#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 5.13 0.17 5.15 1.01 -1.26 -1.05 121.20 130.35 1vdk s ILE 5 Ca 0.00 0.99 0.09 0.00 0.00 0.00 0.00 60.65 61.73 1vdk s ILE 5 Cb 0.00 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 1vdk s ILE 5 CO 0.00 0.23 -0.18 -1.61 0.00 0.00 0.00 174.94 173.38 1vdk s GLU 6 N 1.22 1.31 0.05 2.79 0.41 -0.36 -4.85 118.70 119.27 1vdk s GLU 6 Ca 0.26 -1.44 0.00 0.00 -0.41 0.00 0.00 54.97 53.38 1vdk s GLU 6 Cb -0.15 -1.37 -0.03 0.00 -1.78 0.00 0.00 34.13 30.79 1vdk s GLU 6 CO 0.10 0.28 -0.04 -0.98 -0.49 0.00 0.00 175.26 174.13 1vdk s ARG 7 N -2.87 0.53 0.32 1.61 1.70 -1.26 -0.37 118.95 118.61 1vdk s ARG 7 Ca 0.17 -0.99 0.07 0.00 -0.47 0.00 0.00 55.73 54.51 1vdk s ARG 7 Cb -0.06 0.07 -0.03 0.00 -0.57 0.00 0.00 34.95 34.37 1vdk s ARG 7 CO 0.07 -0.06 0.28 -0.40 -1.08 0.00 0.00 175.30 174.11 1vdk n ASP 8 N 0.72 -0.72 0.33 -2.89 5.68 -0.43 -4.62 116.55 114.63 1vdk n ASP 8 Ca -0.18 -3.07 0.19 0.00 -0.50 0.00 0.00 54.79 51.23 1vdk n ASP 8 Cb 0.58 1.65 0.99 0.00 -1.14 0.00 0.00 41.12 43.20 1vdk n ASP 8 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 1vdk h THR 9 N 2.02 0.01 0.00 2.12 1.35 -2.03 -0.84 112.91 115.55 1vdk h THR 9 Ca -0.22 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.59 1vdk h THR 9 Cb 1.14 0.81 -0.01 0.00 -1.73 0.00 0.00 68.15 68.36 1vdk h THR 9 CO 0.33 0.00 -0.89 -0.03 -0.25 0.00 0.00 175.52 174.67 1vdk h MET 10 N 0.00 0.00 0.00 4.72 1.85 -2.03 -3.50 114.93 115.97 1vdk h MET 10 Ca 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.09 1vdk h MET 10 Cb 0.39 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.42 1vdk h MET 10 CO -0.00 0.12 0.00 0.41 -0.40 0.00 0.00 176.91 177.04 1vdk n GLY 11 N 1.22 0.38 3.89 1.39 0.00 -0.32 -5.12 105.19 106.64 1vdk n GLY 11 Ca -0.01 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 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 -2.00 3.39 0.09 1.61 2.02 -1.26 -1.31 118.70 121.24 1vdk s GLU 12 Ca 0.00 -0.36 -0.04 0.00 0.02 0.00 0.00 54.97 54.59 1vdk s GLU 12 Cb 0.00 -3.06 -0.03 0.00 0.10 0.00 0.00 34.13 31.15 1vdk s GLU 12 CO 0.00 0.66 0.09 0.14 0.02 0.00 0.00 175.26 176.17 1vdk s VAL 13 N -1.34 0.15 -0.14 2.63 -7.23 0.50 -4.98 120.40 110.00 1vdk s VAL 13 Ca 0.28 -1.62 -0.13 0.00 -1.81 0.00 0.00 61.98 58.70 1vdk s VAL 13 Cb -0.13 -1.63 -0.05 0.00 0.56 0.00 0.00 36.38 35.13 1vdk s VAL 13 CO 0.20 -0.70 0.27 -0.13 -0.31 0.00 0.00 175.10 174.42 1vdk s ARG 14 N -3.94 4.08 0.13 4.82 0.52 -1.26 -1.23 118.95 122.07 1vdk s ARG 14 Ca 0.12 0.07 0.06 0.00 -0.52 0.00 0.00 55.73 55.46 1vdk s ARG 14 Cb 0.06 -3.36 -0.04 0.00 0.52 0.00 0.00 34.95 32.14 1vdk s ARG 14 CO -0.06 0.39 -0.15 0.14 0.02 0.00 0.00 175.30 175.63 1vdk s VAL 15 N 0.02 1.42 0.17 3.52 -7.23 -0.21 -4.97 120.40 113.12 1vdk s VAL 15 Ca 0.16 -1.72 -0.34 0.00 -1.81 0.00 0.00 61.98 58.28 1vdk s VAL 15 Cb -0.13 -1.56 -0.14 0.00 0.56 0.00 0.00 36.38 35.11 1vdk s VAL 15 CO 0.05 -0.37 1.54 -2.65 -0.31 0.00 0.00 175.10 173.35 1vdk n PRO 16 N 0.56 2.09 0.30 4.82 -0.02 -1.26 -0.11 135.00 141.39 1vdk n PRO 16 Ca -0.16 0.75 0.16 0.00 -2.02 0.00 0.00 63.50 62.24 1vdk n PRO 16 Cb 0.57 -2.50 0.95 0.00 -0.02 0.00 0.00 33.50 32.50 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 5.59 1.43 -0.05 3.55 0.00 -1.99 -1.74 119.26 126.04 1vdk h ALA 17 Ca -0.45 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1vdk h ALA 17 Cb 1.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1vdk h ALA 17 CO 0.86 0.01 0.00 -0.40 0.00 0.00 0.00 179.25 179.72 1vdk n ASP 18 N -3.71 2.00 -4.75 0.00 3.85 -1.26 -4.87 116.55 107.81 1vdk n ASP 18 Ca -0.03 -1.68 -0.31 0.00 -0.71 0.00 0.00 54.79 52.06 1vdk n ASP 18 Cb 0.09 -0.02 -0.07 0.00 -1.35 0.00 0.00 41.12 39.77 1vdk n ASP 18 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1vdk s LYS 19 N -1.95 2.84 0.00 0.11 -0.14 -0.66 -5.03 119.74 114.91 1vdk s LYS 19 Ca 0.35 -0.67 0.25 0.00 -1.36 0.00 0.00 55.97 54.54 1vdk s LYS 19 Cb 0.20 -2.71 0.58 0.00 -1.68 0.00 0.00 37.83 34.23 1vdk s LYS 19 CO 0.32 0.58 1.48 0.66 -0.76 0.00 0.00 175.35 177.63 1vdk n TYR 20 N 0.75 0.12 -1.67 3.18 4.02 -1.26 -4.84 117.16 117.45 1vdk n TYR 20 Ca -0.11 -0.06 -0.29 0.00 -0.01 0.00 0.00 57.90 57.43 1vdk n TYR 20 Cb 0.52 0.00 0.15 0.00 -0.02 0.00 0.00 39.34 39.99 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 -1.88 2.15 0.00 -0.72 -2.14 -1.26 -3.72 118.94 111.37 1vdk s TRP 21 Ca 0.34 0.65 0.00 0.00 2.66 0.00 0.00 56.10 59.74 1vdk s TRP 21 Cb 0.20 -3.61 0.00 0.00 -3.10 0.00 0.00 33.47 26.96 1vdk s TRP 21 CO 0.31 -2.47 0.00 0.41 -2.66 0.00 0.00 176.95 172.54 1vdk n GLY 22 N -2.74 6.06 0.18 3.67 0.00 -1.26 -4.91 105.19 106.19 1vdk n GLY 22 Ca 0.10 -1.98 -0.09 0.00 0.00 0.00 0.00 46.02 44.05 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 0.57 0.47 0.00 4.61 0.00 -1.84 -2.19 119.26 120.89 1vdk h ALA 23 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1vdk h ALA 23 Cb 0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1vdk h ALA 23 CO 0.00 0.05 -0.32 1.96 0.00 0.00 0.00 179.25 180.94 1vdk h GLN 24 N 0.45 0.00 -0.14 0.00 4.20 -1.93 -1.03 115.11 116.65 1vdk h GLN 24 Ca 0.12 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 58.73 1vdk h GLN 24 Cb 0.14 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.92 1vdk h GLN 24 CO -0.01 0.32 -0.31 1.15 -0.67 0.00 0.00 178.83 179.30 1vdk h THR 25 N 0.00 1.36 -0.69 -0.54 2.02 -1.82 -2.45 112.91 110.80 1vdk h THR 25 Ca -0.00 -1.58 0.01 0.00 0.77 0.00 0.00 66.41 65.60 1vdk h THR 25 Cb 0.72 2.02 -0.03 0.00 -1.74 0.00 0.00 68.15 69.12 1vdk h THR 25 CO 0.04 0.47 0.45 -0.61 0.37 0.00 0.00 175.52 176.25 1vdk h GLN 26 N 0.07 0.90 -0.33 6.66 5.75 -1.00 0.85 115.11 128.01 1vdk h GLN 26 Ca 0.00 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.44 1vdk h GLN 26 Cb 0.91 -0.20 -0.02 0.00 1.07 0.00 0.00 27.48 29.24 1vdk h GLN 26 CO 0.07 0.60 0.17 0.00 -2.65 0.00 0.00 178.83 177.01 1vdk h ARG 27 N 0.93 0.48 -0.85 1.69 3.08 -1.20 -1.71 114.38 116.80 1vdk h ARG 27 Ca 0.25 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1vdk h ARG 27 Cb -0.10 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.82 1vdk h ARG 27 CO -0.06 0.43 0.47 1.03 -1.07 0.00 0.00 179.97 180.76 1vdk h SER 28 N 0.41 1.07 -0.54 7.04 0.87 -1.02 0.21 113.55 121.58 1vdk h SER 28 Ca 0.12 -0.10 0.08 0.00 -1.23 0.00 0.00 61.79 60.65 1vdk h SER 28 Cb 0.10 -0.27 -0.06 0.00 -0.44 0.00 0.00 62.40 61.73 1vdk h SER 28 CO -0.02 0.86 0.18 0.25 -0.53 0.00 0.00 176.83 177.58 1vdk h LEU 29 N 1.19 0.17 0.05 2.23 5.85 -0.44 -1.45 115.31 122.92 1vdk h LEU 29 Ca 0.30 0.07 -0.25 0.00 0.84 0.00 0.00 57.88 58.84 1vdk h LEU 29 Cb 0.03 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1vdk h LEU 29 CO -0.05 0.12 -1.26 -0.33 -0.34 0.00 0.00 178.44 176.58 1vdk h GLU 30 N 0.36 0.10 0.00 1.25 5.08 -0.84 -3.37 114.58 117.16 1vdk h GLU 30 Ca 0.26 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 1vdk h GLU 30 Cb 0.31 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1vdk h GLU 30 CO -0.28 0.99 -0.63 0.09 -1.00 0.00 0.00 179.01 178.18 1vdk n ASN 31 N -3.36 0.62 -3.32 1.42 3.02 0.68 -4.50 115.26 109.82 1vdk n ASN 31 Ca -0.08 -0.02 -0.26 0.00 -0.03 0.00 0.00 54.58 54.20 1vdk n ASN 31 Cb 0.99 0.26 -0.07 0.00 -0.61 0.00 0.00 39.78 40.35 1vdk n ASN 31 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1vdk n PHE 32 N -1.91 2.42 -1.99 3.10 3.72 -0.56 -4.96 117.46 117.28 1vdk n PHE 32 Ca 0.04 -3.97 -0.41 0.00 -0.05 0.00 0.00 57.45 53.06 1vdk n PHE 32 Cb 0.41 -0.49 -0.00 0.00 -0.94 0.00 0.00 39.48 38.45 1vdk n PHE 32 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1vdk n ARG 33 N 0.93 4.04 -4.00 -1.08 5.12 -1.26 -4.74 116.66 115.66 1vdk n ARG 33 Ca 0.27 -3.25 -0.31 0.00 -1.93 0.00 0.00 57.85 52.63 1vdk n ARG 33 Cb 0.45 -2.80 -0.15 0.00 -1.16 0.00 0.00 32.46 28.80 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 0.10 1.81 -0.89 0.55 1.01 -1.26 -4.70 121.20 117.82 1vdk s ILE 34 Ca 0.51 -1.35 -0.04 0.00 0.00 0.00 0.00 60.65 59.77 1vdk s ILE 34 Cb 0.15 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.65 1vdk s ILE 34 CO -0.06 -0.02 0.50 0.61 0.00 0.00 0.00 174.94 175.97 1vdk n GLY 35 N 4.57 -0.00 0.27 6.18 0.00 -1.26 -4.48 105.19 110.48 1vdk n GLY 35 Ca -0.13 -0.19 0.05 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.14 1.10 -0.01 2.61 1.35 -1.90 0.12 112.91 115.03 1vdk h THR 36 Ca -0.33 -0.32 -0.10 0.00 -0.55 0.00 0.00 66.41 65.12 1vdk h THR 36 Cb 1.22 0.87 0.01 0.00 -1.73 0.00 0.00 68.15 68.51 1vdk h THR 36 CO 0.34 0.11 -0.38 0.44 -0.25 0.00 0.00 175.52 175.79 1vdk h ASP 37 N 0.29 0.36 0.00 5.36 3.32 -1.99 -3.40 116.42 120.36 1vdk h ASP 37 Ca 0.07 -0.75 0.00 0.00 0.02 0.00 0.00 57.03 56.38 1vdk h ASP 37 Cb 0.09 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 39.53 1vdk h ASP 37 CO -0.01 1.05 -0.82 0.54 -1.72 0.00 0.00 179.24 178.29 1vdk n ARG 38 N -4.40 2.17 -1.90 3.56 1.74 -1.21 -4.71 116.66 111.92 1vdk n ARG 38 Ca -0.10 -0.02 -0.27 0.00 -0.77 0.00 0.00 57.85 56.69 1vdk n ARG 38 Cb 0.56 -1.17 0.03 0.00 -1.02 0.00 0.00 32.46 30.86 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 -1.44 2.89 -2.06 -1.55 3.01 0.41 -5.02 117.46 113.69 1vdk n PHE 39 Ca 0.02 -2.44 -0.38 0.00 1.01 0.00 0.00 57.45 55.66 1vdk n PHE 39 Cb 0.24 -0.57 0.00 0.00 -0.01 0.00 0.00 39.48 39.14 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 -3.65 3.72 0.13 -1.08 3.52 -1.26 -0.59 118.95 119.75 1vdk s ARG 40 Ca 0.54 2.05 -0.35 0.00 -0.13 0.00 0.00 55.73 57.84 1vdk s ARG 40 Cb 0.43 -2.54 -0.15 0.00 -1.56 0.00 0.00 34.95 31.13 1vdk s ARG 40 CO 0.01 -0.66 1.40 -0.12 -0.81 0.00 0.00 175.30 175.12 1vdk n MET 41 N -0.32 1.56 -1.62 5.12 0.00 -0.23 -4.65 117.12 116.98 1vdk n MET 41 Ca 0.06 0.56 -0.48 0.00 -0.00 0.00 0.00 57.70 57.85 1vdk n MET 41 Cb 0.45 -2.23 -0.04 0.00 0.00 0.00 0.00 33.22 31.40 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 2.68 1.54 0.28 2.12 -0.02 -1.26 -4.85 135.00 135.48 1vdk n PRO 42 Ca 0.17 0.55 0.16 0.00 -2.02 0.00 0.00 63.50 62.35 1vdk n PRO 42 Cb 0.24 -2.15 0.77 0.00 -0.02 0.00 0.00 33.50 32.34 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 4.11 0.00 -1.07 2.45 3.38 -2.00 -1.75 115.31 120.44 1vdk h LEU 43 Ca -0.45 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.54 1vdk h LEU 43 Cb 1.31 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.01 1vdk h LEU 43 CO 0.75 0.07 0.63 -0.33 0.09 0.00 0.00 178.44 179.66 1vdk h GLU 44 N 0.00 1.23 -0.36 1.13 3.07 -1.96 0.20 114.58 117.89 1vdk h GLU 44 Ca -0.00 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.64 1vdk h GLU 44 Cb 0.39 -0.28 -0.01 0.00 -0.84 0.00 0.00 28.75 28.01 1vdk h GLU 44 CO 0.01 0.81 -0.35 0.82 -1.40 0.00 0.00 179.01 178.91 1vdk h ILE 45 N 1.27 1.28 -0.22 3.13 2.04 -1.65 -1.29 117.51 122.07 1vdk h ILE 45 Ca 0.36 -1.51 -0.03 0.00 1.00 0.00 0.00 64.86 64.68 1vdk h ILE 45 Cb -0.11 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 1vdk h ILE 45 CO -0.09 0.50 0.04 0.40 0.00 0.00 0.00 178.15 179.00 1vdk h ILE 46 N 0.68 1.22 -0.52 -0.67 1.08 -1.13 0.42 117.51 118.60 1vdk h ILE 46 Ca 0.07 -0.74 -0.02 0.00 -0.39 0.00 0.00 64.86 63.78 1vdk h ILE 46 Cb 0.90 1.29 -0.02 0.00 -3.07 0.00 0.00 36.82 35.91 1vdk h ILE 46 CO 0.08 0.23 0.26 0.03 -0.69 0.00 0.00 178.15 178.07 1vdk h ARG 47 N 0.17 0.74 -0.45 2.37 2.47 -0.60 -0.73 114.38 118.35 1vdk h ARG 47 Ca 0.07 -0.10 -0.04 0.00 -1.26 0.00 0.00 59.98 58.64 1vdk h ARG 47 Cb 0.31 -0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.47 1vdk h ARG 47 CO 0.00 0.60 0.10 0.00 0.56 0.00 0.00 179.97 181.24 1vdk h ALA 48 N 1.10 1.33 -0.26 0.04 0.00 -1.11 -1.26 119.26 119.11 1vdk h ALA 48 Ca 0.18 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1vdk h ALA 48 Cb 0.09 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1vdk h ALA 48 CO -0.03 0.47 -0.15 1.88 0.00 0.00 0.00 179.25 181.43 1vdk h TYR 49 N 0.66 0.48 -0.66 0.00 0.99 -0.20 -0.21 116.97 118.03 1vdk h TYR 49 Ca 0.15 -0.07 -0.04 0.00 2.00 0.00 0.00 58.73 60.76 1vdk h TYR 49 Cb 0.26 -0.13 -0.03 0.00 1.00 0.00 0.00 36.73 37.83 1vdk h TYR 49 CO 0.01 0.58 0.25 0.78 -0.00 0.00 0.00 178.16 179.78 1vdk h GLY 50 N 0.92 1.07 1.02 3.88 0.00 -0.03 0.12 103.07 110.05 1vdk h GLY 50 Ca 0.07 -0.60 -0.05 0.00 0.00 0.00 0.00 47.33 46.76 1vdk h GLY 50 CO 0.03 0.56 0.21 -0.33 0.00 0.00 0.00 176.54 177.02 1vdk h MET 51 N 0.94 1.00 -0.21 4.80 2.86 -0.65 -1.39 114.93 122.28 1vdk h MET 51 Ca 0.22 -0.21 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1vdk h MET 51 Cb 0.23 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1vdk h MET 51 CO -0.01 0.87 0.04 1.25 1.06 0.00 0.00 176.91 180.11 1vdk h LEU 52 N 0.93 0.32 -1.30 1.22 6.46 -0.62 -1.57 115.31 120.75 1vdk h LEU 52 Ca 0.21 -0.25 -0.07 0.00 -0.12 0.00 0.00 57.88 57.65 1vdk h LEU 52 Cb 0.28 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.11 1vdk h LEU 52 CO -0.01 0.49 -0.31 0.11 -0.62 0.00 0.00 178.44 178.10 1vdk h LYS 53 N 0.14 0.07 -0.20 1.25 1.79 -0.66 0.14 116.57 119.09 1vdk h LYS 53 Ca 0.06 -0.02 -0.05 0.00 -2.18 0.00 0.00 60.65 58.46 1vdk h LYS 53 Cb 0.29 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 1vdk h LYS 53 CO 0.00 0.37 -0.07 -0.22 -1.08 0.00 0.00 179.45 178.46 1vdk h LYS 54 N 0.06 0.41 -0.36 3.15 3.64 -1.08 -1.35 116.57 121.04 1vdk h LYS 54 Ca 0.01 -0.16 -0.08 0.00 -1.27 0.00 0.00 60.65 59.14 1vdk h LYS 54 Cb 0.58 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1vdk h LYS 54 CO 0.04 0.67 -0.12 0.00 -2.27 0.00 0.00 179.45 177.77 1vdk h ALA 55 N 0.72 1.12 -0.38 5.00 0.00 -0.92 -1.23 119.26 123.57 1vdk h ALA 55 Ca 0.05 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1vdk h ALA 55 Cb 0.53 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1vdk h ALA 55 CO 0.02 0.55 0.05 0.00 0.00 0.00 0.00 179.25 179.88 1vdk h ALA 56 N 1.30 0.50 -0.59 0.00 0.00 -0.60 0.14 119.26 120.01 1vdk h ALA 56 Ca 0.10 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 1vdk h ALA 56 Cb 0.55 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 1vdk h ALA 56 CO 0.03 0.22 0.05 0.00 0.00 0.00 0.00 179.25 179.55 1vdk h ALA 57 N 0.91 0.79 -0.47 0.00 0.00 -1.07 0.68 119.26 120.09 1vdk h ALA 57 Ca 0.11 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1vdk h ALA 57 Cb 0.38 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1vdk h ALA 57 CO 0.01 0.58 0.24 -0.09 0.00 0.00 0.00 179.25 179.99 1vdk h ARG 58 N 0.90 0.67 -0.13 0.00 2.43 -1.02 -0.73 114.38 116.51 1vdk h ARG 58 Ca 0.17 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1vdk h ARG 58 Cb 0.49 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.91 1vdk h ARG 58 CO 0.02 0.55 0.00 0.00 -1.51 0.00 0.00 179.97 179.03 1vdk h ALA 59 N 1.08 0.17 -0.55 2.80 0.00 -0.48 -1.41 119.26 120.88 1vdk h ALA 59 Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1vdk h ALA 59 Cb 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1vdk h ALA 59 CO -0.02 -0.14 0.27 -0.91 0.00 0.00 0.00 179.25 178.45 1vdk h ASN 60 N -0.04 0.68 -0.26 0.00 2.35 -0.77 0.34 115.58 117.88 1vdk h ASN 60 Ca 0.04 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.69 1vdk h ASN 60 Cb 0.36 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1vdk h ASN 60 CO 0.01 0.57 -0.00 0.25 -1.65 0.00 0.00 177.43 176.61 1vdk h LEU 61 N 0.77 0.45 -1.47 1.61 5.85 -1.02 0.53 115.31 122.03 1vdk h LEU 61 Ca 0.19 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 1vdk h LEU 61 Cb 0.06 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1vdk h LEU 61 CO -0.03 0.65 0.13 -0.08 -0.34 0.00 0.00 178.44 178.77 1vdk h GLU 62 N 0.23 0.49 -0.11 1.25 4.57 -0.65 -2.39 114.58 117.96 1vdk h GLU 62 Ca 0.07 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1vdk h GLU 62 Cb 0.42 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.92 1vdk h GLU 62 CO 0.01 0.41 0.00 1.28 -1.18 0.00 0.00 179.01 179.54 1vdk n LEU 63 N -4.39 1.78 -0.06 1.64 4.77 0.05 -4.94 117.00 115.86 1vdk n LEU 63 Ca 0.02 -0.68 -0.01 0.00 -0.03 0.00 0.00 56.01 55.31 1vdk n LEU 63 Cb 0.14 -0.06 -0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1vdk n LEU 63 CO 0.37 0.34 -0.01 0.61 -1.33 0.00 0.00 177.39 177.37 1vdk n GLY 64 N 1.18 0.48 0.05 -0.72 0.00 -0.52 -4.92 105.19 100.76 1vdk n GLY 64 Ca 0.17 -0.41 0.12 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.77 0.20 -4.04 1.61 -0.58 0.18 -4.88 120.64 110.36 1vdk n GLU 65 Ca -0.01 0.09 -0.12 0.00 -0.42 0.00 0.00 57.16 56.70 1vdk n GLU 65 Cb 0.05 -1.66 -0.12 0.00 -0.57 0.00 0.00 31.44 29.14 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 -3.94 2.19 0.48 -4.62 1.43 -1.12 -4.94 118.68 108.16 1vdk s LEU 66 Ca 0.09 -0.41 -0.21 0.00 -1.03 0.00 0.00 54.13 52.57 1vdk s LEU 66 Cb 0.14 -0.10 -0.08 0.00 0.03 0.00 0.00 46.19 46.19 1vdk s LEU 66 CO 0.67 -0.16 1.09 -2.84 0.23 0.00 0.00 176.35 175.34 1vdk s PRO 67 N -1.15 3.74 0.13 1.29 0.02 -1.26 -4.55 135.00 133.22 1vdk s PRO 67 Ca -0.09 1.55 -0.25 0.00 0.02 0.00 0.00 61.00 62.23 1vdk s PRO 67 Cb -0.08 -2.22 -0.02 0.00 0.02 0.00 0.00 34.50 32.20 1vdk s PRO 67 CO -0.00 -0.52 1.63 1.49 -0.33 0.00 0.00 177.00 179.27 1vdk h GLU 68 N 1.75 -0.34 -0.12 5.54 4.57 -1.98 -0.69 114.58 123.30 1vdk h GLU 68 Ca -0.49 0.02 0.02 0.00 -1.18 0.00 0.00 59.36 57.73 1vdk h GLU 68 Cb 1.24 0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 29.86 1vdk h GLU 68 CO 0.59 -0.23 -0.40 1.49 -1.18 0.00 0.00 179.01 179.28 1vdk h GLU 69 N -0.35 -0.40 -0.71 1.92 4.81 -2.00 -0.65 114.58 117.21 1vdk h GLU 69 Ca 0.09 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 1vdk h GLU 69 Cb 0.49 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.93 1vdk h GLU 69 CO -0.30 -0.27 0.34 0.82 -0.73 0.00 0.00 179.01 178.87 1vdk h ILE 70 N -0.41 1.23 -0.24 2.32 2.04 -1.95 -2.77 117.51 117.73 1vdk h ILE 70 Ca 0.03 -0.65 0.01 0.00 1.00 0.00 0.00 64.86 65.24 1vdk h ILE 70 Cb 0.49 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1vdk h ILE 70 CO -0.33 0.27 0.14 0.00 0.00 0.00 0.00 178.15 178.23 1vdk h ALA 71 N 1.16 0.29 -0.87 1.87 0.00 -0.86 -1.07 119.26 119.79 1vdk h ALA 71 Ca 0.24 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.15 1vdk h ALA 71 Cb 0.12 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 1vdk h ALA 71 CO -0.03 -0.26 0.57 0.87 0.00 0.00 0.00 179.25 180.40 1vdk h LYS 72 N 0.28 1.15 -0.42 0.00 1.57 -1.03 -0.11 116.57 118.02 1vdk h LYS 72 Ca 0.09 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 1vdk h LYS 72 Cb -0.00 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 1vdk h LYS 72 CO -0.04 0.77 -0.03 0.00 -0.57 0.00 0.00 179.45 179.58 1vdk h ALA 73 N 1.44 0.57 -0.58 3.86 0.00 -1.18 -1.71 119.26 121.65 1vdk h ALA 73 Ca 0.32 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1vdk h ALA 73 Cb -0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1vdk h ALA 73 CO -0.07 0.38 0.29 0.82 0.00 0.00 0.00 179.25 180.67 1vdk h ILE 74 N 0.59 1.20 -0.90 0.00 2.04 -0.74 -0.04 117.51 119.67 1vdk h ILE 74 Ca 0.11 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.42 1vdk h ILE 74 Cb 0.53 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.08 1vdk h ILE 74 CO 0.03 0.23 0.58 0.40 0.00 0.00 0.00 178.15 179.39 1vdk h ILE 75 N 0.78 1.24 -0.20 -0.67 2.04 -0.85 0.32 117.51 120.17 1vdk h ILE 75 Ca 0.20 -0.45 -0.04 0.00 1.00 0.00 0.00 64.86 65.57 1vdk h ILE 75 Cb 0.10 -0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.10 1vdk h ILE 75 CO -0.03 0.23 -0.02 -0.61 0.00 0.00 0.00 178.15 177.73 1vdk h GLN 76 N 1.23 0.37 -0.71 2.37 4.15 -0.89 -1.61 115.11 120.02 1vdk h GLN 76 Ca 0.33 -0.13 -0.01 0.00 0.77 0.00 0.00 58.65 59.61 1vdk h GLN 76 Cb -0.12 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.51 1vdk h GLN 76 CO -0.07 0.59 0.39 0.00 -1.93 0.00 0.00 178.83 177.81 1vdk h ALA 77 N 0.77 0.90 -0.65 3.38 0.00 -0.61 -2.07 119.26 120.98 1vdk h ALA 77 Ca 0.05 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 1vdk h ALA 77 Cb 0.44 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1vdk h ALA 77 CO 0.01 0.42 0.19 0.00 0.00 0.00 0.00 179.25 179.87 1vdk h ALA 78 N 1.20 0.85 -0.43 0.00 0.00 -0.30 -2.46 119.26 118.12 1vdk h ALA 78 Ca 0.25 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1vdk h ALA 78 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1vdk h ALA 78 CO -0.04 0.54 0.15 1.49 0.00 0.00 0.00 179.25 181.39 1vdk h GLU 79 N 0.95 0.61 -0.30 0.00 4.57 -0.94 -1.13 114.58 118.34 1vdk h GLU 79 Ca 0.21 -0.09 -0.07 0.00 -1.18 0.00 0.00 59.36 58.23 1vdk h GLU 79 Cb 0.31 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 1vdk h GLU 79 CO -0.00 0.52 -0.11 0.93 -1.18 0.00 0.00 179.01 179.17 1vdk h GLU 80 N 0.61 0.50 -0.31 1.92 5.08 -0.94 -1.33 114.58 120.11 1vdk h GLU 80 Ca 0.15 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.29 1vdk h GLU 80 Cb 0.15 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1vdk h GLU 80 CO -0.01 0.61 -0.09 0.28 -1.00 0.00 0.00 179.01 178.80 1vdk h VAL 81 N 0.47 1.28 -0.67 3.13 2.07 -0.86 -1.49 116.25 120.18 1vdk h VAL 81 Ca 0.09 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.52 1vdk h VAL 81 Cb 0.48 1.39 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 1vdk h VAL 81 CO 0.03 0.37 0.45 0.58 0.02 0.00 0.00 177.57 179.01 1vdk h VAL 82 N 0.37 1.05 0.00 2.57 2.07 -0.82 0.14 116.25 121.62 1vdk h VAL 82 Ca 0.08 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1vdk h VAL 82 Cb 0.59 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 1vdk h VAL 82 CO 0.03 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.76 1vdk n GLN 83 N -4.47 0.92 -1.01 1.57 1.13 -0.54 -4.89 117.38 110.09 1vdk n GLN 83 Ca 0.09 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.15 1vdk n GLN 83 Cb 0.19 -1.50 -0.00 0.00 0.11 0.00 0.00 30.24 29.04 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 0.85 0.47 0.15 1.08 0.00 0.04 -4.93 105.19 102.85 1vdk n GLY 84 Ca 0.22 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1vdk n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vdk h LYS 85 N 0.64 0.00 0.00 1.61 1.57 -1.46 -3.21 116.57 115.71 1vdk h LYS 85 Ca -0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1vdk h LYS 85 Cb 0.05 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1vdk h LYS 85 CO 0.01 0.00 -0.13 0.91 -0.57 0.00 0.00 179.45 179.67 1vdk n TRP 86 N -2.39 0.00 -0.35 -1.35 7.02 -1.26 -4.83 117.44 114.28 1vdk n TRP 86 Ca 0.02 -0.94 0.15 0.00 -1.02 0.00 0.00 57.50 55.71 1vdk n TRP 86 Cb 0.27 -0.15 0.34 0.00 -2.42 0.00 0.00 31.31 29.36 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 0.13 0.74 0.00 -0.99 3.32 -1.89 -0.26 116.42 117.47 1vdk h ASP 87 Ca -0.00 0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.16 1vdk h ASP 87 Cb 1.06 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1vdk h ASP 87 CO 0.00 0.21 0.00 0.47 -1.72 0.00 0.00 179.24 178.20 1vdk n ASP 88 N -4.82 0.00 -1.38 6.45 8.00 -1.26 -2.91 116.55 120.63 1vdk n ASP 88 Ca 0.25 -0.80 0.08 0.00 0.71 0.00 0.00 54.79 55.03 1vdk n ASP 88 Cb 0.64 0.00 0.33 0.00 -0.02 0.00 0.00 41.12 42.07 1vdk n ASP 88 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1vdk n HIS 89 N -0.87 1.48 -3.79 1.24 8.25 -0.11 -4.72 115.22 116.70 1vdk n HIS 89 Ca 0.11 -0.78 -0.30 0.00 -0.26 0.00 0.00 57.72 56.49 1vdk n HIS 89 Cb 0.05 -0.39 -0.14 0.00 1.12 0.00 0.00 29.99 30.63 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 -2.68 2.30 -1.52 4.41 0.08 -1.14 -4.61 117.98 114.81 1vdk s PHE 90 Ca 0.48 -2.37 0.19 0.00 0.12 0.00 0.00 56.93 55.34 1vdk s PHE 90 Cb 0.37 -2.09 0.56 0.00 -0.57 0.00 0.00 43.02 41.28 1vdk s PHE 90 CO 0.13 -0.84 1.47 -0.35 -0.10 0.00 0.00 175.22 175.54 1vdk n PRO 91 N 4.03 2.91 -2.99 0.24 -0.04 -1.26 -4.91 135.00 132.98 1vdk n PRO 91 Ca 0.04 -2.53 -0.30 0.00 -0.04 0.00 0.00 63.50 60.67 1vdk n PRO 91 Cb 0.38 -1.53 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 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 -1.16 3.91 0.48 1.53 1.43 -1.26 -4.93 118.68 118.68 1vdk s LEU 92 Ca 0.42 1.05 0.02 0.00 -1.03 0.00 0.00 54.13 54.59 1vdk s LEU 92 Cb 0.23 -3.91 0.01 0.00 0.03 0.00 0.00 46.19 42.55 1vdk s LEU 92 CO 0.27 -0.33 0.68 0.68 0.23 0.00 0.00 176.35 177.88 1vdk s VAL 93 N -2.27 3.36 0.23 -1.59 -7.23 -1.26 -1.07 120.40 110.57 1vdk s VAL 93 Ca 0.50 -0.67 -0.04 0.00 -1.81 0.00 0.00 61.98 59.95 1vdk s VAL 93 Cb -0.10 -3.23 0.10 0.00 0.56 0.00 0.00 36.38 33.71 1vdk s VAL 93 CO 0.30 -0.14 1.72 0.58 -0.31 0.00 0.00 175.10 177.24 1vdk h VAL 94 N 0.34 1.25 -0.60 1.32 2.07 -1.11 -3.34 116.25 116.18 1vdk h VAL 94 Ca -0.44 -1.06 -0.72 0.00 0.82 0.00 0.00 66.70 65.30 1vdk h VAL 94 Cb 1.27 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 31.82 1vdk h VAL 94 CO 0.53 0.38 2.83 0.49 0.02 0.00 0.00 177.57 181.82 1vdk n PHE 95 N -4.20 2.98 -1.83 1.57 3.01 -1.26 -4.57 117.46 113.16 1vdk n PHE 95 Ca 0.03 -2.92 0.00 0.00 1.01 0.00 0.00 57.45 55.57 1vdk n PHE 95 Cb 0.32 -2.25 0.00 0.00 -0.01 0.00 0.00 39.48 37.54 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 4.24 3.99 -1.82 -1.08 10.64 -1.25 -4.74 117.38 127.35 1vdk n GLN 96 Ca 0.55 0.00 -0.38 0.00 -1.83 0.00 0.00 57.00 55.34 1vdk n GLN 96 Cb 0.33 0.00 0.04 0.00 -0.86 0.00 0.00 30.24 29.75 1vdk n GLN 96 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 1vdk s THR 97 N 2.17 2.16 -1.10 -0.39 -1.32 -1.26 -4.88 115.64 111.03 1vdk s THR 97 Ca 0.00 0.12 0.15 0.00 -1.21 0.00 0.00 61.69 60.75 1vdk s THR 97 Cb 0.00 -3.06 0.16 0.00 -1.51 0.00 0.00 72.50 68.09 1vdk s THR 97 CO 0.00 -0.00 1.47 0.61 -2.21 0.00 0.00 174.62 174.49 1vdk n GLY 98 N 0.70 -0.97 0.00 6.08 0.00 -1.26 -2.15 105.19 107.60 1vdk n GLY 98 Ca 0.10 -0.06 0.10 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 -1.45 0.90 -0.09 1.61 3.41 -1.26 -2.03 113.62 114.71 1vdk n SER 99 Ca 0.04 -0.86 -0.01 0.00 -0.26 0.00 0.00 58.87 57.78 1vdk n SER 99 Cb 0.16 0.94 -0.00 0.00 -0.26 0.00 0.00 64.21 65.05 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 1.49 0.50 0.32 5.00 0.00 -0.91 -4.52 105.19 107.06 1vdk n GLY 100 Ca 0.04 -0.62 0.08 0.00 0.00 0.00 0.00 46.02 45.52 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 0.76 -0.62 2.61 2.02 -1.88 -0.94 112.91 114.86 1vdk h THR 101 Ca -0.02 -0.24 -0.08 0.00 0.77 0.00 0.00 66.41 66.84 1vdk h THR 101 Cb 0.11 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.49 1vdk h THR 101 CO 0.03 0.13 0.09 1.56 0.37 0.00 0.00 175.52 177.70 1vdk h GLN 102 N 0.70 1.02 -0.11 6.66 4.20 -1.91 -0.56 115.11 125.11 1vdk h GLN 102 Ca 0.48 -0.27 -0.18 0.00 0.06 0.00 0.00 58.65 58.74 1vdk h GLN 102 Cb 0.65 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1vdk h GLN 102 CO -0.35 0.94 -0.68 1.15 -0.67 0.00 0.00 178.83 179.23 1vdk h THR 103 N 0.95 1.36 -0.41 -0.54 2.02 -1.80 -0.03 112.91 114.46 1vdk h THR 103 Ca 0.19 -2.03 -0.00 0.00 0.77 0.00 0.00 66.41 65.34 1vdk h THR 103 Cb 0.43 2.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.83 1vdk h THR 103 CO 0.01 0.62 0.25 -1.13 0.37 0.00 0.00 175.52 175.64 1vdk h ASN 104 N 0.32 0.49 0.43 4.18 -1.24 -0.85 0.25 115.58 119.16 1vdk h ASN 104 Ca -0.02 -0.04 -0.09 0.00 0.71 0.00 0.00 56.30 56.86 1vdk h ASN 104 Cb 1.25 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 40.16 1vdk h ASN 104 CO 0.12 0.39 -0.42 0.24 -1.29 0.00 0.00 177.43 176.46 1vdk h MET 105 N 0.55 0.00 -0.50 6.67 2.86 -0.94 0.53 114.93 124.09 1vdk h MET 105 Ca 0.15 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.74 1vdk h MET 105 Cb -0.02 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1vdk h MET 105 CO -0.03 0.42 0.14 -0.97 1.06 0.00 0.00 176.91 177.54 1vdk h ASN 106 N 0.00 0.74 -0.28 1.22 -0.00 -0.27 0.22 115.58 117.20 1vdk h ASN 106 Ca -0.00 -0.22 -0.04 0.00 -0.00 0.00 0.00 56.30 56.04 1vdk h ASN 106 Cb 0.75 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.87 1vdk h ASN 106 CO 0.05 0.76 0.01 0.58 -0.00 0.00 0.00 177.43 178.84 1vdk h VAL 107 N 0.68 1.25 -0.64 2.57 2.07 -0.47 -1.88 116.25 119.83 1vdk h VAL 107 Ca 0.16 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.76 1vdk h VAL 107 Cb 0.30 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1vdk h VAL 107 CO -0.00 0.29 0.35 0.78 0.02 0.00 0.00 177.57 179.01 1vdk h ASN 108 N 0.29 0.80 -0.38 0.57 2.35 -0.60 -1.97 115.58 116.64 1vdk h ASN 108 Ca 0.08 -0.09 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 1vdk h ASN 108 Cb 0.41 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1vdk h ASN 108 CO 0.01 0.67 -0.13 -0.33 -1.65 0.00 0.00 177.43 176.00 1vdk h GLU 109 N 0.88 0.76 -0.10 0.81 5.08 -0.52 -0.36 114.58 121.14 1vdk h GLU 109 Ca 0.23 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1vdk h GLU 109 Cb 0.04 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1vdk h GLU 109 CO -0.04 0.92 -0.01 0.28 -1.00 0.00 0.00 179.01 179.17 1vdk h VAL 110 N 0.56 1.26 -0.77 3.13 2.07 -1.28 -0.56 116.25 120.67 1vdk h VAL 110 Ca 0.09 -0.84 -0.05 0.00 0.82 0.00 0.00 66.70 66.73 1vdk h VAL 110 Cb 0.66 1.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1vdk h VAL 110 CO 0.05 0.24 0.30 0.40 0.02 0.00 0.00 177.57 178.58 1vdk h ILE 111 N -0.11 1.26 -0.53 4.57 2.04 -1.39 -1.03 117.51 122.31 1vdk h ILE 111 Ca 0.03 -0.82 -0.10 0.00 1.00 0.00 0.00 64.86 64.97 1vdk h ILE 111 Cb 0.37 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.78 1vdk h ILE 111 CO 0.01 0.33 -0.06 0.00 0.00 0.00 0.00 178.15 178.43 1vdk h ALA 112 N 1.16 0.72 -0.29 1.87 0.00 -0.98 0.51 119.26 122.24 1vdk h ALA 112 Ca 0.26 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1vdk h ALA 112 Cb 0.22 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1vdk h ALA 112 CO -0.02 0.59 -0.02 -0.91 0.00 0.00 0.00 179.25 178.88 1vdk h ASN 113 N 0.84 0.53 -0.31 0.00 2.35 -0.88 -0.57 115.58 117.53 1vdk h ASN 113 Ca 0.14 -0.33 -0.06 0.00 -0.55 0.00 0.00 56.30 55.51 1vdk h ASN 113 Cb 0.61 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.82 1vdk h ASN 113 CO 0.04 0.73 0.01 -0.09 -1.65 0.00 0.00 177.43 176.47 1vdk h ARG 114 N 0.31 0.64 -0.26 0.81 9.65 -1.11 -1.34 114.38 123.08 1vdk h ARG 114 Ca 0.08 -0.15 -0.05 0.00 -1.10 0.00 0.00 59.98 58.76 1vdk h ARG 114 Cb 0.47 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 1vdk h ARG 114 CO 0.02 0.65 -0.02 0.00 2.80 0.00 0.00 179.97 183.42 1vdk h ALA 115 N 1.41 0.36 -0.59 2.80 0.00 -0.69 0.26 119.26 122.80 1vdk h ALA 115 Ca 0.13 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.83 1vdk h ALA 115 Cb 0.37 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 1vdk h ALA 115 CO 0.01 0.12 0.34 0.77 0.00 0.00 0.00 179.25 180.50 1vdk h SER 116 N 0.25 0.54 -0.71 0.00 0.02 -0.83 -1.41 113.55 111.42 1vdk h SER 116 Ca 0.07 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.02 1vdk h SER 116 Cb 0.46 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 1vdk h SER 116 CO 0.02 0.37 0.36 -0.08 -1.14 0.00 0.00 176.83 176.37 1vdk h GLU 117 N 0.67 1.00 0.00 3.45 4.81 -1.03 0.39 114.58 123.87 1vdk h GLU 117 Ca 0.25 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1vdk h GLU 117 Cb 0.07 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 1vdk h GLU 117 CO -0.13 0.77 -0.05 0.82 -0.73 0.00 0.00 179.01 179.69 1vdk h ILE 118 N 0.98 0.95 -0.37 2.32 2.04 -0.21 0.27 117.51 123.49 1vdk h ILE 118 Ca 0.25 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1vdk h ILE 118 Cb 0.08 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 1vdk h ILE 118 CO -0.04 0.05 0.00 0.18 0.00 0.00 0.00 178.15 178.34 1vdk n LEU 119 N -4.36 3.71 -0.95 1.44 4.77 -0.58 -4.89 117.00 116.15 1vdk n LEU 119 Ca -0.03 -1.88 -0.12 0.00 -0.03 0.00 0.00 56.01 53.95 1vdk n LEU 119 Cb 0.13 -0.57 -0.05 0.00 -2.33 0.00 0.00 43.42 40.61 1vdk n LEU 119 CO 0.34 0.51 -0.12 0.61 -1.33 0.00 0.00 177.39 177.39 1vdk n GLY 120 N 0.52 1.16 3.85 -0.72 0.00 0.08 -5.01 105.19 105.07 1vdk n GLY 120 Ca 0.17 -0.47 -0.28 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 -3.16 3.11 0.59 1.61 -0.14 0.13 -4.97 119.74 116.91 1vdk s LYS 121 Ca 0.00 -0.68 -0.16 0.00 -1.36 0.00 0.00 55.97 53.77 1vdk s LYS 121 Cb 0.00 -2.81 -0.04 0.00 -1.68 0.00 0.00 37.83 33.30 1vdk s LYS 121 CO 0.00 0.54 1.07 -1.25 -0.76 0.00 0.00 175.35 174.95 1vdk s PRO 122 N -2.80 3.28 0.37 -1.68 0.04 -1.26 -3.11 135.00 129.84 1vdk s PRO 122 Ca 0.32 1.27 -0.27 0.00 0.04 0.00 0.00 61.00 62.35 1vdk s PRO 122 Cb -0.11 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.31 1vdk s PRO 122 CO 0.25 -0.85 1.26 -0.51 0.04 0.00 0.00 177.00 177.19 1vdk s LEU 123 N -4.43 4.31 0.00 -3.56 1.43 -1.26 -2.48 118.68 112.70 1vdk s LEU 123 Ca 0.65 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 56.32 1vdk s LEU 123 Cb -0.17 -3.81 0.00 0.00 0.03 0.00 0.00 46.19 42.24 1vdk s LEU 123 CO 0.36 -0.64 0.00 0.61 0.23 0.00 0.00 176.35 176.91 1vdk n GLY 124 N 0.75 1.73 0.14 -3.19 0.00 -1.26 -4.87 105.19 98.49 1vdk n GLY 124 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 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 0.26 -1.68 1.61 4.64 -1.86 -3.47 113.55 113.03 1vdk h SER 125 Ca 0.00 -0.18 -0.26 0.00 -0.47 0.00 0.00 61.79 60.88 1vdk h SER 125 Cb 0.00 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 61.99 1vdk h SER 125 CO 0.00 0.91 -0.32 0.29 -0.87 0.00 0.00 176.83 176.84 1vdk n LYS 126 N -3.75 -1.02 -0.25 4.77 5.02 -1.26 -4.88 118.16 116.79 1vdk n LYS 126 Ca -0.03 0.67 0.02 0.00 -2.02 0.00 0.00 58.31 56.96 1vdk n LYS 126 Cb 0.72 -4.87 0.15 0.00 -0.02 0.00 0.00 35.03 31.01 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 0.65 -3.56 2.13 3.20 -1.89 -2.86 116.97 114.64 1vdk h TYR 127 Ca -0.30 0.03 -0.71 0.00 3.14 0.00 0.00 58.73 60.89 1vdk h TYR 127 Cb 1.18 -0.18 -0.21 0.00 1.54 0.00 0.00 36.73 39.05 1vdk h TYR 127 CO 0.35 0.22 -0.46 0.00 -1.64 0.00 0.00 178.16 176.62 1vdk s ALA 128 N -6.05 3.43 0.03 1.82 0.00 -1.26 -5.03 121.76 114.70 1vdk s ALA 128 Ca -0.13 -1.65 -0.24 0.00 0.00 0.00 0.00 51.96 49.95 1vdk s ALA 128 Cb 0.19 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.49 1vdk s ALA 128 CO 0.77 -1.33 0.72 -1.58 0.00 0.00 0.00 175.76 174.33 1vdk s HIS 129 N 1.66 3.72 0.22 0.00 2.46 -1.08 -4.59 115.29 117.67 1vdk s HIS 129 Ca 0.04 1.40 -0.09 0.00 0.47 0.00 0.00 55.06 56.89 1vdk s HIS 129 Cb -0.19 -2.77 0.24 0.00 -0.13 0.00 0.00 32.58 29.73 1vdk s HIS 129 CO 0.09 0.28 1.84 -1.35 -2.47 0.00 0.00 174.74 173.13 1vdk h PRO 130 N 5.71 0.83 0.02 2.88 0.11 -1.88 -1.41 132.00 138.26 1vdk h PRO 130 Ca -0.44 -0.05 -0.27 0.00 0.11 0.00 0.00 66.00 65.35 1vdk h PRO 130 Cb 1.20 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.09 1vdk h PRO 130 CO 0.71 0.55 -1.48 0.09 -0.21 0.00 0.00 178.00 177.66 1vdk n ASN 131 N -4.68 1.91 0.20 -2.05 5.03 -1.26 -1.50 115.26 112.92 1vdk n ASN 131 Ca 0.09 0.38 0.06 0.00 0.87 0.00 0.00 54.58 55.98 1vdk n ASN 131 Cb 0.13 -0.94 0.43 0.00 -1.02 0.00 0.00 39.78 38.38 1vdk n ASN 131 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.26 175.87 1vdk h ASP 132 N -0.80 0.00 0.00 6.41 3.32 -1.92 -3.20 116.42 120.22 1vdk h ASP 132 Ca -0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1vdk h ASP 132 Cb 1.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.01 1vdk h ASP 132 CO -0.17 0.32 -0.15 1.41 -1.72 0.00 0.00 179.24 178.93 1vdk n HIS 133 N -3.75 0.00 0.06 4.55 8.25 -0.61 -4.36 115.22 119.36 1vdk n HIS 133 Ca -0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.48 1vdk n HIS 133 Cb 0.41 -0.07 0.40 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 -0.15 1.14 -0.66 1.59 2.07 -1.40 -2.40 116.25 116.44 1vdk h VAL 134 Ca 0.00 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1vdk h VAL 134 Cb 0.15 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1vdk h VAL 134 CO 0.00 0.17 0.00 -3.20 0.02 0.00 0.00 177.57 174.56 1vdk n ASN 135 N -4.38 4.14 -4.67 0.57 5.15 -0.56 -4.89 115.26 110.62 1vdk n ASN 135 Ca 0.01 -2.18 -0.51 0.00 -0.60 0.00 0.00 54.58 51.31 1vdk n ASN 135 Cb 0.17 -0.50 -0.05 0.00 -0.53 0.00 0.00 39.78 38.87 1vdk n ASN 135 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1vdk n ARG 136 N 1.31 1.74 -1.15 1.20 3.00 -0.91 -1.42 116.66 120.43 1vdk n ARG 136 Ca 0.24 0.63 -0.05 0.00 -0.00 0.00 0.00 57.85 58.67 1vdk n ARG 136 Cb 0.70 -2.38 -0.02 0.00 0.00 0.00 0.00 32.46 30.76 1vdk n ARG 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1vdk n GLY 137 N 3.72 0.73 3.45 5.14 0.00 -1.26 -5.00 105.19 111.97 1vdk n GLY 137 Ca 0.21 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.94 1.59 0.12 1.61 -0.21 -0.50 -4.40 119.66 115.93 1vdk s GLN 138 Ca 0.00 -1.82 0.02 0.00 0.02 0.00 0.00 55.36 53.59 1vdk s GLN 138 Cb 0.00 -1.21 -0.04 0.00 1.00 0.00 0.00 33.01 32.76 1vdk s GLN 138 CO 0.00 0.03 -0.06 0.45 -2.12 0.00 0.00 175.29 173.59 1vdk s SER 139 N -3.47 1.27 0.33 5.90 0.15 -1.26 -4.93 113.70 111.69 1vdk s SER 139 Ca 0.30 -1.04 0.15 0.00 0.70 0.00 0.00 55.95 56.06 1vdk s SER 139 Cb 0.04 0.08 0.56 0.00 -1.71 0.00 0.00 66.02 64.99 1vdk s SER 139 CO 0.13 -0.46 1.69 0.77 1.20 0.00 0.00 173.24 176.57 1vdk h SER 140 N 2.88 0.00 -1.00 5.45 4.64 -1.90 -2.42 113.55 121.19 1vdk h SER 140 Ca -0.36 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.02 1vdk h SER 140 Cb 1.18 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.20 1vdk h SER 140 CO 0.64 0.47 0.65 0.78 -0.87 0.00 0.00 176.83 178.50 1vdk h ASN 141 N 0.00 1.06 0.11 4.97 2.35 -1.82 -1.02 115.58 121.23 1vdk h ASN 141 Ca -0.00 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.42 1vdk h ASN 141 Cb 0.95 -0.23 -0.06 0.00 0.05 0.00 0.00 38.32 39.03 1vdk h ASN 141 CO 0.06 0.70 -2.21 -0.90 -1.65 0.00 0.00 177.43 173.43 1vdk n ASP 142 N -4.47 0.18 0.06 5.81 5.75 -1.21 -4.36 116.55 118.30 1vdk n ASP 142 Ca 0.15 0.09 -0.15 0.00 -0.01 0.00 0.00 54.79 54.87 1vdk n ASP 142 Cb 0.15 0.85 -0.05 0.00 -1.03 0.00 0.00 41.12 41.04 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 1.37 -0.00 2.12 1.35 -1.36 -2.77 112.91 113.61 1vdk h THR 143 Ca -0.45 -2.35 -0.00 0.00 -0.55 0.00 0.00 66.41 63.06 1vdk h THR 143 Cb 2.10 2.35 -0.00 0.00 -1.73 0.00 0.00 68.15 70.88 1vdk h THR 143 CO 0.04 0.71 0.00 0.15 -0.25 0.00 0.00 175.52 176.17 1vdk h PHE 144 N 0.29 0.01 0.00 4.73 3.57 -1.41 0.11 116.94 124.23 1vdk h PHE 144 Ca -0.08 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.37 1vdk h PHE 144 Cb 1.56 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.29 1vdk h PHE 144 CO 0.07 0.12 -0.23 -1.00 -2.23 0.00 0.00 178.31 175.03 1vdk h PRO 145 N -0.10 0.00 -0.04 6.41 0.13 -1.76 0.81 132.00 137.44 1vdk h PRO 145 Ca 0.00 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 1vdk h PRO 145 Cb 0.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.24 1vdk h PRO 145 CO -0.00 0.23 -0.01 1.15 -0.23 0.00 0.00 178.00 179.14 1vdk h THR 146 N 0.00 1.29 -0.77 1.56 2.02 -1.14 -0.83 112.91 115.04 1vdk h THR 146 Ca -0.00 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.26 1vdk h THR 146 Cb 0.52 1.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.71 1vdk h THR 146 CO 0.03 0.24 0.40 0.00 0.37 0.00 0.00 175.52 176.56 1vdk h ALA 147 N 0.65 1.25 -0.09 6.16 0.00 -0.44 -2.04 119.26 124.76 1vdk h ALA 147 Ca 0.01 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.63 1vdk h ALA 147 Cb 0.39 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1vdk h ALA 147 CO 0.00 0.59 -0.63 0.00 0.00 0.00 0.00 179.25 179.22 1vdk h MET 148 N 1.09 0.32 -0.42 0.00 -0.00 -0.72 -0.04 114.93 115.16 1vdk h MET 148 Ca 0.27 -0.23 -0.09 0.00 -0.00 0.00 0.00 59.70 59.66 1vdk h MET 148 Cb 0.06 0.04 -0.01 0.00 -0.00 0.00 0.00 31.60 31.68 1vdk h MET 148 CO -0.04 0.84 -0.08 1.88 -0.00 0.00 0.00 176.91 179.51 1vdk h TYR 149 N 0.23 0.89 -0.42 -0.10 -1.99 -0.92 -1.09 116.97 113.56 1vdk h TYR 149 Ca -0.01 -0.18 -0.03 0.00 2.00 0.00 0.00 58.73 60.51 1vdk h TYR 149 Cb 1.16 -0.22 -0.02 0.00 2.00 0.00 0.00 36.73 39.65 1vdk h TYR 149 CO 0.03 0.90 0.15 0.28 -0.00 0.00 0.00 178.16 179.53 1vdk h VAL 150 N 0.62 1.21 -0.40 -2.88 2.07 -1.27 -1.28 116.25 114.32 1vdk h VAL 150 Ca 0.11 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 66.99 1vdk h VAL 150 Cb 0.60 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1vdk h VAL 150 CO 0.04 0.24 0.22 0.00 0.02 0.00 0.00 177.57 178.09 1vdk h ALA 151 N 1.00 0.50 -0.34 1.67 0.00 -0.80 -0.68 119.26 120.60 1vdk h ALA 151 Ca 0.14 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1vdk h ALA 151 Cb 0.22 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1vdk h ALA 151 CO -0.01 -0.13 -0.06 0.28 0.00 0.00 0.00 179.25 179.33 1vdk h VAL 152 N 0.45 1.27 -0.38 0.00 2.07 -1.09 -1.10 116.25 117.46 1vdk h VAL 152 Ca 0.16 -1.11 0.02 0.00 0.82 0.00 0.00 66.70 66.59 1vdk h VAL 152 Cb 0.04 1.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1vdk h VAL 152 CO -0.09 0.36 0.22 0.00 0.02 0.00 0.00 177.57 178.08 1vdk h ALA 153 N 0.82 0.48 -0.68 1.67 0.00 -1.00 -1.56 119.26 118.99 1vdk h ALA 153 Ca 0.09 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1vdk h ALA 153 Cb 0.56 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1vdk h ALA 153 CO 0.03 -0.12 0.19 -0.07 0.00 0.00 0.00 179.25 179.28 1vdk h LEU 154 N 0.45 1.00 -1.12 0.00 3.38 -1.03 -2.76 115.31 115.24 1vdk h LEU 154 Ca 0.15 -0.19 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 1vdk h LEU 154 Cb 0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.48 1vdk h LEU 154 CO -0.07 0.95 -0.16 0.00 0.09 0.00 0.00 178.44 179.24 1vdk h ALA 155 N 1.18 1.27 -0.21 1.53 0.00 -0.81 0.16 119.26 122.38 1vdk h ALA 155 Ca 0.22 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1vdk h ALA 155 Cb 0.32 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1vdk h ALA 155 CO -0.00 0.48 0.11 -0.07 0.00 0.00 0.00 179.25 179.76 1vdk h LEU 156 N 0.39 0.26 -0.48 0.00 3.38 -1.02 0.51 115.31 118.36 1vdk h LEU 156 Ca 0.07 -0.10 -0.16 0.00 0.09 0.00 0.00 57.88 57.78 1vdk h LEU 156 Cb 0.51 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1vdk h LEU 156 CO 0.03 0.29 -0.45 0.45 0.09 0.00 0.00 178.44 178.86 1vdk h HIS 157 N 0.22 0.92 0.04 1.13 3.86 -1.23 0.06 115.15 120.14 1vdk h HIS 157 Ca 0.07 -0.29 -0.26 0.00 -1.16 0.00 0.00 60.37 58.74 1vdk h HIS 157 Cb 0.09 -0.19 0.01 0.00 1.06 0.00 0.00 27.41 28.39 1vdk h HIS 157 CO -0.03 1.06 -1.07 0.37 0.86 0.00 0.00 177.93 179.12 1vdk h GLN 158 N 0.60 0.51 0.00 2.45 5.75 -0.61 -3.40 115.11 120.41 1vdk h GLN 158 Ca 0.04 -0.60 -0.02 0.00 -0.15 0.00 0.00 58.65 57.92 1vdk h GLN 158 Cb 1.01 0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.74 1vdk h GLN 158 CO 0.10 1.23 -0.86 0.54 -2.65 0.00 0.00 178.83 177.19 1vdk n ARG 159 N -3.75 0.03 0.14 1.69 1.74 0.16 -4.74 116.66 111.93 1vdk n ARG 159 Ca -0.09 0.01 -0.13 0.00 -0.77 0.00 0.00 57.85 56.87 1vdk n ARG 159 Cb 0.90 -0.56 -0.08 0.00 -1.02 0.00 0.00 32.46 31.70 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 -0.06 -0.30 -0.40 0.55 5.85 -1.38 -2.99 115.31 116.58 1vdk h LEU 160 Ca -0.03 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.55 1vdk h LEU 160 Cb 0.81 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.88 1vdk h LEU 160 CO -0.02 0.05 0.12 1.88 -0.34 0.00 0.00 178.44 180.13 1vdk h TYR 161 N -0.69 0.20 -0.99 1.25 0.99 -1.24 -1.10 116.97 115.39 1vdk h TYR 161 Ca -0.04 0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.75 1vdk h TYR 161 Cb 0.48 -0.03 -0.06 0.00 1.00 0.00 0.00 36.73 38.12 1vdk h TYR 161 CO 0.02 0.06 0.65 -1.35 -0.00 0.00 0.00 178.16 177.55 1vdk h PRO 162 N 0.26 1.23 -0.00 4.88 0.11 -1.77 0.90 132.00 137.61 1vdk h PRO 162 Ca 0.19 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 1vdk h PRO 162 Cb 0.19 -0.28 -0.00 0.00 0.11 0.00 0.00 31.00 31.02 1vdk h PRO 162 CO -0.21 0.81 -0.00 0.00 -0.21 0.00 0.00 178.00 178.39 1vdk h ALA 163 N 1.42 0.00 -0.51 -0.75 0.00 -1.26 -1.23 119.26 116.93 1vdk h ALA 163 Ca 0.39 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 1vdk h ALA 163 Cb -0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1vdk h ALA 163 CO -0.11 -0.33 -0.03 0.28 0.00 0.00 0.00 179.25 179.05 1vdk h VAL 164 N -0.33 1.27 -0.44 0.00 2.07 -1.04 -1.74 116.25 116.03 1vdk h VAL 164 Ca 0.00 -1.14 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 1vdk h VAL 164 Cb 0.33 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 1vdk h VAL 164 CO 0.00 0.40 0.15 -0.33 0.02 0.00 0.00 177.57 177.81 1vdk h GLU 165 N 0.79 0.63 -0.35 1.57 5.08 -0.85 -0.19 114.58 121.28 1vdk h GLU 165 Ca 0.14 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1vdk h GLU 165 Cb 0.57 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 1vdk h GLU 165 CO 0.03 0.55 0.07 0.78 -1.00 0.00 0.00 179.01 179.44 1vdk h GLY 166 N 0.80 0.61 1.43 -3.84 0.00 -0.78 -1.78 103.07 99.51 1vdk h GLY 166 Ca 0.15 -0.40 -0.08 0.00 0.00 0.00 0.00 47.33 47.00 1vdk h GLY 166 CO -0.01 0.37 -0.10 -2.00 0.00 0.00 0.00 176.54 174.79 1vdk h LEU 167 N 0.40 0.66 -0.72 3.11 5.85 -0.76 -1.72 115.31 122.14 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 0.33 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1vdk h LEU 167 CO 0.00 0.80 0.42 0.40 -0.34 0.00 0.00 178.44 179.72 1vdk h ILE 168 N 0.62 1.21 -0.54 4.05 2.04 -0.83 -0.78 117.51 123.29 1vdk h ILE 168 Ca 0.11 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.47 1vdk h ILE 168 Cb 0.54 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1vdk h ILE 168 CO 0.03 0.23 0.30 0.03 0.00 0.00 0.00 178.15 178.74 1vdk h ARG 169 N 0.99 0.74 -0.04 2.37 3.08 -0.84 0.43 114.38 121.10 1vdk h ARG 169 Ca 0.26 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.22 1vdk h ARG 169 Cb -0.00 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.90 1vdk h ARG 169 CO -0.05 0.57 0.02 1.15 -1.07 0.00 0.00 179.97 180.59 1vdk h THR 170 N 0.72 1.10 -0.43 2.04 2.02 -0.87 -1.00 112.91 116.48 1vdk h THR 170 Ca 0.19 -0.28 -0.06 0.00 0.77 0.00 0.00 66.41 67.03 1vdk h THR 170 Cb 0.03 1.21 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1vdk h THR 170 CO -0.03 0.08 0.02 -0.26 0.37 0.00 0.00 175.52 175.70 1vdk h PHE 171 N -0.05 0.73 -0.56 3.16 0.05 -1.02 -0.53 116.94 118.72 1vdk h PHE 171 Ca 0.01 -0.09 -0.04 0.00 3.82 0.00 0.00 57.97 61.68 1vdk h PHE 171 Cb 0.11 -0.21 -0.02 0.00 2.00 0.00 0.00 35.95 37.83 1vdk h PHE 171 CO -0.04 0.68 0.21 1.15 -0.18 0.00 0.00 178.31 180.13 1vdk h THR 172 N 0.66 1.23 -0.42 -1.55 2.02 -0.69 0.79 112.91 114.94 1vdk h THR 172 Ca 0.14 -0.72 -0.09 0.00 0.77 0.00 0.00 66.41 66.50 1vdk h THR 172 Cb 0.38 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1vdk h THR 172 CO 0.01 0.28 -0.08 0.00 0.37 0.00 0.00 175.52 176.10 1vdk h ALA 173 N 1.06 0.58 -0.61 6.16 0.00 -0.77 -2.40 119.26 123.28 1vdk h ALA 173 Ca 0.18 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1vdk h ALA 173 Cb 0.22 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1vdk h ALA 173 CO -0.01 0.44 0.04 0.87 0.00 0.00 0.00 179.25 180.58 1vdk h LYS 174 N 0.62 1.03 -0.84 0.00 1.79 -0.92 -1.81 116.57 116.45 1vdk h LYS 174 Ca 0.11 -0.30 -0.02 0.00 -2.18 0.00 0.00 60.65 58.26 1vdk h LYS 174 Cb 0.60 -0.11 -0.04 0.00 -1.58 0.00 0.00 32.23 31.11 1vdk h LYS 174 CO 0.04 0.99 0.44 0.00 -1.08 0.00 0.00 179.45 179.84 1vdk h ALA 175 N 1.07 1.08 -0.31 3.86 0.00 -0.73 -1.33 119.26 122.90 1vdk h ALA 175 Ca 0.18 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1vdk h ALA 175 Cb 0.50 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1vdk h ALA 175 CO 0.02 0.61 -0.06 1.96 0.00 0.00 0.00 179.25 181.78 1vdk h GLN 176 N 1.18 0.59 0.00 0.00 4.20 -1.21 -1.80 115.11 118.06 1vdk h GLN 176 Ca 0.29 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.74 1vdk h GLN 176 Cb 0.06 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.80 1vdk h GLN 176 CO -0.04 0.77 -0.19 0.00 -0.67 0.00 0.00 178.83 178.69 1vdk h ALA 177 N 0.80 1.66 -0.23 3.87 0.00 -1.02 -3.02 119.26 121.32 1vdk h ALA 177 Ca 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1vdk h ALA 177 Cb 0.55 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1vdk h ALA 177 CO 0.03 0.24 -0.00 1.19 0.00 0.00 0.00 179.25 180.71 1vdk n PHE 178 N -4.28 0.84 0.93 0.00 3.72 -0.53 -4.66 117.46 113.48 1vdk n PHE 178 Ca -0.02 -0.92 0.10 0.00 -0.05 0.00 0.00 57.45 56.55 1vdk n PHE 178 Cb 0.26 -0.30 0.50 0.00 -0.94 0.00 0.00 39.48 38.99 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 -0.65 0.00 -0.76 4.37 2.03 -0.69 -1.73 116.55 119.12 1vdk n ASP 179 Ca 0.21 0.05 0.09 0.00 0.52 0.00 0.00 54.79 55.66 1vdk n ASP 179 Cb 0.87 -0.31 0.11 0.00 -0.72 0.00 0.00 41.12 41.08 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 1.74 -3.14 -0.67 1.13 -1.26 -4.73 117.38 109.14 1vdk n GLN 180 Ca 0.09 -1.73 -0.44 0.00 -1.94 0.00 0.00 57.00 52.99 1vdk n GLN 180 Cb 0.17 -1.35 -0.06 0.00 0.11 0.00 0.00 30.24 29.11 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 -1.33 4.85 0.16 5.09 1.01 -1.03 -5.03 121.20 124.93 1vdk s ILE 181 Ca 0.24 -0.47 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 1vdk s ILE 181 Cb 0.15 -4.31 -0.07 0.00 0.01 0.00 0.00 42.46 38.24 1vdk s ILE 181 CO 0.22 -0.83 0.96 -0.69 0.00 0.00 0.00 174.94 174.61 1vdk s VAL 182 N 2.69 4.30 0.29 2.92 1.01 -1.26 -0.61 120.40 129.74 1vdk s VAL 182 Ca 0.16 2.05 -0.01 0.00 0.00 0.00 0.00 61.98 64.18 1vdk s VAL 182 Cb -0.19 -4.31 -0.02 0.00 0.00 0.00 0.00 36.38 31.86 1vdk s VAL 182 CO 0.12 0.38 0.34 -1.59 0.00 0.00 0.00 175.10 174.36 1vdk s LYS 183 N -0.48 1.64 -0.08 2.72 -2.85 0.24 -4.80 119.74 116.13 1vdk s LYS 183 Ca 0.45 -1.71 -0.26 0.00 -1.00 0.00 0.00 55.97 53.45 1vdk s LYS 183 Cb -0.25 0.37 -0.03 0.00 -2.06 0.00 0.00 37.83 35.87 1vdk s LYS 183 CO 0.31 -0.63 0.82 0.08 0.10 0.00 0.00 175.35 176.03 1vdk s VAL 184 N -3.57 4.94 0.56 1.79 1.01 -1.26 -0.55 120.40 123.31 1vdk s VAL 184 Ca 0.34 1.68 -0.08 0.00 0.00 0.00 0.00 61.98 63.92 1vdk s VAL 184 Cb 0.02 -4.15 -0.03 0.00 0.00 0.00 0.00 36.38 32.21 1vdk s VAL 184 CO 0.18 0.15 0.92 -0.83 0.00 0.00 0.00 175.10 175.52 1vdk s GLY 185 N 0.97 1.58 -0.03 4.51 0.00 -0.59 -4.83 107.32 108.94 1vdk s GLY 185 Ca 0.42 -0.31 0.01 0.00 0.00 0.00 0.00 44.72 44.84 1vdk s GLY 185 CO 0.19 -0.08 -0.03 0.50 0.00 0.00 0.00 173.10 173.68 1vdk s ARG 186 N -4.99 0.63 -0.03 2.90 0.52 -1.26 -0.20 118.95 116.52 1vdk s ARG 186 Ca 0.52 -0.07 0.03 0.00 -0.52 0.00 0.00 55.73 55.68 1vdk s ARG 186 Cb -0.11 -0.68 0.01 0.00 0.52 0.00 0.00 34.95 34.69 1vdk s ARG 186 CO 0.50 -0.06 -0.10 0.95 0.02 0.00 0.00 175.30 176.60 1vdk s THR 187 N 0.77 0.88 -0.30 0.02 -4.23 -0.77 -4.65 115.64 107.36 1vdk s THR 187 Ca -0.09 -0.39 0.00 0.00 -1.18 0.00 0.00 61.69 60.02 1vdk s THR 187 Cb -0.13 -0.79 0.00 0.00 1.34 0.00 0.00 72.50 72.92 1vdk s THR 187 CO -0.00 0.28 0.00 1.41 -0.54 0.00 0.00 174.62 175.76 1vdk n HIS 188 N 3.41 0.00 -0.73 3.99 8.25 -1.26 -0.81 115.22 128.07 1vdk n HIS 188 Ca -0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.26 1vdk n HIS 188 Cb 0.53 -1.57 0.00 0.00 1.12 0.00 0.00 29.99 30.07 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 -0.32 0.00 -4.92 2.41 4.77 -1.26 -5.03 117.00 112.65 1vdk n LEU 189 Ca -0.03 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.67 1vdk n LEU 189 Cb 0.36 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.42 1vdk n LEU 189 CO 0.04 0.00 0.04 -0.04 -1.33 0.00 0.00 177.39 176.11 1vdk s MET 190 N -0.15 3.55 0.07 3.23 -1.94 0.01 -5.02 119.30 119.06 1vdk s MET 190 Ca 0.00 -0.24 -0.35 0.00 -1.71 0.00 0.00 55.69 53.38 1vdk s MET 190 Cb 0.00 -2.82 -0.14 0.00 2.01 0.00 0.00 34.83 33.87 1vdk s MET 190 CO 0.00 0.40 1.57 -0.25 -0.01 0.00 0.00 175.02 176.73 1vdk n ASP 191 N -0.51 2.72 -0.34 3.03 9.92 -1.26 -1.85 116.55 128.26 1vdk n ASP 191 Ca -0.04 1.08 0.00 0.00 -0.53 0.00 0.00 54.79 55.30 1vdk n ASP 191 Cb 0.53 -1.34 0.00 0.00 -0.64 0.00 0.00 41.12 39.68 1vdk n ASP 191 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1vdk n ALA 192 N 3.80 0.00 -1.58 2.24 0.00 0.72 -4.81 120.51 120.88 1vdk n ALA 192 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.31 1vdk n ALA 192 Cb 0.25 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.74 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 0.16 3.88 0.66 0.00 -7.23 -1.26 -4.16 120.40 112.45 1vdk s VAL 193 Ca 0.00 0.72 -0.17 0.00 -1.81 0.00 0.00 61.98 60.71 1vdk s VAL 193 Cb 0.00 -3.35 -0.00 0.00 0.56 0.00 0.00 36.38 33.59 1vdk s VAL 193 CO 0.00 -0.69 1.23 -2.65 -0.31 0.00 0.00 175.10 172.68 1vdk n PRO 194 N -2.73 0.97 -4.01 4.82 -0.02 -1.26 -1.54 135.00 131.23 1vdk n PRO 194 Ca 0.08 0.39 -0.14 0.00 -2.02 0.00 0.00 63.50 61.81 1vdk n PRO 194 Cb 0.53 -2.47 -0.02 0.00 -0.02 0.00 0.00 33.50 31.52 1vdk n PRO 194 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 1vdk s ILE 195 N -1.49 0.00 0.22 4.25 -4.36 0.28 -4.25 121.20 115.85 1vdk s ILE 195 Ca 0.81 -1.44 0.08 0.00 -0.26 0.00 0.00 60.65 59.84 1vdk s ILE 195 Cb -0.37 -2.74 -0.04 0.00 1.25 0.00 0.00 42.46 40.55 1vdk s ILE 195 CO 0.42 0.00 0.04 0.42 0.24 0.00 0.00 174.94 176.06 1vdk s THR 196 N -2.75 3.79 0.40 8.37 -4.23 -1.26 0.82 115.64 120.78 1vdk s THR 196 Ca 0.27 -1.57 0.14 0.00 -1.18 0.00 0.00 61.69 59.34 1vdk s THR 196 Cb -0.02 -2.97 0.13 0.00 1.34 0.00 0.00 72.50 70.98 1vdk s THR 196 CO 0.19 -0.24 1.90 0.25 -0.54 0.00 0.00 174.62 176.17 1vdk h LEU 197 N 2.21 0.00 -0.85 4.79 5.85 -0.93 -2.39 115.31 123.99 1vdk h LEU 197 Ca -0.46 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.17 1vdk h LEU 197 Cb 1.22 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.24 1vdk h LEU 197 CO 0.59 0.29 -0.10 1.23 -0.34 0.00 0.00 178.44 180.12 1vdk h GLY 198 N 0.88 0.82 1.14 3.75 0.00 -1.51 -1.32 103.07 106.83 1vdk h GLY 198 Ca -0.00 -0.60 -0.14 0.00 0.00 0.00 0.00 47.33 46.58 1vdk h GLY 198 CO 0.04 0.55 -0.29 1.46 0.00 0.00 0.00 176.54 178.30 1vdk h GLN 199 N 0.69 0.96 0.09 4.80 4.20 -1.72 0.11 115.11 124.24 1vdk h GLN 199 Ca 0.12 -0.45 -0.00 0.00 0.06 0.00 0.00 58.65 58.37 1vdk h GLN 199 Cb 0.56 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1vdk h GLN 199 CO 0.03 1.12 -0.04 1.49 -0.67 0.00 0.00 178.83 180.76 1vdk h GLU 200 N 0.81 -0.12 -0.33 1.46 4.81 -1.26 -1.55 114.58 118.39 1vdk h GLU 200 Ca 0.09 0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.26 1vdk h GLU 200 Cb 0.88 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 1vdk h GLU 200 CO 0.08 0.12 -0.05 0.82 -0.73 0.00 0.00 179.01 179.24 1vdk h ILE 201 N -0.35 1.22 -0.33 2.32 2.04 -1.27 -2.09 117.51 119.05 1vdk h ILE 201 Ca -0.01 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 1vdk h ILE 201 Cb 0.29 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 1vdk h ILE 201 CO 0.02 0.31 0.09 1.23 0.00 0.00 0.00 178.15 179.80 1vdk h GLY 202 N 0.89 0.51 1.81 5.37 0.00 -0.75 -1.71 103.07 109.18 1vdk h GLY 202 Ca 0.10 -0.25 -0.06 0.00 0.00 0.00 0.00 47.33 47.12 1vdk h GLY 202 CO 0.02 0.24 -0.20 1.48 0.00 0.00 0.00 176.54 178.08 1vdk h SER 203 N 0.47 0.22 -0.25 0.19 4.64 -0.56 -0.93 113.55 117.34 1vdk h SER 203 Ca 0.11 -0.06 -0.03 0.00 -0.47 0.00 0.00 61.79 61.34 1vdk h SER 203 Cb 0.16 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.18 1vdk h SER 203 CO -0.01 0.44 0.03 -0.50 -0.87 0.00 0.00 176.83 175.92 1vdk h TRP 204 N 0.22 0.45 -0.86 4.77 6.55 -1.27 -1.38 115.95 124.43 1vdk h TRP 204 Ca 0.04 -0.07 0.03 0.00 0.95 0.00 0.00 58.89 59.84 1vdk h TRP 204 Cb 0.48 -0.12 -0.05 0.00 -0.86 0.00 0.00 29.16 28.61 1vdk h TRP 204 CO 0.01 0.55 0.56 0.00 -1.05 0.00 0.00 178.44 178.51 1vdk h ALA 205 N 0.84 1.11 -0.66 1.49 0.00 -1.13 -2.34 119.26 118.57 1vdk h ALA 205 Ca 0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1vdk h ALA 205 Cb 0.35 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1vdk h ALA 205 CO 0.01 0.42 0.29 0.00 0.00 0.00 0.00 179.25 179.97 1vdk h ALA 206 N 1.34 0.85 -0.95 0.00 0.00 -0.90 -1.08 119.26 118.53 1vdk h ALA 206 Ca 0.33 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1vdk h ALA 206 Cb -0.04 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.45 1vdk h ALA 206 CO -0.10 0.45 0.60 1.96 0.00 0.00 0.00 179.25 182.16 1vdk h GLN 207 N 0.92 1.27 -0.28 0.00 4.20 -0.79 0.18 115.11 120.61 1vdk h GLN 207 Ca 0.22 -0.10 -0.15 0.00 0.06 0.00 0.00 58.65 58.69 1vdk h GLN 207 Cb 0.17 -0.28 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1vdk h GLN 207 CO -0.02 0.86 -0.43 -0.07 -0.67 0.00 0.00 178.83 178.50 1vdk h LEU 208 N 1.30 0.75 -0.40 1.46 3.38 -1.05 -0.88 115.31 119.87 1vdk h LEU 208 Ca 0.34 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1vdk h LEU 208 Cb -0.10 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.42 1vdk h LEU 208 CO -0.07 1.08 0.10 0.11 0.09 0.00 0.00 178.44 179.75 1vdk h LYS 209 N 0.56 0.64 -0.14 1.13 1.57 -0.64 0.69 116.57 120.38 1vdk h LYS 209 Ca 0.04 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1vdk h LYS 209 Cb 0.97 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.19 1vdk h LYS 209 CO 0.09 0.66 0.05 1.15 -0.57 0.00 0.00 179.45 180.84 1vdk h THR 210 N 0.51 1.16 -0.14 -0.16 2.02 -0.87 -1.39 112.91 114.03 1vdk h THR 210 Ca 0.13 -0.48 -0.18 0.00 0.77 0.00 0.00 66.41 66.65 1vdk h THR 210 Cb 0.31 1.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1vdk h THR 210 CO 0.00 0.15 -0.64 0.71 0.37 0.00 0.00 175.52 176.10 1vdk h THR 211 N 0.06 1.34 -0.43 3.16 1.35 -1.12 -2.83 112.91 114.43 1vdk h THR 211 Ca 0.05 -1.95 -0.07 0.00 -0.55 0.00 0.00 66.41 63.89 1vdk h THR 211 Cb 0.18 1.93 -0.02 0.00 -1.73 0.00 0.00 68.15 68.51 1vdk h THR 211 CO -0.00 0.60 -0.02 0.25 -0.25 0.00 0.00 175.52 176.09 1vdk h LEU 212 N 0.38 0.69 -0.85 3.87 5.85 -0.84 -2.09 115.31 122.33 1vdk h LEU 212 Ca -0.01 -0.17 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 1vdk h LEU 212 Cb 1.21 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 42.02 1vdk h LEU 212 CO 0.12 0.77 0.50 0.00 -0.34 0.00 0.00 178.44 179.50 1vdk h ALA 213 N 1.30 1.08 -0.47 1.25 0.00 -1.11 -1.36 119.26 119.95 1vdk h ALA 213 Ca 0.13 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1vdk h ALA 213 Cb 0.45 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1vdk h ALA 213 CO 0.02 0.55 -0.15 0.00 0.00 0.00 0.00 179.25 179.67 1vdk h ALA 214 N 1.27 0.85 -0.66 0.00 0.00 -1.22 -1.56 119.26 117.95 1vdk h ALA 214 Ca 0.30 -0.35 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1vdk h ALA 214 Cb -0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 1vdk h ALA 214 CO -0.06 0.64 0.27 0.28 0.00 0.00 0.00 179.25 180.39 1vdk h VAL 215 N 0.79 1.24 0.00 0.00 2.07 -0.91 -0.67 116.25 118.76 1vdk h VAL 215 Ca 0.12 -0.72 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1vdk h VAL 215 Cb 0.68 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 1vdk h VAL 215 CO 0.05 0.29 -0.30 0.11 0.02 0.00 0.00 177.57 177.74 1vdk h LYS 216 N 0.92 0.00 -0.05 1.57 1.57 -0.99 -0.20 116.57 119.40 1vdk h LYS 216 Ca 0.22 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.85 1vdk h LYS 216 Cb 0.19 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.51 1vdk h LYS 216 CO -0.02 0.30 -0.57 1.49 -0.57 0.00 0.00 179.45 180.08 1vdk h GLU 217 N 0.00 0.47 0.00 3.15 4.57 -0.75 -3.13 114.58 118.89 1vdk h GLU 217 Ca -0.00 -0.44 -0.05 0.00 -1.18 0.00 0.00 59.36 57.69 1vdk h GLU 217 Cb 0.56 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.26 1vdk h GLU 217 CO 0.04 1.08 -0.23 0.52 -1.18 0.00 0.00 179.01 179.25 1vdk h MET 218 N 0.01 0.00 -0.68 1.92 2.86 -0.88 -2.48 114.93 115.68 1vdk h MET 218 Ca -0.06 0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.73 1vdk h MET 218 Cb 1.25 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.87 1vdk h MET 218 CO 0.11 0.23 0.46 1.49 1.06 0.00 0.00 176.91 180.26 1vdk h GLU 219 N 0.00 0.27 -0.09 1.72 4.81 -0.98 -1.57 114.58 118.75 1vdk h GLU 219 Ca -0.00 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 1vdk h GLU 219 Cb 0.43 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.74 1vdk h GLU 219 CO 0.03 0.18 0.09 0.87 -0.73 0.00 0.00 179.01 179.45 1vdk h LYS 220 N 0.28 0.00 0.00 1.92 1.57 -1.52 -0.74 116.57 118.08 1vdk h LYS 220 Ca 0.33 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.07 1vdk h LYS 220 Cb 0.89 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1vdk h LYS 220 CO -0.08 0.00 -0.21 0.78 -0.57 0.00 0.00 179.45 179.37 1vdk h GLY 221 N 0.00 0.00 2.00 3.86 0.00 -1.47 -2.28 103.07 105.18 1vdk h GLY 221 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 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 -3.60 0.41 0.23 3.11 4.77 -0.28 -2.71 117.00 118.92 1vdk n LEU 222 Ca -0.01 0.58 0.15 0.00 -0.03 0.00 0.00 56.01 56.70 1vdk n LEU 222 Cb 0.34 -0.50 0.59 0.00 -2.33 0.00 0.00 43.42 41.53 1vdk n LEU 222 CO 0.33 -0.32 0.94 1.88 -1.33 0.00 0.00 177.39 178.89 1vdk h TYR 223 N 0.00 0.00 -3.61 -1.77 0.99 -1.51 -3.41 116.97 107.66 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 0.42 0.00 -0.14 0.00 1.00 0.00 0.00 36.73 38.02 1vdk h TYR 223 CO 0.00 0.00 0.29 -0.80 -0.00 0.00 0.00 178.16 177.65 1vdk s ASN 224 N -5.30 6.39 0.14 3.88 0.01 -1.10 -0.64 114.94 118.31 1vdk s ASN 224 Ca 0.03 -0.15 0.02 0.00 -0.71 0.00 0.00 52.86 52.05 1vdk s ASN 224 Cb 0.09 -2.37 -0.04 0.00 0.41 0.00 0.00 41.25 39.35 1vdk s ASN 224 CO 0.51 -0.86 0.27 -0.76 -1.51 0.00 0.00 177.10 174.75 1vdk s LEU 225 N 3.14 4.33 0.21 0.60 1.43 0.87 -4.64 118.68 124.61 1vdk s LEU 225 Ca 0.28 0.17 0.25 0.00 -1.03 0.00 0.00 54.13 53.80 1vdk s LEU 225 Cb -0.13 -2.90 0.55 0.00 0.03 0.00 0.00 46.19 43.73 1vdk s LEU 225 CO 0.21 0.06 1.56 0.00 0.23 0.00 0.00 176.35 178.42 1vdk h ALA 226 N 2.25 0.83 -1.33 4.21 0.00 -1.85 0.14 119.26 123.50 1vdk h ALA 226 Ca -0.48 0.00 -0.75 0.00 0.00 0.00 0.00 54.91 53.68 1vdk h ALA 226 Cb 1.19 0.00 0.05 0.00 0.00 0.00 0.00 17.79 19.03 1vdk h ALA 226 CO 0.69 0.00 0.34 1.51 0.00 0.00 0.00 179.25 181.79 1vdk n ILE 227 N -2.35 0.02 0.00 0.00 0.13 -1.25 -1.87 119.36 114.04 1vdk n ILE 227 Ca 0.04 -0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.69 1vdk n ILE 227 Cb 0.45 -0.48 0.00 0.00 -0.84 0.00 0.00 39.64 38.77 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 2.32 1.74 0.01 4.50 0.00 -1.26 -4.61 105.19 107.89 1vdk n GLY 228 Ca 0.21 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.36 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 -1.71 -1.40 7.00 -0.02 0.00 -0.78 -3.81 105.19 104.46 1vdk n GLY 229 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.44 0.00 0.01 2.61 -2.24 -1.26 -0.48 114.28 111.47 1vdk n THR 230 Ca 0.08 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.76 1vdk n THR 230 Cb 0.32 0.00 -0.05 0.00 -2.10 0.00 0.00 70.33 68.50 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 -0.40 0.05 0.00 6.98 0.00 -1.92 -3.30 119.26 120.68 1vdk h ALA 231 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1vdk h ALA 231 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1vdk h ALA 231 CO 0.00 -0.49 0.00 1.33 0.00 0.00 0.00 179.25 180.09 1vdk n VAL 232 N -5.14 0.00 0.00 0.00 0.24 -1.24 -4.87 118.33 107.33 1vdk n VAL 232 Ca -0.05 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.90 1vdk n VAL 232 Cb 0.07 1.12 0.00 0.00 -1.47 0.00 0.00 33.84 33.56 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 0.43 1.50 0.22 7.63 0.00 0.36 -4.61 105.19 110.73 1vdk n GLY 233 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 0.13 0.00 2.61 1.35 -1.86 -3.41 112.91 111.72 1vdk h THR 234 Ca 0.00 -1.03 0.00 0.00 -0.55 0.00 0.00 66.41 64.83 1vdk h THR 234 Cb 0.00 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1vdk h THR 234 CO 0.00 0.07 0.00 0.61 -0.25 0.00 0.00 175.52 175.95 1vdk n GLY 235 N 0.82 0.59 3.71 5.82 0.00 -0.96 -4.99 105.19 110.17 1vdk n GLY 235 Ca 0.03 -0.07 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 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 3.77 0.00 0.99 7.94 -1.26 -1.67 117.00 126.78 1vdk n LEU 236 Ca 0.00 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 56.00 1vdk n LEU 236 Cb 0.00 -1.53 0.00 0.00 0.53 0.00 0.00 43.42 42.42 1vdk n LEU 236 CO 0.00 -0.03 0.00 0.59 -1.11 0.00 0.00 177.39 176.84 1vdk n ASN 237 N 3.03 0.00 -4.76 1.96 3.02 -1.26 -4.68 115.26 112.57 1vdk n ASN 237 Ca 0.13 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.37 1vdk n ASN 237 Cb 0.34 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.44 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 -3.21 3.51 0.37 5.41 0.00 -0.67 -4.03 121.76 123.14 1vdk s ALA 238 Ca 0.00 -0.98 -0.27 0.00 0.00 0.00 0.00 51.96 50.71 1vdk s ALA 238 Cb 0.00 -1.44 -0.09 0.00 0.00 0.00 0.00 23.12 21.59 1vdk s ALA 238 CO 0.00 0.72 1.29 -1.58 0.00 0.00 0.00 175.76 176.19 1vdk s HIS 239 N -1.30 2.95 0.57 0.00 2.46 -1.26 -4.89 115.29 113.82 1vdk s HIS 239 Ca 0.26 1.43 0.30 0.00 0.47 0.00 0.00 55.06 57.53 1vdk s HIS 239 Cb -0.12 -3.64 1.44 0.00 -0.13 0.00 0.00 32.58 30.14 1vdk s HIS 239 CO 0.18 -1.89 1.84 -1.00 -2.47 0.00 0.00 174.74 171.41 1vdk h PRO 240 N 2.96 0.00 -0.14 2.88 0.13 -1.98 -0.69 132.00 135.15 1vdk h PRO 240 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1vdk h PRO 240 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1vdk h PRO 240 CO 0.64 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.95 1vdk n ARG 241 N -3.86 1.76 0.21 0.86 1.74 -1.26 -4.69 116.66 111.42 1vdk n ARG 241 Ca 0.13 -1.74 -0.15 0.00 -0.77 0.00 0.00 57.85 55.32 1vdk n ARG 241 Cb 0.86 -1.36 -0.08 0.00 -1.02 0.00 0.00 32.46 30.86 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 3.39 -0.95 -0.52 -1.55 3.04 -1.48 -1.72 116.94 117.15 1vdk h PHE 242 Ca 0.00 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.00 1vdk h PHE 242 Cb 0.76 0.37 -0.05 0.00 2.56 0.00 0.00 35.95 39.60 1vdk h PHE 242 CO 0.08 -0.49 0.26 0.78 -2.02 0.00 0.00 178.31 176.93 1vdk h GLY 243 N -0.72 0.74 0.68 2.40 0.00 -1.82 -1.09 103.07 103.26 1vdk h GLY 243 Ca -0.02 -0.18 0.04 0.00 0.00 0.00 0.00 47.33 47.17 1vdk h GLY 243 CO -0.07 0.11 0.08 -2.09 0.00 0.00 0.00 176.54 174.57 1vdk h GLU 244 N 0.51 0.19 -0.53 4.80 4.81 -1.82 -1.57 114.58 120.97 1vdk h GLU 244 Ca 0.23 -0.01 -0.11 0.00 -0.13 0.00 0.00 59.36 59.34 1vdk h GLU 244 Cb 0.15 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 1vdk h GLU 244 CO -0.17 0.13 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.08 1vdk h LEU 245 N 0.20 0.99 -0.44 1.64 3.38 -1.01 -2.12 115.31 117.95 1vdk h LEU 245 Ca 0.14 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1vdk h LEU 245 Cb 0.14 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1vdk h LEU 245 CO -0.17 1.11 0.29 0.58 0.09 0.00 0.00 178.44 180.34 1vdk h VAL 246 N 0.86 1.11 -0.90 1.22 2.07 -0.89 0.48 116.25 120.20 1vdk h VAL 246 Ca 0.14 -0.21 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1vdk h VAL 246 Cb 0.65 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 1vdk h VAL 246 CO 0.05 0.11 0.50 0.00 0.02 0.00 0.00 177.57 178.24 1vdk h ALA 247 N 1.16 1.15 -0.31 1.67 0.00 -1.23 0.03 119.26 121.73 1vdk h ALA 247 Ca 0.16 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1vdk h ALA 247 Cb -0.07 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 1vdk h ALA 247 CO -0.04 0.65 0.19 -0.22 0.00 0.00 0.00 179.25 179.83 1vdk h LYS 248 N 1.26 0.43 -0.40 0.00 3.64 -0.67 -0.94 116.57 119.88 1vdk h LYS 248 Ca 0.32 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.57 1vdk h LYS 248 Cb 0.02 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 1vdk h LYS 248 CO -0.05 0.33 -0.13 1.88 -2.27 0.00 0.00 179.45 179.21 1vdk h TYR 249 N 0.40 0.78 -0.47 1.91 0.99 -0.51 -1.42 116.97 118.65 1vdk h TYR 249 Ca 0.11 -0.14 -0.09 0.00 2.00 0.00 0.00 58.73 60.61 1vdk h TYR 249 Cb 0.02 -0.20 -0.02 0.00 1.00 0.00 0.00 36.73 37.52 1vdk h TYR 249 CO -0.04 0.80 -0.07 -0.07 -0.00 0.00 0.00 178.16 178.79 1vdk h LEU 250 N 0.65 0.82 -0.65 3.88 3.38 -0.74 -0.15 115.31 122.49 1vdk h LEU 250 Ca 0.11 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.78 1vdk h LEU 250 Cb 0.59 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1vdk h LEU 250 CO 0.04 0.92 0.13 0.00 0.09 0.00 0.00 178.44 179.62 1vdk h ALA 251 N 1.16 0.87 -0.37 1.53 0.00 -0.79 -0.27 119.26 121.39 1vdk h ALA 251 Ca 0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1vdk h ALA 251 Cb 0.55 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1vdk h ALA 251 CO 0.03 0.61 0.15 0.93 0.00 0.00 0.00 179.25 180.98 1vdk h GLU 252 N 0.99 0.55 -0.38 0.00 5.08 -0.88 0.61 114.58 120.56 1vdk h GLU 252 Ca 0.20 -0.10 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1vdk h GLU 252 Cb 0.41 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1vdk h GLU 252 CO 0.01 0.53 0.14 1.49 -1.00 0.00 0.00 179.01 180.18 1vdk h GLU 253 N 0.46 0.57 0.00 2.33 4.57 -0.77 -3.34 114.58 118.40 1vdk h GLU 253 Ca 0.12 -0.11 -0.18 0.00 -1.18 0.00 0.00 59.36 58.02 1vdk h GLU 253 Cb 0.18 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.65 1vdk h GLU 253 CO -0.01 0.55 -1.64 0.25 -1.18 0.00 0.00 179.01 176.98 1vdk n THR 254 N -4.66 1.07 -0.58 0.32 -2.24 -0.13 -4.98 114.28 103.08 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 0.15 -0.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 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 1.43 0.76 3.74 3.38 0.00 0.20 -5.04 105.19 109.66 1vdk n GLY 255 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 3.71 -1.08 0.99 1.43 -1.23 -5.03 118.68 117.46 1vdk s LEU 256 Ca 0.00 0.05 -0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1vdk s LEU 256 Cb 0.00 -2.18 -0.07 0.00 0.03 0.00 0.00 46.19 43.97 1vdk s LEU 256 CO 0.00 0.26 2.43 -0.81 0.23 0.00 0.00 176.35 178.46 1vdk n PRO 257 N 1.17 2.57 -2.15 1.29 -0.04 -1.26 -4.18 135.00 132.39 1vdk n PRO 257 Ca -0.13 -1.65 -0.40 0.00 -0.04 0.00 0.00 63.50 61.28 1vdk n PRO 257 Cb 0.53 -2.52 -0.02 0.00 -0.04 0.00 0.00 33.50 31.44 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 2.88 3.05 0.11 0.54 0.08 -1.26 -4.86 117.98 118.53 1vdk s PHE 258 Ca 0.50 1.45 -0.08 0.00 0.12 0.00 0.00 56.93 58.92 1vdk s PHE 258 Cb 0.14 -3.62 -0.00 0.00 -0.57 0.00 0.00 43.02 38.96 1vdk s PHE 258 CO -0.04 -1.74 0.21 1.03 -0.10 0.00 0.00 175.22 174.59 1vdk s ARG 259 N -1.89 0.94 0.25 0.44 0.52 0.18 -4.51 118.95 114.88 1vdk s ARG 259 Ca 0.51 -1.04 -0.30 0.00 -0.52 0.00 0.00 55.73 54.38 1vdk s ARG 259 Cb -0.38 0.35 -0.09 0.00 0.52 0.00 0.00 34.95 35.35 1vdk s ARG 259 CO 0.50 -0.31 1.10 0.08 0.02 0.00 0.00 175.30 176.69 1vdk s VAL 260 N -3.90 3.58 0.53 3.52 1.01 -1.26 -0.09 120.40 123.79 1vdk s VAL 260 Ca 0.09 1.52 -0.22 0.00 0.00 0.00 0.00 61.98 63.37 1vdk s VAL 260 Cb 0.04 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 1vdk s VAL 260 CO -0.07 0.33 1.36 0.00 0.00 0.00 0.00 175.10 176.72 1vdk n ALA 261 N 1.54 1.62 -0.16 5.51 0.00 0.50 -4.66 120.51 124.85 1vdk n ALA 261 Ca 0.00 0.14 -0.04 0.00 0.00 0.00 0.00 53.44 53.54 1vdk n ALA 261 Cb 0.45 -2.36 0.05 0.00 0.00 0.00 0.00 19.45 17.60 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 1.53 0.46 -4.65 0.00 4.81 -1.93 -3.35 114.58 111.45 1vdk h GLU 262 Ca -0.51 -0.03 -0.70 0.00 -0.13 0.00 0.00 59.36 58.00 1vdk h GLU 262 Cb 1.30 -0.10 -0.30 0.00 0.63 0.00 0.00 28.75 30.27 1vdk h GLU 262 CO 0.57 0.31 -0.61 1.21 -0.73 0.00 0.00 179.01 179.77 1vdk s ASN 263 N -5.48 5.25 0.36 1.04 3.84 -1.26 -4.97 114.94 113.72 1vdk s ASN 263 Ca -0.13 -1.32 0.12 0.00 0.21 0.00 0.00 52.86 51.74 1vdk s ASN 263 Cb 0.14 -1.84 0.69 0.00 -0.55 0.00 0.00 41.25 39.69 1vdk s ASN 263 CO 0.73 -0.36 1.81 0.03 -2.79 0.00 0.00 177.10 176.52 1vdk h ARG 264 N 8.17 0.03 -0.18 0.43 3.08 -1.86 -3.00 114.38 121.05 1vdk h ARG 264 Ca -0.21 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.80 1vdk h ARG 264 Cb 1.07 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.11 1vdk h ARG 264 CO 0.62 0.40 -0.00 0.74 -1.07 0.00 0.00 179.97 180.66 1vdk h PHE 265 N 0.03 0.34 0.00 3.04 0.04 -1.81 -2.75 116.94 115.82 1vdk h PHE 265 Ca 0.00 -0.06 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 1vdk h PHE 265 Cb 0.67 -0.09 -0.00 0.00 2.20 0.00 0.00 35.95 38.73 1vdk h PHE 265 CO 0.00 0.52 -0.10 0.00 -0.60 0.00 0.00 178.31 178.13 1vdk h ALA 266 N 0.78 1.09 0.00 2.45 0.00 -1.92 -0.97 119.26 120.68 1vdk h ALA 266 Ca 0.05 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1vdk h ALA 266 Cb 0.38 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1vdk h ALA 266 CO 0.01 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.38 1vdk h ALA 267 N 1.90 1.00 0.00 0.00 0.00 -1.35 -2.58 119.26 118.24 1vdk h ALA 267 Ca -0.00 0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.61 1vdk h ALA 267 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 1vdk h ALA 267 CO 0.01 0.00 -2.13 1.28 0.00 0.00 0.00 179.25 178.42 1vdk n LEU 268 N -2.37 2.00 0.02 0.00 4.77 -0.74 -4.54 117.00 116.14 1vdk n LEU 268 Ca 0.03 -0.07 0.13 0.00 -0.03 0.00 0.00 56.01 56.07 1vdk n LEU 268 Cb 0.32 -0.34 0.54 0.00 -2.33 0.00 0.00 43.42 41.61 1vdk n LEU 268 CO 0.25 0.69 0.92 0.00 -1.33 0.00 0.00 177.39 177.92 1vdk n ALA 269 N -2.92 2.24 -3.76 -1.18 0.00 -0.44 -1.61 120.51 112.83 1vdk n ALA 269 Ca -0.32 -0.07 -0.07 0.00 0.00 0.00 0.00 53.44 52.97 1vdk n ALA 269 Cb 0.92 -1.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 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 -3.03 -1.37 -0.33 0.00 0.00 -0.97 -3.81 121.76 112.25 1vdk s ALA 270 Ca 0.12 -0.07 0.17 0.00 0.00 0.00 0.00 51.96 52.18 1vdk s ALA 270 Cb 0.17 0.81 0.44 0.00 0.00 0.00 0.00 23.12 24.54 1vdk s ALA 270 CO 0.51 -0.98 0.95 0.72 0.00 0.00 0.00 175.76 176.96 1vdk n HIS 271 N -0.44 0.81 0.16 0.00 -0.00 -1.26 -4.48 115.22 110.01 1vdk n HIS 271 Ca -0.07 -2.86 0.13 0.00 -0.00 0.00 0.00 57.72 54.92 1vdk n HIS 271 Cb 0.60 -0.26 0.66 0.00 -0.00 0.00 0.00 29.99 30.99 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 2.95 0.00 -0.61 0.41 3.32 -1.91 -1.06 116.42 119.52 1vdk h ASP 272 Ca -0.09 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.89 1vdk h ASP 272 Cb 1.16 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.69 1vdk h ASP 272 CO 0.47 0.00 0.11 -0.33 -1.72 0.00 0.00 179.24 177.76 1vdk h GLU 273 N 0.00 1.00 -0.52 3.56 3.07 -1.91 -1.31 114.58 118.46 1vdk h GLU 273 Ca 0.10 -0.26 -0.12 0.00 -0.50 0.00 0.00 59.36 58.57 1vdk h GLU 273 Cb 0.39 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 1vdk h GLU 273 CO -0.00 0.94 -0.15 1.25 -1.40 0.00 0.00 179.01 179.65 1vdk h LEU 274 N 0.91 1.01 -0.70 1.33 5.85 -1.58 -2.13 115.31 120.00 1vdk h LEU 274 Ca 0.18 -0.35 0.04 0.00 0.84 0.00 0.00 57.88 58.59 1vdk h LEU 274 Cb 0.42 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.12 1vdk h LEU 274 CO 0.01 1.14 0.43 0.58 -0.34 0.00 0.00 178.44 180.27 1vdk h VAL 275 N 0.88 1.07 -0.04 1.05 2.07 -1.02 -1.23 116.25 119.04 1vdk h VAL 275 Ca 0.13 -0.29 -0.11 0.00 0.82 0.00 0.00 66.70 67.25 1vdk h VAL 275 Cb 0.71 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1vdk h VAL 275 CO 0.05 0.15 -0.49 0.78 0.02 0.00 0.00 177.57 178.08 1vdk h ASN 276 N 0.83 0.11 -0.25 0.57 2.35 -1.04 -0.10 115.58 118.05 1vdk h ASN 276 Ca 0.29 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.94 1vdk h ASN 276 Cb 0.05 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1vdk h ASN 276 CO -0.12 0.59 -0.01 0.58 -1.65 0.00 0.00 177.43 176.82 1vdk h VAL 277 N 0.08 1.26 -0.83 2.81 2.07 -0.90 -1.50 116.25 119.25 1vdk h VAL 277 Ca 0.00 -0.92 -0.03 0.00 0.82 0.00 0.00 66.70 66.57 1vdk h VAL 277 Cb 0.91 1.37 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 1vdk h VAL 277 CO 0.07 0.29 0.41 -0.03 0.02 0.00 0.00 177.57 178.33 1vdk h MET 278 N 0.22 1.19 -0.81 1.57 1.85 -1.03 -1.30 114.93 116.62 1vdk h MET 278 Ca 0.07 -0.17 0.02 0.00 -0.61 0.00 0.00 59.70 59.01 1vdk h MET 278 Cb 0.43 -0.22 -0.04 0.00 0.43 0.00 0.00 31.60 32.20 1vdk h MET 278 CO 0.01 0.91 0.53 0.78 -0.40 0.00 0.00 176.91 178.74 1vdk h GLY 279 N 1.18 1.15 1.58 1.39 0.00 -0.77 0.11 103.07 107.71 1vdk h GLY 279 Ca 0.29 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 47.10 1vdk h GLY 279 CO -0.04 0.38 -0.27 0.00 0.00 0.00 0.00 176.54 176.61 1vdk h ALA 280 N 1.32 1.07 -0.51 3.60 0.00 -0.78 -2.37 119.26 121.58 1vdk h ALA 280 Ca 0.31 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 1vdk h ALA 280 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1vdk h ALA 280 CO -0.09 0.57 -0.02 0.82 0.00 0.00 0.00 179.25 180.53 1vdk h ILE 281 N 0.43 1.25 -0.92 0.00 2.04 -0.41 -2.19 117.51 117.72 1vdk h ILE 281 Ca 0.06 -1.08 -0.00 0.00 1.00 0.00 0.00 64.86 64.84 1vdk h ILE 281 Cb 0.70 0.89 -0.04 0.00 -0.74 0.00 0.00 36.82 37.62 1vdk h ILE 281 CO 0.05 0.38 0.56 -0.09 0.00 0.00 0.00 178.15 179.06 1vdk h ARG 282 N 0.80 1.24 -0.60 2.37 2.43 -0.52 -0.61 114.38 119.50 1vdk h ARG 282 Ca 0.15 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.13 1vdk h ARG 282 Cb 0.51 -0.26 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1vdk h ARG 282 CO 0.03 0.86 0.06 1.15 -1.51 0.00 0.00 179.97 180.55 1vdk h THR 283 N 1.26 1.26 -0.72 0.20 2.02 -1.00 -0.80 112.91 115.13 1vdk h THR 283 Ca 0.33 -1.04 -0.03 0.00 0.77 0.00 0.00 66.41 66.44 1vdk h THR 283 Cb -0.07 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.04 1vdk h THR 283 CO -0.06 0.38 0.34 0.25 0.37 0.00 0.00 175.52 176.80 1vdk h LEU 284 N 0.93 0.95 -0.87 2.58 5.85 -0.90 -1.57 115.31 122.28 1vdk h LEU 284 Ca 0.18 -0.14 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1vdk h LEU 284 Cb 0.46 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1vdk h LEU 284 CO 0.02 0.82 0.27 0.00 -0.34 0.00 0.00 178.44 179.21 1vdk h ALA 285 N 1.17 1.09 -0.85 1.25 0.00 -0.53 -1.14 119.26 120.26 1vdk h ALA 285 Ca 0.25 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1vdk h ALA 285 Cb 0.13 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1vdk h ALA 285 CO -0.03 0.63 0.48 0.78 0.00 0.00 0.00 179.25 181.11 1vdk h GLY 286 N 1.11 1.25 1.17 0.00 0.00 -0.57 -0.54 103.07 105.49 1vdk h GLY 286 Ca 0.24 -0.55 -0.10 0.00 0.00 0.00 0.00 47.33 46.93 1vdk h GLY 286 CO -0.02 0.53 -0.03 0.00 0.00 0.00 0.00 176.54 177.02 1vdk h ALA 287 N 1.35 0.89 -0.29 3.60 0.00 -0.73 -1.71 119.26 122.36 1vdk h ALA 287 Ca 0.30 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.83 1vdk h ALA 287 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1vdk h ALA 287 CO -0.05 0.65 -0.09 -0.07 0.00 0.00 0.00 179.25 179.69 1vdk h LEU 288 N 0.90 0.45 -0.21 0.00 3.38 -0.43 -0.18 115.31 119.22 1vdk h LEU 288 Ca 0.16 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1vdk h LEU 288 Cb 0.57 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1vdk h LEU 288 CO 0.03 0.59 -0.10 -0.03 0.09 0.00 0.00 178.44 179.02 1vdk h MET 289 N 0.44 0.44 -0.11 1.13 4.05 -0.76 0.22 114.93 120.34 1vdk h MET 289 Ca 0.09 -0.19 0.03 0.00 -0.28 0.00 0.00 59.70 59.34 1vdk h MET 289 Cb 0.44 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.20 1vdk h MET 289 CO 0.02 0.72 -0.05 -0.22 0.23 0.00 0.00 176.91 177.61 1vdk h LYS 290 N 0.15 -0.05 -0.08 0.39 3.11 -0.92 0.18 116.57 119.35 1vdk h LYS 290 Ca 0.05 0.00 -0.00 0.00 -2.81 0.00 0.00 60.65 57.89 1vdk h LYS 290 Cb 0.58 0.01 -0.00 0.00 -1.00 0.00 0.00 32.23 31.82 1vdk h LYS 290 CO 0.03 -0.03 0.05 0.82 -2.81 0.00 0.00 179.45 177.51 1vdk h ILE 291 N -0.05 1.07 -0.71 2.00 2.04 -1.00 -1.06 117.51 119.79 1vdk h ILE 291 Ca 0.06 -0.18 0.04 0.00 1.00 0.00 0.00 64.86 65.79 1vdk h ILE 291 Cb 0.14 1.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1vdk h ILE 291 CO -0.14 0.06 0.43 1.23 0.00 0.00 0.00 178.15 179.73 1vdk h GLY 292 N 0.06 1.04 1.07 5.37 0.00 -0.22 -0.48 103.07 109.91 1vdk h GLY 292 Ca 0.03 -0.32 -0.08 0.00 0.00 0.00 0.00 47.33 46.96 1vdk h GLY 292 CO -0.01 0.24 0.12 3.43 0.00 0.00 0.00 176.54 180.33 1vdk h ASN 293 N 0.82 1.06 -0.54 0.19 2.35 -0.43 -1.59 115.58 117.45 1vdk h ASN 293 Ca 0.30 -0.26 0.02 0.00 -0.55 0.00 0.00 56.30 55.82 1vdk h ASN 293 Cb 0.09 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.14 1vdk h ASN 293 CO -0.14 1.05 0.33 0.44 -1.65 0.00 0.00 177.43 177.46 1vdk h ASP 294 N 1.04 0.54 -0.08 5.81 5.19 -0.51 -0.70 116.42 127.71 1vdk h ASP 294 Ca 0.21 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.63 1vdk h ASP 294 Cb 0.43 -0.11 -0.01 0.00 0.18 0.00 0.00 39.33 39.81 1vdk h ASP 294 CO 0.01 0.38 -0.01 0.58 -3.12 0.00 0.00 179.24 177.08 1vdk h VAL 295 N 0.66 0.93 0.00 -1.35 2.07 -0.68 0.45 116.25 118.33 1vdk h VAL 295 Ca 0.22 -0.01 -0.11 0.00 0.82 0.00 0.00 66.70 67.62 1vdk h VAL 295 Cb 0.01 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1vdk h VAL 295 CO -0.09 0.00 -0.52 0.08 0.02 0.00 0.00 177.57 177.06 1vdk h ARG 296 N 0.02 0.00 -0.24 1.57 0.11 -1.10 -1.89 114.38 112.84 1vdk h ARG 296 Ca 0.04 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.92 1vdk h ARG 296 Cb 0.05 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.13 1vdk h ARG 296 CO -0.07 0.52 -0.61 -1.49 0.10 0.00 0.00 179.97 178.42 1vdk h TRP 297 N 0.00 1.05 -0.03 4.08 4.06 -0.88 -0.62 115.95 123.62 1vdk h TRP 297 Ca -0.01 -0.40 -0.07 0.00 2.06 0.00 0.00 58.89 60.47 1vdk h TRP 297 Cb 0.96 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 28.93 1vdk h TRP 297 CO 0.00 1.22 -0.33 -0.07 -3.56 0.00 0.00 178.44 175.71 1vdk h LEU 298 N 0.61 0.05 -1.22 -4.49 3.38 -0.77 -2.47 115.31 110.40 1vdk h LEU 298 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1vdk h LEU 298 Cb 1.22 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1vdk h LEU 298 CO 0.13 0.37 -0.04 0.00 0.09 0.00 0.00 178.44 179.00 1vdk n ALA 299 N -2.48 2.61 -1.67 1.53 0.00 -0.72 0.26 120.51 120.05 1vdk n ALA 299 Ca -0.02 -0.52 -0.37 0.00 0.00 0.00 0.00 53.44 52.52 1vdk n ALA 299 Cb 0.38 -1.04 0.06 0.00 0.00 0.00 0.00 19.45 18.85 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 0.46 1.35 0.00 0.00 3.41 -0.25 -4.53 113.62 114.07 1vdk n SER 300 Ca 0.17 0.82 0.00 0.00 -0.26 0.00 0.00 58.87 59.59 1vdk n SER 300 Cb 0.43 -1.46 0.00 0.00 -0.26 0.00 0.00 64.21 62.92 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 1.13 0.92 0.00 5.00 0.00 -1.26 -0.43 105.19 110.55 1vdk n GLY 301 Ca 0.15 -0.90 0.15 0.00 0.00 0.00 0.00 46.02 45.41 1vdk n GLY 301 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vdk n PRO 302 N 0.00 0.69 -0.08 1.61 -0.04 -1.26 -4.68 135.00 131.24 1vdk n PRO 302 Ca 0.00 0.01 -0.11 0.00 -0.04 0.00 0.00 63.50 63.35 1vdk n PRO 302 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 1vdk n PRO 302 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1vdk n TYR 303 N -1.13 0.00 -1.29 0.54 4.02 -1.26 -4.67 117.16 113.36 1vdk n TYR 303 Ca 0.18 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.99 1vdk n TYR 303 Cb 0.16 -0.65 0.21 0.00 -0.02 0.00 0.00 39.34 39.05 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 -2.97 4.53 -3.00 -0.72 0.00 -1.26 -4.96 120.51 112.12 1vdk n ALA 304 Ca -0.30 -2.89 0.00 0.00 0.00 0.00 0.00 53.44 50.26 1vdk n ALA 304 Cb 0.82 -0.98 0.00 0.00 0.00 0.00 0.00 19.45 19.29 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 -0.95 5.15 0.08 0.00 0.00 -1.26 -4.83 105.19 103.38 1vdk n GLY 305 Ca 0.40 -1.65 -0.14 0.00 0.00 0.00 0.00 46.02 44.63 1vdk n GLY 305 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1vdk h ILE 306 N 0.00 1.18 -6.36 -0.61 2.04 -1.70 -3.46 117.51 108.61 1vdk h ILE 306 Ca 0.00 -2.03 -0.48 0.00 1.00 0.00 0.00 64.86 63.35 1vdk h ILE 306 Cb 0.00 2.38 -0.05 0.00 -0.74 0.00 0.00 36.82 38.40 1vdk h ILE 306 CO 0.00 0.40 -0.79 0.61 0.00 0.00 0.00 178.15 178.37 1vdk n GLY 307 N 1.58 -0.45 0.09 5.37 0.00 0.43 -4.89 105.19 107.33 1vdk n GLY 307 Ca -0.15 0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1vdk n GLY 307 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vdk h GLU 308 N -1.96 0.00 -4.69 1.61 5.08 -0.49 -3.43 114.58 110.70 1vdk h GLU 308 Ca -0.59 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.53 1vdk h GLU 308 Cb 1.38 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.48 1vdk h GLU 308 CO 0.67 0.00 -0.69 0.96 -1.00 0.00 0.00 179.01 178.96 1vdk s ILE 309 N -3.15 0.68 0.21 3.13 -4.36 -1.05 -0.36 121.20 116.30 1vdk s ILE 309 Ca 0.08 -1.95 0.10 0.00 -0.26 0.00 0.00 60.65 58.62 1vdk s ILE 309 Cb 0.12 -1.81 -0.05 0.00 1.25 0.00 0.00 42.46 41.98 1vdk s ILE 309 CO 0.67 -0.76 -0.19 0.42 0.24 0.00 0.00 174.94 175.32 1vdk s THR 310 N -3.64 2.10 0.12 8.37 -4.23 0.93 -4.20 115.64 115.10 1vdk s THR 310 Ca 0.15 -2.12 0.03 0.00 -1.18 0.00 0.00 61.69 58.57 1vdk s THR 310 Cb 0.05 -2.06 -0.04 0.00 1.34 0.00 0.00 72.50 71.79 1vdk s THR 310 CO -0.02 -0.34 -0.07 0.27 -0.54 0.00 0.00 174.62 173.92 1vdk s ILE 311 N -2.23 0.86 0.41 2.99 -4.36 -1.26 -2.10 121.20 115.51 1vdk s ILE 311 Ca 0.22 -1.98 -0.27 0.00 -0.26 0.00 0.00 60.65 58.36 1vdk s ILE 311 Cb -0.05 -1.79 -0.09 0.00 1.25 0.00 0.00 42.46 41.77 1vdk s ILE 311 CO 0.10 -0.78 1.41 -2.84 0.24 0.00 0.00 174.94 173.06 1vdk s PRO 312 N -3.81 3.93 -0.40 0.37 0.02 -1.26 -4.99 135.00 128.85 1vdk s PRO 312 Ca 0.15 2.40 -0.14 0.00 0.02 0.00 0.00 61.00 63.42 1vdk s PRO 312 Cb 0.04 -2.81 0.02 0.00 0.02 0.00 0.00 34.50 31.78 1vdk s PRO 312 CO -0.02 -0.61 0.28 0.00 -0.33 0.00 0.00 177.00 176.32 1vdk s ALA 313 N -1.18 3.45 -0.51 -1.55 0.00 -1.26 -4.94 121.76 115.76 1vdk s ALA 313 Ca 0.57 -1.73 0.22 0.00 0.00 0.00 0.00 51.96 51.02 1vdk s ALA 313 Cb -0.43 -2.84 -0.22 0.00 0.00 0.00 0.00 23.12 19.63 1vdk s ALA 313 CO 0.57 -1.45 0.75 0.09 0.00 0.00 0.00 175.76 175.71 1vdk n ASN 314 N 5.13 0.51 -3.86 0.00 3.02 -1.26 -5.01 115.26 113.78 1vdk n ASN 314 Ca -0.11 -0.41 -0.09 0.00 -0.03 0.00 0.00 54.58 53.93 1vdk n ASN 314 Cb 0.47 1.37 -0.06 0.00 -0.61 0.00 0.00 39.78 40.95 1vdk n ASN 314 CO 0.00 0.00 0.00 -1.83 -2.62 0.00 0.00 177.26 172.81 1vdk s GLU 315 N -3.26 1.10 0.11 3.52 1.03 -1.26 -5.08 118.70 114.86 1vdk s GLU 315 Ca 0.00 -1.02 -0.25 0.00 0.03 0.00 0.00 54.97 53.73 1vdk s GLU 315 Cb 0.15 0.40 -0.09 0.00 -0.80 0.00 0.00 34.13 33.79 1vdk s GLU 315 CO 0.87 -0.41 1.67 -1.35 -1.33 0.00 0.00 175.26 174.71 1vdk h PRO 316 N 2.52 -0.32 0.00 -4.83 0.11 -2.01 -3.49 132.00 123.98 1vdk h PRO 316 Ca -0.32 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1vdk h PRO 316 Cb 1.23 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1vdk h PRO 316 CO 0.48 -0.21 0.00 0.41 -0.21 0.00 0.00 178.00 178.47 1vdk n GLY 317 N -1.30 0.45 0.02 -0.55 0.00 -1.26 -4.83 105.19 97.72 1vdk n GLY 317 Ca -0.06 -1.89 -0.01 0.00 0.00 0.00 0.00 46.02 44.06 1vdk n GLY 317 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1vdk h SER 318 N 0.00 -0.04 -3.44 1.61 4.64 -2.02 -3.44 113.55 110.86 1vdk h SER 318 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.73 1vdk h SER 318 Cb 0.00 0.01 -0.10 0.00 -0.31 0.00 0.00 62.40 62.00 1vdk h SER 318 CO 0.00 0.01 -0.09 -0.94 -0.87 0.00 0.00 176.83 174.94 1vdk s SER 319 N -2.98 6.55 -0.06 4.97 1.04 -1.26 -5.06 113.70 116.91 1vdk s SER 319 Ca -0.01 0.66 -0.16 0.00 0.48 0.00 0.00 55.95 56.92 1vdk s SER 319 Cb 0.00 -2.28 -0.05 0.00 0.10 0.00 0.00 66.02 63.79 1vdk s SER 319 CO 0.02 -0.13 0.43 -0.63 0.98 0.00 0.00 173.24 173.92 1vdk s ILE 320 N 1.39 5.11 -0.20 -1.02 -1.09 -1.26 -5.06 121.20 119.06 1vdk s ILE 320 Ca 0.23 0.88 -0.09 0.00 -2.23 0.00 0.00 60.65 59.44 1vdk s ILE 320 Cb -0.15 -3.76 0.08 0.00 -1.58 0.00 0.00 42.46 37.05 1vdk s ILE 320 CO 0.09 0.45 0.44 -0.32 -1.23 0.00 0.00 174.94 174.38 1vdk s MET 321 N -0.21 0.39 -0.12 2.79 -2.45 -1.26 -5.10 119.30 113.34 1vdk s MET 321 Ca 0.24 0.96 -0.38 0.00 -1.25 0.00 0.00 55.69 55.27 1vdk s MET 321 Cb -0.16 0.19 -0.15 0.00 1.25 0.00 0.00 34.83 35.96 1vdk s MET 321 CO 0.11 -0.20 1.66 -2.30 1.05 0.00 0.00 175.02 175.34 1vdk n PRO 322 N 4.85 1.41 0.00 4.11 -0.02 -1.26 -1.12 135.00 142.97 1vdk n PRO 322 Ca -0.16 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1vdk n PRO 322 Cb 0.52 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 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 3.76 3.09 3.71 -1.23 0.00 -1.26 -5.02 105.19 108.24 1vdk n GLY 323 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1vdk n GLY 323 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vdk s LYS 324 N -0.47 4.50 -0.19 1.61 2.20 -0.27 -4.80 119.74 122.33 1vdk s LYS 324 Ca 0.00 1.50 -0.01 0.00 -0.36 0.00 0.00 55.97 57.10 1vdk s LYS 324 Cb 0.00 -3.45 0.05 0.00 -1.51 0.00 0.00 37.83 32.92 1vdk s LYS 324 CO 0.00 -0.15 -0.02 0.08 -0.36 0.00 0.00 175.35 174.91 1vdk s VAL 325 N 1.23 0.95 0.27 4.02 1.01 -1.26 -4.79 120.40 121.83 1vdk s VAL 325 Ca 0.53 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.49 1vdk s VAL 325 Cb -0.22 -1.29 -0.10 0.00 0.00 0.00 0.00 36.38 34.77 1vdk s VAL 325 CO 0.26 -0.06 1.27 0.20 0.00 0.00 0.00 175.10 176.77 1vdk s ASN 326 N 1.67 6.92 -1.42 3.32 0.01 -1.26 -4.88 114.94 119.30 1vdk s ASN 326 Ca -0.02 2.49 -0.09 0.00 -0.71 0.00 0.00 52.86 54.54 1vdk s ASN 326 Cb -0.17 -2.63 -0.09 0.00 0.41 0.00 0.00 41.25 38.78 1vdk s ASN 326 CO -0.07 -0.45 2.78 -0.81 -1.51 0.00 0.00 177.10 177.04 1vdk n PRO 327 N 1.59 3.29 -0.24 -0.60 -0.04 -1.26 -4.73 135.00 133.01 1vdk n PRO 327 Ca 0.02 -1.99 0.09 0.00 -0.04 0.00 0.00 63.50 61.58 1vdk n PRO 327 Cb 0.43 -2.70 0.36 0.00 -0.04 0.00 0.00 33.50 31.55 1vdk n PRO 327 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1vdk h THR 328 N 3.07 0.92 -0.03 0.52 1.35 -1.96 -1.07 112.91 115.72 1vdk h THR 328 Ca 0.77 -0.26 -0.07 0.00 -0.55 0.00 0.00 66.41 66.31 1vdk h THR 328 Cb 0.28 0.11 -0.01 0.00 -1.73 0.00 0.00 68.15 66.80 1vdk h THR 328 CO 1.67 0.14 -0.32 1.56 -0.25 0.00 0.00 175.52 178.32 1vdk h GLN 329 N 0.74 0.05 -0.32 4.72 1.08 -1.94 -1.61 115.11 117.84 1vdk h GLN 329 Ca 0.40 -0.02 -0.15 0.00 -1.45 0.00 0.00 58.65 57.43 1vdk h GLN 329 Cb 0.52 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1vdk h GLN 329 CO -0.16 0.37 -0.41 0.28 -0.95 0.00 0.00 178.83 177.95 1vdk h VAL 330 N 0.05 1.28 -0.47 -0.54 2.07 -1.58 -2.05 116.25 115.00 1vdk h VAL 330 Ca 0.00 -1.59 -0.05 0.00 0.82 0.00 0.00 66.70 65.89 1vdk h VAL 330 Cb 0.59 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1vdk h VAL 330 CO 0.04 0.52 0.11 -0.33 0.02 0.00 0.00 177.57 177.93 1vdk h GLU 331 N 0.64 0.76 -0.53 1.57 5.08 -0.98 0.10 114.58 121.23 1vdk h GLU 331 Ca 0.05 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 1vdk h GLU 331 Cb 0.97 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.10 1vdk h GLU 331 CO 0.09 0.75 0.15 0.00 -1.00 0.00 0.00 179.01 179.00 1vdk h ALA 332 N 0.98 0.69 -0.18 3.43 0.00 -1.26 -1.57 119.26 121.36 1vdk h ALA 332 Ca 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1vdk h ALA 332 Cb 0.34 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1vdk h ALA 332 CO 0.00 0.37 0.09 1.25 0.00 0.00 0.00 179.25 180.96 1vdk h LEU 333 N 0.73 0.23 -1.29 0.00 5.85 -1.14 -1.81 115.31 117.89 1vdk h LEU 333 Ca 0.17 -0.11 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 1vdk h LEU 333 Cb 0.31 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.27 1vdk h LEU 333 CO -0.00 0.28 -0.32 0.71 -0.34 0.00 0.00 178.44 178.76 1vdk h THR 334 N 0.17 0.99 -0.19 1.05 1.35 -0.90 -0.47 112.91 114.92 1vdk h THR 334 Ca 0.06 -1.21 -0.14 0.00 -0.55 0.00 0.00 66.41 64.57 1vdk h THR 334 Cb 0.11 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 1vdk h THR 334 CO -0.01 0.32 -0.48 0.24 -0.25 0.00 0.00 175.52 175.34 1vdk h MET 335 N 0.00 0.49 -0.48 4.72 2.86 -1.06 -1.58 114.93 119.88 1vdk h MET 335 Ca -0.00 -0.28 -0.11 0.00 -2.06 0.00 0.00 59.70 57.25 1vdk h MET 335 Cb 0.67 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.34 1vdk h MET 335 CO 0.04 0.86 -0.15 0.28 1.06 0.00 0.00 176.91 179.01 1vdk h VAL 336 N 0.39 1.27 -0.42 -2.22 2.07 -0.60 -2.42 116.25 114.31 1vdk h VAL 336 Ca 0.02 -1.28 0.01 0.00 0.82 0.00 0.00 66.70 66.27 1vdk h VAL 336 Cb 0.98 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1vdk h VAL 336 CO 0.09 0.44 0.28 0.58 0.02 0.00 0.00 177.57 178.98 1vdk h VAL 337 N 0.81 1.10 0.00 2.57 2.07 -0.64 0.71 116.25 122.87 1vdk h VAL 337 Ca 0.12 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 1vdk h VAL 337 Cb 0.69 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1vdk h VAL 337 CO 0.05 0.10 -0.30 -0.37 0.02 0.00 0.00 177.57 177.08 1vdk h VAL 338 N 0.57 1.08 -0.32 2.57 -1.51 -1.20 -1.72 116.25 115.72 1vdk h VAL 338 Ca 0.16 -1.06 -0.07 0.00 -1.23 0.00 0.00 66.70 64.50 1vdk h VAL 338 Cb -0.06 1.59 -0.01 0.00 -2.13 0.00 0.00 31.29 30.69 1vdk h VAL 338 CO -0.04 0.29 -0.06 -0.09 -1.23 0.00 0.00 177.57 176.44 1vdk h ARG 339 N 0.00 0.61 -0.90 5.19 9.65 -0.84 -2.90 114.38 125.19 1vdk h ARG 339 Ca -0.00 -0.23 -0.01 0.00 -1.10 0.00 0.00 59.98 58.64 1vdk h ARG 339 Cb 0.57 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 29.07 1vdk h ARG 339 CO 0.04 0.78 0.53 0.28 2.80 0.00 0.00 179.97 184.40 1vdk h VAL 340 N 0.39 1.25 -0.37 0.20 2.07 -0.22 -0.44 116.25 119.14 1vdk h VAL 340 Ca 0.08 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1vdk h VAL 340 Cb 0.55 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1vdk h VAL 340 CO 0.03 0.26 0.12 1.88 0.02 0.00 0.00 177.57 179.88 1vdk h TYR 341 N 1.24 0.52 -0.31 1.57 -1.99 -1.25 -0.20 116.97 116.55 1vdk h TYR 341 Ca 0.32 -0.02 -0.16 0.00 2.00 0.00 0.00 58.73 60.87 1vdk h TYR 341 Cb -0.04 -0.16 -0.01 0.00 2.00 0.00 0.00 36.73 38.52 1vdk h TYR 341 CO 0.01 0.43 -0.45 0.78 -0.00 0.00 0.00 178.16 178.93 1vdk h GLY 342 N 0.71 0.88 1.02 3.88 0.00 -1.09 -1.82 103.07 106.65 1vdk h GLY 342 Ca 0.13 -0.94 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1vdk h GLY 342 CO -0.01 0.84 0.44 3.43 0.00 0.00 0.00 176.54 181.24 1vdk h ASN 343 N 0.65 1.03 -0.57 0.19 2.35 -0.08 -0.94 115.58 118.21 1vdk h ASN 343 Ca 0.04 -0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 1vdk h ASN 343 Cb 1.02 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 39.10 1vdk h ASN 343 CO 0.10 0.84 0.26 -0.78 -1.65 0.00 0.00 177.43 176.20 1vdk h ASP 344 N 1.14 0.75 -0.52 5.81 3.58 -0.90 -0.54 116.42 125.75 1vdk h ASP 344 Ca 0.29 -0.14 0.04 0.00 0.42 0.00 0.00 57.03 57.63 1vdk h ASP 344 Cb 0.05 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 40.87 1vdk h ASP 344 CO -0.04 0.68 0.28 -0.74 -2.88 0.00 0.00 179.24 176.54 1vdk h HIS 345 N 0.77 0.52 0.03 0.28 2.76 -0.79 -0.90 115.15 117.82 1vdk h HIS 345 Ca 0.19 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.38 1vdk h HIS 345 Cb 0.14 -0.16 0.00 0.00 1.55 0.00 0.00 27.41 28.94 1vdk h HIS 345 CO 0.00 0.27 -0.01 1.15 -1.30 0.00 0.00 177.93 178.03 1vdk h THR 346 N 0.55 1.02 -0.28 6.26 2.02 -0.74 -1.37 112.91 120.37 1vdk h THR 346 Ca 0.22 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 67.24 1vdk h THR 346 Cb 0.10 1.13 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1vdk h THR 346 CO -0.14 0.04 0.17 0.58 0.37 0.00 0.00 175.52 176.54 1vdk h VAL 347 N -0.10 1.10 -0.26 3.16 2.07 -0.80 -1.54 116.25 119.88 1vdk h VAL 347 Ca -0.00 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.17 1vdk h VAL 347 Cb 0.09 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1vdk h VAL 347 CO 0.01 0.10 -0.27 0.00 0.02 0.00 0.00 177.57 177.43 1vdk h ALA 348 N 1.06 1.06 0.29 1.67 0.00 -1.16 -0.31 119.26 121.86 1vdk h ALA 348 Ca 0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1vdk h ALA 348 Cb 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1vdk h ALA 348 CO -0.02 0.57 -0.14 0.35 0.00 0.00 0.00 179.25 180.02 1vdk h PHE 349 N 0.44 -0.36 -0.77 0.00 3.04 -1.08 -2.82 116.94 115.39 1vdk h PHE 349 Ca 0.06 -0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.06 1vdk h PHE 349 Cb 0.70 0.12 -0.05 0.00 2.56 0.00 0.00 35.95 39.28 1vdk h PHE 349 CO 0.02 -0.09 0.51 0.00 -2.02 0.00 0.00 178.31 176.73 1vdk h ALA 350 N 0.06 1.61 0.00 2.41 0.00 -1.16 -2.06 119.26 120.12 1vdk h ALA 350 Ca -0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1vdk h ALA 350 Cb 0.43 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1vdk h ALA 350 CO 0.06 0.29 -0.08 0.78 0.00 0.00 0.00 179.25 180.30 1vdk h GLY 351 N 0.87 0.00 0.97 0.00 0.00 -0.81 -1.95 103.07 102.15 1vdk h GLY 351 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1vdk h GLY 351 CO -0.11 0.00 -0.23 -1.14 0.00 0.00 0.00 176.54 175.07 1vdk n SER 352 N -3.88 0.52 -1.70 0.19 3.41 -0.78 -4.23 113.62 107.16 1vdk n SER 352 Ca -0.02 -0.38 0.08 0.00 -0.26 0.00 0.00 58.87 58.28 1vdk n SER 352 Cb 0.17 -0.01 0.37 0.00 -0.26 0.00 0.00 64.21 64.48 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 -1.13 4.18 -1.68 4.33 1.13 -0.73 -4.99 117.38 118.49 1vdk n GLN 353 Ca 0.10 -2.89 -0.33 0.00 -1.94 0.00 0.00 57.00 51.94 1vdk n GLN 353 Cb 0.32 -2.05 0.06 0.00 0.11 0.00 0.00 30.24 28.67 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 -0.81 2.24 -0.04 1.08 0.00 -1.26 -4.76 107.32 103.76 1vdk s GLY 354 Ca 0.51 0.66 0.01 0.00 0.00 0.00 0.00 44.72 45.90 1vdk s GLY 354 CO 0.20 1.03 -0.06 -1.31 0.00 0.00 0.00 173.10 172.96 1vdk s ASN 355 N -2.37 1.02 0.99 1.64 -0.87 -1.13 -4.96 114.94 109.26 1vdk s ASN 355 Ca 0.69 -0.15 0.00 0.00 -1.57 0.00 0.00 52.86 51.83 1vdk s ASN 355 Cb -0.23 -0.49 0.00 0.00 -0.02 0.00 0.00 41.25 40.51 1vdk s ASN 355 CO 0.42 -0.04 0.00 0.49 -2.57 0.00 0.00 177.10 175.40 1vdk n PHE 356 N 3.96 0.00 1.36 2.20 3.72 -1.26 -1.91 117.46 125.53 1vdk n PHE 356 Ca -0.25 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.19 1vdk n PHE 356 Cb 0.51 0.00 0.14 0.00 -0.94 0.00 0.00 39.48 39.19 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 1.48 -3.65 -1.08 3.00 -1.26 -4.70 117.38 125.17 1vdk n GLN 357 Ca 0.00 -0.74 -0.07 0.00 -0.01 0.00 0.00 57.00 56.18 1vdk n GLN 357 Cb 0.00 -1.19 -0.07 0.00 0.00 0.00 0.00 30.24 28.98 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 -1.08 -0.83 -0.22 1.08 2.96 -0.80 -3.85 118.68 115.93 1vdk s LEU 358 Ca 0.16 1.43 -0.21 0.00 -0.22 0.00 0.00 54.13 55.28 1vdk s LEU 358 Cb 0.08 2.23 -0.02 0.00 0.50 0.00 0.00 46.19 48.98 1vdk s LEU 358 CO 0.11 -0.23 0.67 0.21 -1.32 0.00 0.00 176.35 175.79 1vdk s ASN 359 N 1.66 6.69 -0.69 3.68 3.84 -0.63 -2.84 114.94 126.64 1vdk s ASN 359 Ca -0.10 0.84 0.00 0.00 0.21 0.00 0.00 52.86 53.82 1vdk s ASN 359 Cb -0.06 -2.36 0.38 0.00 -0.55 0.00 0.00 41.25 38.66 1vdk s ASN 359 CO -0.19 -0.35 1.72 1.33 -2.79 0.00 0.00 177.10 176.82 1vdk n VAL 360 N 4.95 3.19 -1.51 -5.21 0.24 -1.26 -4.24 118.33 114.49 1vdk n VAL 360 Ca 0.00 -4.41 0.04 0.00 -2.04 0.00 0.00 64.34 57.93 1vdk n VAL 360 Cb 0.49 -1.24 0.06 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 -0.55 0.00 -0.05 6.34 4.02 -1.19 -4.18 117.16 121.55 1vdk n TYR 361 Ca 0.50 -0.45 -0.07 0.00 -0.01 0.00 0.00 57.90 57.86 1vdk n TYR 361 Cb 0.41 -0.09 -0.01 0.00 -0.02 0.00 0.00 39.34 39.63 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 -0.13 -0.56 -0.72 1.57 -1.58 -2.40 116.57 112.74 1vdk h LYS 362 Ca 0.00 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.86 1vdk h LYS 362 Cb 1.19 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.47 1vdk h LYS 362 CO 0.00 -0.09 0.24 -1.35 -0.57 0.00 0.00 179.45 177.68 1vdk h PRO 363 N -0.14 0.44 -0.03 3.15 0.11 -1.85 -1.55 132.00 132.12 1vdk h PRO 363 Ca 0.14 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.10 1vdk h PRO 363 Cb 0.35 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 1vdk h PRO 363 CO -0.34 0.29 -0.56 -0.24 -0.21 0.00 0.00 178.00 176.94 1vdk h VAL 364 N 0.45 1.39 -0.34 3.15 3.04 -1.77 0.89 116.25 123.06 1vdk h VAL 364 Ca 0.27 -1.92 -0.06 0.00 -1.01 0.00 0.00 66.70 63.99 1vdk h VAL 364 Cb 0.26 2.00 -0.01 0.00 -2.01 0.00 0.00 31.29 31.53 1vdk h VAL 364 CO -0.24 0.55 -0.01 0.24 -1.01 0.00 0.00 177.57 177.11 1vdk h MET 365 N 0.07 0.60 -0.31 4.17 2.86 -1.00 -1.40 114.93 119.93 1vdk h MET 365 Ca -0.00 -0.20 -0.09 0.00 -2.06 0.00 0.00 59.70 57.35 1vdk h MET 365 Cb 1.02 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1vdk h MET 365 CO 0.08 0.73 -0.16 0.00 1.06 0.00 0.00 176.91 178.62 1vdk h ALA 366 N 0.85 0.43 0.05 6.32 0.00 -1.13 -2.85 119.26 122.93 1vdk h ALA 366 Ca 0.10 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1vdk h ALA 366 Cb 0.46 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1vdk h ALA 366 CO 0.02 0.34 -0.02 -0.92 0.00 0.00 0.00 179.25 178.67 1vdk h TYR 367 N 0.40 -0.06 0.00 0.00 3.20 -0.74 -1.13 116.97 118.65 1vdk h TYR 367 Ca 0.07 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.89 1vdk h TYR 367 Cb 0.69 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 1vdk h TYR 367 CO 0.06 -0.03 -0.23 0.77 -1.64 0.00 0.00 178.16 177.09 1vdk h SER 368 N -0.07 0.00 -0.08 -2.11 0.02 -1.31 0.11 113.55 110.11 1vdk h SER 368 Ca -0.01 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.80 1vdk h SER 368 Cb 0.05 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.60 1vdk h SER 368 CO 0.01 0.23 -0.51 0.74 -1.14 0.00 0.00 176.83 176.16 1vdk h THR 369 N 0.00 1.38 -0.47 -2.27 2.02 -1.25 -2.61 112.91 109.71 1vdk h THR 369 Ca -0.00 -1.87 -0.07 0.00 0.77 0.00 0.00 66.41 65.24 1vdk h THR 369 Cb 0.42 2.28 -0.02 0.00 -1.74 0.00 0.00 68.15 69.08 1vdk h THR 369 CO 0.03 0.56 -0.01 -0.07 0.37 0.00 0.00 175.52 176.39 1vdk h LEU 370 N 0.06 0.76 -0.66 2.58 3.38 -0.82 -1.59 115.31 119.02 1vdk h LEU 370 Ca -0.04 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 1vdk h LEU 370 Cb 1.17 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.68 1vdk h LEU 370 CO 0.10 0.83 0.38 -0.08 0.09 0.00 0.00 178.44 179.77 1vdk h GLU 371 N 0.73 0.90 -0.55 1.13 4.81 -0.81 -0.15 114.58 120.64 1vdk h GLU 371 Ca 0.14 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 59.26 1vdk h GLU 371 Cb 0.46 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.63 1vdk h GLU 371 CO 0.02 0.66 0.25 0.77 -0.73 0.00 0.00 179.01 179.97 1vdk h SER 372 N 0.90 0.74 -0.25 1.04 0.02 -1.05 -0.21 113.55 114.73 1vdk h SER 372 Ca 0.23 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 1vdk h SER 372 Cb -0.00 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.33 1vdk h SER 372 CO -0.04 0.68 0.13 0.40 -1.14 0.00 0.00 176.83 176.85 1vdk h ILE 373 N 0.75 1.14 -0.37 3.27 2.04 -0.88 -1.43 117.51 122.03 1vdk h ILE 373 Ca 0.19 -0.39 -0.11 0.00 1.00 0.00 0.00 64.86 65.55 1vdk h ILE 373 Cb 0.15 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1vdk h ILE 373 CO -0.02 0.14 -0.19 0.78 0.00 0.00 0.00 178.15 178.86 1vdk h ASN 374 N 0.28 0.80 -0.43 1.72 2.35 -0.88 -1.05 115.58 118.37 1vdk h ASN 374 Ca 0.09 -0.41 -0.10 0.00 -0.55 0.00 0.00 56.30 55.33 1vdk h ASN 374 Cb 0.11 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1vdk h ASN 374 CO -0.01 1.04 -0.12 -0.07 -1.65 0.00 0.00 177.43 176.61 1vdk h LEU 375 N 0.57 0.85 -0.51 1.61 3.38 -1.03 -0.77 115.31 119.41 1vdk h LEU 375 Ca 0.08 -0.37 -0.07 0.00 0.09 0.00 0.00 57.88 57.61 1vdk h LEU 375 Cb 0.74 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1vdk h LEU 375 CO 0.06 1.02 0.04 -0.07 0.09 0.00 0.00 178.44 179.58 1vdk h LEU 376 N 0.66 0.85 -0.54 1.67 3.38 -1.26 0.84 115.31 120.90 1vdk h LEU 376 Ca 0.11 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1vdk h LEU 376 Cb 0.66 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1vdk h LEU 376 CO 0.05 0.92 0.34 0.00 0.09 0.00 0.00 178.44 179.84 1vdk h ALA 377 N 0.95 0.68 0.41 1.53 0.00 -1.07 0.19 119.26 121.96 1vdk h ALA 377 Ca 0.15 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1vdk h ALA 377 Cb 0.47 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1vdk h ALA 377 CO 0.02 0.15 -0.20 -0.44 0.00 0.00 0.00 179.25 178.78 1vdk h ASP 378 N 0.73 -0.46 -0.48 0.00 3.32 -0.88 -2.32 116.42 116.32 1vdk h ASP 378 Ca 0.19 -0.03 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1vdk h ASP 378 Cb -0.05 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1vdk h ASP 378 CO -0.04 -0.27 -0.08 0.00 -1.72 0.00 0.00 179.24 177.13 1vdk h ALA 379 N -0.06 0.88 -0.38 3.45 0.00 -0.69 -1.41 119.26 121.05 1vdk h ALA 379 Ca -0.06 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 1vdk h ALA 379 Cb 0.46 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1vdk h ALA 379 CO 0.09 0.65 0.02 0.28 0.00 0.00 0.00 179.25 180.28 1vdk h VAL 380 N 0.85 1.25 -0.76 0.00 2.07 -0.67 0.37 116.25 119.36 1vdk h VAL 380 Ca 0.14 -0.96 -0.05 0.00 0.82 0.00 0.00 66.70 66.66 1vdk h VAL 380 Cb 0.61 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1vdk h VAL 380 CO 0.04 0.32 0.28 0.00 0.02 0.00 0.00 177.57 178.24 1vdk h ALA 381 N 0.88 1.06 -0.10 1.67 0.00 -1.32 0.00 119.26 121.46 1vdk h ALA 381 Ca 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1vdk h ALA 381 Cb 0.44 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1vdk h ALA 381 CO 0.02 0.65 -0.02 1.03 0.00 0.00 0.00 179.25 180.93 1vdk h SER 382 N 1.11 0.20 -0.91 0.00 0.87 -1.07 -1.37 113.55 112.38 1vdk h SER 382 Ca 0.25 -0.37 0.02 0.00 -1.23 0.00 0.00 61.79 60.46 1vdk h SER 382 Cb 0.24 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.10 1vdk h SER 382 CO -0.02 0.52 0.60 0.15 -0.53 0.00 0.00 176.83 177.55 1vdk h PHE 383 N -0.13 1.12 0.63 2.24 3.57 -0.79 0.18 116.94 123.77 1vdk h PHE 383 Ca 0.03 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1vdk h PHE 383 Cb 0.43 -0.38 0.01 0.00 2.79 0.00 0.00 35.95 38.80 1vdk h PHE 383 CO 0.05 0.68 -0.30 0.22 -2.23 0.00 0.00 178.31 176.73 1vdk h ASP 384 N 1.19 -0.72 -0.49 0.41 1.82 -0.89 -0.12 116.42 117.62 1vdk h ASP 384 Ca 0.34 -0.02 -0.12 0.00 -0.39 0.00 0.00 57.03 56.85 1vdk h ASP 384 Cb -0.08 0.19 -0.02 0.00 0.68 0.00 0.00 39.33 40.10 1vdk h ASP 384 CO -0.09 -0.42 -0.14 0.00 -1.61 0.00 0.00 179.24 176.97 1vdk h ALA 385 N -0.71 0.77 -0.11 -0.78 0.00 -1.10 -1.66 119.26 115.66 1vdk h ALA 385 Ca -0.09 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1vdk h ALA 385 Cb 0.69 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1vdk h ALA 385 CO 0.14 0.67 0.00 0.72 0.00 0.00 0.00 179.25 180.78 1vdk n HIS 386 N -4.13 0.12 0.13 0.00 8.25 0.63 -4.68 115.22 115.54 1vdk n HIS 386 Ca 0.01 -0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.41 1vdk n HIS 386 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 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 1.06 -1.26 -0.22 2.41 0.00 -0.63 -4.66 117.00 113.69 1vdk n LEU 387 Ca 0.16 0.47 0.03 0.00 0.00 0.00 0.00 56.01 56.67 1vdk n LEU 387 Cb 0.53 1.33 0.13 0.00 0.00 0.00 0.00 43.42 45.41 1vdk n LEU 387 CO 0.15 -0.41 0.87 0.00 0.00 0.00 0.00 177.39 178.01 1vdk h ALA 388 N 0.00 0.75 0.00 1.96 0.00 -1.00 0.10 119.26 121.07 1vdk h ALA 388 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1vdk h ALA 388 Cb 0.00 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1vdk h ALA 388 CO 0.00 -0.37 0.00 1.96 0.00 0.00 0.00 179.25 180.84 1vdk h GLN 389 N 0.17 0.00 -0.42 0.00 4.20 -1.55 -2.72 115.11 114.79 1vdk h GLN 389 Ca 0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.07 1vdk h GLN 389 Cb 0.60 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1vdk h GLN 389 CO -0.53 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.04 1vdk n GLY 390 N -0.51 2.49 3.72 3.46 0.00 0.34 -5.00 105.19 109.69 1vdk n GLY 390 Ca 0.00 -0.49 -0.42 0.00 0.00 0.00 0.00 46.02 45.12 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 -1.02 2.67 0.03 -0.61 1.01 -1.03 -4.34 121.20 117.92 1vdk s ILE 391 Ca 0.29 0.48 0.02 0.00 0.00 0.00 0.00 60.65 61.45 1vdk s ILE 391 Cb 0.16 -3.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 1vdk s ILE 391 CO 0.21 0.04 -0.08 -1.61 0.00 0.00 0.00 174.94 173.49 1vdk s GLU 392 N 1.10 0.56 0.47 2.79 0.41 -0.89 -4.99 118.70 118.15 1vdk s GLU 392 Ca 0.69 -0.66 -0.15 0.00 -0.41 0.00 0.00 54.97 54.44 1vdk s GLU 392 Cb -0.43 -0.40 -0.08 0.00 -1.78 0.00 0.00 34.13 31.44 1vdk s GLU 392 CO 0.31 0.08 0.91 -1.25 -0.49 0.00 0.00 175.26 174.83 1vdk s PRO 393 N -1.28 3.91 -0.90 0.39 0.04 -1.26 -0.05 135.00 135.85 1vdk s PRO 393 Ca -0.06 0.81 -0.06 0.00 0.04 0.00 0.00 61.00 61.73 1vdk s PRO 393 Cb -0.08 -2.22 0.23 0.00 0.04 0.00 0.00 34.50 32.46 1vdk s PRO 393 CO 0.00 -0.18 0.81 1.21 0.04 0.00 0.00 177.00 178.89 1vdk s ASN 394 N -3.03 6.34 0.25 6.66 3.84 0.51 -4.75 114.94 124.77 1vdk s ASN 394 Ca 0.57 -3.41 -0.05 0.00 0.21 0.00 0.00 52.86 50.18 1vdk s ASN 394 Cb -0.10 -2.02 0.50 0.00 -0.55 0.00 0.00 41.25 39.07 1vdk s ASN 394 CO 0.30 -0.30 1.65 -0.07 -2.79 0.00 0.00 177.10 175.89 1vdk h LEU 395 N 6.60 -0.20 -0.14 3.21 3.38 -1.94 -1.29 115.31 124.93 1vdk h LEU 395 Ca 0.13 0.18 0.01 0.00 0.09 0.00 0.00 57.88 58.29 1vdk h LEU 395 Cb 0.88 0.30 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1vdk h LEU 395 CO 0.86 -0.14 0.08 -0.33 0.09 0.00 0.00 178.44 178.99 1vdk h GLU 396 N 0.16 0.16 -0.55 1.13 5.08 -1.97 -0.76 114.58 117.83 1vdk h GLU 396 Ca 0.44 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.72 1vdk h GLU 396 Cb 0.80 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.99 1vdk h GLU 396 CO -0.63 0.10 0.08 -0.09 -1.00 0.00 0.00 179.01 177.47 1vdk h ARG 397 N 0.16 0.91 -0.51 2.33 9.65 -1.73 -0.60 114.38 124.60 1vdk h ARG 397 Ca 0.05 -0.25 0.03 0.00 -1.10 0.00 0.00 59.98 58.72 1vdk h ARG 397 Cb -0.00 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 28.44 1vdk h ARG 397 CO -0.03 0.89 0.28 0.82 2.80 0.00 0.00 179.97 184.73 1vdk h ILE 398 N 0.80 1.00 -0.40 1.20 2.04 -1.05 -2.24 117.51 118.87 1vdk h ILE 398 Ca 0.16 -0.19 -0.11 0.00 1.00 0.00 0.00 64.86 65.73 1vdk h ILE 398 Cb 0.43 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1vdk h ILE 398 CO 0.01 0.10 -0.18 -0.08 0.00 0.00 0.00 178.15 178.00 1vdk h GLU 399 N 0.56 0.77 -0.52 2.37 4.57 -0.91 -2.31 114.58 119.10 1vdk h GLU 399 Ca 0.22 -0.29 0.07 0.00 -1.18 0.00 0.00 59.36 58.17 1vdk h GLU 399 Cb 0.08 -0.05 -0.06 0.00 -0.16 0.00 0.00 28.75 28.57 1vdk h GLU 399 CO -0.12 0.90 0.22 1.49 -1.18 0.00 0.00 179.01 180.31 1vdk h GLU 400 N 0.68 0.41 -0.20 1.92 4.81 -0.53 -1.69 114.58 119.98 1vdk h GLU 400 Ca 0.10 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 1vdk h GLU 400 Cb 0.68 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1vdk h GLU 400 CO 0.05 0.27 -0.17 1.88 -0.73 0.00 0.00 179.01 180.31 1vdk h TYR 401 N 0.42 0.55 -0.65 0.92 0.99 -1.33 -3.27 116.97 114.59 1vdk h TYR 401 Ca 0.25 -0.16 0.06 0.00 2.00 0.00 0.00 58.73 60.88 1vdk h TYR 401 Cb 0.24 -0.12 -0.05 0.00 1.00 0.00 0.00 36.73 37.80 1vdk h TYR 401 CO -0.14 0.81 0.36 1.25 -0.00 0.00 0.00 178.16 180.43 1vdk h LEU 402 N 0.14 0.53 -2.90 3.88 5.85 -1.13 -1.89 115.31 119.78 1vdk h LEU 402 Ca 0.03 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1vdk h LEU 402 Cb 0.70 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.66 1vdk h LEU 402 CO 0.04 0.34 0.01 1.56 -0.34 0.00 0.00 178.44 180.05 1vdk h GLN 403 N 0.66 0.00 -0.01 1.25 1.08 -1.36 -0.07 115.11 116.66 1vdk h GLN 403 Ca 0.29 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.49 1vdk h GLN 403 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 1vdk h GLN 403 CO -0.18 0.00 -0.43 1.63 -0.95 0.00 0.00 178.83 178.90 1vdk n LYS 404 N -3.19 0.93 -2.12 1.46 5.02 -0.72 -4.62 118.16 114.92 1vdk n LYS 404 Ca -0.03 -0.69 -0.42 0.00 -2.02 0.00 0.00 58.31 55.15 1vdk n LYS 404 Cb 0.08 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.57 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 -2.55 6.77 0.56 4.39 3.84 -0.04 -4.91 114.94 123.00 1vdk s ASN 405 Ca 0.20 2.32 0.24 0.00 0.21 0.00 0.00 52.86 55.83 1vdk s ASN 405 Cb 0.18 -2.57 1.57 0.00 -0.55 0.00 0.00 41.25 39.88 1vdk s ASN 405 CO 0.58 -0.74 2.18 1.55 -2.79 0.00 0.00 177.10 177.88 1vdk h PRO 406 N 7.45 0.00 -0.31 0.43 0.13 -1.91 -2.61 132.00 135.18 1vdk h PRO 406 Ca -0.41 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.71 1vdk h PRO 406 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1vdk h PRO 406 CO 0.89 0.00 0.13 0.52 -0.23 0.00 0.00 178.00 179.31 1vdk h MET 407 N 0.00 0.43 0.00 0.86 2.86 -1.92 -0.66 114.93 116.50 1vdk h MET 407 Ca 0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1vdk h MET 407 Cb 0.14 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1vdk h MET 407 CO -0.00 0.36 0.00 -0.07 1.06 0.00 0.00 176.91 178.26 1vdk h LEU 408 N 0.43 0.00 -0.19 1.22 3.38 -1.79 -2.49 115.31 115.88 1vdk h LEU 408 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1vdk h LEU 408 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1vdk h LEU 408 CO -0.01 0.00 -0.45 0.00 0.09 0.00 0.00 178.44 178.06 1vdk n ALA 409 N -1.99 3.48 0.12 1.53 0.00 -0.28 -3.97 120.51 119.41 1vdk n ALA 409 Ca 0.01 -0.39 -0.02 0.00 0.00 0.00 0.00 53.44 53.04 1vdk n ALA 409 Cb 0.30 -1.09 0.14 0.00 0.00 0.00 0.00 19.45 18.80 1vdk n ALA 409 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1vdk h THR 410 N 0.48 1.46 0.00 0.00 1.35 -1.20 -2.76 112.91 112.23 1vdk h THR 410 Ca 0.00 -2.20 0.00 0.00 -0.55 0.00 0.00 66.41 63.66 1vdk h THR 410 Cb 0.51 2.18 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 1vdk h THR 410 CO 0.00 0.63 0.00 0.00 -0.25 0.00 0.00 175.52 175.90 1vdk h ALA 411 N 1.32 1.00 0.11 6.62 0.00 -1.71 -3.13 119.26 123.47 1vdk h ALA 411 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.55 1vdk h ALA 411 Cb 1.15 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1vdk h ALA 411 CO 0.09 0.00 -1.90 -0.07 0.00 0.00 0.00 179.25 177.37 1vdk h LEU 412 N 0.00 0.37 -1.35 0.00 3.38 -1.71 -3.28 115.31 112.72 1vdk h LEU 412 Ca 0.00 -0.77 0.14 0.00 0.09 0.00 0.00 57.88 57.34 1vdk h LEU 412 Cb 0.53 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 1vdk h LEU 412 CO 0.00 1.69 0.56 0.78 0.09 0.00 0.00 178.44 181.55 1vdk h ASN 413 N 0.06 0.60 -0.57 -0.43 2.35 -1.44 0.12 115.58 116.26 1vdk h ASN 413 Ca -0.38 0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.29 1vdk h ASN 413 Cb 2.04 -0.08 -0.07 0.00 0.05 0.00 0.00 38.32 40.26 1vdk h ASN 413 CO 0.10 0.31 0.12 0.29 -1.65 0.00 0.00 177.43 176.60 1vdk n LYS 414 N -4.54 3.78 0.00 0.81 5.02 -1.24 -2.41 118.16 119.58 1vdk n LYS 414 Ca 0.17 -3.08 0.00 0.00 -2.02 0.00 0.00 58.31 53.38 1vdk n LYS 414 Cb 0.48 -2.14 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 1vdk n LYS 414 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vdk n ALA 415 N -0.08 1.82 -1.04 7.82 0.00 0.20 -4.86 120.51 124.37 1vdk n ALA 415 Ca 0.33 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1vdk n ALA 415 Cb 1.22 0.24 0.00 0.00 0.00 0.00 0.00 19.45 20.91 1vdk n ALA 415 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1vdk n ILE 416 N -1.80 0.00 0.00 0.00 -5.35 0.05 -5.07 119.36 107.18 1vdk n ILE 416 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1vdk n ILE 416 Cb 0.38 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.31 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 0.00 2.56 0.19 3.28 0.00 -1.01 -4.41 105.19 105.80 1vdk n GLY 417 Ca 0.00 -1.81 -0.09 0.00 0.00 0.00 0.00 46.02 44.12 1vdk n GLY 417 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1vdk h TYR 418 N 0.00 0.58 -0.02 1.61 -1.99 -1.79 -2.32 116.97 113.04 1vdk h TYR 418 Ca 0.00 -0.23 -0.11 0.00 2.00 0.00 0.00 58.73 60.39 1vdk h TYR 418 Cb 0.00 -0.10 0.01 0.00 2.00 0.00 0.00 36.73 38.64 1vdk h TYR 418 CO 0.00 0.95 -0.41 -0.44 -0.00 0.00 0.00 178.16 178.26 1vdk h ASP 419 N 0.33 0.40 0.34 3.88 3.32 -1.90 0.54 116.42 123.34 1vdk h ASP 419 Ca -0.01 -0.73 0.00 0.00 0.02 0.00 0.00 57.03 56.31 1vdk h ASP 419 Cb 1.17 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.60 1vdk h ASP 419 CO 0.11 1.07 0.00 0.29 -1.72 0.00 0.00 179.24 178.99 1vdk n LYS 420 N -4.36 0.15 -0.10 3.56 4.01 -1.23 -0.95 118.16 119.24 1vdk n LYS 420 Ca -0.09 0.18 -0.13 0.00 -0.51 0.00 0.00 58.31 57.75 1vdk n LYS 420 Cb 0.57 -1.50 -0.10 0.00 -0.51 0.00 0.00 35.03 33.49 1vdk n LYS 420 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1vdk n ALA 421 N -1.34 1.57 0.22 7.82 0.00 -0.87 -4.07 120.51 123.83 1vdk n ALA 421 Ca 0.06 -0.91 0.10 0.00 0.00 0.00 0.00 53.44 52.69 1vdk n ALA 421 Cb 0.13 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.01 1vdk n ALA 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vdk h ALA 422 N 0.17 0.98 -0.08 0.00 0.00 -0.56 -2.74 119.26 117.03 1vdk h ALA 422 Ca -0.45 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.09 1vdk h ALA 422 Cb 1.77 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1vdk h ALA 422 CO -0.05 0.26 -0.72 1.49 0.00 0.00 0.00 179.25 180.23 1vdk h GLU 423 N 0.00 0.39 0.00 0.00 4.81 -1.24 -2.41 114.58 116.14 1vdk h GLU 423 Ca -0.00 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1vdk h GLU 423 Cb 0.80 0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.24 1vdk h GLU 423 CO 0.03 0.96 0.00 0.82 -0.73 0.00 0.00 179.01 180.08 1vdk h ILE 424 N 0.27 0.00 0.00 2.32 2.04 -1.63 -1.55 117.51 118.95 1vdk h ILE 424 Ca -0.03 -0.30 -0.12 0.00 1.00 0.00 0.00 64.86 65.41 1vdk h ILE 424 Cb 1.29 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 1vdk h ILE 424 CO 0.12 0.00 -0.89 0.58 0.00 0.00 0.00 178.15 177.97 1vdk h VAL 425 N 0.00 0.63 -0.03 1.67 2.07 -1.35 -1.92 116.25 117.33 1vdk h VAL 425 Ca 0.00 -2.00 0.00 0.00 0.82 0.00 0.00 66.70 65.52 1vdk h VAL 425 Cb 0.39 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 1vdk h VAL 425 CO 0.00 0.36 0.00 0.29 0.02 0.00 0.00 177.57 178.24 1vdk n LYS 426 N -3.05 1.71 -0.05 1.57 5.02 -0.61 -3.82 118.16 118.93 1vdk n LYS 426 Ca -0.03 -1.03 -0.11 0.00 -2.02 0.00 0.00 58.31 55.12 1vdk n LYS 426 Cb 0.76 -1.47 -0.04 0.00 -0.02 0.00 0.00 35.03 34.26 1vdk n LYS 426 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1vdk n LYS 427 N 0.25 0.29 -0.56 1.97 4.81 -1.02 -4.27 118.16 119.63 1vdk n LYS 427 Ca 0.19 0.12 -0.07 0.00 -0.87 0.00 0.00 58.31 57.67 1vdk n LYS 427 Cb 0.37 -0.99 0.03 0.00 0.02 0.00 0.00 35.03 34.46 1vdk n LYS 427 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1vdk n ALA 428 N -3.76 4.10 -0.56 3.14 0.00 -0.72 -4.28 120.51 118.43 1vdk n ALA 428 Ca -0.20 -0.76 0.00 0.00 0.00 0.00 0.00 53.44 52.48 1vdk n ALA 428 Cb 0.54 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.83 1vdk n ALA 428 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1vdk n LEU 429 N 0.67 0.00 -1.64 0.00 7.94 -1.25 -4.44 117.00 118.29 1vdk n LEU 429 Ca 0.14 0.00 -0.12 0.00 -1.11 0.00 0.00 56.01 54.93 1vdk n LEU 429 Cb 0.61 0.07 0.06 0.00 0.53 0.00 0.00 43.42 44.69 1vdk n LEU 429 CO 0.17 -0.22 0.97 0.29 -1.11 0.00 0.00 177.39 177.49 1vdk n LYS 430 N -1.66 1.59 0.00 1.96 5.02 -1.26 -5.11 118.16 118.71 1vdk n LYS 430 Ca 0.00 -1.29 0.00 0.00 -2.02 0.00 0.00 58.31 55.00 1vdk n LYS 430 Cb 0.00 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 1vdk n LYS 430 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1vdk n LYS 433 N 0.08 0.00 -2.89 1.97 4.76 -1.26 -4.91 118.16 115.90 1vdk n LYS 433 Ca 0.25 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.31 1vdk n LYS 433 Cb 0.83 -0.15 -0.06 0.00 -1.84 0.00 0.00 35.03 33.81 1vdk n LYS 433 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1vdk s THR 434 N -0.57 4.29 0.37 -0.18 -1.32 -1.26 -4.69 115.64 112.28 1vdk s THR 434 Ca 0.00 1.76 0.08 0.00 -1.21 0.00 0.00 61.69 62.32 1vdk s THR 434 Cb 0.00 -4.11 0.16 0.00 -1.51 0.00 0.00 72.50 67.04 1vdk s THR 434 CO 0.00 0.37 1.90 -0.07 -2.21 0.00 0.00 174.62 174.61 1vdk h LEU 435 N 3.84 0.30 -2.35 9.08 3.38 -1.82 -1.49 115.31 126.24 1vdk h LEU 435 Ca -0.47 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.45 1vdk h LEU 435 Cb 1.20 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.87 1vdk h LEU 435 CO 0.66 0.43 -0.00 0.50 0.09 0.00 0.00 178.44 180.12 1vdk h LYS 436 N 0.30 0.00 0.08 1.13 3.64 -1.96 -2.42 116.57 117.33 1vdk h LYS 436 Ca 0.06 0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 59.13 1vdk h LYS 436 Cb 0.36 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1vdk h LYS 436 CO 0.02 0.00 -1.68 0.37 -2.27 0.00 0.00 179.45 175.89 1vdk h GLN 437 N 0.00 0.16 -0.62 1.90 5.75 -1.68 -3.31 115.11 117.31 1vdk h GLN 437 Ca -0.00 -0.27 0.06 0.00 -0.15 0.00 0.00 58.65 58.28 1vdk h GLN 437 Cb 0.22 0.10 -0.05 0.00 1.07 0.00 0.00 27.48 28.82 1vdk h GLN 437 CO 0.00 1.13 0.33 0.00 -2.65 0.00 0.00 178.83 177.64 1vdk h ALA 438 N -0.17 0.82 -0.02 3.38 0.00 -1.21 0.80 119.26 122.86 1vdk h ALA 438 Ca -0.39 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.50 1vdk h ALA 438 Cb 1.73 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.42 1vdk h ALA 438 CO -0.03 -0.00 -0.16 0.00 0.00 0.00 0.00 179.25 179.05 1vdk h ALA 439 N 1.33 1.69 0.00 0.00 0.00 -1.62 -2.25 119.26 118.41 1vdk h ALA 439 Ca 0.28 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1vdk h ALA 439 Cb 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1vdk h ALA 439 CO -0.18 0.23 -0.11 -0.07 0.00 0.00 0.00 179.25 179.12 1vdk h LEU 440 N 0.03 0.09 -2.39 0.00 3.38 -1.19 -2.33 115.31 112.91 1vdk h LEU 440 Ca 0.01 -0.81 -0.00 0.00 0.09 0.00 0.00 57.88 57.16 1vdk h LEU 440 Cb 0.31 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1vdk h LEU 440 CO 0.02 0.89 -0.02 -0.33 0.09 0.00 0.00 178.44 179.09 1vdk h GLU 441 N -0.69 0.00 -0.00 1.13 5.08 -0.77 -0.81 114.58 118.52 1vdk h GLU 441 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1vdk h GLU 441 Cb 0.91 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.16 1vdk h GLU 441 CO 0.02 0.02 -0.69 1.28 -1.00 0.00 0.00 179.01 178.64 1vdk n LEU 442 N -3.78 0.95 0.00 1.33 4.77 -0.86 -4.95 117.00 114.46 1vdk n LEU 442 Ca -0.03 -0.33 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 1vdk n LEU 442 Cb 0.11 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1vdk n LEU 442 CO 0.28 0.22 0.00 0.61 -1.33 0.00 0.00 177.39 177.16 1vdk n GLY 443 N 1.48 1.63 0.34 -0.72 0.00 -0.31 -4.83 105.19 102.78 1vdk n GLY 443 Ca 0.06 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 -1.82 1.61 -1.99 -1.71 -3.44 116.97 109.63 1vdk h TYR 444 Ca 0.00 0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.79 1vdk h TYR 444 Cb 0.00 0.00 -0.20 0.00 2.00 0.00 0.00 36.73 38.53 1vdk h TYR 444 CO 0.00 0.00 0.46 -1.17 -0.00 0.00 0.00 178.16 177.45 1vdk s LEU 445 N -7.25 -0.43 0.40 3.88 2.96 -0.92 -5.06 118.68 112.26 1vdk s LEU 445 Ca -0.04 0.38 -0.00 0.00 -0.22 0.00 0.00 54.13 54.24 1vdk s LEU 445 Cb 0.14 2.04 -0.02 0.00 0.50 0.00 0.00 46.19 48.85 1vdk s LEU 445 CO 0.51 -0.46 0.63 0.28 -1.32 0.00 0.00 176.35 175.98 1vdk s THR 446 N -1.57 4.71 0.43 3.68 -1.32 -1.26 -3.42 115.64 116.90 1vdk s THR 446 Ca -0.02 -0.37 0.21 0.00 -1.21 0.00 0.00 61.69 60.30 1vdk s THR 446 Cb -0.00 -3.74 0.24 0.00 -1.51 0.00 0.00 72.50 67.49 1vdk s THR 446 CO 0.01 -0.53 2.04 1.05 -2.21 0.00 0.00 174.62 174.97 1vdk h GLU 447 N 0.55 0.00 -0.05 7.08 9.09 -1.95 0.31 114.58 129.61 1vdk h GLU 447 Ca -0.48 0.00 -0.03 0.00 0.05 0.00 0.00 59.36 58.90 1vdk h GLU 447 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 1vdk h GLU 447 CO 0.60 0.15 -0.09 0.93 0.05 0.00 0.00 179.01 180.65 1vdk h GLU 448 N 0.00 0.15 -0.03 1.06 5.08 -1.98 -3.09 114.58 115.77 1vdk h GLU 448 Ca -0.00 -0.09 -0.14 0.00 -1.00 0.00 0.00 59.36 58.13 1vdk h GLU 448 Cb 0.33 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 1vdk h GLU 448 CO 0.02 0.67 -0.61 0.93 -1.00 0.00 0.00 179.01 179.02 1vdk h GLU 449 N -0.35 0.11 0.45 2.33 5.08 -1.90 -3.25 114.58 117.04 1vdk h GLU 449 Ca 0.00 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1vdk h GLU 449 Cb 0.66 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1vdk h GLU 449 CO 0.02 0.69 -0.40 0.35 -1.00 0.00 0.00 179.01 178.66 1vdk h PHE 450 N 0.08 -1.11 0.00 4.33 3.57 -0.96 -0.82 116.94 122.03 1vdk h PHE 450 Ca -0.01 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1vdk h PHE 450 Cb 1.10 0.42 0.00 0.00 2.79 0.00 0.00 35.95 40.26 1vdk h PHE 450 CO 0.01 -0.55 0.01 -0.25 -2.23 0.00 0.00 178.31 175.30 1vdk n ASP 451 N -4.86 0.00 -0.02 0.41 8.00 -1.17 -0.06 116.55 118.85 1vdk n ASP 451 Ca -0.10 0.39 -0.04 0.00 0.71 0.00 0.00 54.79 55.74 1vdk n ASP 451 Cb 0.38 -0.39 -0.12 0.00 -0.02 0.00 0.00 41.12 40.97 1vdk n ASP 451 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1vdk n ARG 452 N -1.38 0.64 -0.05 -1.24 0.63 -0.45 -4.34 116.66 110.47 1vdk n ARG 452 Ca 0.00 0.16 -0.17 0.00 -0.92 0.00 0.00 57.85 56.92 1vdk n ARG 452 Cb 0.01 -1.71 -0.14 0.00 0.45 0.00 0.00 32.46 31.06 1vdk n ARG 452 CO 0.00 0.00 0.00 -0.89 -2.51 0.00 0.00 177.63 174.23 1vdk n ILE 453 N -2.85 1.63 -3.45 5.15 5.41 0.67 -4.77 119.36 121.15 1vdk n ILE 453 Ca -0.17 -0.68 -0.43 0.00 1.00 0.00 0.00 62.75 62.47 1vdk n ILE 453 Cb 0.96 -1.38 -0.07 0.00 -0.71 0.00 0.00 39.64 38.43 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 -2.55 4.66 -0.58 1.39 1.01 0.92 -4.86 120.40 120.38 1vdk s VAL 454 Ca -0.21 -1.61 0.04 0.00 0.00 0.00 0.00 61.98 60.20 1vdk s VAL 454 Cb 0.07 -4.01 0.15 0.00 0.00 0.00 0.00 36.38 32.59 1vdk s VAL 454 CO 0.74 -0.79 0.35 -0.69 0.00 0.00 0.00 175.10 174.71 1vdk s VAL 455 N 1.47 2.58 0.33 2.92 1.01 -1.26 -4.57 120.40 122.89 1vdk s VAL 455 Ca 0.04 -3.63 0.12 0.00 0.00 0.00 0.00 61.98 58.52 1vdk s VAL 455 Cb -0.27 -2.75 0.34 0.00 0.00 0.00 0.00 36.38 33.69 1vdk s VAL 455 CO 0.01 -0.89 1.63 -0.65 0.00 0.00 0.00 175.10 175.20 1vdk h PRO 456 N 6.08 0.19 -0.34 2.72 0.11 -1.96 0.23 132.00 139.04 1vdk h PRO 456 Ca 0.02 -0.01 0.07 0.00 0.11 0.00 0.00 66.00 66.19 1vdk h PRO 456 Cb 0.84 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 31.89 1vdk h PRO 456 CO 0.68 0.13 0.23 1.98 -0.21 0.00 0.00 178.00 180.81 1vdk h MET 457 N 0.20 0.13 0.00 1.05 4.05 -1.97 0.13 114.93 118.51 1vdk h MET 457 Ca 0.71 -0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 60.08 1vdk h MET 457 Cb 1.64 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 32.41 1vdk h MET 457 CO -0.68 0.09 -0.19 0.00 0.23 0.00 0.00 176.91 176.35 1vdk h ARG 458 N 0.13 0.00 0.17 0.39 3.08 -0.80 0.27 114.38 117.63 1vdk h ARG 458 Ca 0.15 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.91 1vdk h ARG 458 Cb 0.44 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.51 1vdk h ARG 458 CO -0.02 0.19 -1.33 -0.07 -1.07 0.00 0.00 179.97 177.68 1vdk h LEU 459 N 0.00 0.57 -0.54 3.04 3.38 -0.85 -2.38 115.31 118.52 1vdk h LEU 459 Ca -0.00 -0.61 -0.14 0.00 0.09 0.00 0.00 57.88 57.22 1vdk h LEU 459 Cb 0.34 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1vdk h LEU 459 CO 0.02 1.48 -0.67 0.00 0.09 0.00 0.00 178.44 179.37 1vdk h ALA 460 N 0.44 0.80 -2.10 1.53 0.00 -0.83 -3.36 119.26 115.74 1vdk h ALA 460 Ca -0.18 -0.61 -0.57 0.00 0.00 0.00 0.00 54.91 53.55 1vdk h ALA 460 Cb 2.04 -0.11 -0.40 0.00 0.00 0.00 0.00 17.79 19.33 1vdk h ALA 460 CO 0.23 0.83 -0.94 1.63 0.00 0.00 0.00 179.25 181.00 1vdk n LYS 461 N -3.60 1.22 0.28 0.00 5.02 0.91 -4.78 118.16 117.21 1vdk n LYS 461 Ca -0.00 -3.66 0.18 0.00 -2.02 0.00 0.00 58.31 52.81 1vdk n LYS 461 Cb 0.69 -1.56 0.80 0.00 -0.02 0.00 0.00 35.03 34.94 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 4.18 0.00 -0.02 1.97 0.13 -1.58 -3.42 132.00 133.26 1vdk h PRO 462 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1vdk h PRO 462 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1vdk h PRO 462 CO 0.57 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.06