29 -2.16 0.24 0.00 0.00 174.94 174.41 1vdk s PRO 312 N -2.17 3.11 0.63 0.37 0.04 -1.26 -4.75 135.00 130.98 1vdk s PRO 312 Ca 0.15 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 63.06 1vdk s PRO 312 Cb -0.10 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 1vdk s PRO 312 CO 0.07 -1.15 0.95 0.00 0.04 0.00 0.00 177.00 176.90 1vdk n ALA 313 N -1.19 0.05 0.16 8.56 0.00 -1.26 -4.90 120.51 121.92 1vdk n ALA 313 Ca 0.11 -0.04 0.02 0.00 0.00 0.00 0.00 53.44 53.54 1vdk n ALA 313 Cb 0.47 -2.10 0.21 0.00 0.00 0.00 0.00 19.45 18.03 1vdk n ALA 313 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1vdk h ASN 314 N 0.30 0.00 -3.51 0.00 2.35 -1.91 -3.43 115.58 109.37 1vdk h ASN 314 Ca -0.48 0.00 -0.39 0.00 -0.55 0.00 0.00 56.30 54.88 1vdk h ASN 314 Cb 1.36 0.00 -0.33 0.00 0.05 0.00 0.00 38.32 39.40 1vdk h ASN 314 CO 0.50 0.50 -0.77 -1.83 -1.65 0.00 0.00 177.43 174.18 1vdk s GLU 315 N -3.44 0.69 -0.68 0.81 1.03 -1.26 -5.17 118.70 110.68 1vdk s GLU 315 Ca 0.00 -0.08 -0.27 0.00 0.03 0.00 0.00 54.97 54.65 1vdk s GLU 315 Cb 0.11 -0.73 -0.26 0.00 -0.80 0.00 0.00 34.13 32.45 1vdk s GLU 315 CO 0.72 -0.07 1.88 -0.35 -1.33 0.00 0.00 175.26 176.12 1vdk n PRO 316 N 3.94 0.43 -1.57 -4.83 -0.04 -1.26 -5.22 135.00 126.45 1vdk n PRO 316 Ca -0.25 -1.58 0.00 0.00 -0.04 0.00 0.00 63.50 61.63 1vdk n PRO 316 Cb 0.51 -3.28 0.00 0.00 -0.04 0.00 0.00 33.50 30.69 1vdk n PRO 316 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1vdk n ILE 320 N 7.82 -7.26 -2.30 0.52 -0.00 -1.26 -5.23 119.36 111.65 1vdk n ILE 320 Ca 0.45 1.47 -0.29 0.00 -0.00 0.00 0.00 62.75 64.38 1vdk n ILE 320 Cb 0.44 -4.34 0.00 0.00 -0.00 0.00 0.00 39.64 35.75 1vdk n ILE 320 CO 0.00 0.00 0.00 -0.04 -0.00 0.00 0.00 176.55 176.51 1vdk s MET 321 N -1.44 3.57 0.07 0.38 -1.94 -1.26 -4.92 119.30 113.76 1vdk s MET 321 Ca 0.00 0.45 -0.36 0.00 -1.71 0.00 0.00 55.69 54.07 1vdk s MET 321 Cb 0.00 -2.24 -0.15 0.00 2.01 0.00 0.00 34.83 34.45 1vdk s MET 321 CO 0.00 -0.36 1.54 -2.30 -0.01 0.00 0.00 175.02 173.88 1vdk n PRO 322 N -2.47 1.68 0.00 2.03 -0.02 -1.26 -1.76 135.00 133.21 1vdk n PRO 322 Ca 0.03 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1vdk n PRO 322 Cb 0.55 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1vdk n PRO 322 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vdk n GLY 323 N 3.25 0.39 0.01 -1.23 0.00 -1.26 -4.90 105.19 101.46 1vdk n GLY 323 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.22 1vdk n GLY 323 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vdk n LYS 324 N -1.75 2.34 -2.81 1.61 5.02 -0.72 -2.11 118.16 119.74 1vdk n LYS 324 Ca 0.00 -1.40 -0.42 0.00 -2.02 0.00 0.00 58.31 54.47 1vdk n LYS 324 Cb 0.00 -0.95 -0.03 0.00 -0.02 0.00 0.00 35.03 34.03 1vdk n LYS 324 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1vdk s VAL 325 N -0.95 4.87 0.21 -0.18 1.01 -1.26 -4.90 120.40 119.21 1vdk s VAL 325 Ca 0.02 1.83 -0.30 0.00 0.00 0.00 0.00 61.98 63.53 1vdk s VAL 325 Cb 0.02 -4.22 -0.09 0.00 0.00 0.00 0.00 36.38 32.09 1vdk s VAL 325 CO 0.00 0.08 1.36 0.20 0.00 0.00 0.00 175.10 176.74 1vdk s ASN 326 N 1.05 6.81 -1.15 3.32 0.02 -1.26 -4.87 114.94 118.86 1vdk s ASN 326 Ca 0.44 2.49 -0.09 0.00 -1.02 0.00 0.00 52.86 54.69 1vdk s ASN 326 Cb -0.18 -2.61 -0.07 0.00 0.02 0.00 0.00 41.25 38.41 1vdk s ASN 326 CO 0.18 -0.59 2.35 -0.81 0.02 0.00 0.00 177.10 178.26 1vdk n PRO 327 N 2.56 2.56 -0.24 -0.60 -0.04 -1.26 -4.73 135.00 133.25 1vdk n PRO 327 Ca 0.06 -1.78 0.01 0.00 -0.04 0.00 0.00 63.50 61.75 1vdk n PRO 327 Cb 0.42 -2.65 0.13 0.00 -0.04 0.00 0.00 33.50 31.36 1vdk n PRO 327 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1vdk h THR 328 N 3.44 0.84 -0.02 0.52 2.02 -1.98 -1.90 112.91 115.83 1vdk h THR 328 Ca 0.61 -0.20 -0.03 0.00 0.77 0.00 0.00 66.41 67.56 1vdk h THR 328 Cb 0.27 0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1vdk h THR 328 CO 1.62 0.10 -0.13 1.56 0.37 0.00 0.00 175.52 179.05 1vdk h GLN 329 N 0.57 0.03 -0.23 6.66 1.08 -1.93 -1.04 115.11 120.25 1vdk h GLN 329 Ca 0.34 -0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.40 1vdk h GLN 329 Cb 0.36 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1vdk h GLN 329 CO -0.27 0.16 -0.39 0.28 -0.95 0.00 0.00 178.83 177.66 1vdk h VAL 330 N 0.03 1.32 -0.53 -0.54 2.07 -1.72 -1.63 116.25 115.25 1vdk h VAL 330 Ca 0.01 -1.60 -0.02 0.00 0.82 0.00 0.00 66.70 65.91 1vdk h VAL 330 Cb 0.25 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.78 1vdk h VAL 330 CO 0.02 0.50 0.25 -0.33 0.02 0.00 0.00 177.57 178.03 1vdk h GLU 331 N 0.36 0.76 -0.48 1.57 5.08 -1.02 0.15 114.58 121.01 1vdk h GLU 331 Ca 0.02 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 1vdk h GLU 331 Cb 0.98 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 1vdk h GLU 331 CO 0.09 0.63 0.01 0.00 -1.00 0.00 0.00 179.01 178.74 1vdk h ALA 332 N 1.09 0.65 -0.18 3.43 0.00 -1.21 -1.68 119.26 121.36 1vdk h ALA 332 Ca 0.18 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1vdk h ALA 332 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1vdk h ALA 332 CO -0.02 0.44 0.06 1.25 0.00 0.00 0.00 179.25 180.99 1vdk h LEU 333 N 0.70 0.25 -1.28 0.00 5.85 -1.00 -2.15 115.31 117.68 1vdk h LEU 333 Ca 0.14 -0.18 -0.06 0.00 0.84 0.00 0.00 57.88 58.61 1vdk h LEU 333 Cb 0.50 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1vdk h LEU 333 CO 0.02 0.37 -0.29 0.71 -0.34 0.00 0.00 178.44 178.91 1vdk h THR 334 N 0.12 0.84 -0.13 1.05 1.35 -0.67 0.24 112.91 115.71 1vdk h THR 334 Ca 0.06 -1.16 -0.15 0.00 -0.55 0.00 0.00 66.41 64.60 1vdk h THR 334 Cb 0.20 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.32 1vdk h THR 334 CO -0.00 0.28 -0.57 0.24 -0.25 0.00 0.00 175.52 175.22 1vdk h MET 335 N 0.00 0.41 -0.54 4.72 2.86 -1.14 -1.83 114.93 119.41 1vdk h MET 335 Ca -0.00 -0.26 -0.12 0.00 -2.06 0.00 0.00 59.70 57.26 1vdk h MET 335 Cb 0.68 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.36 1vdk h MET 335 CO 0.04 0.86 -0.12 0.28 1.06 0.00 0.00 176.91 179.03 1vdk h VAL 336 N 0.31 1.27 -0.37 -2.22 2.07 -0.69 -2.54 116.25 114.08 1vdk h VAL 336 Ca 0.00 -1.28 0.02 0.00 0.82 0.00 0.00 66.70 66.26 1vdk h VAL 336 Cb 1.09 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 1vdk h VAL 336 CO 0.10 0.45 0.22 0.58 0.02 0.00 0.00 177.57 178.94 1vdk h VAL 337 N 0.91 1.04 0.00 2.57 2.07 -0.62 0.72 116.25 122.95 1vdk h VAL 337 Ca 0.14 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.45 1vdk h VAL 337 Cb 0.69 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 1vdk h VAL 337 CO 0.05 0.08 -0.27 -0.37 0.02 0.00 0.00 177.57 177.09 1vdk h VAL 338 N 0.44 1.17 -0.41 2.57 -1.51 -1.25 -1.16 116.25 116.11 1vdk h VAL 338 Ca 0.15 -0.92 -0.10 0.00 -1.23 0.00 0.00 66.70 64.60 1vdk h VAL 338 Cb 0.00 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 30.65 1vdk h VAL 338 CO -0.07 0.26 -0.12 -0.09 -1.23 0.00 0.00 177.57 176.32 1vdk h ARG 339 N 0.00 0.81 -0.85 5.19 9.65 -0.92 -2.75 114.38 125.50 1vdk h ARG 339 Ca -0.00 -0.32 -0.03 0.00 -1.10 0.00 0.00 59.98 58.53 1vdk h ARG 339 Cb 0.48 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.98 1vdk h ARG 339 CO 0.03 0.94 0.42 0.28 2.80 0.00 0.00 179.97 184.44 1vdk h VAL 340 N 0.63 1.26 -0.61 0.20 2.07 0.13 -0.74 116.25 119.17 1vdk h VAL 340 Ca 0.10 -0.72 -0.02 0.00 0.82 0.00 0.00 66.70 66.89 1vdk h VAL 340 Cb 0.66 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1vdk h VAL 340 CO 0.04 0.31 0.30 1.88 0.02 0.00 0.00 177.57 180.13 1vdk h TYR 341 N 1.21 0.85 -0.51 1.57 -1.99 -1.15 -0.41 116.97 116.55 1vdk h TYR 341 Ca 0.29 -0.02 -0.12 0.00 2.00 0.00 0.00 58.73 60.88 1vdk h TYR 341 Cb 0.11 -0.27 -0.02 0.00 2.00 0.00 0.00 36.73 38.55 1vdk h TYR 341 CO 0.01 0.62 -0.15 0.78 -0.00 0.00 0.00 178.16 179.42 1vdk h GLY 342 N 0.95 1.07 1.00 3.88 0.00 -1.07 -1.89 103.07 107.01 1vdk h GLY 342 Ca 0.22 -0.90 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 1vdk h GLY 342 CO -0.03 0.82 0.37 3.43 0.00 0.00 0.00 176.54 181.13 1vdk h ASN 343 N 0.87 0.80 -0.84 0.19 2.35 -0.31 -1.34 115.58 117.30 1vdk h ASN 343 Ca 0.13 -0.08 -0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1vdk h ASN 343 Cb 0.72 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.85 1vdk h ASN 343 CO 0.06 0.64 0.51 -0.78 -1.65 0.00 0.00 177.43 176.21 1vdk h ASP 344 N 0.88 1.00 -0.29 5.81 3.58 -0.88 -1.13 116.42 125.40 1vdk h ASP 344 Ca 0.23 -0.06 0.02 0.00 0.42 0.00 0.00 57.03 57.63 1vdk h ASP 344 Cb 0.01 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 40.78 1vdk h ASP 344 CO -0.04 0.77 0.15 -0.74 -2.88 0.00 0.00 179.24 176.50 1vdk h HIS 345 N 1.15 0.28 -0.19 0.28 2.76 -0.74 -0.64 115.15 118.06 1vdk h HIS 345 Ca 0.30 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.51 1vdk h HIS 345 Cb -0.05 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 28.80 1vdk h HIS 345 CO -0.00 0.16 0.04 1.15 -1.30 0.00 0.00 177.93 177.97 1vdk h THR 346 N 0.31 0.92 -0.19 6.26 2.02 -0.72 -1.05 112.91 120.46 1vdk h THR 346 Ca 0.12 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 1vdk h THR 346 Cb 0.03 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1vdk h THR 346 CO -0.07 0.02 0.08 0.58 0.37 0.00 0.00 175.52 176.49 1vdk h VAL 347 N 0.12 1.16 -0.65 3.16 2.07 -0.93 -1.38 116.25 119.80 1vdk h VAL 347 Ca 0.08 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 1vdk h VAL 347 Cb 0.07 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1vdk h VAL 347 CO -0.11 0.15 0.13 0.00 0.02 0.00 0.00 177.57 177.76 1vdk h ALA 348 N 0.92 1.00 0.30 1.67 0.00 -1.06 0.39 119.26 122.48 1vdk h ALA 348 Ca 0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1vdk h ALA 348 Cb 0.17 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1vdk h ALA 348 CO -0.01 0.64 -0.14 0.35 0.00 0.00 0.00 179.25 180.09 1vdk h PHE 349 N 0.98 -0.37 -0.98 0.00 3.57 -1.11 -2.74 116.94 116.29 1vdk h PHE 349 Ca 0.20 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.76 1vdk h PHE 349 Cb 0.39 0.12 -0.07 0.00 2.79 0.00 0.00 35.95 39.19 1vdk h PHE 349 CO 0.03 -0.16 0.64 0.00 -2.23 0.00 0.00 178.31 176.58 1vdk h ALA 350 N 0.16 1.43 0.00 2.41 0.00 -1.09 -2.17 119.26 120.00 1vdk h ALA 350 Ca -0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1vdk h ALA 350 Cb 0.38 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1vdk h ALA 350 CO 0.07 0.42 -0.03 0.78 0.00 0.00 0.00 179.25 180.49 1vdk h GLY 351 N 1.14 0.00 0.71 0.00 0.00 -0.62 -1.49 103.07 102.81 1vdk h GLY 351 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1vdk h GLY 351 CO -0.17 0.00 -0.27 -1.14 0.00 0.00 0.00 176.54 174.96 1vdk n SER 352 N -3.70 0.69 -1.70 0.19 3.41 -0.82 -4.27 113.62 107.43 1vdk n SER 352 Ca -0.03 -0.55 0.07 0.00 -0.26 0.00 0.00 58.87 58.10 1vdk n SER 352 Cb 0.12 0.08 0.36 0.00 -0.26 0.00 0.00 64.21 64.51 1vdk n SER 352 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vdk n GLN 353 N -1.00 4.27 -1.64 4.33 1.13 -0.56 -4.99 117.38 118.92 1vdk n GLN 353 Ca 0.11 -2.83 -0.33 0.00 -1.94 0.00 0.00 57.00 52.00 1vdk n GLN 353 Cb 0.33 -2.10 0.06 0.00 0.11 0.00 0.00 30.24 28.64 1vdk n GLN 353 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1vdk s GLY 354 N -0.76 2.14 -0.05 1.08 0.00 -1.26 -4.76 107.32 103.71 1vdk s GLY 354 Ca 0.50 0.59 0.00 0.00 0.00 0.00 0.00 44.72 45.80 1vdk s GLY 354 CO 0.17 0.95 -0.02 -1.31 0.00 0.00 0.00 173.10 172.89 1vdk s ASN 355 N -2.54 1.10 1.15 1.64 -0.87 -1.20 -4.96 114.94 109.25 1vdk s ASN 355 Ca 0.68 -0.10 0.00 0.00 -1.57 0.00 0.00 52.86 51.87 1vdk s ASN 355 Cb -0.22 -0.42 0.00 0.00 -0.02 0.00 0.00 41.25 40.60 1vdk s ASN 355 CO 0.43 -0.11 0.00 0.49 -2.57 0.00 0.00 177.10 175.35 1vdk n PHE 356 N 4.44 0.00 1.67 2.20 3.72 -1.26 -2.05 117.46 126.18 1vdk n PHE 356 Ca -0.19 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.28 1vdk n PHE 356 Cb 0.50 0.00 0.34 0.00 -0.94 0.00 0.00 39.48 39.38 1vdk n PHE 356 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1vdk n GLN 357 N 14.00 1.28 -3.65 -1.08 3.00 -1.26 -4.65 117.38 125.02 1vdk n GLN 357 Ca 0.00 -0.43 -0.05 0.00 -0.01 0.00 0.00 57.00 56.51 1vdk n GLN 357 Cb 0.00 -1.25 -0.06 0.00 0.00 0.00 0.00 30.24 28.93 1vdk n GLN 357 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 1vdk s LEU 358 N -1.38 -0.93 -0.20 1.08 2.96 -0.87 -3.81 118.68 115.52 1vdk s LEU 358 Ca 0.22 1.44 -0.25 0.00 -0.22 0.00 0.00 54.13 55.33 1vdk s LEU 358 Cb 0.11 2.16 -0.01 0.00 0.50 0.00 0.00 46.19 48.95 1vdk s LEU 358 CO 0.17 -0.23 0.82 0.21 -1.32 0.00 0.00 176.35 176.01 1vdk s ASN 359 N 2.27 6.89 -0.71 3.68 3.84 -0.73 -3.27 114.94 126.91 1vdk s ASN 359 Ca -0.07 1.10 -0.00 0.00 0.21 0.00 0.00 52.86 54.09 1vdk s ASN 359 Cb -0.09 -2.44 0.39 0.00 -0.55 0.00 0.00 41.25 38.56 1vdk s ASN 359 CO -0.18 -0.45 1.83 1.33 -2.79 0.00 0.00 177.10 176.84 1vdk n VAL 360 N 4.96 3.34 -1.23 -5.21 0.24 -1.26 -4.24 118.33 114.94 1vdk n VAL 360 Ca 0.05 -4.12 0.03 0.00 -2.04 0.00 0.00 64.34 58.26 1vdk n VAL 360 Cb 0.48 -1.22 0.05 0.00 -1.47 0.00 0.00 33.84 31.68 1vdk n VAL 360 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1vdk n TYR 361 N -0.62 0.00 -0.11 6.34 4.02 -1.21 -4.14 117.16 121.45 1vdk n TYR 361 Ca 0.53 -0.42 -0.05 0.00 -0.01 0.00 0.00 57.90 57.94 1vdk n TYR 361 Cb 0.43 -0.08 0.01 0.00 -0.02 0.00 0.00 39.34 39.68 1vdk n TYR 361 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1vdk h LYS 362 N 0.00 -0.03 -0.27 -0.72 1.57 -1.66 -2.30 116.57 113.16 1vdk h LYS 362 Ca 0.00 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.83 1vdk h LYS 362 Cb 1.07 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.34 1vdk h LYS 362 CO 0.00 -0.02 0.02 -1.35 -0.57 0.00 0.00 179.45 177.53 1vdk h PRO 363 N -0.03 0.10 -0.13 3.15 0.11 -1.86 -1.51 132.00 131.83 1vdk h PRO 363 Ca 0.18 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.18 1vdk h PRO 363 Cb 0.31 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.38 1vdk h PRO 363 CO -0.40 0.07 -0.37 -0.24 -0.21 0.00 0.00 178.00 176.84 1vdk h VAL 364 N 0.10 1.29 -0.44 3.15 3.04 -1.79 0.46 116.25 122.08 1vdk h VAL 364 Ca 0.13 -1.43 -0.06 0.00 -1.01 0.00 0.00 66.70 64.33 1vdk h VAL 364 Cb 0.15 1.61 -0.02 0.00 -2.01 0.00 0.00 31.29 31.03 1vdk h VAL 364 CO -0.20 0.43 0.06 0.24 -1.01 0.00 0.00 177.57 177.09 1vdk h MET 365 N 0.23 0.73 -0.22 4.17 2.86 -1.12 -1.37 114.93 120.20 1vdk h MET 365 Ca 0.02 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.43 1vdk h MET 365 Cb 0.77 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1vdk h MET 365 CO 0.06 0.77 0.01 0.00 1.06 0.00 0.00 176.91 178.80 1vdk h ALA 366 N 0.93 0.29 -0.08 6.32 0.00 -1.03 -2.83 119.26 122.87 1vdk h ALA 366 Ca 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1vdk h ALA 366 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1vdk h ALA 366 CO 0.01 0.01 0.01 -0.92 0.00 0.00 0.00 179.25 178.36 1vdk h TYR 367 N 0.15 0.02 -0.03 0.00 3.20 -0.79 -1.22 116.97 118.30 1vdk h TYR 367 Ca 0.06 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 1vdk h TYR 367 Cb 0.39 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1vdk h TYR 367 CO 0.03 0.01 -0.25 0.77 -1.64 0.00 0.00 178.16 177.08 1vdk h SER 368 N 0.05 0.05 -0.10 -2.11 0.02 -1.31 0.10 113.55 110.25 1vdk h SER 368 Ca 0.04 -0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.86 1vdk h SER 368 Cb 0.03 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.56 1vdk h SER 368 CO -0.05 0.30 -0.39 0.74 -1.14 0.00 0.00 176.83 176.29 1vdk h THR 369 N 0.05 1.39 -0.48 -2.27 2.02 -1.23 -2.51 112.91 109.87 1vdk h THR 369 Ca 0.01 -1.74 -0.08 0.00 0.77 0.00 0.00 66.41 65.36 1vdk h THR 369 Cb 0.47 2.22 -0.02 0.00 -1.74 0.00 0.00 68.15 69.07 1vdk h THR 369 CO 0.03 0.51 -0.04 -0.07 0.37 0.00 0.00 175.52 176.33 1vdk h LEU 370 N 0.00 0.80 -0.43 2.58 3.38 -0.95 -1.61 115.31 119.08 1vdk h LEU 370 Ca -0.02 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.75 1vdk h LEU 370 Cb 1.03 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.54 1vdk h LEU 370 CO 0.08 0.89 0.27 -0.08 0.09 0.00 0.00 178.44 179.69 1vdk h GLU 371 N 0.76 0.53 -0.49 1.13 4.81 -0.81 -0.31 114.58 120.20 1vdk h GLU 371 Ca 0.14 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.35 1vdk h GLU 371 Cb 0.51 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.74 1vdk h GLU 371 CO 0.03 0.35 0.30 0.77 -0.73 0.00 0.00 179.01 179.73 1vdk h SER 372 N 0.55 0.50 -0.15 1.04 0.02 -1.07 0.43 113.55 114.86 1vdk h SER 372 Ca 0.16 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 1vdk h SER 372 Cb -0.03 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 1vdk h SER 372 CO -0.06 0.36 0.09 0.40 -1.14 0.00 0.00 176.83 176.48 1vdk h ILE 373 N 0.61 1.08 -0.35 3.27 2.04 -0.86 -1.16 117.51 122.13 1vdk h ILE 373 Ca 0.19 -0.19 -0.07 0.00 1.00 0.00 0.00 64.86 65.79 1vdk h ILE 373 Cb -0.01 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1vdk h ILE 373 CO -0.07 0.07 -0.04 0.78 0.00 0.00 0.00 178.15 178.89 1vdk h ASN 374 N 0.17 0.64 -0.51 1.72 2.35 -0.80 -0.63 115.58 118.52 1vdk h ASN 374 Ca 0.05 -0.34 -0.07 0.00 -0.55 0.00 0.00 56.30 55.40 1vdk h ASN 374 Cb 0.04 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 1vdk h ASN 374 CO -0.01 0.83 0.04 -0.07 -1.65 0.00 0.00 177.43 176.57 1vdk h LEU 375 N 0.44 0.84 -0.52 1.61 3.38 -0.89 -0.34 115.31 119.84 1vdk h LEU 375 Ca 0.09 -0.29 -0.06 0.00 0.09 0.00 0.00 57.88 57.72 1vdk h LEU 375 Cb 0.52 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1vdk h LEU 375 CO 0.03 0.92 0.09 -0.07 0.09 0.00 0.00 178.44 179.49 1vdk h LEU 376 N 0.74 0.83 -0.57 1.67 3.38 -1.18 0.13 115.31 120.29 1vdk h LEU 376 Ca 0.15 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1vdk h LEU 376 Cb 0.46 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1vdk h LEU 376 CO 0.02 0.87 0.36 0.00 0.09 0.00 0.00 178.44 179.78 1vdk h ALA 377 N 0.98 0.73 0.27 1.53 0.00 -0.93 0.24 119.26 122.08 1vdk h ALA 377 Ca 0.16 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1vdk h ALA 377 Cb 0.40 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1vdk h ALA 377 CO 0.01 0.19 -0.13 -0.44 0.00 0.00 0.00 179.25 178.88 1vdk h ASP 378 N 0.77 -0.30 -0.58 0.00 3.32 -0.77 -2.33 116.42 116.54 1vdk h ASP 378 Ca 0.21 -0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 1vdk h ASP 378 Cb -0.05 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1vdk h ASP 378 CO -0.04 -0.10 0.19 0.00 -1.72 0.00 0.00 179.24 177.56 1vdk h ALA 379 N 0.20 0.76 -0.51 3.45 0.00 -0.59 -1.53 119.26 121.04 1vdk h ALA 379 Ca -0.04 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1vdk h ALA 379 Cb 0.37 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1vdk h ALA 379 CO 0.06 0.42 0.10 0.28 0.00 0.00 0.00 179.25 180.10 1vdk h VAL 380 N 0.81 1.25 -0.73 0.00 2.07 -0.57 0.58 116.25 119.66 1vdk h VAL 380 Ca 0.19 -0.91 -0.07 0.00 0.82 0.00 0.00 66.70 66.73 1vdk h VAL 380 Cb 0.28 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1vdk h VAL 380 CO -0.01 0.33 0.20 0.00 0.02 0.00 0.00 177.57 178.11 1vdk h ALA 381 N 0.98 0.98 -0.15 1.67 0.00 -1.31 -0.54 119.26 120.89 1vdk h ALA 381 Ca 0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1vdk h ALA 381 Cb 0.38 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 1vdk h ALA 381 CO 0.01 0.67 -0.04 1.03 0.00 0.00 0.00 179.25 180.91 1vdk h SER 382 N 1.10 0.30 -1.00 0.00 0.87 -1.06 -1.64 113.55 112.12 1vdk h SER 382 Ca 0.23 -0.38 0.03 0.00 -1.23 0.00 0.00 61.79 60.44 1vdk h SER 382 Cb 0.34 -0.08 -0.06 0.00 -0.44 0.00 0.00 62.40 62.17 1vdk h SER 382 CO -0.00 0.61 0.66 0.15 -0.53 0.00 0.00 176.83 177.71 1vdk h PHE 383 N -0.01 1.23 0.62 2.24 3.57 -0.76 0.69 116.94 124.52 1vdk h PHE 383 Ca 0.04 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.54 1vdk h PHE 383 Cb 0.48 -0.41 0.01 0.00 2.79 0.00 0.00 35.95 38.82 1vdk h PHE 383 CO 0.06 0.73 -0.30 0.22 -2.23 0.00 0.00 178.31 176.79 1vdk h ASP 384 N 1.29 -0.71 -0.46 0.41 3.58 -0.99 -0.54 116.42 119.00 1vdk h ASP 384 Ca 0.39 -0.02 -0.10 0.00 0.42 0.00 0.00 57.03 57.72 1vdk h ASP 384 Cb -0.04 0.18 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 1vdk h ASP 384 CO -0.11 -0.35 -0.07 0.00 -2.88 0.00 0.00 179.24 175.84 1vdk h ALA 385 N -0.93 0.92 -0.11 -0.78 0.00 -1.21 -1.68 119.26 115.48 1vdk h ALA 385 Ca -0.09 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1vdk h ALA 385 Cb 0.68 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1vdk h ALA 385 CO 0.14 0.63 0.00 0.72 0.00 0.00 0.00 179.25 180.74 1vdk n HIS 386 N -4.17 0.11 0.12 0.00 8.25 0.23 -4.68 115.22 115.07 1vdk n HIS 386 Ca 0.02 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1vdk n HIS 386 Cb 0.36 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1vdk n HIS 386 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1vdk n LEU 387 N 1.17 -0.98 -0.18 2.41 0.00 -0.71 -4.69 117.00 114.02 1vdk n LEU 387 Ca 0.16 0.42 -0.03 0.00 0.00 0.00 0.00 56.01 56.56 1vdk n LEU 387 Cb 0.56 1.07 0.04 0.00 0.00 0.00 0.00 43.42 45.09 1vdk n LEU 387 CO 0.15 -0.46 0.73 0.00 0.00 0.00 0.00 177.39 177.81 1vdk h ALA 388 N 0.00 0.27 0.00 1.96 0.00 -1.10 -0.22 119.26 120.18 1vdk h ALA 388 Ca 0.00 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1vdk h ALA 388 Cb 0.00 0.48 -0.00 0.00 0.00 0.00 0.00 17.79 18.27 1vdk h ALA 388 CO 0.00 -0.49 -0.03 1.96 0.00 0.00 0.00 179.25 180.69 1vdk h GLN 389 N -0.05 0.00 -0.68 0.00 4.20 -1.56 -2.49 115.11 114.53 1vdk h GLN 389 Ca 0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.97 1vdk h GLN 389 Cb 0.44 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1vdk h GLN 389 CO -0.58 0.03 0.00 0.41 -0.67 0.00 0.00 178.83 178.02 1vdk n GLY 390 N -0.97 2.56 3.73 3.46 0.00 -0.13 -4.98 105.19 108.88 1vdk n GLY 390 Ca -0.02 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 1vdk n GLY 390 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vdk s ILE 391 N -1.06 2.69 0.03 -0.61 1.01 -0.94 -4.04 121.20 118.28 1vdk s ILE 391 Ca 0.46 0.54 0.01 0.00 0.00 0.00 0.00 60.65 61.67 1vdk s ILE 391 Cb 0.25 -3.35 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 1vdk s ILE 391 CO 0.31 0.07 -0.05 -1.61 0.00 0.00 0.00 174.94 173.66 1vdk s GLU 392 N 0.22 0.42 0.49 2.79 0.41 -0.92 -4.99 118.70 117.12 1vdk s GLU 392 Ca 0.63 -0.71 -0.16 0.00 -0.41 0.00 0.00 54.97 54.32 1vdk s GLU 392 Cb -0.42 -0.06 -0.08 0.00 -1.78 0.00 0.00 34.13 31.79 1vdk s GLU 392 CO 0.38 -0.01 0.94 -1.25 -0.49 0.00 0.00 175.26 174.84 1vdk s PRO 393 N -1.66 3.95 -0.87 0.39 0.04 -1.26 -0.36 135.00 135.22 1vdk s PRO 393 Ca -0.12 0.89 -0.06 0.00 0.04 0.00 0.00 61.00 61.75 1vdk s PRO 393 Cb -0.09 -2.19 0.22 0.00 0.04 0.00 0.00 34.50 32.48 1vdk s PRO 393 CO -0.01 -0.21 0.77 1.21 0.04 0.00 0.00 177.00 178.81 1vdk s ASN 394 N -2.99 6.24 0.28 6.66 3.84 0.02 -4.71 114.94 124.27 1vdk s ASN 394 Ca 0.58 -3.32 0.02 0.00 0.21 0.00 0.00 52.86 50.35 1vdk s ASN 394 Cb -0.10 -2.01 0.66 0.00 -0.55 0.00 0.00 41.25 39.25 1vdk s ASN 394 CO 0.29 -0.31 1.73 -0.07 -2.79 0.00 0.00 177.10 175.95 1vdk h LEU 395 N 6.68 0.44 -0.21 3.21 3.38 -1.94 -0.72 115.31 126.15 1vdk h LEU 395 Ca 0.12 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1vdk h LEU 395 Cb 0.90 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.71 1vdk h LEU 395 CO 0.84 0.10 0.12 -0.33 0.09 0.00 0.00 178.44 179.25 1vdk h GLU 396 N 0.51 0.28 -0.21 1.13 3.07 -1.97 -0.15 114.58 117.25 1vdk h GLU 396 Ca 0.53 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 59.33 1vdk h GLU 396 Cb 0.91 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.75 1vdk h GLU 396 CO -0.46 0.26 0.01 0.00 -1.40 0.00 0.00 179.01 177.43 1vdk h ARG 397 N 0.23 0.35 -0.27 2.33 2.47 -1.70 -1.04 114.38 116.76 1vdk h ARG 397 Ca 0.07 -0.11 0.04 0.00 -1.26 0.00 0.00 59.98 58.72 1vdk h ARG 397 Cb 0.05 -0.04 -0.03 0.00 -1.65 0.00 0.00 29.97 28.30 1vdk h ARG 397 CO -0.01 0.53 0.06 0.82 0.56 0.00 0.00 179.97 181.93 1vdk h ILE 398 N 0.13 0.88 -0.30 2.04 2.04 -1.08 -2.15 117.51 119.07 1vdk h ILE 398 Ca 0.06 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 1vdk h ILE 398 Cb 0.36 0.71 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 1vdk h ILE 398 CO 0.01 0.03 0.16 -0.08 0.00 0.00 0.00 178.15 178.26 1vdk h GLU 399 N 0.16 0.43 -0.97 2.37 4.81 -0.95 -1.67 114.58 118.75 1vdk h GLU 399 Ca 0.12 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.35 1vdk h GLU 399 Cb 0.12 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.36 1vdk h GLU 399 CO -0.16 0.39 0.63 1.49 -0.73 0.00 0.00 179.01 180.63 1vdk h GLU 400 N 0.36 1.14 -0.12 1.92 4.81 -0.96 0.53 114.58 122.26 1vdk h GLU 400 Ca 0.11 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.23 1vdk h GLU 400 Cb 0.09 -0.26 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 1vdk h GLU 400 CO -0.02 0.75 -0.08 1.88 -0.73 0.00 0.00 179.01 180.81 1vdk h TYR 401 N 1.17 0.31 0.11 0.92 0.99 -1.18 -2.98 116.97 116.30 1vdk h TYR 401 Ca 0.41 -0.09 -0.01 0.00 2.00 0.00 0.00 58.73 61.05 1vdk h TYR 401 Cb 0.11 -0.07 0.00 0.00 1.00 0.00 0.00 36.73 37.77 1vdk h TYR 401 CO -0.00 0.64 -0.05 1.25 -0.00 0.00 0.00 178.16 180.00 1vdk h LEU 402 N -0.11 -0.12 -2.07 3.88 5.85 -0.95 -2.68 115.31 119.11 1vdk h LEU 402 Ca 0.02 -0.24 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1vdk h LEU 402 Cb 0.58 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.64 1vdk h LEU 402 CO 0.02 0.17 -0.09 1.56 -0.34 0.00 0.00 178.44 179.77 1vdk h GLN 403 N -0.43 0.00 -0.33 1.25 1.08 -1.02 -2.26 115.11 113.41 1vdk h GLN 403 Ca -0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1vdk h GLN 403 Cb 0.35 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1vdk h GLN 403 CO 0.02 0.09 0.00 1.63 -0.95 0.00 0.00 178.83 179.62 1vdk n LYS 404 N -3.64 2.43 -3.57 1.46 5.02 -1.13 -1.59 118.16 117.15 1vdk n LYS 404 Ca -0.02 -2.20 -0.38 0.00 -2.02 0.00 0.00 58.31 53.69 1vdk n LYS 404 Cb 0.20 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.66 1vdk n LYS 404 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1vdk s ASN 405 N -1.52 6.70 0.67 4.39 3.84 -0.85 -4.81 114.94 123.35 1vdk s ASN 405 Ca 0.36 0.83 0.41 0.00 0.21 0.00 0.00 52.86 54.67 1vdk s ASN 405 Cb 0.22 -2.21 2.22 0.00 -0.55 0.00 0.00 41.25 40.93 1vdk s ASN 405 CO 0.30 0.31 2.26 -0.65 -2.79 0.00 0.00 177.10 176.53 1vdk h PRO 406 N 5.00 0.00 0.00 0.43 0.11 -1.91 -2.67 132.00 132.96 1vdk h PRO 406 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1vdk h PRO 406 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1vdk h PRO 406 CO 0.63 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.42 1vdk n MET 407 N -3.05 0.16 0.00 1.05 0.00 -1.26 -1.65 117.12 112.36 1vdk n MET 407 Ca -0.03 0.57 0.13 0.00 0.00 0.00 0.00 57.70 58.36 1vdk n MET 407 Cb 0.15 -1.94 0.31 0.00 0.00 0.00 0.00 33.22 31.74 1vdk n MET 407 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1vdk n LEU 408 N -2.27 0.88 0.16 3.17 4.77 -1.01 -4.17 117.00 118.53 1vdk n LEU 408 Ca -0.00 -0.19 0.13 0.00 -0.03 0.00 0.00 56.01 55.91 1vdk n LEU 408 Cb 0.10 -0.16 0.53 0.00 -2.33 0.00 0.00 43.42 41.57 1vdk n LEU 408 CO 0.13 0.18 0.88 0.00 -1.33 0.00 0.00 177.39 177.25 1vdk h ALA 409 N 3.44 1.00 -0.68 -1.18 0.00 -1.53 -3.34 119.26 116.97 1vdk h ALA 409 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 1vdk h ALA 409 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.18 1vdk h ALA 409 CO 0.00 0.00 -0.39 1.15 0.00 0.00 0.00 179.25 180.01 1vdk h THR 410 N 0.00 0.10 -0.17 0.00 2.02 -1.78 0.13 112.91 113.20 1vdk h THR 410 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1vdk h THR 410 Cb 0.39 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 1vdk h THR 410 CO 0.00 0.00 0.05 0.00 0.37 0.00 0.00 175.52 175.94 1vdk h ALA 411 N 0.91 1.77 -0.46 6.16 0.00 -1.87 -2.84 119.26 122.92 1vdk h ALA 411 Ca 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1vdk h ALA 411 Cb 0.56 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1vdk h ALA 411 CO -0.75 0.19 0.22 -0.07 0.00 0.00 0.00 179.25 178.83 1vdk h LEU 412 N 0.24 0.61 -0.95 0.00 3.38 -1.21 -2.57 115.31 114.81 1vdk h LEU 412 Ca 0.06 -0.13 0.16 0.00 0.09 0.00 0.00 57.88 58.06 1vdk h LEU 412 Cb 0.08 -0.16 -0.10 0.00 0.09 0.00 0.00 40.66 40.58 1vdk h LEU 412 CO -0.00 0.57 0.55 0.78 0.09 0.00 0.00 178.44 180.43 1vdk h ASN 413 N 0.61 0.72 1.51 -0.43 2.35 -1.23 0.18 115.58 119.29 1vdk h ASN 413 Ca 0.16 0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.90 1vdk h ASN 413 Cb 0.13 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.44 1vdk h ASN 413 CO -0.02 0.30 -0.50 0.50 -1.65 0.00 0.00 177.43 176.06 1vdk h LYS 414 N 0.76 0.00 0.11 0.81 3.64 -1.63 -0.87 116.57 119.38 1vdk h LYS 414 Ca 0.52 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.69 1vdk h LYS 414 Cb 0.74 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1vdk h LYS 414 CO -0.35 0.43 -1.08 0.00 -2.27 0.00 0.00 179.45 176.18 1vdk h ALA 415 N 1.56 0.07 0.00 5.00 0.00 -0.72 -3.41 119.26 121.76 1vdk h ALA 415 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 54.91 53.99 1vdk h ALA 415 Cb 1.35 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1vdk h ALA 415 CO 0.06 0.59 0.00 0.44 0.00 0.00 0.00 179.25 180.34 1vdk n ILE 416 N -4.09 0.58 0.00 0.00 -5.35 0.47 -5.10 119.36 105.88 1vdk n ILE 416 Ca -0.20 -0.64 0.00 0.00 -0.27 0.00 0.00 62.75 61.64 1vdk n ILE 416 Cb 0.82 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.48 1vdk n ILE 416 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vdk n GLY 417 N -0.29 0.09 0.33 3.28 0.00 -0.34 -4.45 105.19 103.81 1vdk n GLY 417 Ca 0.00 -1.59 -0.05 0.00 0.00 0.00 0.00 46.02 44.38 1vdk n GLY 417 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1vdk h TYR 418 N 0.00 1.12 -0.14 1.61 3.20 -1.85 -2.59 116.97 118.33 1vdk h TYR 418 Ca 0.00 -0.05 0.04 0.00 3.14 0.00 0.00 58.73 61.87 1vdk h TYR 418 Cb 0.00 -0.35 -0.07 0.00 1.54 0.00 0.00 36.73 37.85 1vdk h TYR 418 CO 0.00 0.81 -0.45 0.22 -1.64 0.00 0.00 178.16 177.10 1vdk h ASP 419 N 1.12 -1.40 -0.45 -2.11 3.58 -1.93 0.42 116.42 115.63 1vdk h ASP 419 Ca 0.28 0.18 -0.04 0.00 0.42 0.00 0.00 57.03 57.87 1vdk h ASP 419 Cb 0.09 0.57 -0.02 0.00 1.72 0.00 0.00 39.33 41.69 1vdk h ASP 419 CO -0.04 -0.44 0.13 0.11 -2.88 0.00 0.00 179.24 176.12 1vdk h LYS 420 N -0.51 0.71 -0.53 0.28 1.57 -1.77 -2.13 116.57 114.19 1vdk h LYS 420 Ca 0.07 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1vdk h LYS 420 Cb 0.64 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1vdk h LYS 420 CO -0.41 0.69 0.34 0.00 -0.57 0.00 0.00 179.45 179.51 1vdk h ALA 421 N 0.98 0.67 -0.72 3.86 0.00 -1.05 0.09 119.26 123.11 1vdk h ALA 421 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1vdk h ALA 421 Cb 0.29 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1vdk h ALA 421 CO -0.00 0.09 0.37 0.00 0.00 0.00 0.00 179.25 179.71 1vdk h ALA 422 N 1.20 1.30 -0.37 0.00 0.00 -0.05 -1.11 119.26 120.24 1vdk h ALA 422 Ca 0.20 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1vdk h ALA 422 Cb -0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 1vdk h ALA 422 CO -0.05 0.56 -0.28 1.49 0.00 0.00 0.00 179.25 180.96 1vdk h GLU 423 N 1.00 0.77 -0.17 0.00 4.81 -0.69 -0.62 114.58 119.69 1vdk h GLU 423 Ca 0.25 -0.34 -0.01 0.00 -0.13 0.00 0.00 59.36 59.13 1vdk h GLU 423 Cb 0.06 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1vdk h GLU 423 CO -0.04 0.96 0.07 0.82 -0.73 0.00 0.00 179.01 180.09 1vdk h ILE 424 N 0.66 1.16 -0.33 2.32 2.04 -0.35 -1.07 117.51 121.94 1vdk h ILE 424 Ca 0.08 -0.47 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 1vdk h ILE 424 Cb 0.81 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 1vdk h ILE 424 CO 0.07 0.15 0.19 0.58 0.00 0.00 0.00 178.15 179.13 1vdk h VAL 425 N 0.11 1.12 -0.86 1.67 2.07 -1.11 -0.54 116.25 118.72 1vdk h VAL 425 Ca 0.06 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.31 1vdk h VAL 425 Cb 0.17 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 1vdk h VAL 425 CO -0.00 0.12 0.56 0.50 0.02 0.00 0.00 177.57 178.77 1vdk h LYS 426 N 0.41 1.00 -0.06 1.57 3.64 -0.96 -0.97 116.57 121.21 1vdk h LYS 426 Ca 0.12 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.41 1vdk h LYS 426 Cb 0.04 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.63 1vdk h LYS 426 CO -0.02 0.66 -0.06 -0.22 -2.27 0.00 0.00 179.45 177.54 1vdk h LYS 427 N 1.03 0.14 -0.52 1.90 3.64 -0.81 -1.82 116.57 120.14 1vdk h LYS 427 Ca 0.35 -0.08 0.07 0.00 -1.27 0.00 0.00 60.65 59.73 1vdk h LYS 427 Cb 0.09 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.85 1vdk h LYS 427 CO -0.11 0.60 0.19 0.00 -2.27 0.00 0.00 179.45 177.86 1vdk h ALA 428 N 0.54 0.64 -0.43 5.00 0.00 -0.71 0.16 119.26 124.46 1vdk h ALA 428 Ca 0.01 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1vdk h ALA 428 Cb 0.58 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1vdk h ALA 428 CO 0.01 -0.20 -0.10 -0.07 0.00 0.00 0.00 179.25 178.89 1vdk h LEU 429 N 0.37 0.83 -0.49 0.00 3.38 -1.23 0.50 115.31 118.67 1vdk h LEU 429 Ca 0.25 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1vdk h LEU 429 Cb 0.26 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1vdk h LEU 429 CO -0.25 1.00 0.17 0.50 0.09 0.00 0.00 178.44 179.95 1vdk h LYS 430 N 0.65 0.76 -0.41 1.13 1.63 -0.80 -2.94 116.57 116.58 1vdk h LYS 430 Ca 0.11 -0.15 0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1vdk h LYS 430 Cb 0.63 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 1vdk h LYS 430 CO 0.04 0.69 0.00 0.39 -3.45 0.00 0.00 179.45 177.13 1vdk n GLU 431 N -4.53 2.27 -3.75 1.90 1.02 0.51 -4.96 120.64 113.11 1vdk n GLU 431 Ca 0.01 -1.94 -0.22 0.00 -0.02 0.00 0.00 57.16 54.99 1vdk n GLU 431 Cb 0.18 -1.46 0.02 0.00 -0.02 0.00 0.00 31.44 30.16 1vdk n GLU 431 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1vdk n LYS 432 N 1.12 -4.70 -4.46 3.49 5.02 0.79 -4.99 118.16 114.42 1vdk n LYS 432 Ca 0.19 0.59 -0.22 0.00 -2.02 0.00 0.00 58.31 56.84 1vdk n LYS 432 Cb 0.50 -5.10 -0.11 0.00 -0.02 0.00 0.00 35.03 30.30 1vdk n LYS 432 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1vdk s LYS 433 N -6.10 1.64 0.56 1.97 -0.14 0.14 -5.01 119.74 112.80 1vdk s LYS 433 Ca 0.04 -1.87 -0.18 0.00 -1.36 0.00 0.00 55.97 52.61 1vdk s LYS 433 Cb -0.02 -1.16 -0.05 0.00 -1.68 0.00 0.00 37.83 34.92 1vdk s LYS 433 CO 0.82 -0.03 1.08 0.95 -0.76 0.00 0.00 175.35 177.41 1vdk s THR 434 N -3.03 3.57 0.45 2.17 -4.23 -1.26 -4.45 115.64 108.86 1vdk s THR 434 Ca 0.32 0.86 0.14 0.00 -1.18 0.00 0.00 61.69 61.83 1vdk s THR 434 Cb 0.06 -3.34 0.32 0.00 1.34 0.00 0.00 72.50 70.89 1vdk s THR 434 CO 0.14 -0.33 2.00 -0.07 -0.54 0.00 0.00 174.62 175.82 1vdk h LEU 435 N 0.86 0.31 -0.27 4.79 4.07 -1.61 -1.23 115.31 122.23 1vdk h LEU 435 Ca -0.48 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.44 1vdk h LEU 435 Cb 1.23 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.90 1vdk h LEU 435 CO 0.57 0.20 0.00 0.50 -1.08 0.00 0.00 178.44 178.63 1vdk h LYS 436 N 0.35 0.47 0.09 1.13 3.64 -1.92 -0.85 116.57 119.49 1vdk h LYS 436 Ca 0.24 -0.15 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1vdk h LYS 436 Cb 0.48 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.26 1vdk h LYS 436 CO -0.06 0.63 -0.04 0.37 -2.27 0.00 0.00 179.45 178.08 1vdk h GLN 437 N 0.26 -0.11 -0.52 1.90 5.75 -1.64 -1.48 115.11 119.27 1vdk h GLN 437 Ca 0.08 0.01 0.03 0.00 -0.15 0.00 0.00 58.65 58.62 1vdk h GLN 437 Cb 0.41 0.03 -0.04 0.00 1.07 0.00 0.00 27.48 28.95 1vdk h GLN 437 CO 0.01 -0.06 0.29 0.00 -2.65 0.00 0.00 178.83 176.43 1vdk h ALA 438 N 0.78 0.66 0.00 3.38 0.00 -1.26 -0.06 119.26 122.76 1vdk h ALA 438 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1vdk h ALA 438 Cb 0.11 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1vdk h ALA 438 CO 0.02 -0.02 -0.05 0.00 0.00 0.00 0.00 179.25 179.20 1vdk h ALA 439 N 1.25 1.25 0.11 0.00 0.00 -0.93 -2.21 119.26 118.72 1vdk h ALA 439 Ca 0.21 -0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.87 1vdk h ALA 439 Cb 0.06 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.85 1vdk h ALA 439 CO -0.12 0.06 -1.03 1.25 0.00 0.00 0.00 179.25 179.42 1vdk h LEU 440 N 0.00 0.37 -0.39 0.00 5.85 -0.08 -2.67 115.31 118.40 1vdk h LEU 440 Ca -0.00 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 57.83 1vdk h LEU 440 Cb 0.19 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1vdk h LEU 440 CO 0.01 1.46 0.00 -0.62 -0.34 0.00 0.00 178.44 178.95 1vdk n GLU 441 N -4.09 0.08 -0.00 1.25 1.02 -0.18 -1.57 120.64 117.14 1vdk n GLU 441 Ca -0.19 0.39 0.11 0.00 -0.02 0.00 0.00 57.16 57.45 1vdk n GLU 441 Cb 0.82 -1.67 -0.14 0.00 -0.02 0.00 0.00 31.44 30.43 1vdk n GLU 441 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1vdk n LEU 442 N -1.82 0.28 0.00 -4.62 4.77 -0.86 -4.98 117.00 109.77 1vdk n LEU 442 Ca 0.02 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 1vdk n LEU 442 Cb 0.15 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 1vdk n LEU 442 CO 0.13 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1vdk n GLY 443 N 1.32 0.54 0.14 -0.72 0.00 -0.61 -4.90 105.19 100.95 1vdk n GLY 443 Ca -0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.95 1vdk n GLY 443 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1vdk h TYR 444 N 0.00 0.20 -2.75 1.61 0.99 -1.76 -3.45 116.97 111.81 1vdk h TYR 444 Ca 0.00 -0.09 -0.12 0.00 2.00 0.00 0.00 58.73 60.52 1vdk h TYR 444 Cb 0.06 -0.03 -0.24 0.00 1.00 0.00 0.00 36.73 37.53 1vdk h TYR 444 CO 0.04 0.82 -0.23 -0.51 -0.00 0.00 0.00 178.16 178.28 1vdk s LEU 445 N -7.60 0.45 0.58 3.88 1.43 -1.03 -5.08 118.68 111.31 1vdk s LEU 445 Ca -0.03 0.76 -0.13 0.00 -1.03 0.00 0.00 54.13 53.71 1vdk s LEU 445 Cb 0.11 1.42 -0.05 0.00 0.03 0.00 0.00 46.19 47.70 1vdk s LEU 445 CO 0.80 -0.18 1.01 0.42 0.23 0.00 0.00 176.35 178.63 1vdk s THR 446 N 0.05 4.65 -2.00 5.49 -4.23 -1.26 -3.75 115.64 114.59 1vdk s THR 446 Ca -0.01 0.99 0.04 0.00 -1.18 0.00 0.00 61.69 61.52 1vdk s THR 446 Cb -0.03 -3.82 0.11 0.00 1.34 0.00 0.00 72.50 70.10 1vdk s THR 446 CO 0.01 -0.99 0.71 1.21 -0.54 0.00 0.00 174.62 175.02 1vdk n GLU 447 N -2.35 0.12 -0.12 3.99 2.13 -1.26 -1.84 120.64 121.32 1vdk n GLU 447 Ca 0.06 0.00 -0.22 0.00 0.66 0.00 0.00 57.16 57.66 1vdk n GLU 447 Cb 0.54 -1.50 -0.07 0.00 0.27 0.00 0.00 31.44 30.68 1vdk n GLU 447 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1vdk n GLU 448 N -1.00 0.53 -0.14 5.31 4.07 -1.26 -4.39 120.64 123.77 1vdk n GLU 448 Ca 0.03 0.23 0.00 0.00 -0.06 0.00 0.00 57.16 57.36 1vdk n GLU 448 Cb 0.01 -1.40 0.27 0.00 -0.06 0.00 0.00 31.44 30.26 1vdk n GLU 448 CO 0.00 0.00 0.00 0.93 -0.06 0.00 0.00 177.13 178.00 1vdk h GLU 449 N -0.93 0.83 -0.08 5.31 5.08 -1.76 -2.95 114.58 120.09 1vdk h GLU 449 Ca -0.48 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 57.83 1vdk h GLU 449 Cb 1.40 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 1vdk h GLU 449 CO -0.29 0.61 -0.15 0.35 -1.00 0.00 0.00 179.01 178.54 1vdk h PHE 450 N 0.84 -0.37 0.00 4.33 3.57 -1.61 -1.41 116.94 122.29 1vdk h PHE 450 Ca 0.22 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.73 1vdk h PHE 450 Cb 0.02 0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.94 1vdk h PHE 450 CO 0.00 -0.21 0.00 -0.44 -2.23 0.00 0.00 178.31 175.43 1vdk h ASP 451 N -0.21 0.00 0.76 0.41 3.32 -1.72 0.36 116.42 119.35 1vdk h ASP 451 Ca 0.08 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.93 1vdk h ASP 451 Cb 0.31 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.83 1vdk h ASP 451 CO -0.20 0.00 -1.35 -0.09 -1.72 0.00 0.00 179.24 175.88 1vdk h ARG 452 N 0.00 0.00 0.06 3.56 2.43 -1.27 -3.39 114.38 115.77 1vdk h ARG 452 Ca 0.00 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.81 1vdk h ARG 452 Cb 0.06 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.57 1vdk h ARG 452 CO 0.00 0.40 -2.03 -0.89 -1.51 0.00 0.00 179.97 175.94 1vdk n ILE 453 N -2.99 1.65 -3.24 1.20 5.41 -0.56 -4.78 119.36 116.05 1vdk n ILE 453 Ca -0.09 -0.50 -0.45 0.00 1.00 0.00 0.00 62.75 62.70 1vdk n ILE 453 Cb 0.88 -1.73 -0.05 0.00 -0.71 0.00 0.00 39.64 38.03 1vdk n ILE 453 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1vdk s VAL 454 N -2.51 5.06 -0.40 1.39 1.01 0.12 -4.80 120.40 120.26 1vdk s VAL 454 Ca -0.28 -1.23 0.04 0.00 0.00 0.00 0.00 61.98 60.50 1vdk s VAL 454 Cb 0.08 -4.37 0.11 0.00 0.00 0.00 0.00 36.38 32.19 1vdk s VAL 454 CO 0.67 -0.93 0.12 -0.69 0.00 0.00 0.00 175.10 174.27 1vdk s VAL 455 N 2.04 2.44 0.31 2.92 1.01 -1.26 -4.60 120.40 123.26 1vdk s VAL 455 Ca 0.07 -2.64 0.08 0.00 0.00 0.00 0.00 61.98 59.49 1vdk s VAL 455 Cb -0.27 -2.76 0.32 0.00 0.00 0.00 0.00 36.38 33.67 1vdk s VAL 455 CO 0.05 -0.67 1.66 -0.65 0.00 0.00 0.00 175.10 175.49 1vdk h PRO 456 N 7.28 0.29 0.00 2.72 0.11 -1.96 -0.46 132.00 139.99 1vdk h PRO 456 Ca -0.05 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.03 1vdk h PRO 456 Cb 0.98 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 1vdk h PRO 456 CO 0.58 0.19 -0.03 1.98 -0.21 0.00 0.00 178.00 180.51 1vdk h MET 457 N 0.30 0.00 0.00 1.05 4.05 -1.97 -0.75 114.93 117.62 1vdk h MET 457 Ca 0.64 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 60.06 1vdk h MET 457 Cb 1.37 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 32.17 1vdk h MET 457 CO -0.61 0.03 -0.03 0.00 0.23 0.00 0.00 176.91 176.52 1vdk h ARG 458 N 0.00 0.00 0.13 0.39 3.08 -1.33 0.14 114.38 116.80 1vdk h ARG 458 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 1vdk h ARG 458 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 1vdk h ARG 458 CO 0.00 0.03 -1.83 -0.07 -1.07 0.00 0.00 179.97 177.03 1vdk h LEU 459 N 0.00 0.45 -0.60 3.04 3.38 -1.23 -2.91 115.31 117.43 1vdk h LEU 459 Ca -0.00 -0.81 -0.14 0.00 0.09 0.00 0.00 57.88 57.02 1vdk h LEU 459 Cb 0.38 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1vdk h LEU 459 CO 0.00 1.71 -0.67 0.00 0.09 0.00 0.00 178.44 179.58 1vdk h ALA 460 N 0.22 0.84 -2.17 1.53 0.00 -1.16 -3.34 119.26 115.18 1vdk h ALA 460 Ca -0.36 -0.61 -0.58 0.00 0.00 0.00 0.00 54.91 53.36 1vdk h ALA 460 Cb 2.05 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 19.34 1vdk h ALA 460 CO 0.13 0.83 -0.89 1.63 0.00 0.00 0.00 179.25 180.95 1vdk n LYS 461 N -3.66 1.34 0.29 0.00 5.02 0.46 -4.85 118.16 116.77 1vdk n LYS 461 Ca -0.01 -3.79 0.20 0.00 -2.02 0.00 0.00 58.31 52.69 1vdk n LYS 461 Cb 0.68 -1.67 0.97 0.00 -0.02 0.00 0.00 35.03 34.98 1vdk n LYS 461 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1vdk h PRO 462 N 4.30 0.00 -0.02 1.97 0.13 -1.64 -3.41 132.00 133.33 1vdk h PRO 462 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1vdk h PRO 462 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1vdk h PRO 462 CO 0.60 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.09