#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkg n PRO 16 N 0.00 -1.01 -4.98 7.34 -0.02 -1.26 -4.69 135.00 130.38 1vkg n PRO 16 Ca 0.00 -0.26 -0.32 0.00 -2.02 0.00 0.00 63.50 60.91 1vkg n PRO 16 Cb 0.00 -1.95 -0.14 0.00 -0.02 0.00 0.00 33.50 31.39 1vkg n PRO 16 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1vkg s VAL 17 N -2.40 2.60 -0.24 -1.45 1.01 -1.00 -1.22 120.40 117.71 1vkg s VAL 17 Ca 0.60 -1.00 0.02 0.00 0.00 0.00 0.00 61.98 61.60 1vkg s VAL 17 Cb -0.20 -2.00 0.05 0.00 0.00 0.00 0.00 36.38 34.24 1vkg s VAL 17 CO 0.65 0.52 -0.11 -0.47 0.00 0.00 0.00 175.10 175.69 1vkg s TYR 18 N -0.74 2.93 -0.70 5.22 5.04 0.96 -0.14 117.35 129.92 1vkg s TYR 18 Ca 0.12 -2.05 -0.26 0.00 -2.44 0.00 0.00 57.07 52.44 1vkg s TYR 18 Cb -0.10 -1.82 0.04 0.00 0.35 0.00 0.00 41.96 40.43 1vkg s TYR 18 CO 0.01 -0.83 1.18 0.42 -1.34 0.00 0.00 175.55 174.99 1vkg s ILE 19 N 1.22 3.92 -0.03 3.14 -1.09 -0.68 -0.55 121.20 127.12 1vkg s ILE 19 Ca -0.06 0.22 -0.11 0.00 -2.23 0.00 0.00 60.65 58.46 1vkg s ILE 19 Cb -0.19 -4.84 0.02 0.00 -1.58 0.00 0.00 42.46 35.88 1vkg s ILE 19 CO -0.06 -1.70 0.25 -0.47 -1.23 0.00 0.00 174.94 171.72 1vkg s TYR 20 N 5.19 -0.14 -0.28 3.97 5.04 0.22 -4.86 117.35 126.49 1vkg s TYR 20 Ca 0.32 0.25 -0.21 0.00 -2.44 0.00 0.00 57.07 54.99 1vkg s TYR 20 Cb -0.11 0.05 0.10 0.00 0.35 0.00 0.00 41.96 42.36 1vkg s TYR 20 CO 0.14 -0.31 0.83 -1.54 -1.34 0.00 0.00 175.55 173.33 1vkg s SER 21 N -1.03 -0.70 0.23 4.32 1.04 -1.26 -4.12 113.70 112.19 1vkg s SER 21 Ca -0.11 1.22 -0.14 0.00 0.48 0.00 0.00 55.95 57.40 1vkg s SER 21 Cb -0.05 1.27 0.28 0.00 0.10 0.00 0.00 66.02 67.61 1vkg s SER 21 CO 0.03 -0.20 1.58 -0.65 0.98 0.00 0.00 173.24 174.98 1vkg h PRO 22 N 5.62 -0.04 -0.63 4.02 0.11 -2.00 0.22 132.00 139.29 1vkg h PRO 22 Ca -0.29 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.95 1vkg h PRO 22 Cb 1.19 0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 1vkg h PRO 22 CO 0.12 -0.03 0.43 0.93 -0.21 0.00 0.00 178.00 179.25 1vkg h GLU 23 N -0.04 0.31 -0.01 1.05 3.07 -1.98 -0.05 114.58 116.94 1vkg h GLU 23 Ca 0.35 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 59.18 1vkg h GLU 23 Cb 0.59 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1vkg h GLU 23 CO -0.84 0.21 -0.06 -0.92 -1.40 0.00 0.00 179.01 175.99 1vkg h TYR 24 N 0.32 0.07 0.41 4.33 3.20 -1.00 -0.92 116.97 123.39 1vkg h TYR 24 Ca 0.30 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1vkg h TYR 24 Cb 0.74 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 1vkg h TYR 24 CO -0.00 0.76 -0.46 0.28 -1.64 0.00 0.00 178.16 177.10 1vkg h VAL 25 N -0.64 0.09 -0.91 1.81 2.07 -0.74 0.15 116.25 118.08 1vkg h VAL 25 Ca -0.01 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.75 1vkg h VAL 25 Cb 0.78 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.58 1vkg h VAL 25 CO 0.01 0.00 0.62 0.28 0.02 0.00 0.00 177.57 178.50 1vkg h SER 26 N -0.90 0.22 -0.38 0.57 0.02 -1.10 0.45 113.55 112.42 1vkg h SER 26 Ca -0.04 0.03 -0.14 0.00 -0.84 0.00 0.00 61.79 60.80 1vkg h SER 26 Cb 0.80 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.32 1vkg h SER 26 CO -0.10 0.08 -0.28 -0.03 -1.14 0.00 0.00 176.83 175.36 1vkg h MET 27 N 0.21 0.90 -1.57 3.45 -1.53 0.63 -3.10 114.93 113.92 1vkg h MET 27 Ca 0.46 -0.41 -0.24 0.00 -3.44 0.00 0.00 59.70 56.07 1vkg h MET 27 Cb 1.45 -0.02 -0.11 0.00 -0.55 0.00 0.00 31.60 32.38 1vkg h MET 27 CO -0.11 1.06 0.31 0.00 0.14 0.00 0.00 176.91 178.32 1vkg n ASP 29 N 0.54 -0.14 0.00 0.00 8.00 -1.17 -3.67 116.55 120.10 1vkg n ASP 29 Ca 0.23 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.71 1vkg n ASP 29 Cb 0.60 0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.77 1vkg n ASP 29 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1vkg n SER 30 N -0.03 0.00 0.00 -2.24 3.41 -1.16 -4.78 113.62 108.82 1vkg n SER 30 Ca -0.12 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 1vkg n SER 30 Cb 0.89 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.84 1vkg n SER 30 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1vkg n LEU 31 N -0.40 0.00 0.00 1.04 4.77 -1.26 -4.15 117.00 116.99 1vkg n LEU 31 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1vkg n LEU 31 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1vkg n LEU 31 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.06 1vkg n ALA 32 N 0.00 0.00 -1.87 -1.18 0.00 -1.26 0.13 120.51 116.33 1vkg n ALA 32 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 1vkg n ALA 32 Cb 0.00 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.53 1vkg n ALA 32 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 1vkg n LYS 33 N -1.34 2.94 -4.34 0.00 2.85 -1.26 -5.03 118.16 111.98 1vkg n LYS 33 Ca 0.00 -3.87 -0.32 0.00 -1.05 0.00 0.00 58.31 53.07 1vkg n LYS 33 Cb 0.00 -2.07 -0.09 0.00 -0.65 0.00 0.00 35.03 32.22 1vkg n LYS 33 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1vkg s ILE 34 N -4.16 3.93 0.00 0.58 1.09 0.34 -5.12 121.20 117.87 1vkg s ILE 34 Ca 0.47 -0.70 0.00 0.00 -1.10 0.00 0.00 60.65 59.32 1vkg s ILE 34 Cb 0.40 -2.75 0.00 0.00 -1.06 0.00 0.00 42.46 39.05 1vkg s ILE 34 CO 0.00 0.36 0.00 -0.81 -0.10 0.00 0.00 174.94 174.40 1vkg n PRO 35 N 1.40 0.85 -2.88 2.79 -0.04 -1.26 -4.77 135.00 131.10 1vkg n PRO 35 Ca -0.15 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 62.96 1vkg n PRO 35 Cb 0.53 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.97 1vkg n PRO 35 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1vkg n LYS 36 N -0.98 4.28 0.10 0.54 5.02 -1.26 -4.33 118.16 121.54 1vkg n LYS 36 Ca 0.00 -4.72 -0.16 0.00 -2.02 0.00 0.00 58.31 51.41 1vkg n LYS 36 Cb 0.00 -2.38 -0.14 0.00 -0.02 0.00 0.00 35.03 32.49 1vkg n LYS 36 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 1vkg h ARG 37 N 3.99 0.28 -0.25 1.97 2.43 -1.96 -2.91 114.38 117.94 1vkg h ARG 37 Ca 0.32 -0.48 0.03 0.00 -0.81 0.00 0.00 59.98 59.04 1vkg h ARG 37 Cb 0.46 0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 1vkg h ARG 37 CO 1.05 1.22 0.08 0.00 -1.51 0.00 0.00 179.97 180.82 1vkg h ALA 38 N 0.56 0.27 0.10 2.80 0.00 -1.83 -1.78 119.26 119.37 1vkg h ALA 38 Ca -0.14 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1vkg h ALA 38 Cb 1.98 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.79 1vkg h ALA 38 CO 0.20 -0.33 -0.05 0.77 0.00 0.00 0.00 179.25 179.84 1vkg h SER 39 N 0.20 -0.12 -0.69 0.00 0.02 -1.83 -1.49 113.55 109.63 1vkg h SER 39 Ca 0.11 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.12 1vkg h SER 39 Cb 0.08 0.03 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 1vkg h SER 39 CO -0.11 -0.09 0.40 0.24 -1.14 0.00 0.00 176.83 176.14 1vkg h MET 40 N -0.14 0.73 0.55 3.45 2.07 -1.34 0.38 114.93 120.63 1vkg h MET 40 Ca -0.01 -0.04 -0.03 0.00 -2.07 0.00 0.00 59.70 57.55 1vkg h MET 40 Cb 0.11 -0.17 0.01 0.00 -1.87 0.00 0.00 31.60 29.68 1vkg h MET 40 CO 0.02 0.48 -0.26 0.28 1.07 0.00 0.00 176.91 178.50 1vkg h VAL 41 N 0.75 0.43 0.46 -2.22 2.07 -1.17 -2.34 116.25 114.24 1vkg h VAL 41 Ca 0.30 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1vkg h VAL 41 Cb 0.15 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1vkg h VAL 41 CO -0.16 0.03 -0.36 -0.74 0.02 0.00 0.00 177.57 176.35 1vkg h HIS 42 N -0.84 -0.97 -0.99 1.57 2.76 -1.05 -1.78 115.15 113.86 1vkg h HIS 42 Ca -0.08 -0.00 0.40 0.00 -2.20 0.00 0.00 60.37 58.49 1vkg h HIS 42 Cb 0.61 0.36 -0.18 0.00 1.55 0.00 0.00 27.41 29.75 1vkg h HIS 42 CO -0.02 -0.52 0.48 0.45 -1.30 0.00 0.00 177.93 177.02 1vkg n SER 43 N -5.48 0.30 0.00 3.26 2.88 0.13 0.14 113.62 114.85 1vkg n SER 43 Ca -0.11 1.65 -0.19 0.00 -1.33 0.00 0.00 58.87 58.89 1vkg n SER 43 Cb 0.38 -0.78 -0.14 0.00 -0.75 0.00 0.00 64.21 62.92 1vkg n SER 43 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1vkg h LEU 44 N 0.00 0.30 -1.13 2.46 5.85 -0.93 0.26 115.31 122.12 1vkg h LEU 44 Ca 0.81 -0.93 0.14 0.00 0.84 0.00 0.00 57.88 58.75 1vkg h LEU 44 Cb 2.12 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 42.97 1vkg h LEU 44 CO -0.78 1.32 0.61 0.40 -0.34 0.00 0.00 178.44 179.64 1vkg h ILE 45 N -0.57 0.84 0.11 4.05 2.04 -0.08 0.14 117.51 124.04 1vkg h ILE 45 Ca -0.13 -0.28 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 1vkg h ILE 45 Cb 1.46 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1vkg h ILE 45 CO 0.08 0.15 -0.05 -0.08 0.00 0.00 0.00 178.15 178.25 1vkg h GLU 46 N 0.82 -0.14 -0.96 2.37 4.81 -0.34 0.50 114.58 121.65 1vkg h GLU 46 Ca 0.49 0.01 0.26 0.00 -0.13 0.00 0.00 59.36 59.99 1vkg h GLU 46 Cb 0.67 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.03 1vkg h GLU 46 CO -0.26 0.25 0.66 0.00 -0.73 0.00 0.00 179.01 178.93 1vkg h ALA 47 N 0.27 2.64 -0.49 2.92 0.00 0.22 0.64 119.26 125.46 1vkg h ALA 47 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1vkg h ALA 47 Cb 0.45 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1vkg h ALA 47 CO 0.02 -0.94 0.00 0.66 0.00 0.00 0.00 179.25 179.00 1vkg n TYR 48 N -4.37 0.64 -2.04 0.00 4.01 -0.20 -4.83 117.16 110.38 1vkg n TYR 48 Ca 0.21 -0.32 -0.20 0.00 -0.16 0.00 0.00 57.90 57.43 1vkg n TYR 48 Cb 0.93 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.91 1vkg n TYR 48 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1vkg n ALA 49 N 1.43 -0.49 -0.00 -0.72 0.00 0.22 -4.88 120.51 116.06 1vkg n ALA 49 Ca 0.21 0.23 -0.01 0.00 0.00 0.00 0.00 53.44 53.86 1vkg n ALA 49 Cb 0.58 -2.03 0.26 0.00 0.00 0.00 0.00 19.45 18.25 1vkg n ALA 49 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1vkg h LEU 50 N 0.00 0.51 -1.60 0.00 3.38 -1.09 -2.36 115.31 114.16 1vkg h LEU 50 Ca -0.44 -0.12 0.15 0.00 0.09 0.00 0.00 57.88 57.56 1vkg h LEU 50 Cb 1.32 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 41.88 1vkg h LEU 50 CO 0.57 0.63 0.50 1.12 0.09 0.00 0.00 178.44 181.35 1vkg h HIS 51 N 0.50 0.46 -0.17 1.13 2.07 -1.87 0.22 115.15 117.49 1vkg h HIS 51 Ca 0.10 0.01 0.05 0.00 -2.85 0.00 0.00 60.37 57.68 1vkg h HIS 51 Cb 0.44 -0.15 -0.01 0.00 2.57 0.00 0.00 27.41 30.26 1vkg h HIS 51 CO 0.02 0.18 0.24 0.87 -3.07 0.00 0.00 177.93 176.16 1vkg h LYS 52 N 0.40 0.00 -0.60 5.12 1.79 -1.76 0.93 116.57 122.44 1vkg h LYS 52 Ca 0.37 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.84 1vkg h LYS 52 Cb 0.87 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.52 1vkg h LYS 52 CO -0.11 0.00 0.00 1.04 -1.08 0.00 0.00 179.45 179.30 1vkg n GLN 53 N -3.56 4.06 -4.40 3.15 6.02 0.77 -4.95 117.38 118.46 1vkg n GLN 53 Ca 0.01 -2.97 -0.20 0.00 -0.01 0.00 0.00 57.00 53.84 1vkg n GLN 53 Cb 0.36 -2.00 -0.10 0.00 1.02 0.00 0.00 30.24 29.51 1vkg n GLN 53 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1vkg s MET 54 N -2.18 1.51 -0.26 -1.09 -1.94 0.32 -4.69 119.30 110.97 1vkg s MET 54 Ca 0.51 -1.79 -0.11 0.00 -1.71 0.00 0.00 55.69 52.60 1vkg s MET 54 Cb 0.36 -0.86 -0.05 0.00 2.01 0.00 0.00 34.83 36.29 1vkg s MET 54 CO 0.21 -0.09 0.18 0.50 -0.01 0.00 0.00 175.02 175.81 1vkg s ARG 55 N -3.83 4.01 -0.09 2.03 3.52 -0.36 -4.95 118.95 119.27 1vkg s ARG 55 Ca 0.32 -0.30 -0.11 0.00 -0.13 0.00 0.00 55.73 55.51 1vkg s ARG 55 Cb 0.06 -3.60 -0.05 0.00 -1.56 0.00 0.00 34.95 29.80 1vkg s ARG 55 CO 0.12 -0.06 0.26 0.42 -0.81 0.00 0.00 175.30 175.22 1vkg s ILE 56 N 1.42 5.31 0.07 4.11 1.01 -1.26 -0.03 121.20 131.82 1vkg s ILE 56 Ca 0.07 0.48 0.07 0.00 0.00 0.00 0.00 60.65 61.27 1vkg s ILE 56 Cb -0.15 -3.55 -0.03 0.00 0.01 0.00 0.00 42.46 38.74 1vkg s ILE 56 CO 0.08 0.55 -0.18 -0.69 0.00 0.00 0.00 174.94 174.69 1vkg s VAL 57 N -0.65 1.47 -0.24 2.92 1.01 0.29 -4.88 120.40 120.32 1vkg s VAL 57 Ca 0.18 -1.28 -0.10 0.00 0.00 0.00 0.00 61.98 60.78 1vkg s VAL 57 Cb -0.14 -1.33 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 1vkg s VAL 57 CO 0.07 0.01 0.16 -0.75 0.00 0.00 0.00 175.10 174.59 1vkg s LYS 58 N -1.48 4.06 0.95 2.72 2.20 -1.26 -0.61 119.74 126.32 1vkg s LYS 58 Ca 0.04 -0.28 -0.11 0.00 -0.36 0.00 0.00 55.97 55.26 1vkg s LYS 58 Cb -0.09 -3.53 0.16 0.00 -1.51 0.00 0.00 37.83 32.86 1vkg s LYS 58 CO 0.03 0.06 1.09 -1.25 -0.36 0.00 0.00 175.35 174.91 1vkg s PRO 59 N 1.06 0.76 0.49 4.03 0.04 -1.26 -4.97 135.00 135.15 1vkg s PRO 59 Ca 0.07 0.97 0.06 0.00 0.04 0.00 0.00 61.00 62.15 1vkg s PRO 59 Cb -0.14 -1.74 0.01 0.00 0.04 0.00 0.00 34.50 32.67 1vkg s PRO 59 CO 0.04 -2.62 0.38 -1.59 0.04 0.00 0.00 177.00 173.25 1vkg s LYS 60 N -4.78 2.33 -0.16 4.56 -2.85 -1.26 -4.96 119.74 112.62 1vkg s LYS 60 Ca 0.65 -1.84 -0.04 0.00 -1.00 0.00 0.00 55.97 53.73 1vkg s LYS 60 Cb -0.20 -2.18 -0.03 0.00 -2.06 0.00 0.00 37.83 33.36 1vkg s LYS 60 CO 0.59 -0.43 -0.02 0.08 0.10 0.00 0.00 175.35 175.67 1vkg s VAL 61 N -2.66 4.01 1.00 1.79 1.01 -1.26 -3.66 120.40 120.63 1vkg s VAL 61 Ca 0.40 -0.31 -0.11 0.00 0.00 0.00 0.00 61.98 61.95 1vkg s VAL 61 Cb -0.02 -2.77 0.19 0.00 0.00 0.00 0.00 36.38 33.78 1vkg s VAL 61 CO 0.24 0.48 1.09 0.00 0.00 0.00 0.00 175.10 176.91 1vkg s ALA 62 N 0.43 0.80 0.25 5.51 0.00 0.08 -4.85 121.76 123.98 1vkg s ALA 62 Ca -0.03 0.19 0.08 0.00 0.00 0.00 0.00 51.96 52.20 1vkg s ALA 62 Cb -0.14 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 1vkg s ALA 62 CO 0.02 -3.04 0.12 -1.54 0.00 0.00 0.00 175.76 171.32 1vkg s SER 63 N -2.79 5.19 0.19 0.00 1.04 -1.26 -4.88 113.70 111.19 1vkg s SER 63 Ca 0.66 -0.37 -0.14 0.00 0.48 0.00 0.00 55.95 56.58 1vkg s SER 63 Cb -0.22 -1.22 0.18 0.00 0.10 0.00 0.00 66.02 64.85 1vkg s SER 63 CO 0.60 -0.01 1.67 -0.03 0.98 0.00 0.00 173.24 176.45 1vkg h MET 64 N 1.73 0.07 -0.63 4.02 4.05 -1.99 0.24 114.93 122.42 1vkg h MET 64 Ca -0.47 -0.00 0.18 0.00 -0.28 0.00 0.00 59.70 59.13 1vkg h MET 64 Cb 1.24 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 32.00 1vkg h MET 64 CO 0.61 0.05 0.50 1.05 0.23 0.00 0.00 176.91 179.34 1vkg h GLU 65 N 0.07 0.00 0.16 0.39 4.11 -1.96 0.19 114.58 117.54 1vkg h GLU 65 Ca 0.24 0.00 -0.35 0.00 0.07 0.00 0.00 59.36 59.32 1vkg h GLU 65 Cb 0.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1vkg h GLU 65 CO -0.45 0.00 -1.82 0.93 0.07 0.00 0.00 179.01 177.75 1vkg h GLU 66 N 0.00 0.34 -0.52 1.06 5.08 -1.00 -3.24 114.58 116.30 1vkg h GLU 66 Ca 0.30 -0.58 -0.07 0.00 -1.00 0.00 0.00 59.36 58.01 1vkg h GLU 66 Cb 1.29 0.22 -0.02 0.00 0.50 0.00 0.00 28.75 30.74 1vkg h GLU 66 CO -0.00 1.28 0.03 0.52 -1.00 0.00 0.00 179.01 179.84 1vkg h MET 67 N 0.06 0.85 0.00 2.33 2.86 -0.43 -1.55 114.93 119.06 1vkg h MET 67 Ca -0.37 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.05 1vkg h MET 67 Cb 2.05 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 33.61 1vkg h MET 67 CO 0.14 0.83 0.00 0.00 1.06 0.00 0.00 176.91 178.94 1vkg n ALA 68 N -2.47 1.61 0.18 6.32 0.00 0.61 -0.76 120.51 125.99 1vkg n ALA 68 Ca 0.03 -0.04 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1vkg n ALA 68 Cb 0.29 -1.13 0.30 0.00 0.00 0.00 0.00 19.45 18.92 1vkg n ALA 68 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1vkg h THR 69 N 0.00 1.07 0.00 0.00 2.02 -1.30 -3.33 112.91 111.37 1vkg h THR 69 Ca 0.00 -1.64 -0.04 0.00 0.77 0.00 0.00 66.41 65.50 1vkg h THR 69 Cb 0.05 1.95 -0.01 0.00 -1.74 0.00 0.00 68.15 68.40 1vkg h THR 69 CO 0.00 0.43 -1.17 0.33 0.37 0.00 0.00 175.52 175.48 1vkg n PHE 70 N -3.67 0.00 -3.39 3.16 7.35 -0.92 -5.06 117.46 114.93 1vkg n PHE 70 Ca -0.01 0.00 -0.28 0.00 -0.76 0.00 0.00 57.45 56.40 1vkg n PHE 70 Cb 0.52 -0.11 -0.03 0.00 0.35 0.00 0.00 39.48 40.21 1vkg n PHE 70 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1vkg s HIS 71 N -2.06 3.48 0.00 -5.13 3.76 0.06 -4.50 115.29 110.90 1vkg s HIS 71 Ca -0.03 0.57 -0.30 0.00 -0.15 0.00 0.00 55.06 55.15 1vkg s HIS 71 Cb 0.01 -2.05 -0.04 0.00 1.11 0.00 0.00 32.58 31.61 1vkg s HIS 71 CO 0.07 0.19 1.12 0.95 -0.85 0.00 0.00 174.74 176.23 1vkg s THR 72 N -2.08 4.38 0.24 1.30 -4.23 0.29 -4.29 115.64 111.25 1vkg s THR 72 Ca 0.43 1.70 -0.09 0.00 -1.18 0.00 0.00 61.69 62.55 1vkg s THR 72 Cb -0.11 -4.09 0.36 0.00 1.34 0.00 0.00 72.50 70.01 1vkg s THR 72 CO 0.30 0.09 1.37 0.47 -0.54 0.00 0.00 174.62 176.31 1vkg n ASP 73 N 4.33 -0.37 -0.20 3.99 8.00 -1.26 0.11 116.55 131.14 1vkg n ASP 73 Ca 0.09 1.52 -0.02 0.00 0.71 0.00 0.00 54.79 57.09 1vkg n ASP 73 Cb 0.48 -0.43 0.05 0.00 -0.02 0.00 0.00 41.12 41.19 1vkg n ASP 73 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vkg h ALA 74 N 1.64 0.33 0.49 2.24 0.00 -1.97 0.86 119.26 122.86 1vkg h ALA 74 Ca 0.40 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.51 1vkg h ALA 74 Cb 0.62 0.52 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1vkg h ALA 74 CO -0.90 -0.47 -0.23 -0.92 0.00 0.00 0.00 179.25 176.73 1vkg h TYR 75 N -0.03 -0.61 -0.84 0.00 3.20 0.39 -1.24 116.97 117.84 1vkg h TYR 75 Ca 0.29 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.23 1vkg h TYR 75 Cb 0.47 0.20 -0.07 0.00 1.54 0.00 0.00 36.73 38.87 1vkg h TYR 75 CO -0.52 -0.33 0.49 -0.07 -1.64 0.00 0.00 178.16 176.08 1vkg h LEU 76 N -0.76 0.71 -0.48 2.82 3.38 -0.87 0.24 115.31 120.35 1vkg h LEU 76 Ca -0.07 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 1vkg h LEU 76 Cb 0.55 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1vkg h LEU 76 CO 0.11 0.41 0.29 1.56 0.09 0.00 0.00 178.44 180.90 1vkg h GLN 77 N 0.83 0.65 0.34 1.13 4.20 -0.71 -0.46 115.11 121.09 1vkg h GLN 77 Ca 0.40 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 59.03 1vkg h GLN 77 Cb 0.34 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1vkg h GLN 77 CO -0.24 0.47 -0.17 1.25 -0.67 0.00 0.00 178.83 179.48 1vkg h HIS 78 N 0.64 -0.43 -0.77 2.96 2.76 -0.34 -1.24 115.15 118.73 1vkg h HIS 78 Ca 0.17 -0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.44 1vkg h HIS 78 Cb -0.01 0.14 -0.12 0.00 1.55 0.00 0.00 27.41 28.97 1vkg h HIS 78 CO -0.03 -0.10 -0.45 1.25 -1.30 0.00 0.00 177.93 177.30 1vkg h LEU 79 N -0.79 -1.58 0.23 0.26 5.85 -0.47 -0.34 115.31 118.47 1vkg h LEU 79 Ca -0.05 0.28 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1vkg h LEU 79 Cb 0.52 0.75 -0.04 0.00 0.37 0.00 0.00 40.66 42.26 1vkg h LEU 79 CO 0.08 -0.30 -0.41 -0.61 -0.34 0.00 0.00 178.44 176.86 1vkg h GLN 80 N -0.12 -0.69 -0.87 1.25 4.15 -1.06 0.32 115.11 118.09 1vkg h GLN 80 Ca 0.22 0.05 0.09 0.00 0.77 0.00 0.00 58.65 59.78 1vkg h GLN 80 Cb 0.55 0.16 -0.12 0.00 0.21 0.00 0.00 27.48 28.28 1vkg h GLN 80 CO -0.82 -0.46 -0.56 -0.22 -1.93 0.00 0.00 178.83 174.85 1vkg h LYS 81 N -0.72 -0.08 -0.02 1.69 3.64 0.11 -0.39 116.57 120.80 1vkg h LYS 81 Ca -0.00 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1vkg h LYS 81 Cb 0.69 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1vkg h LYS 81 CO -0.17 -0.06 0.01 0.28 -2.27 0.00 0.00 179.45 177.25 1vkg h VAL 82 N -0.09 1.05 -0.80 2.00 2.07 -0.92 -3.19 116.25 116.37 1vkg h VAL 82 Ca 0.16 -0.16 0.23 0.00 0.82 0.00 0.00 66.70 67.76 1vkg h VAL 82 Cb 0.47 1.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1vkg h VAL 82 CO -0.87 0.04 0.76 -0.24 0.02 0.00 0.00 177.57 177.29 1vkg n SER 83 N -5.05 0.00 -0.11 0.57 2.88 0.08 0.81 113.62 112.81 1vkg n SER 83 Ca -0.07 0.49 -0.23 0.00 -1.33 0.00 0.00 58.87 57.73 1vkg n SER 83 Cb 0.06 -0.20 -0.11 0.00 -0.75 0.00 0.00 64.21 63.21 1vkg n SER 83 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vkg n GLN 84 N -2.67 0.57 0.20 -1.46 10.64 -1.20 -0.72 117.38 122.73 1vkg n GLN 84 Ca 0.18 0.50 -0.16 0.00 -1.83 0.00 0.00 57.00 55.69 1vkg n GLN 84 Cb 1.00 -1.68 -0.08 0.00 -0.86 0.00 0.00 30.24 28.62 1vkg n GLN 84 CO 0.00 0.00 0.00 0.93 -1.83 0.00 0.00 177.06 176.16 1vkg h GLU 85 N -1.00 -0.76 0.00 2.61 5.08 0.29 -3.44 114.58 117.37 1vkg h GLU 85 Ca -0.43 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1vkg h GLU 85 Cb 1.36 0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.79 1vkg h GLU 85 CO -0.26 -0.51 0.00 0.41 -1.00 0.00 0.00 179.01 177.65 1vkg n GLY 86 N -1.50 0.21 3.29 -3.84 0.00 -0.52 -4.80 105.19 98.02 1vkg n GLY 86 Ca -0.09 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.67 1vkg n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vkg s ASP 87 N -4.00 6.93 -0.02 1.61 3.68 -1.26 -4.35 116.67 119.25 1vkg s ASP 87 Ca 0.00 -3.49 0.03 0.00 2.13 0.00 0.00 52.55 51.22 1vkg s ASP 87 Cb 0.00 -2.14 0.04 0.00 -1.45 0.00 0.00 42.92 39.37 1vkg s ASP 87 CO 0.00 -0.31 0.99 0.47 0.13 0.00 0.00 175.17 176.46 1vkg n ASP 88 N 2.81 1.91 -0.55 -0.34 8.00 -1.26 -5.08 116.55 122.04 1vkg n ASP 88 Ca 0.22 -2.09 0.00 0.00 0.71 0.00 0.00 54.79 53.62 1vkg n ASP 88 Cb 0.40 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 1vkg n ASP 88 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vkg n ALA 104 N -0.59 -2.90 -3.03 2.24 0.00 -1.26 -5.20 120.51 109.77 1vkg n ALA 104 Ca 0.02 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1vkg n ALA 104 Cb 0.32 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.17 1vkg n ALA 104 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1vkg n THR 105 N 0.05 0.00 -4.00 0.00 5.66 -1.26 -4.82 114.28 109.91 1vkg n THR 105 Ca 0.00 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.68 1vkg n THR 105 Cb 0.00 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 68.72 1vkg n THR 105 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1vkg s GLU 106 N 0.79 3.18 0.00 1.09 8.01 -1.26 -4.11 118.70 126.39 1vkg s GLU 106 Ca 0.00 -0.51 0.00 0.00 0.01 0.00 0.00 54.97 54.47 1vkg s GLU 106 Cb 0.00 -2.91 0.00 0.00 -4.31 0.00 0.00 34.13 26.91 1vkg s GLU 106 CO 0.00 0.62 0.00 0.41 0.01 0.00 0.00 175.26 176.30 1vkg n GLY 107 N 0.66 3.17 0.06 -1.39 0.00 0.10 -4.60 105.19 103.18 1vkg n GLY 107 Ca -0.09 -0.92 0.03 0.00 0.00 0.00 0.00 46.02 45.04 1vkg n GLY 107 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1vkg n ILE 108 N 0.00 -0.07 -0.03 -0.61 -5.35 -1.26 0.14 119.36 112.17 1vkg n ILE 108 Ca 0.00 0.35 -0.14 0.00 -0.27 0.00 0.00 62.75 62.69 1vkg n ILE 108 Cb 0.00 -0.52 -0.10 0.00 -1.74 0.00 0.00 39.64 37.28 1vkg n ILE 108 CO 0.00 0.00 0.00 0.15 -1.76 0.00 0.00 176.55 174.94 1vkg h PHE 109 N 0.00 0.23 -0.43 4.28 3.57 -1.87 0.25 116.94 122.98 1vkg h PHE 109 Ca 0.10 -0.11 0.03 0.00 3.53 0.00 0.00 57.97 61.52 1vkg h PHE 109 Cb 0.22 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 1vkg h PHE 109 CO -0.07 0.83 0.23 -0.44 -2.23 0.00 0.00 178.31 176.63 1vkg h ASP 110 N -0.43 0.35 0.38 0.41 3.45 0.78 0.12 116.42 121.47 1vkg h ASP 110 Ca -0.01 0.01 -0.00 0.00 0.43 0.00 0.00 57.03 57.46 1vkg h ASP 110 Cb 0.86 -0.05 -0.03 0.00 -0.56 0.00 0.00 39.33 39.55 1vkg h ASP 110 CO 0.04 0.25 -0.43 0.22 -1.57 0.00 0.00 179.24 177.75 1vkg h TYR 111 N 0.46 -1.17 -0.21 4.55 5.03 -0.78 -2.27 116.97 122.58 1vkg h TYR 111 Ca 0.18 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.53 1vkg h TYR 111 Cb 0.06 0.46 -0.03 0.00 1.55 0.00 0.00 36.73 38.77 1vkg h TYR 111 CO -0.09 -0.58 0.01 0.00 -1.32 0.00 0.00 178.16 176.19 1vkg h ALA 112 N -0.50 0.19 -0.93 1.82 0.00 -0.28 -2.16 119.26 117.41 1vkg h ALA 112 Ca -0.03 0.05 0.18 0.00 0.00 0.00 0.00 54.91 55.11 1vkg h ALA 112 Cb 0.76 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.52 1vkg h ALA 112 CO -0.09 -0.42 0.51 0.00 0.00 0.00 0.00 179.25 179.25 1vkg h ALA 113 N 1.17 1.48 0.64 0.00 0.00 -0.65 0.70 119.26 122.60 1vkg h ALA 113 Ca 0.10 0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1vkg h ALA 113 Cb 0.11 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.89 1vkg h ALA 113 CO -0.15 -0.11 -0.31 0.00 0.00 0.00 0.00 179.25 178.68 1vkg h ALA 114 N 1.62 -0.87 -0.66 0.00 0.00 -0.85 0.72 119.26 119.22 1vkg h ALA 114 Ca 0.53 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.30 1vkg h ALA 114 Cb 0.83 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.90 1vkg h ALA 114 CO -0.40 -0.81 0.39 0.82 0.00 0.00 0.00 179.25 179.25 1vkg h ILE 115 N -1.22 1.01 -0.11 0.00 2.04 -1.23 0.25 117.51 118.25 1vkg h ILE 115 Ca -0.09 -0.25 0.04 0.00 1.00 0.00 0.00 64.86 65.57 1vkg h ILE 115 Cb 0.66 0.22 -0.05 0.00 -0.74 0.00 0.00 36.82 36.91 1vkg h ILE 115 CO 0.14 0.13 -0.20 1.23 0.00 0.00 0.00 178.15 179.46 1vkg h GLY 116 N 0.73 -0.18 0.47 5.37 0.00 -0.91 -0.49 103.07 108.06 1vkg h GLY 116 Ca 0.29 0.24 0.08 0.00 0.00 0.00 0.00 47.33 47.93 1vkg h GLY 116 CO -0.15 -0.18 0.22 -1.33 0.00 0.00 0.00 176.54 175.10 1vkg h GLY 117 N -0.26 0.79 0.31 4.60 0.00 0.13 -1.47 103.07 107.18 1vkg h GLY 117 Ca 0.09 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.31 1vkg h GLY 117 CO -0.26 0.01 -0.44 0.00 0.00 0.00 0.00 176.54 175.85 1vkg h ALA 118 N 1.38 -0.82 -0.21 3.60 0.00 0.69 0.20 119.26 124.10 1vkg h ALA 118 Ca 0.28 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.15 1vkg h ALA 118 Cb 0.31 0.71 -0.06 0.00 0.00 0.00 0.00 17.79 18.76 1vkg h ALA 118 CO -0.27 -1.02 -0.16 1.15 0.00 0.00 0.00 179.25 178.94 1vkg h THR 119 N -0.71 0.54 -0.88 0.00 2.02 -0.78 -0.42 112.91 112.68 1vkg h THR 119 Ca 0.01 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.26 1vkg h THR 119 Cb 0.71 0.54 -0.06 0.00 -1.74 0.00 0.00 68.15 67.60 1vkg h THR 119 CO -0.21 0.00 0.57 0.40 0.37 0.00 0.00 175.52 176.65 1vkg h ILE 120 N -0.17 1.02 -0.48 3.11 2.04 -0.86 0.69 117.51 122.87 1vkg h ILE 120 Ca 0.12 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.61 1vkg h ILE 120 Cb 0.35 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 1vkg h ILE 120 CO -0.31 0.17 0.09 0.74 0.00 0.00 0.00 178.15 178.83 1vkg h THR 121 N 0.94 1.22 -0.51 -0.27 2.02 0.96 0.57 112.91 117.84 1vkg h THR 121 Ca 0.39 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.71 1vkg h THR 121 Cb 0.30 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1vkg h THR 121 CO -0.16 0.30 0.14 0.00 0.37 0.00 0.00 175.52 176.17 1vkg h ALA 122 N 1.38 0.67 0.17 6.16 0.00 0.27 -1.66 119.26 126.25 1vkg h ALA 122 Ca 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1vkg h ALA 122 Cb 0.31 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1vkg h ALA 122 CO 0.00 0.35 -0.08 0.00 0.00 0.00 0.00 179.25 179.52 1vkg h ALA 123 N 1.00 -0.23 -0.71 0.00 0.00 -0.76 -2.41 119.26 116.16 1vkg h ALA 123 Ca 0.16 -0.14 0.15 0.00 0.00 0.00 0.00 54.91 55.08 1vkg h ALA 123 Cb 0.31 0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 1vkg h ALA 123 CO -0.00 -0.51 0.18 0.37 0.00 0.00 0.00 179.25 179.28 1vkg h GLN 124 N -0.46 0.28 -0.66 0.00 5.75 -0.75 0.11 115.11 119.38 1vkg h GLN 124 Ca -0.02 -0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.43 1vkg h GLN 124 Cb 0.36 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 28.81 1vkg h GLN 124 CO 0.04 0.18 0.31 0.00 -2.65 0.00 0.00 178.83 176.71 1vkg h LEU 126 N 0.91 -0.46 -0.68 0.00 3.38 -0.64 -1.42 115.31 116.39 1vkg h LEU 126 Ca 0.23 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.31 1vkg h LEU 126 Cb 0.13 0.12 -0.08 0.00 0.09 0.00 0.00 40.66 40.91 1vkg h LEU 126 CO -0.03 -0.31 0.25 0.40 0.09 0.00 0.00 178.44 178.85 1vkg h ILE 127 N -0.57 0.70 -0.22 1.22 1.08 -0.63 -1.02 117.51 118.08 1vkg h ILE 127 Ca -0.06 -0.14 -0.16 0.00 -0.39 0.00 0.00 64.86 64.11 1vkg h ILE 127 Cb 0.43 0.25 -0.06 0.00 -3.07 0.00 0.00 36.82 34.37 1vkg h ILE 127 CO 0.09 0.08 0.09 0.47 -0.69 0.00 0.00 178.15 178.18 1vkg n ASP 128 N -5.01 5.74 -2.51 1.72 8.00 0.86 -4.83 116.55 120.51 1vkg n ASP 128 Ca 0.11 -2.67 -0.01 0.00 0.71 0.00 0.00 54.79 52.94 1vkg n ASP 128 Cb 0.34 -1.16 -0.00 0.00 -0.02 0.00 0.00 41.12 40.28 1vkg n ASP 128 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1vkg n GLY 129 N 1.28 -0.00 0.12 0.44 0.00 -0.38 -4.67 105.19 101.97 1vkg n GLY 129 Ca 0.19 0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 1vkg n GLY 129 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1vkg n MET 130 N -1.08 0.65 -4.22 1.61 0.00 -0.57 -4.99 117.12 108.51 1vkg n MET 130 Ca -0.01 0.40 -0.13 0.00 0.00 0.00 0.00 57.70 57.96 1vkg n MET 130 Cb 0.02 -1.69 -0.10 0.00 0.00 0.00 0.00 33.22 31.45 1vkg n MET 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1vkg n LYS 132 N -0.27 2.21 -3.83 0.00 5.02 -1.26 -4.45 118.16 115.58 1vkg n LYS 132 Ca -0.02 -0.44 -0.17 0.00 -2.02 0.00 0.00 58.31 55.66 1vkg n LYS 132 Cb 0.65 -0.92 -0.16 0.00 -0.02 0.00 0.00 35.03 34.58 1vkg n LYS 132 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1vkg s VAL 133 N -0.80 0.06 0.00 -0.18 1.01 -1.26 -0.03 120.40 119.20 1vkg s VAL 133 Ca 0.04 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.25 1vkg s VAL 133 Cb 0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 36.38 36.20 1vkg s VAL 133 CO 0.10 0.13 -0.14 0.00 0.00 0.00 0.00 175.10 175.19 1vkg s ALA 134 N 1.25 1.21 -0.05 5.51 0.00 -0.35 -2.36 121.76 126.97 1vkg s ALA 134 Ca -0.07 -0.68 0.06 0.00 0.00 0.00 0.00 51.96 51.27 1vkg s ALA 134 Cb -0.13 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.70 1vkg s ALA 134 CO -0.03 0.28 -0.22 0.42 0.00 0.00 0.00 175.76 176.22 1vkg s ILE 135 N -0.47 1.77 -0.43 0.00 1.01 0.80 -1.22 121.20 122.66 1vkg s ILE 135 Ca 0.05 -0.92 0.05 0.00 0.00 0.00 0.00 60.65 59.83 1vkg s ILE 135 Cb -0.06 -1.50 0.18 0.00 0.01 0.00 0.00 42.46 41.09 1vkg s ILE 135 CO -0.00 0.50 0.42 -3.20 0.00 0.00 0.00 174.94 172.66 1vkg n ASN 136 N 2.95 -0.92 0.04 3.58 5.15 -0.04 -1.69 115.26 124.32 1vkg n ASN 136 Ca -0.17 -2.49 0.06 0.00 -0.60 0.00 0.00 54.58 51.37 1vkg n ASN 136 Cb 0.52 -0.18 0.28 0.00 -0.53 0.00 0.00 39.78 39.87 1vkg n ASN 136 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 1vkg n TRP 137 N 2.71 0.23 0.58 1.20 7.02 -1.26 -1.80 117.44 126.13 1vkg n TRP 137 Ca 0.27 0.10 0.11 0.00 -1.02 0.00 0.00 57.50 56.96 1vkg n TRP 137 Cb 0.50 -0.67 0.27 0.00 -2.42 0.00 0.00 31.31 28.99 1vkg n TRP 137 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 1vkg n SER 138 N -1.72 2.78 -4.49 -0.99 7.64 -1.26 -3.72 113.62 111.86 1vkg n SER 138 Ca 0.01 -1.91 -0.17 0.00 1.01 0.00 0.00 58.87 57.81 1vkg n SER 138 Cb 0.11 -0.23 0.05 0.00 -1.01 0.00 0.00 64.21 63.12 1vkg n SER 138 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vkg n GLY 139 N 1.36 2.10 0.00 0.23 0.00 -0.74 -4.83 105.19 103.30 1vkg n GLY 139 Ca 0.18 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.98 1vkg n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkg n GLY 140 N -0.96 1.59 3.56 -0.02 0.00 -1.26 -0.55 105.19 107.55 1vkg n GLY 140 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1vkg n GLY 140 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1vkg s TRP 141 N -2.00 2.70 -2.13 1.61 0.52 -1.26 -4.55 118.94 113.84 1vkg s TRP 141 Ca 0.00 -1.30 0.16 0.00 0.02 0.00 0.00 56.10 54.98 1vkg s TRP 141 Cb 0.00 -4.71 0.53 0.00 -1.15 0.00 0.00 33.47 28.14 1vkg s TRP 141 CO 0.00 -1.84 1.40 -2.39 0.02 0.00 0.00 176.95 174.14 1vkg n HIS 142 N 8.47 0.34 0.78 -1.98 1.44 -1.26 -3.78 115.22 119.24 1vkg n HIS 142 Ca 0.41 -0.17 0.11 0.00 -2.01 0.00 0.00 57.72 56.06 1vkg n HIS 142 Cb 0.48 0.00 0.11 0.00 0.12 0.00 0.00 29.99 30.70 1vkg n HIS 142 CO 0.00 0.00 0.00 0.72 -2.81 0.00 0.00 176.34 174.25 1vkg n HIS 143 N 0.42 0.08 -2.93 -1.40 8.25 -1.26 -1.39 115.22 116.98 1vkg n HIS 143 Ca 0.14 -0.04 -0.30 0.00 -0.26 0.00 0.00 57.72 57.25 1vkg n HIS 143 Cb 0.31 -0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.38 1vkg n HIS 143 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vkg s ALA 144 N -1.71 3.37 0.41 -1.41 0.00 -1.26 -3.50 121.76 117.66 1vkg s ALA 144 Ca 0.26 -0.20 0.07 0.00 0.00 0.00 0.00 51.96 52.10 1vkg s ALA 144 Cb 0.18 -2.68 -0.06 0.00 0.00 0.00 0.00 23.12 20.56 1vkg s ALA 144 CO 0.27 0.06 0.10 0.15 0.00 0.00 0.00 175.76 176.34 1vkg s LYS 145 N -3.71 2.11 0.36 0.00 -0.14 0.37 -4.43 119.74 114.30 1vkg s LYS 145 Ca 0.51 -1.94 0.03 0.00 -1.36 0.00 0.00 55.97 53.21 1vkg s LYS 145 Cb -0.10 -1.85 0.66 0.00 -1.68 0.00 0.00 37.83 34.86 1vkg s LYS 145 CO 0.29 -0.07 2.01 1.57 -0.76 0.00 0.00 175.35 178.39 1vkg h LYS 146 N 1.59 0.80 0.00 1.68 2.10 -1.93 -3.07 116.57 117.74 1vkg h LYS 146 Ca -0.43 -0.05 -0.04 0.00 -2.00 0.00 0.00 60.65 58.13 1vkg h LYS 146 Cb 1.25 -0.18 -0.08 0.00 -0.90 0.00 0.00 32.23 32.32 1vkg h LYS 146 CO 0.74 0.53 -0.51 -0.40 -2.00 0.00 0.00 179.45 177.81 1vkg n ASP 147 N -4.45 1.57 -3.58 7.07 3.85 -1.26 -0.55 116.55 119.21 1vkg n ASP 147 Ca 0.06 -3.24 -0.13 0.00 -0.71 0.00 0.00 54.79 50.77 1vkg n ASP 147 Cb 0.06 -0.44 -0.06 0.00 -1.35 0.00 0.00 41.12 39.32 1vkg n ASP 147 CO 0.00 0.00 0.00 -0.70 -1.01 0.00 0.00 177.20 175.49 1vkg s GLU 148 N -2.31 0.77 -0.13 0.11 2.12 -1.16 -4.96 118.70 113.15 1vkg s GLU 148 Ca 0.33 0.42 -0.07 0.00 0.36 0.00 0.00 54.97 56.01 1vkg s GLU 148 Cb 0.33 0.37 -0.04 0.00 0.26 0.00 0.00 34.13 35.05 1vkg s GLU 148 CO -0.07 -0.19 0.11 0.00 -0.54 0.00 0.00 175.26 174.57 1vkg s ALA 149 N -0.62 3.74 0.05 6.30 0.00 -1.26 -0.48 121.76 129.48 1vkg s ALA 149 Ca -0.04 -0.68 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 1vkg s ALA 149 Cb -0.02 -1.92 -0.02 0.00 0.00 0.00 0.00 23.12 21.17 1vkg s ALA 149 CO 0.03 0.53 0.07 0.45 0.00 0.00 0.00 175.76 176.85 1vkg s SER 150 N -0.75 0.25 -0.82 0.00 0.15 -0.44 -4.93 113.70 107.15 1vkg s SER 150 Ca 0.13 -0.67 -0.14 0.00 0.70 0.00 0.00 55.95 55.97 1vkg s SER 150 Cb -0.12 0.23 0.02 0.00 -1.71 0.00 0.00 66.02 64.45 1vkg s SER 150 CO 0.03 -0.56 0.51 0.61 1.20 0.00 0.00 173.24 175.03 1vkg n GLY 151 N 0.50 -0.87 2.32 9.45 0.00 -1.26 -0.53 105.19 114.79 1vkg n GLY 151 Ca -0.17 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1vkg n GLY 151 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vkg n PHE 152 N -3.23 -1.86 -4.25 1.61 3.01 -1.26 -4.79 117.46 106.68 1vkg n PHE 152 Ca -0.18 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 57.94 1vkg n PHE 152 Cb 0.51 -0.97 -0.15 0.00 -0.01 0.00 0.00 39.48 38.86 1vkg n PHE 152 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1vkg n TYR 154 N 4.38 0.00 -3.74 0.00 4.02 -1.26 -1.33 117.16 119.22 1vkg n TYR 154 Ca -0.19 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.57 1vkg n TYR 154 Cb 0.51 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.73 1vkg n TYR 154 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 1vkg s LEU 155 N -0.62 0.61 -0.95 7.72 2.96 -1.26 -4.87 118.68 122.27 1vkg s LEU 155 Ca 0.08 0.58 -0.02 0.00 -0.22 0.00 0.00 54.13 54.56 1vkg s LEU 155 Cb 0.06 1.31 0.27 0.00 0.50 0.00 0.00 46.19 48.33 1vkg s LEU 155 CO 0.09 -0.22 1.10 -3.20 -1.32 0.00 0.00 176.35 172.79 1vkg n ASN 156 N 2.42 5.17 0.34 3.68 2.85 -1.26 -4.59 115.26 123.86 1vkg n ASN 156 Ca -0.15 -3.29 0.16 0.00 -0.11 0.00 0.00 54.58 51.18 1vkg n ASN 156 Cb 0.57 -1.10 0.86 0.00 1.24 0.00 0.00 39.78 41.35 1vkg n ASN 156 CO 0.00 0.00 0.00 -2.24 -2.11 0.00 0.00 177.26 172.91 1vkg h ASP 157 N 5.49 0.00 -0.07 1.20 3.04 -1.95 0.07 116.42 124.21 1vkg h ASP 157 Ca 0.19 0.00 -0.10 0.00 -3.24 0.00 0.00 57.03 53.88 1vkg h ASP 157 Cb 0.71 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.01 1vkg h ASP 157 CO 1.06 0.00 -0.36 0.00 -2.04 0.00 0.00 179.24 177.91 1vkg h ALA 158 N 1.41 0.13 0.09 4.15 0.00 -1.89 -2.58 119.26 120.57 1vkg h ALA 158 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 1vkg h ALA 158 Cb 0.60 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 1vkg h ALA 158 CO -0.00 0.22 -0.06 0.28 0.00 0.00 0.00 179.25 179.69 1vkg h VAL 159 N -0.13 0.88 -0.93 0.00 2.07 -1.35 -0.82 116.25 115.97 1vkg h VAL 159 Ca -0.03 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.73 1vkg h VAL 159 Cb 1.01 0.88 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 1vkg h VAL 159 CO 0.07 0.00 0.63 -0.07 0.02 0.00 0.00 177.57 178.23 1vkg h LEU 160 N -0.15 0.25 0.11 2.57 3.38 -1.51 0.23 115.31 120.20 1vkg h LEU 160 Ca -0.01 0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1vkg h LEU 160 Cb 0.12 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 40.88 1vkg h LEU 160 CO 0.01 0.09 -0.73 1.23 0.09 0.00 0.00 178.44 179.12 1vkg h GLY 161 N 0.25 0.34 0.43 0.83 0.00 -0.99 -2.55 103.07 101.37 1vkg h GLY 161 Ca 0.48 -0.81 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1vkg h GLY 161 CO -0.13 0.71 -0.47 -2.22 0.00 0.00 0.00 176.54 174.44 1vkg h ILE 162 N -0.38 0.08 -0.58 2.60 2.04 0.39 0.99 117.51 122.66 1vkg h ILE 162 Ca -0.12 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.84 1vkg h ILE 162 Cb 1.56 0.08 -0.11 0.00 -0.74 0.00 0.00 36.82 37.61 1vkg h ILE 162 CO 0.14 0.00 -0.33 -0.07 0.00 0.00 0.00 178.15 177.89 1vkg h LEU 163 N -0.86 -1.13 -2.00 1.44 3.38 -0.74 0.55 115.31 115.96 1vkg h LEU 163 Ca -0.03 0.22 0.15 0.00 0.09 0.00 0.00 57.88 58.31 1vkg h LEU 163 Cb 0.79 0.56 -0.02 0.00 0.09 0.00 0.00 40.66 42.08 1vkg h LEU 163 CO -0.13 -0.30 0.37 -0.09 0.09 0.00 0.00 178.44 178.38 1vkg h ARG 164 N -0.16 0.00 -0.01 1.13 9.65 -0.76 0.11 114.38 124.34 1vkg h ARG 164 Ca 0.23 0.00 -0.19 0.00 -1.10 0.00 0.00 59.98 58.92 1vkg h ARG 164 Cb 0.55 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.12 1vkg h ARG 164 CO -0.67 0.00 -0.84 -0.07 2.80 0.00 0.00 179.97 181.19 1vkg h LEU 165 N 0.00 0.30 -0.92 3.80 3.38 0.25 -3.24 115.31 118.88 1vkg h LEU 165 Ca 0.25 -0.23 0.23 0.00 0.09 0.00 0.00 57.88 58.22 1vkg h LEU 165 Cb 0.99 -0.09 -0.13 0.00 0.09 0.00 0.00 40.66 41.52 1vkg h LEU 165 CO -0.00 1.01 0.42 0.03 0.09 0.00 0.00 178.44 179.99 1vkg h ARG 166 N 0.14 0.39 -1.39 1.13 2.47 0.57 0.87 114.38 118.56 1vkg h ARG 166 Ca -0.04 -0.02 0.40 0.00 -1.26 0.00 0.00 59.98 59.06 1vkg h ARG 166 Cb 1.45 -0.09 -0.06 0.00 -1.65 0.00 0.00 29.97 29.62 1vkg h ARG 166 CO 0.13 0.26 1.22 0.00 0.56 0.00 0.00 179.97 182.14 1vkg h ARG 167 N 0.40 0.00 0.00 0.04 3.08 -1.60 -2.72 114.38 113.59 1vkg h ARG 167 Ca 0.59 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.64 1vkg h ARG 167 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1vkg h ARG 167 CO -0.54 0.00 -0.52 1.17 -1.07 0.00 0.00 179.97 179.01 1vkg n LYS 168 N -3.63 2.13 -3.70 0.04 4.81 -0.64 -5.02 118.16 112.15 1vkg n LYS 168 Ca 0.31 0.00 -0.37 0.00 -0.87 0.00 0.00 58.31 57.38 1vkg n LYS 168 Cb 1.65 -0.76 -0.11 0.00 0.02 0.00 0.00 35.03 35.83 1vkg n LYS 168 CO 0.00 0.00 0.00 -0.06 1.17 0.00 0.00 177.40 178.51 1vkg s PHE 169 N -1.48 3.20 -0.08 5.64 0.40 0.21 -4.98 117.98 120.88 1vkg s PHE 169 Ca 0.00 -0.03 -0.24 0.00 -0.60 0.00 0.00 56.93 56.06 1vkg s PHE 169 Cb 0.00 -2.28 -0.20 0.00 0.51 0.00 0.00 43.02 41.05 1vkg s PHE 169 CO 0.00 -0.14 0.86 1.49 0.70 0.00 0.00 175.22 178.13 1vkg h GLU 170 N 7.98 -0.06 -5.14 0.44 4.57 -1.85 -3.31 114.58 117.20 1vkg h GLU 170 Ca -0.37 0.00 -0.62 0.00 -1.18 0.00 0.00 59.36 57.20 1vkg h GLU 170 Cb 1.18 0.01 -0.16 0.00 -0.16 0.00 0.00 28.75 29.62 1vkg h GLU 170 CO 0.59 0.58 -0.54 1.03 -1.18 0.00 0.00 179.01 179.50 1vkg s ARG 171 N -3.00 3.99 0.06 1.92 0.52 -1.26 -4.71 118.95 116.47 1vkg s ARG 171 Ca -0.15 -0.32 0.09 0.00 -0.52 0.00 0.00 55.73 54.83 1vkg s ARG 171 Cb -0.01 -3.40 -0.03 0.00 0.52 0.00 0.00 34.95 32.03 1vkg s ARG 171 CO 0.57 0.11 -0.23 0.42 0.02 0.00 0.00 175.30 176.19 1vkg s ILE 172 N 0.87 2.44 -0.08 1.52 -1.09 -0.63 -1.08 121.20 123.14 1vkg s ILE 172 Ca 0.06 -1.38 0.04 0.00 -2.23 0.00 0.00 60.65 57.15 1vkg s ILE 172 Cb -0.13 -2.01 -0.01 0.00 -1.58 0.00 0.00 42.46 38.73 1vkg s ILE 172 CO 0.03 0.30 -0.23 -0.22 -1.23 0.00 0.00 174.94 173.59 1vkg s LEU 173 N -1.48 2.19 -0.14 2.97 2.96 -0.80 -0.86 118.68 123.52 1vkg s LEU 173 Ca 0.13 -0.49 0.02 0.00 -0.22 0.00 0.00 54.13 53.57 1vkg s LEU 173 Cb -0.10 -1.43 0.01 0.00 0.50 0.00 0.00 46.19 45.17 1vkg s LEU 173 CO 0.04 0.21 -0.20 -0.47 -1.32 0.00 0.00 176.35 174.61 1vkg s TYR 174 N 0.06 2.56 -0.08 5.38 5.04 0.63 -0.92 117.35 130.02 1vkg s TYR 174 Ca -0.09 -1.34 0.03 0.00 -2.44 0.00 0.00 57.07 53.23 1vkg s TYR 174 Cb -0.15 -1.76 -0.02 0.00 0.35 0.00 0.00 41.96 40.37 1vkg s TYR 174 CO 0.06 -0.64 -0.17 0.08 -1.34 0.00 0.00 175.55 173.54 1vkg s VAL 175 N 0.97 2.77 -0.25 3.14 1.01 -0.34 0.26 120.40 127.96 1vkg s VAL 175 Ca -0.04 -0.81 0.03 0.00 0.00 0.00 0.00 61.98 61.16 1vkg s VAL 175 Cb -0.15 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.20 1vkg s VAL 175 CO -0.05 0.56 -0.11 -0.62 0.00 0.00 0.00 175.10 174.89 1vkg s ASP 176 N -0.24 4.28 -0.00 3.32 -1.08 0.75 -1.73 116.67 121.97 1vkg s ASP 176 Ca 0.00 -1.32 0.21 0.00 -0.52 0.00 0.00 52.55 50.92 1vkg s ASP 176 Cb -0.13 -1.50 0.60 0.00 -1.46 0.00 0.00 42.92 40.43 1vkg s ASP 176 CO 0.03 -0.18 1.50 0.18 0.52 0.00 0.00 175.17 177.22 1vkg n LEU 177 N 4.47 3.81 -4.76 -1.34 4.77 -0.17 -2.34 117.00 121.45 1vkg n LEU 177 Ca -0.14 -2.00 -0.33 0.00 -0.03 0.00 0.00 56.01 53.50 1vkg n LEU 177 Cb 0.43 -0.45 0.06 0.00 -2.33 0.00 0.00 43.42 41.13 1vkg n LEU 177 CO 0.21 0.95 0.74 -0.62 -1.33 0.00 0.00 177.39 177.34 1vkg s ASP 178 N -1.00 4.82 0.63 -1.43 3.68 -1.26 -4.66 116.67 117.44 1vkg s ASP 178 Ca 0.45 2.03 0.38 0.00 2.13 0.00 0.00 52.55 57.54 1vkg s ASP 178 Cb 0.24 -2.55 2.12 0.00 -1.45 0.00 0.00 42.92 41.27 1vkg s ASP 178 CO 0.31 -1.83 2.30 0.25 0.13 0.00 0.00 175.17 176.33 1vkg h LEU 179 N -0.24 0.00-10.16 -1.34 5.85 -1.83 -3.41 115.31 104.18 1vkg h LEU 179 Ca -0.46 0.00 -0.47 0.00 0.84 0.00 0.00 57.88 57.79 1vkg h LEU 179 Cb 1.25 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 1vkg h LEU 179 CO 0.53 0.01 -0.42 -1.00 -0.34 0.00 0.00 178.44 177.21 1vkg s HIS 180 N -4.32 3.16 0.06 1.25 3.76 -1.26 -0.08 115.29 117.86 1vkg s HIS 180 Ca -0.05 -0.17 -0.31 0.00 -0.15 0.00 0.00 55.06 54.39 1vkg s HIS 180 Cb 0.14 -1.74 -0.07 0.00 1.11 0.00 0.00 32.58 32.02 1vkg s HIS 180 CO 0.48 0.24 1.37 -1.58 -0.85 0.00 0.00 174.74 174.40 1vkg s HIS 181 N -2.14 3.10 -0.87 1.40 2.46 -1.26 -4.68 115.29 113.29 1vkg s HIS 181 Ca 0.39 0.93 -0.06 0.00 0.47 0.00 0.00 55.06 56.80 1vkg s HIS 181 Cb -0.08 -3.64 -0.02 0.00 -0.13 0.00 0.00 32.58 28.71 1vkg s HIS 181 CO 0.29 -2.29 2.86 0.41 -2.47 0.00 0.00 174.74 173.54 1vkg n GLY 182 N 3.53 4.34 0.39 1.59 0.00 -1.26 -4.71 105.19 109.06 1vkg n GLY 182 Ca 0.12 -1.73 -0.13 0.00 0.00 0.00 0.00 46.02 44.28 1vkg n GLY 182 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1vkg h ASP 183 N 3.90 -1.24 -0.32 1.61 -0.00 -1.90 -2.75 116.42 115.72 1vkg h ASP 183 Ca 0.55 0.12 0.04 0.00 -0.00 0.00 0.00 57.03 57.74 1vkg h ASP 183 Cb 0.66 0.45 -0.05 0.00 -0.00 0.00 0.00 39.33 40.39 1vkg h ASP 183 CO 1.12 -0.46 -0.15 0.61 -0.00 0.00 0.00 179.24 180.36 1vkg n GLY 184 N -1.40 -0.74 0.17 7.15 0.00 -0.49 0.33 105.19 110.22 1vkg n GLY 184 Ca -0.07 0.37 -0.12 0.00 0.00 0.00 0.00 46.02 46.20 1vkg n GLY 184 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1vkg h VAL 185 N 0.00 0.77 -0.29 1.61 2.07 -1.58 -0.35 116.25 118.49 1vkg h VAL 185 Ca 0.09 -0.83 0.03 0.00 0.82 0.00 0.00 66.70 66.81 1vkg h VAL 185 Cb 0.17 1.20 -0.05 0.00 -1.52 0.00 0.00 31.29 31.08 1vkg h VAL 185 CO -0.31 0.16 -0.36 -0.08 0.02 0.00 0.00 177.57 177.00 1vkg h GLU 186 N -0.79 -0.23 -0.63 1.57 4.81 0.19 -0.91 114.58 118.59 1vkg h GLU 186 Ca -0.03 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.32 1vkg h GLU 186 Cb 0.51 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 29.82 1vkg h GLU 186 CO 0.05 -0.15 -0.38 0.22 -0.73 0.00 0.00 179.01 178.02 1vkg h ASP 187 N -0.24 -1.32 -0.96 1.04 1.82 -0.60 0.14 116.42 116.29 1vkg h ASP 187 Ca 0.05 0.24 0.30 0.00 -0.39 0.00 0.00 57.03 57.23 1vkg h ASP 187 Cb 0.37 0.64 -0.15 0.00 0.68 0.00 0.00 39.33 40.87 1vkg h ASP 187 CO -0.40 -0.31 0.44 0.00 -1.61 0.00 0.00 179.24 177.36 1vkg h ALA 188 N 0.89 1.72 -0.27 -0.78 0.00 0.32 -2.14 119.26 119.00 1vkg h ALA 188 Ca 0.22 0.21 -0.09 0.00 0.00 0.00 0.00 54.91 55.26 1vkg h ALA 188 Cb 0.56 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1vkg h ALA 188 CO -0.72 -0.57 -0.04 1.19 0.00 0.00 0.00 179.25 179.11 1vkg n PHE 189 N -5.14 0.90 0.85 0.00 3.01 0.31 -4.79 117.46 112.60 1vkg n PHE 189 Ca 0.29 -1.24 0.00 0.00 1.01 0.00 0.00 57.45 57.50 1vkg n PHE 189 Cb 0.90 -0.38 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 1vkg n PHE 189 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1vkg n SER 190 N -0.91 2.06 0.00 4.37 3.41 -0.17 -3.03 113.62 119.34 1vkg n SER 190 Ca 0.26 -1.70 0.00 0.00 -0.26 0.00 0.00 58.87 57.17 1vkg n SER 190 Cb 0.93 -0.42 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 1vkg n SER 190 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1vkg n PHE 191 N 0.43 0.00 -4.40 7.33 0.99 -1.26 -1.19 117.46 119.36 1vkg n PHE 191 Ca 0.00 -0.07 -0.20 0.00 -0.00 0.00 0.00 57.45 57.18 1vkg n PHE 191 Cb 0.36 -0.01 -0.10 0.00 -1.00 0.00 0.00 39.48 38.73 1vkg n PHE 191 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.76 176.68 1vkg s THR 192 N -0.14 1.33 -0.10 4.37 -1.32 -1.17 -3.11 115.64 115.50 1vkg s THR 192 Ca 0.00 -2.06 0.05 0.00 -1.21 0.00 0.00 61.69 58.47 1vkg s THR 192 Cb 0.00 -2.51 0.10 0.00 -1.51 0.00 0.00 72.50 68.57 1vkg s THR 192 CO 0.00 -0.23 1.06 -1.54 -2.21 0.00 0.00 174.62 171.70 1vkg n SER 193 N -0.56 2.19 0.12 8.08 3.41 -1.25 -3.77 113.62 121.83 1vkg n SER 193 Ca -0.04 -2.25 0.04 0.00 -0.26 0.00 0.00 58.87 56.36 1vkg n SER 193 Cb 0.64 -0.12 0.01 0.00 -0.26 0.00 0.00 64.21 64.49 1vkg n SER 193 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1vkg h LYS 194 N 0.19 0.00 -4.84 4.33 1.79 -1.93 -3.44 116.57 112.68 1vkg h LYS 194 Ca 0.00 0.00 -0.61 0.00 -2.18 0.00 0.00 60.65 57.86 1vkg h LYS 194 Cb 0.64 0.00 -0.35 0.00 -1.58 0.00 0.00 32.23 30.95 1vkg h LYS 194 CO 0.01 0.33 -0.84 0.08 -1.08 0.00 0.00 179.45 177.95 1vkg s VAL 195 N -3.02 1.64 -0.06 0.50 1.01 -1.26 -1.61 120.40 117.60 1vkg s VAL 195 Ca 0.02 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1vkg s VAL 195 Cb 0.08 -1.49 -0.03 0.00 0.00 0.00 0.00 36.38 34.94 1vkg s VAL 195 CO 0.76 0.47 -0.12 -0.32 0.00 0.00 0.00 175.10 175.88 1vkg s MET 196 N 1.03 2.63 0.09 2.72 1.75 -0.04 -4.84 119.30 122.64 1vkg s MET 196 Ca -0.05 -0.66 0.09 0.00 -1.25 0.00 0.00 55.69 53.82 1vkg s MET 196 Cb -0.15 -2.45 -0.03 0.00 2.84 0.00 0.00 34.83 35.04 1vkg s MET 196 CO -0.03 0.60 -0.23 0.95 -0.65 0.00 0.00 175.02 175.66 1vkg s THR 197 N -0.67 1.86 -0.07 10.11 -4.23 -1.11 -0.27 115.64 121.27 1vkg s THR 197 Ca 0.10 -1.51 -0.02 0.00 -1.18 0.00 0.00 61.69 59.09 1vkg s THR 197 Cb -0.11 -1.66 0.03 0.00 1.34 0.00 0.00 72.50 72.10 1vkg s THR 197 CO 0.01 0.06 0.02 -0.69 -0.54 0.00 0.00 174.62 173.48 1vkg s VAL 198 N -1.03 0.27 -0.12 2.29 1.01 0.14 -0.09 120.40 122.87 1vkg s VAL 198 Ca 0.09 0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.26 1vkg s VAL 198 Cb -0.10 -0.46 0.02 0.00 0.00 0.00 0.00 36.38 35.84 1vkg s VAL 198 CO 0.04 0.23 -0.16 -0.55 0.00 0.00 0.00 175.10 174.66 1vkg s SER 199 N 2.01 2.57 -0.17 3.32 0.15 -0.65 -0.18 113.70 120.76 1vkg s SER 199 Ca 0.05 -0.46 -0.05 0.00 0.70 0.00 0.00 55.95 56.18 1vkg s SER 199 Cb -0.12 -1.15 -0.03 0.00 -1.71 0.00 0.00 66.02 63.00 1vkg s SER 199 CO -0.05 0.00 0.01 -0.76 1.20 0.00 0.00 173.24 173.64 1vkg s LEU 200 N 1.10 3.47 0.36 3.45 1.02 -0.99 -0.94 118.68 126.16 1vkg s LEU 200 Ca -0.04 -0.06 -0.10 0.00 0.02 0.00 0.00 54.13 53.96 1vkg s LEU 200 Cb -0.14 -1.86 0.03 0.00 0.02 0.00 0.00 46.19 44.24 1vkg s LEU 200 CO -0.04 0.16 0.64 -1.38 0.02 0.00 0.00 176.35 175.75 1vkg s HIS 201 N 0.45 0.54 0.11 0.29 -3.43 -1.04 -4.46 115.29 107.74 1vkg s HIS 201 Ca -0.01 -1.00 -0.15 0.00 -0.80 0.00 0.00 55.06 53.10 1vkg s HIS 201 Cb -0.14 0.42 -0.07 0.00 -1.43 0.00 0.00 32.58 31.37 1vkg s HIS 201 CO 0.02 -1.36 0.52 0.21 -2.00 0.00 0.00 174.74 172.12 1vkg s LYS 202 N -2.70 3.98 -0.22 -0.38 2.20 0.89 -0.94 119.74 122.57 1vkg s LYS 202 Ca 0.22 0.48 -0.02 0.00 -0.36 0.00 0.00 55.97 56.29 1vkg s LYS 202 Cb -0.03 -3.02 0.07 0.00 -1.51 0.00 0.00 37.83 33.34 1vkg s LYS 202 CO 0.15 0.54 0.05 0.12 -0.36 0.00 0.00 175.35 175.85 1vkg s PHE 203 N -1.35 1.16 -0.18 4.03 2.19 -0.77 -4.70 117.98 118.37 1vkg s PHE 203 Ca 0.34 -1.04 -0.13 0.00 0.33 0.00 0.00 56.93 56.43 1vkg s PHE 203 Cb -0.16 -1.15 0.05 0.00 -1.31 0.00 0.00 43.02 40.45 1vkg s PHE 203 CO 0.18 -0.67 0.45 0.45 1.83 0.00 0.00 175.22 177.46 1vkg s SER 204 N 1.81 -0.52 -0.80 6.13 0.15 -1.26 -4.76 113.70 114.45 1vkg s SER 204 Ca 0.01 0.94 -0.32 0.00 0.70 0.00 0.00 55.95 57.28 1vkg s SER 204 Cb -0.17 0.89 -0.18 0.00 -1.71 0.00 0.00 66.02 64.85 1vkg s SER 204 CO -0.12 -0.18 2.55 -2.65 1.20 0.00 0.00 173.24 174.04 1vkg n PRO 205 N 3.52 0.28 0.00 5.44 -0.02 -1.26 -0.09 135.00 142.88 1vkg n PRO 205 Ca -0.18 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1vkg n PRO 205 Cb 0.56 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 1vkg n PRO 205 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vkg n GLY 206 N 6.52 1.02 3.83 -1.23 0.00 -1.26 -5.07 105.19 109.00 1vkg n GLY 206 Ca 0.57 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.22 1vkg n GLY 206 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vkg s PHE 207 N -2.00 3.69 0.99 1.61 5.36 0.87 -5.00 117.98 123.50 1vkg s PHE 207 Ca 0.00 0.92 -0.11 0.00 -0.96 0.00 0.00 56.93 56.78 1vkg s PHE 207 Cb 0.00 -2.27 0.19 0.00 -0.34 0.00 0.00 43.02 40.59 1vkg s PHE 207 CO 0.00 0.60 1.10 0.12 -1.46 0.00 0.00 175.22 175.58 1vkg s PHE 208 N -0.88 1.60 0.59 10.12 5.36 -1.26 -2.07 117.98 131.44 1vkg s PHE 208 Ca 0.23 1.56 0.29 0.00 -0.96 0.00 0.00 56.93 58.05 1vkg s PHE 208 Cb -0.16 -3.24 1.72 0.00 -0.34 0.00 0.00 43.02 41.00 1vkg s PHE 208 CO 0.12 -3.10 2.14 -1.00 -1.46 0.00 0.00 175.22 171.92 1vkg h PRO 209 N -2.08 0.00 0.00 10.12 0.13 -1.93 -3.41 132.00 134.82 1vkg h PRO 209 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1vkg h PRO 209 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1vkg h PRO 209 CO 0.45 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.63 1vkg n GLY 210 N -1.37 1.92 3.94 1.56 0.00 -0.88 -5.02 105.19 105.34 1vkg n GLY 210 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 1vkg n GLY 210 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1vkg s THR 211 N -2.16 4.37 0.00 2.61 -4.23 -1.26 -4.76 115.64 110.21 1vkg s THR 211 Ca 0.00 -0.37 0.00 0.00 -1.18 0.00 0.00 61.69 60.14 1vkg s THR 211 Cb 0.00 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.22 1vkg s THR 211 CO 0.00 -0.46 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 1vkg n GLY 212 N -2.06 1.63 3.75 3.99 0.00 -1.26 -4.76 105.19 106.49 1vkg n GLY 212 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1vkg n GLY 212 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1vkg s ASP 213 N -2.00 4.19 0.55 1.61 2.15 -1.26 -4.40 116.67 117.50 1vkg s ASP 213 Ca 0.00 1.91 0.25 0.00 0.43 0.00 0.00 52.55 55.13 1vkg s ASP 213 Cb 0.00 -2.53 1.45 0.00 -0.30 0.00 0.00 42.92 41.53 1vkg s ASP 213 CO 0.00 -2.25 2.05 1.62 -0.17 0.00 0.00 175.17 176.42 1vkg h VAL 214 N -1.25 0.70 0.00 1.11 3.04 -1.98 -0.76 116.25 117.11 1vkg h VAL 214 Ca -0.44 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 1vkg h VAL 214 Cb 1.24 0.81 0.00 0.00 -2.01 0.00 0.00 31.29 31.33 1vkg h VAL 214 CO 0.49 0.00 0.00 -1.54 -1.01 0.00 0.00 177.57 175.51 1vkg n SER 215 N -4.22 0.00 -4.44 3.17 3.41 -1.26 -4.35 113.62 105.92 1vkg n SER 215 Ca 0.05 -0.14 -0.44 0.00 -0.26 0.00 0.00 58.87 58.08 1vkg n SER 215 Cb 0.44 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.14 1vkg n SER 215 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1vkg s ASP 216 N -2.43 6.52 0.00 4.04 -0.00 -0.29 -4.75 116.67 119.75 1vkg s ASP 216 Ca 0.21 -1.83 0.14 0.00 -0.00 0.00 0.00 52.55 51.07 1vkg s ASP 216 Cb 0.13 -2.39 0.27 0.00 -0.00 0.00 0.00 42.92 40.93 1vkg s ASP 216 CO 0.28 -1.13 1.16 1.33 -0.00 0.00 0.00 175.17 176.82 1vkg n VAL 217 N 5.55 0.57 0.00 -1.27 0.24 -1.26 -4.42 118.33 117.75 1vkg n VAL 217 Ca 0.17 -0.79 0.00 0.00 -2.04 0.00 0.00 64.34 61.68 1vkg n VAL 217 Cb 0.48 0.84 0.00 0.00 -1.47 0.00 0.00 33.84 33.69 1vkg n VAL 217 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vkg n GLY 218 N 0.80 0.88 2.51 7.63 0.00 -1.26 0.52 105.19 116.28 1vkg n GLY 218 Ca 0.12 -2.23 -0.21 0.00 0.00 0.00 0.00 46.02 43.70 1vkg n GLY 218 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1vkg n LEU 219 N 0.00 0.00 0.00 0.99 4.77 0.41 -4.64 117.00 118.54 1vkg n LEU 219 Ca 0.00 -2.26 0.00 0.00 -0.03 0.00 0.00 56.01 53.72 1vkg n LEU 219 Cb 0.00 0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 1vkg n LEU 219 CO 0.00 -0.33 0.00 0.61 -1.33 0.00 0.00 177.39 176.34 1vkg n GLY 220 N 0.39 0.12 0.13 -0.72 0.00 -1.26 0.33 105.19 104.18 1vkg n GLY 220 Ca -0.10 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.09 1vkg n GLY 220 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1vkg n LYS 221 N 0.00 0.34 -2.55 1.61 3.00 -1.25 -4.09 118.16 115.22 1vkg n LYS 221 Ca 0.00 -0.26 -0.37 0.00 -0.00 0.00 0.00 58.31 57.68 1vkg n LYS 221 Cb 0.00 -1.49 0.01 0.00 0.00 0.00 0.00 35.03 33.55 1vkg n LYS 221 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1vkg n GLY 222 N 1.47 5.90 3.22 3.14 0.00 0.15 -3.93 105.19 115.13 1vkg n GLY 222 Ca 0.06 -2.62 -0.31 0.00 0.00 0.00 0.00 46.02 43.15 1vkg n GLY 222 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1vkg s ARG 223 N -4.04 2.83 0.00 1.61 3.52 -0.48 -0.44 118.95 121.95 1vkg s ARG 223 Ca 0.44 -0.85 0.00 0.00 -0.13 0.00 0.00 55.73 55.19 1vkg s ARG 223 Cb 0.28 -2.20 0.00 0.00 -1.56 0.00 0.00 34.95 31.47 1vkg s ARG 223 CO -0.19 0.22 0.00 0.66 -0.81 0.00 0.00 175.30 175.17 1vkg n TYR 224 N 3.40 0.00 -1.14 5.12 4.02 0.19 -4.87 117.16 123.88 1vkg n TYR 224 Ca -0.19 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.74 1vkg n TYR 224 Cb 0.53 0.00 0.24 0.00 -0.02 0.00 0.00 39.34 40.08 1vkg n TYR 224 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1vkg n TYR 225 N -2.35 1.02 -3.70 -0.72 4.02 -1.19 -4.75 117.16 109.49 1vkg n TYR 225 Ca 0.00 -1.12 -0.23 0.00 -0.01 0.00 0.00 57.90 56.54 1vkg n TYR 225 Cb 0.00 -0.38 -0.18 0.00 -0.02 0.00 0.00 39.34 38.76 1vkg n TYR 225 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 1vkg s SER 226 N -2.13 1.66 -0.05 7.72 0.01 -1.18 -2.74 113.70 116.99 1vkg s SER 226 Ca 0.43 -0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.55 1vkg s SER 226 Cb 0.36 -0.30 -0.02 0.00 0.21 0.00 0.00 66.02 66.27 1vkg s SER 226 CO 0.06 -0.25 -0.17 -0.69 0.41 0.00 0.00 173.24 172.60 1vkg s VAL 227 N 2.07 2.85 -0.04 3.43 1.01 0.87 -4.18 120.40 126.41 1vkg s VAL 227 Ca 0.04 -0.80 -0.00 0.00 0.00 0.00 0.00 61.98 61.22 1vkg s VAL 227 Cb -0.13 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.17 1vkg s VAL 227 CO -0.05 0.58 0.01 0.20 0.00 0.00 0.00 175.10 175.84 1vkg s ASN 228 N -0.57 0.85 -0.43 3.32 0.01 -1.26 -1.64 114.94 115.22 1vkg s ASN 228 Ca 0.08 -0.02 -0.02 0.00 -0.71 0.00 0.00 52.86 52.20 1vkg s ASN 228 Cb -0.11 -0.26 0.12 0.00 0.41 0.00 0.00 41.25 41.41 1vkg s ASN 228 CO 0.01 -0.15 0.21 -0.69 -1.51 0.00 0.00 177.10 174.97 1vkg s VAL 229 N 1.48 3.17 -0.07 1.60 1.01 -0.12 -4.00 120.40 123.47 1vkg s VAL 229 Ca -0.03 -2.26 -0.29 0.00 0.00 0.00 0.00 61.98 59.39 1vkg s VAL 229 Cb -0.13 -3.18 -0.06 0.00 0.00 0.00 0.00 36.38 33.01 1vkg s VAL 229 CO -0.03 -0.71 1.81 -2.84 0.00 0.00 0.00 175.10 173.34 1vkg s PRO 230 N 0.90 3.99 0.31 2.72 0.02 -1.26 -2.49 135.00 139.19 1vkg s PRO 230 Ca 0.10 2.23 0.10 0.00 0.02 0.00 0.00 61.00 63.45 1vkg s PRO 230 Cb -0.22 -4.10 -0.06 0.00 0.02 0.00 0.00 34.50 30.15 1vkg s PRO 230 CO -0.05 -1.09 -0.13 0.42 -0.33 0.00 0.00 177.00 175.83 1vkg s ILE 231 N 4.82 2.26 0.54 2.83 1.01 -0.11 -4.86 121.20 127.69 1vkg s ILE 231 Ca 0.81 -2.27 0.03 0.00 0.00 0.00 0.00 60.65 59.22 1vkg s ILE 231 Cb -0.35 -2.49 0.03 0.00 0.01 0.00 0.00 42.46 39.65 1vkg s ILE 231 CO 0.34 -0.29 0.23 -1.10 0.00 0.00 0.00 174.94 174.12 1vkg s GLN 232 N -3.58 2.23 0.73 2.79 -1.52 -1.26 -1.84 119.66 117.21 1vkg s GLN 232 Ca 0.31 -2.23 -0.13 0.00 -1.95 0.00 0.00 55.36 51.36 1vkg s GLN 232 Cb -0.00 -1.83 0.04 0.00 -0.22 0.00 0.00 33.01 31.00 1vkg s GLN 232 CO 0.15 -0.56 1.12 -0.51 -0.25 0.00 0.00 175.29 175.25 1vkg s ASP 233 N -4.13 4.56 0.00 5.90 1.01 -1.26 -3.94 116.67 118.81 1vkg s ASP 233 Ca 0.19 2.00 0.00 0.00 0.71 0.00 0.00 52.55 55.45 1vkg s ASP 233 Cb -0.01 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.37 1vkg s ASP 233 CO 0.12 -2.00 0.00 0.61 0.21 0.00 0.00 175.17 174.11 1vkg n GLY 234 N -0.58 0.54 3.77 0.21 0.00 -0.01 -0.90 105.19 108.21 1vkg n GLY 234 Ca 0.10 -0.29 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 1vkg n GLY 234 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1vkg s ILE 235 N -2.00 4.08 0.38 -0.61 2.07 -1.25 -3.88 121.20 119.98 1vkg s ILE 235 Ca 0.00 1.85 0.08 0.00 -1.41 0.00 0.00 60.65 61.17 1vkg s ILE 235 Cb 0.00 -4.08 -0.06 0.00 0.13 0.00 0.00 42.46 38.45 1vkg s ILE 235 CO 0.00 0.26 0.07 -1.10 -1.91 0.00 0.00 174.94 172.26 1vkg s GLN 236 N -1.77 2.11 0.21 3.50 -0.21 -1.26 -1.00 119.66 121.25 1vkg s GLN 236 Ca 0.47 -1.84 0.07 0.00 0.02 0.00 0.00 55.36 54.09 1vkg s GLN 236 Cb -0.22 -1.90 0.67 0.00 1.00 0.00 0.00 33.01 32.55 1vkg s GLN 236 CO 0.28 0.02 0.99 -0.25 -2.12 0.00 0.00 175.29 174.21 1vkg n ASP 237 N -1.05 0.08 0.23 5.90 8.00 -1.26 -1.66 116.55 126.79 1vkg n ASP 237 Ca -0.03 1.05 -0.09 0.00 0.71 0.00 0.00 54.79 56.43 1vkg n ASP 237 Cb 0.64 -0.45 -0.04 0.00 -0.02 0.00 0.00 41.12 41.25 1vkg n ASP 237 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 1vkg h GLU 238 N 0.00 -0.57 -0.44 -1.24 4.11 -1.96 -2.58 114.58 111.90 1vkg h GLU 238 Ca 0.46 0.04 -0.08 0.00 0.07 0.00 0.00 59.36 59.85 1vkg h GLU 238 Cb 1.10 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 1vkg h GLU 238 CO -0.54 -0.38 -0.02 -0.22 0.07 0.00 0.00 179.01 177.93 1vkg h LYS 239 N -0.66 0.80 -0.22 1.06 3.64 -1.88 -2.50 116.57 116.80 1vkg h LYS 239 Ca -0.06 -0.26 0.06 0.00 -1.27 0.00 0.00 60.65 59.12 1vkg h LYS 239 Cb 0.46 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 32.15 1vkg h LYS 239 CO 0.10 0.87 -0.21 -0.92 -2.27 0.00 0.00 179.45 177.02 1vkg h TYR 240 N 0.64 -0.54 -0.82 1.91 3.20 -1.41 -1.99 116.97 117.96 1vkg h TYR 240 Ca 0.12 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 1vkg h TYR 240 Cb 0.52 0.27 -0.04 0.00 1.54 0.00 0.00 36.73 39.02 1vkg h TYR 240 CO 0.04 -0.29 0.43 -0.92 -1.64 0.00 0.00 178.16 175.78 1vkg h TYR 241 N -0.22 1.14 -0.70 -3.82 3.20 -1.37 0.23 116.97 115.43 1vkg h TYR 241 Ca 0.13 -0.04 0.11 0.00 3.14 0.00 0.00 58.73 62.07 1vkg h TYR 241 Cb 0.42 -0.36 -0.08 0.00 1.54 0.00 0.00 36.73 38.25 1vkg h TYR 241 CO -0.36 0.81 0.32 1.96 -1.64 0.00 0.00 178.16 179.25 1vkg h GLN 242 N 1.14 0.51 0.01 1.82 4.20 -0.93 0.21 115.11 122.06 1vkg h GLN 242 Ca 0.28 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 1vkg h GLN 242 Cb 0.06 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.73 1vkg h GLN 242 CO -0.04 0.34 -0.00 0.82 -0.67 0.00 0.00 178.83 179.27 1vkg h ILE 243 N 0.53 1.30 -0.07 2.54 2.04 -0.87 -2.38 117.51 120.60 1vkg h ILE 243 Ca 0.36 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 65.32 1vkg h ILE 243 Cb 0.44 1.92 -0.04 0.00 -0.74 0.00 0.00 36.82 38.40 1vkg h ILE 243 CO -0.31 0.24 -0.33 0.00 0.00 0.00 0.00 178.15 177.75 1vkg h GLU 245 N -0.36 -0.25 0.03 0.00 4.81 -0.67 0.24 114.58 118.38 1vkg h GLU 245 Ca 0.02 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1vkg h GLU 245 Cb 0.41 0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.85 1vkg h GLU 245 CO -0.26 -0.17 -0.02 0.66 -0.73 0.00 0.00 179.01 178.50 1vkg h SER 246 N -0.26 -0.04 0.17 1.04 4.64 -1.36 0.15 113.55 117.89 1vkg h SER 246 Ca 0.13 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.47 1vkg h SER 246 Cb 0.47 0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.53 1vkg h SER 246 CO -0.38 -0.03 -0.43 0.58 -0.87 0.00 0.00 176.83 175.70 1vkg h VAL 247 N -0.05 0.14 -0.89 0.95 2.07 -1.15 -0.19 116.25 117.13 1vkg h VAL 247 Ca -0.00 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.62 1vkg h VAL 247 Cb 0.04 0.14 -0.08 0.00 -1.52 0.00 0.00 31.29 29.87 1vkg h VAL 247 CO 0.00 0.00 0.53 -0.07 0.02 0.00 0.00 177.57 178.05 1vkg h LEU 248 N -0.70 0.76 0.13 2.57 3.38 -0.81 -1.44 115.31 119.20 1vkg h LEU 248 Ca 0.01 0.05 0.02 0.00 0.09 0.00 0.00 57.88 58.05 1vkg h LEU 248 Cb 0.70 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.32 1vkg h LEU 248 CO -0.22 0.42 -0.25 0.50 0.09 0.00 0.00 178.44 178.97 1vkg h LYS 249 N 0.86 -0.45 0.01 1.13 3.64 0.15 -0.20 116.57 121.70 1vkg h LYS 249 Ca 0.44 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.88 1vkg h LYS 249 Cb 0.42 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 32.30 1vkg h LYS 249 CO -0.26 -0.30 -0.28 0.93 -2.27 0.00 0.00 179.45 177.26 1vkg h GLU 250 N -0.47 -0.42 -0.02 1.90 4.39 -0.31 -3.19 114.58 116.46 1vkg h GLU 250 Ca 0.03 0.03 0.01 0.00 0.34 0.00 0.00 59.36 59.76 1vkg h GLU 250 Cb 0.49 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 29.22 1vkg h GLU 250 CO -0.14 -0.28 -0.15 0.28 -1.16 0.00 0.00 179.01 177.56 1vkg h VAL 251 N -0.43 0.00 -0.79 3.13 2.07 -1.04 -1.19 116.25 117.99 1vkg h VAL 251 Ca 0.06 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.75 1vkg h VAL 251 Cb 0.52 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 30.14 1vkg h VAL 251 CO -0.24 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.21 1vkg n TYR 252 N -3.36 0.34 0.11 1.57 9.36 -0.11 0.04 117.16 125.11 1vkg n TYR 252 Ca -0.02 0.96 0.07 0.00 3.32 0.00 0.00 57.90 62.23 1vkg n TYR 252 Cb 0.11 -0.99 0.01 0.00 -0.63 0.00 0.00 39.34 37.84 1vkg n TYR 252 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 1vkg h GLN 253 N 0.00 0.00 -0.61 2.98 4.20 -1.53 0.26 115.11 120.40 1vkg h GLN 253 Ca 0.41 0.00 -0.10 0.00 0.06 0.00 0.00 58.65 59.01 1vkg h GLN 253 Cb 0.68 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.40 1vkg h GLN 253 CO -0.80 0.18 0.12 0.00 -0.67 0.00 0.00 178.83 177.66 1vkg n ALA 254 N -2.24 4.12 0.00 3.87 0.00 0.11 -4.29 120.51 122.07 1vkg n ALA 254 Ca -0.02 -2.19 0.00 0.00 0.00 0.00 0.00 53.44 51.23 1vkg n ALA 254 Cb 0.66 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1vkg n ALA 254 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1vkg n PHE 255 N 0.10 0.00 -2.94 0.00 7.35 0.20 -4.45 117.46 117.72 1vkg n PHE 255 Ca 0.33 0.00 -0.30 0.00 -0.76 0.00 0.00 57.45 56.72 1vkg n PHE 255 Cb 1.25 0.00 0.03 0.00 0.35 0.00 0.00 39.48 41.11 1vkg n PHE 255 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1vkg n ASN 256 N -0.25 -4.16 -4.79 -2.13 5.15 0.91 -4.92 115.26 105.06 1vkg n ASN 256 Ca 0.00 -0.14 -0.28 0.00 -0.60 0.00 0.00 54.58 53.55 1vkg n ASN 256 Cb 0.00 -1.22 0.10 0.00 -0.53 0.00 0.00 39.78 38.14 1vkg n ASN 256 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1vkg s PRO 257 N -1.92 1.80 0.00 1.20 0.04 -1.26 -4.87 135.00 130.00 1vkg s PRO 257 Ca 0.29 -0.07 0.00 0.00 0.04 0.00 0.00 61.00 61.26 1vkg s PRO 257 Cb -0.03 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1vkg s PRO 257 CO 0.67 -1.65 0.00 1.63 0.04 0.00 0.00 177.00 177.70 1vkg n LYS 258 N -3.30 1.15 -3.92 4.56 4.76 -0.24 -4.98 118.16 116.19 1vkg n LYS 258 Ca 0.09 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.44 1vkg n LYS 258 Cb 0.61 -0.94 -0.09 0.00 -1.84 0.00 0.00 35.03 32.77 1vkg n LYS 258 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1vkg s ALA 259 N -1.76 -0.07 0.02 7.82 0.00 -1.18 -4.08 121.76 122.51 1vkg s ALA 259 Ca 0.00 -0.64 0.04 0.00 0.00 0.00 0.00 51.96 51.36 1vkg s ALA 259 Cb 0.00 0.33 -0.02 0.00 0.00 0.00 0.00 23.12 23.43 1vkg s ALA 259 CO 0.00 -0.39 -0.12 0.08 0.00 0.00 0.00 175.76 175.33 1vkg s VAL 260 N -3.19 0.93 -0.15 0.00 1.01 0.25 -1.91 120.40 117.34 1vkg s VAL 260 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.20 1vkg s VAL 260 Cb 0.02 -0.84 0.03 0.00 0.00 0.00 0.00 36.38 35.59 1vkg s VAL 260 CO -0.07 0.06 -0.11 -0.69 0.00 0.00 0.00 175.10 174.29 1vkg s VAL 261 N -0.65 1.41 -0.09 2.92 1.01 -0.10 -0.84 120.40 124.06 1vkg s VAL 261 Ca 0.01 -0.63 0.03 0.00 0.00 0.00 0.00 61.98 61.40 1vkg s VAL 261 Cb -0.06 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 1vkg s VAL 261 CO 0.00 0.34 -0.21 -0.22 0.00 0.00 0.00 175.10 175.02 1vkg s LEU 262 N 1.54 2.31 -0.14 3.92 2.96 -0.19 -1.20 118.68 127.87 1vkg s LEU 262 Ca 0.03 -0.46 -0.00 0.00 -0.22 0.00 0.00 54.13 53.49 1vkg s LEU 262 Cb -0.14 -1.47 -0.01 0.00 0.50 0.00 0.00 46.19 45.07 1vkg s LEU 262 CO -0.09 0.20 -0.13 -1.58 -1.32 0.00 0.00 176.35 173.42 1vkg s GLN 263 N 0.13 3.35 -0.40 1.98 -0.44 -0.70 -0.67 119.66 122.90 1vkg s GLN 263 Ca -0.10 -0.70 0.05 0.00 -2.50 0.00 0.00 55.36 52.11 1vkg s GLN 263 Cb -0.16 -2.64 0.43 0.00 -1.64 0.00 0.00 33.01 29.00 1vkg s GLN 263 CO 0.06 0.16 1.17 1.28 0.50 0.00 0.00 175.29 178.46 1vkg n LEU 264 N 3.68 4.90 -4.57 3.68 4.77 -0.58 -1.00 117.00 127.87 1vkg n LEU 264 Ca -0.18 -5.04 -0.54 0.00 -0.03 0.00 0.00 56.01 50.23 1vkg n LEU 264 Cb 0.52 -0.44 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 1vkg n LEU 264 CO 0.30 2.17 0.84 0.61 -1.33 0.00 0.00 177.39 179.98 1vkg n GLY 265 N -0.57 0.32 2.62 -0.72 0.00 -0.01 -4.72 105.19 102.12 1vkg n GLY 265 Ca 0.41 0.72 -0.38 0.00 0.00 0.00 0.00 46.02 46.78 1vkg n GLY 265 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vkg n ALA 266 N 2.33 6.46 -0.05 4.61 0.00 0.79 -4.06 120.51 130.59 1vkg n ALA 266 Ca 0.19 -4.03 0.09 0.00 0.00 0.00 0.00 53.44 49.69 1vkg n ALA 266 Cb 0.17 -2.30 0.20 0.00 0.00 0.00 0.00 19.45 17.52 1vkg n ALA 266 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1vkg n ASP 267 N 0.53 3.22 -0.01 0.00 5.68 -1.26 -4.04 116.55 120.67 1vkg n ASP 267 Ca 0.53 -1.94 0.10 0.00 -0.50 0.00 0.00 54.79 52.98 1vkg n ASP 267 Cb 0.31 -0.28 -0.14 0.00 -1.14 0.00 0.00 41.12 39.87 1vkg n ASP 267 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1vkg n THR 268 N 1.05 0.00 -2.35 2.12 -2.24 -1.26 -4.48 114.28 107.12 1vkg n THR 268 Ca 0.16 -0.38 -0.41 0.00 -2.27 0.00 0.00 64.05 61.16 1vkg n THR 268 Cb 0.50 0.22 -0.04 0.00 -2.10 0.00 0.00 70.33 68.92 1vkg n THR 268 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1vkg s ILE 269 N -3.26 3.26 0.39 2.28 -1.09 -1.26 -1.06 121.20 120.47 1vkg s ILE 269 Ca -0.05 1.24 -0.27 0.00 -2.23 0.00 0.00 60.65 59.35 1vkg s ILE 269 Cb 0.13 -3.79 -0.09 0.00 -1.58 0.00 0.00 42.46 37.13 1vkg s ILE 269 CO 0.81 0.28 1.32 0.00 -1.23 0.00 0.00 174.94 176.12 1vkg s ALA 270 N -1.00 3.34 0.00 9.38 0.00 -0.14 -3.46 121.76 129.88 1vkg s ALA 270 Ca 0.47 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.70 1vkg s ALA 270 Cb -0.34 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.28 1vkg s ALA 270 CO 0.44 -0.80 0.00 0.41 0.00 0.00 0.00 175.76 175.81 1vkg n GLY 271 N 0.68 3.33 3.18 0.00 0.00 -1.26 -4.95 105.19 106.18 1vkg n GLY 271 Ca 0.03 -0.95 -0.49 0.00 0.00 0.00 0.00 46.02 44.60 1vkg n GLY 271 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1vkg n ASP 272 N 0.12 -0.65 -0.34 1.61 2.03 -1.22 -4.81 116.55 113.28 1vkg n ASP 272 Ca 0.00 1.06 0.15 0.00 0.52 0.00 0.00 54.79 56.52 1vkg n ASP 272 Cb 0.00 -0.87 0.30 0.00 -0.72 0.00 0.00 41.12 39.83 1vkg n ASP 272 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 1vkg n PRO 273 N 1.13 -0.08 -0.36 -0.67 -0.02 -1.26 -0.21 135.00 133.53 1vkg n PRO 273 Ca 0.17 1.48 0.28 0.00 -2.02 0.00 0.00 63.50 63.42 1vkg n PRO 273 Cb 0.16 -2.36 0.54 0.00 -0.02 0.00 0.00 33.50 31.83 1vkg n PRO 273 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 1vkg h MET 274 N 0.00 0.21 -6.93 -0.52 2.86 -1.89 -3.45 114.93 105.22 1vkg h MET 274 Ca 0.60 -0.01 -0.54 0.00 -2.06 0.00 0.00 59.70 57.69 1vkg h MET 274 Cb 1.25 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.85 1vkg h MET 274 CO -0.93 0.14 -0.97 0.00 1.06 0.00 0.00 176.91 176.21 1vkg n SER 276 N -2.04 0.20 -4.96 0.00 7.64 -1.26 -4.99 113.62 108.20 1vkg n SER 276 Ca -0.15 0.05 -0.19 0.00 1.01 0.00 0.00 58.87 59.58 1vkg n SER 276 Cb 0.55 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 1vkg n SER 276 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1vkg s PHE 277 N -2.00 2.52 -0.49 1.43 2.99 -1.26 -0.83 117.98 120.34 1vkg s PHE 277 Ca 0.00 -0.50 0.08 0.00 0.00 0.00 0.00 56.93 56.51 1vkg s PHE 277 Cb 0.00 -2.25 0.34 0.00 0.00 0.00 0.00 43.02 41.11 1vkg s PHE 277 CO 0.00 -0.41 0.84 -1.71 -0.00 0.00 0.00 175.22 173.94 1vkg n ASN 278 N -1.78 2.82 -4.96 1.36 2.85 -0.17 -4.28 115.26 111.10 1vkg n ASN 278 Ca 0.07 -3.37 -0.19 0.00 -0.11 0.00 0.00 54.58 50.98 1vkg n ASN 278 Cb 0.61 -0.59 -0.01 0.00 1.24 0.00 0.00 39.78 41.03 1vkg n ASN 278 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1vkg s MET 279 N -2.96 2.77 0.05 1.20 -1.94 -0.22 -4.12 119.30 114.09 1vkg s MET 279 Ca 0.45 -1.30 0.01 0.00 -1.71 0.00 0.00 55.69 53.14 1vkg s MET 279 Cb 0.30 -2.64 -0.03 0.00 2.01 0.00 0.00 34.83 34.47 1vkg s MET 279 CO -0.11 -0.19 -0.06 0.95 -0.01 0.00 0.00 175.02 175.60 1vkg s THR 280 N -2.36 0.43 0.56 2.05 -4.23 -1.26 -0.96 115.64 109.86 1vkg s THR 280 Ca 0.51 -1.26 0.36 0.00 -1.18 0.00 0.00 61.69 60.12 1vkg s THR 280 Cb -0.08 -0.80 0.53 0.00 1.34 0.00 0.00 72.50 73.49 1vkg s THR 280 CO 0.31 -0.56 1.72 -0.65 -0.54 0.00 0.00 174.62 174.90 1vkg h PRO 281 N 4.13 0.00 -0.33 3.99 0.11 -1.92 -1.34 132.00 136.63 1vkg h PRO 281 Ca -0.35 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 1vkg h PRO 281 Cb 1.19 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.29 1vkg h PRO 281 CO 0.48 0.00 0.16 0.28 -0.21 0.00 0.00 178.00 178.71 1vkg h VAL 282 N 0.00 1.16 0.64 3.15 2.07 -1.96 0.28 116.25 121.59 1vkg h VAL 282 Ca 0.54 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.59 1vkg h VAL 282 Cb 2.36 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.97 1vkg h VAL 282 CO -0.01 0.16 -0.39 1.23 0.02 0.00 0.00 177.57 178.58 1vkg h GLY 283 N 0.40 -1.07 0.56 2.17 0.00 -1.57 -0.56 103.07 103.00 1vkg h GLY 283 Ca 0.11 0.44 0.15 0.00 0.00 0.00 0.00 47.33 48.03 1vkg h GLY 283 CO -0.01 -0.38 0.56 -2.22 0.00 0.00 0.00 176.54 174.49 1vkg h ILE 284 N -0.98 0.82 -0.49 2.60 1.08 -1.57 -0.11 117.51 118.85 1vkg h ILE 284 Ca -0.08 -0.21 -0.03 0.00 -0.39 0.00 0.00 64.86 64.15 1vkg h ILE 284 Cb 0.79 0.16 -0.02 0.00 -3.07 0.00 0.00 36.82 34.67 1vkg h ILE 284 CO 0.08 0.11 0.16 1.23 -0.69 0.00 0.00 178.15 179.05 1vkg h GLY 285 N 0.61 0.77 1.95 5.37 0.00 0.89 0.22 103.07 112.88 1vkg h GLY 285 Ca 0.43 -0.40 -0.18 0.00 0.00 0.00 0.00 47.33 47.18 1vkg h GLY 285 CO -0.18 0.38 -0.85 0.50 0.00 0.00 0.00 176.54 176.39 1vkg h LYS 286 N 0.70 0.04 -0.37 4.80 1.57 0.44 0.22 116.57 123.98 1vkg h LYS 286 Ca 0.17 -0.05 -0.13 0.00 -1.87 0.00 0.00 60.65 58.76 1vkg h LYS 286 Cb 0.19 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1vkg h LYS 286 CO -0.01 0.86 -0.30 0.00 -0.57 0.00 0.00 179.45 179.43 1vkg h LEU 288 N 0.67 -0.33 -0.54 0.00 5.85 -0.29 -2.93 115.31 117.75 1vkg h LEU 288 Ca 0.08 -0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.72 1vkg h LEU 288 Cb 0.84 0.09 -0.09 0.00 0.37 0.00 0.00 40.66 41.86 1vkg h LEU 288 CO 0.07 0.04 -0.05 0.11 -0.34 0.00 0.00 178.44 178.27 1vkg h LYS 289 N -0.74 0.07 -1.04 1.25 1.57 -0.90 0.39 116.57 117.17 1vkg h LYS 289 Ca -0.04 -0.00 0.26 0.00 -1.87 0.00 0.00 60.65 59.00 1vkg h LYS 289 Cb 0.49 -0.02 -0.10 0.00 0.08 0.00 0.00 32.23 32.68 1vkg h LYS 289 CO 0.07 0.05 0.65 -0.92 -0.57 0.00 0.00 179.45 178.72 1vkg h TYR 290 N 0.07 0.77 0.00 -1.35 3.20 -1.10 -0.96 116.97 117.60 1vkg h TYR 290 Ca 0.27 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.17 1vkg h TYR 290 Cb 0.42 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1vkg h TYR 290 CO -0.37 0.05 -0.03 0.82 -1.64 0.00 0.00 178.16 176.99 1vkg h ILE 291 N 0.44 0.00 -0.87 1.81 2.04 -0.89 -3.35 117.51 116.69 1vkg h ILE 291 Ca 0.62 -0.84 0.31 0.00 1.00 0.00 0.00 64.86 65.94 1vkg h ILE 291 Cb 1.45 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.37 1vkg h ILE 291 CO -0.36 0.00 0.26 0.18 0.00 0.00 0.00 178.15 178.23 1vkg n LEU 292 N -4.33 0.11 -0.09 1.44 4.32 -0.05 0.37 117.00 118.78 1vkg n LEU 292 Ca -0.00 1.47 0.15 0.00 -0.02 0.00 0.00 56.01 57.60 1vkg n LEU 292 Cb 0.01 -0.63 0.54 0.00 -1.62 0.00 0.00 43.42 41.73 1vkg n LEU 292 CO 0.01 -1.57 1.19 0.06 -1.22 0.00 0.00 177.39 175.86 1vkg h GLN 293 N 0.00 0.31 -1.16 3.23 -0.00 -1.32 -1.21 115.11 114.95 1vkg h GLN 293 Ca 0.64 -0.02 0.33 0.00 -0.00 0.00 0.00 58.65 59.60 1vkg h GLN 293 Cb 1.55 -0.07 -0.06 0.00 -0.00 0.00 0.00 27.48 28.90 1vkg h GLN 293 CO -0.74 0.20 0.82 -1.49 -0.00 0.00 0.00 178.83 177.62 1vkg h TRP 294 N 0.32 0.16 -0.77 0.06 6.55 -0.24 -3.44 115.95 118.58 1vkg h TRP 294 Ca 0.30 0.01 -0.07 0.00 0.95 0.00 0.00 58.89 60.07 1vkg h TRP 294 Cb 0.73 -0.04 0.00 0.00 -0.86 0.00 0.00 29.16 28.99 1vkg h TRP 294 CO -0.00 0.01 -0.10 1.04 -1.05 0.00 0.00 178.44 178.34 1vkg n GLN 295 N -4.29 -0.50 -3.77 0.49 1.13 -0.46 -5.05 117.38 104.93 1vkg n GLN 295 Ca 0.26 0.17 -0.21 0.00 -1.94 0.00 0.00 57.00 55.28 1vkg n GLN 295 Cb 1.18 -3.73 -0.03 0.00 0.11 0.00 0.00 30.24 27.77 1vkg n GLN 295 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1vkg s LEU 296 N -1.25 3.84 -0.23 1.08 1.43 -1.26 -5.03 118.68 117.26 1vkg s LEU 296 Ca 0.02 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 52.54 1vkg s LEU 296 Cb -0.01 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 1vkg s LEU 296 CO 0.02 -0.29 1.87 0.00 0.23 0.00 0.00 176.35 178.18 1vkg s ALA 297 N -2.20 3.03 -0.06 4.21 0.00 -1.26 -4.75 121.76 120.74 1vkg s ALA 297 Ca 0.40 0.57 0.04 0.00 0.00 0.00 0.00 51.96 52.97 1vkg s ALA 297 Cb -0.08 -3.96 -0.02 0.00 0.00 0.00 0.00 23.12 19.06 1vkg s ALA 297 CO 0.28 -2.35 -0.15 0.99 0.00 0.00 0.00 175.76 174.53 1vkg s THR 298 N 6.47 2.94 -0.16 0.00 2.01 0.96 -0.58 115.64 127.28 1vkg s THR 298 Ca 0.84 -0.76 -0.02 0.00 0.31 0.00 0.00 61.69 62.05 1vkg s THR 298 Cb -0.28 -2.15 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 1vkg s THR 298 CO 0.34 0.58 -0.08 -0.22 -0.69 0.00 0.00 174.62 174.55 1vkg s LEU 299 N -0.58 2.92 -0.18 4.42 0.20 -0.02 -1.21 118.68 124.22 1vkg s LEU 299 Ca 0.08 -0.28 -0.03 0.00 0.69 0.00 0.00 54.13 54.59 1vkg s LEU 299 Cb -0.11 -1.69 -0.01 0.00 -0.43 0.00 0.00 46.19 43.94 1vkg s LEU 299 CO 0.01 0.12 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.49 1vkg s ILE 300 N 0.63 3.35 0.45 6.68 1.01 -0.36 -1.02 121.20 131.94 1vkg s ILE 300 Ca -0.05 -0.52 0.04 0.00 0.00 0.00 0.00 60.65 60.12 1vkg s ILE 300 Cb -0.15 -2.48 -0.05 0.00 0.01 0.00 0.00 42.46 39.79 1vkg s ILE 300 CO 0.03 0.46 0.02 -0.76 0.00 0.00 0.00 174.94 174.69 1vkg s LEU 301 N 0.97 2.50 0.00 2.97 1.43 0.15 -0.86 118.68 125.84 1vkg s LEU 301 Ca -0.01 -1.52 0.00 0.00 -1.03 0.00 0.00 54.13 51.58 1vkg s LEU 301 Cb -0.15 -0.72 0.00 0.00 0.03 0.00 0.00 46.19 45.35 1vkg s LEU 301 CO 0.00 -0.68 0.00 0.61 0.23 0.00 0.00 176.35 176.52 1vkg n GLY 302 N -1.07 0.81 0.00 -3.19 0.00 0.28 -1.52 105.19 100.50 1vkg n GLY 302 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1vkg n GLY 302 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkg n GLY 303 N 4.97 0.23 3.17 -0.02 0.00 -0.60 -0.83 105.19 112.10 1vkg n GLY 303 Ca 0.00 -1.88 -0.25 0.00 0.00 0.00 0.00 46.02 43.89 1vkg n GLY 303 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkg n GLY 304 N 0.00 -2.82 0.00 -0.02 0.00 -1.26 -4.63 105.19 96.46 1vkg n GLY 304 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1vkg n GLY 304 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkg n GLY 305 N 2.08 -0.27 1.80 -0.02 0.00 -1.26 -0.15 105.19 107.37 1vkg n GLY 305 Ca 0.06 0.11 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 1vkg n GLY 305 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1vkg n TYR 306 N 0.00 1.84 -3.15 1.61 0.53 -1.26 -4.18 117.16 112.54 1vkg n TYR 306 Ca 0.00 -1.55 -0.22 0.00 -1.02 0.00 0.00 57.90 55.11 1vkg n TYR 306 Cb 0.00 -0.77 -0.06 0.00 -1.03 0.00 0.00 39.34 37.48 1vkg n TYR 306 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1vkg n ASN 307 N -0.32 -0.05 0.00 7.72 4.05 -1.26 -4.19 115.26 121.22 1vkg n ASN 307 Ca 0.36 -2.77 0.00 0.00 0.45 0.00 0.00 54.58 52.62 1vkg n ASN 307 Cb 1.03 -0.42 0.00 0.00 1.23 0.00 0.00 39.78 41.61 1vkg n ASN 307 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 1vkg n LEU 308 N 1.34 0.00 -0.30 1.20 4.77 -1.26 0.28 117.00 123.03 1vkg n LEU 308 Ca 0.20 0.04 0.03 0.00 -0.03 0.00 0.00 56.01 56.26 1vkg n LEU 308 Cb 0.55 -0.02 0.11 0.00 -2.33 0.00 0.00 43.42 41.73 1vkg n LEU 308 CO 0.17 -0.02 0.69 0.00 -1.33 0.00 0.00 177.39 176.90 1vkg h ALA 309 N -0.07 0.57 -0.00 -1.18 0.00 -1.95 -0.26 119.26 116.36 1vkg h ALA 309 Ca 0.00 0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 1vkg h ALA 309 Cb 0.00 0.65 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1vkg h ALA 309 CO 0.00 -0.40 -0.00 -0.91 0.00 0.00 0.00 179.25 177.94 1vkg h ASN 310 N -0.00 0.00 -0.95 0.00 -0.26 -0.53 0.65 115.58 114.49 1vkg h ASN 310 Ca 0.41 -0.35 0.20 0.00 -0.56 0.00 0.00 56.30 56.00 1vkg h ASN 310 Cb 0.63 -0.00 -0.11 0.00 -1.06 0.00 0.00 38.32 37.77 1vkg h ASN 310 CO -0.88 0.35 0.53 0.74 -1.06 0.00 0.00 177.43 177.11 1vkg h THR 311 N -0.35 0.62 -0.29 2.81 2.02 0.43 1.01 112.91 119.16 1vkg h THR 311 Ca 0.00 -0.21 -0.11 0.00 0.77 0.00 0.00 66.41 66.86 1vkg h THR 311 Cb 0.35 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 1vkg h THR 311 CO 0.00 0.11 -0.28 0.00 0.37 0.00 0.00 175.52 175.72 1vkg h ALA 312 N 1.67 0.97 -0.68 6.16 0.00 -0.85 -0.60 119.26 125.93 1vkg h ALA 312 Ca 0.57 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1vkg h ALA 312 Cb 0.98 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 1vkg h ALA 312 CO -0.43 0.60 0.18 0.00 0.00 0.00 0.00 179.25 179.60 1vkg h ARG 313 N 0.50 1.09 0.41 0.00 3.08 0.32 -1.38 114.38 118.40 1vkg h ARG 313 Ca 0.07 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 59.84 1vkg h ARG 313 Cb 0.75 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1vkg h ARG 313 CO 0.06 0.96 -0.19 0.00 -1.07 0.00 0.00 179.97 179.72 1vkg h TRP 315 N -0.94 0.07 -0.46 0.00 6.55 -1.19 0.20 115.95 120.18 1vkg h TRP 315 Ca -0.06 -0.02 -0.10 0.00 0.95 0.00 0.00 58.89 59.67 1vkg h TRP 315 Cb 0.55 -0.02 -0.02 0.00 -0.86 0.00 0.00 29.16 28.82 1vkg h TRP 315 CO 0.02 0.47 -0.11 1.15 -1.05 0.00 0.00 178.44 178.92 1vkg h THR 316 N 0.05 1.26 0.55 1.49 2.02 -1.27 0.18 112.91 117.20 1vkg h THR 316 Ca 0.00 -1.20 -0.03 0.00 0.77 0.00 0.00 66.41 65.96 1vkg h THR 316 Cb 0.76 1.03 0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1vkg h THR 316 CO 0.06 0.41 -0.27 0.22 0.37 0.00 0.00 175.52 176.31 1vkg h TYR 317 N 0.76 -0.69 -0.86 3.16 5.03 0.02 -2.62 116.97 121.77 1vkg h TYR 317 Ca 0.12 -0.02 0.14 0.00 2.58 0.00 0.00 58.73 61.56 1vkg h TYR 317 Cb 0.61 0.23 -0.09 0.00 1.55 0.00 0.00 36.73 39.03 1vkg h TYR 317 CO 0.03 -0.36 0.45 -0.07 -1.32 0.00 0.00 178.16 176.89 1vkg h LEU 318 N -0.99 0.56 -2.59 2.82 3.38 -0.49 0.41 115.31 118.41 1vkg h LEU 318 Ca -0.08 0.09 0.01 0.00 0.09 0.00 0.00 57.88 57.99 1vkg h LEU 318 Cb 0.64 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.38 1vkg h LEU 318 CO 0.13 0.24 0.09 0.74 0.09 0.00 0.00 178.44 179.73 1vkg h THR 319 N 0.65 0.20 0.16 0.22 2.02 -0.47 -0.18 112.91 115.50 1vkg h THR 319 Ca 0.46 0.00 -0.23 0.00 0.77 0.00 0.00 66.41 67.42 1vkg h THR 319 Cb 0.64 0.92 0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1vkg h THR 319 CO -0.35 0.00 -1.03 1.23 0.37 0.00 0.00 175.52 175.74 1vkg h GLY 320 N 0.00 0.38 0.23 2.16 0.00 0.17 -2.93 103.07 103.09 1vkg h GLY 320 Ca 0.02 -0.98 0.06 0.00 0.00 0.00 0.00 47.33 46.43 1vkg h GLY 320 CO -0.00 0.86 -0.19 -2.08 0.00 0.00 0.00 176.54 175.13 1vkg h VAL 321 N -0.27 0.49 -0.42 4.60 2.07 -0.29 0.44 116.25 122.86 1vkg h VAL 321 Ca -0.19 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.39 1vkg h VAL 321 Cb 1.76 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1vkg h VAL 321 CO 0.16 0.00 0.28 0.40 0.02 0.00 0.00 177.57 178.43 1vkg h ILE 322 N -0.17 0.96 0.00 4.57 2.04 -1.28 -1.79 117.51 121.84 1vkg h ILE 322 Ca 0.14 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1vkg h ILE 322 Cb 0.39 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1vkg h ILE 322 CO -0.36 0.06 -0.67 -0.07 0.00 0.00 0.00 178.15 177.11 1vkg h LEU 323 N 0.33 0.00 -0.12 1.44 3.38 -0.77 -3.48 115.31 116.09 1vkg h LEU 323 Ca 0.18 -0.22 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1vkg h LEU 323 Cb 0.31 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.07 1vkg h LEU 323 CO -0.04 0.11 -0.17 0.61 0.09 0.00 0.00 178.44 179.04 1vkg n GLY 324 N 1.33 0.35 3.47 0.83 0.00 0.13 -5.02 105.19 106.28 1vkg n GLY 324 Ca 0.03 -0.53 -0.31 0.00 0.00 0.00 0.00 46.02 45.21 1vkg n GLY 324 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkg s LYS 325 N -4.85 2.13 -0.13 1.61 -0.14 -0.72 -5.03 119.74 112.62 1vkg s LYS 325 Ca 0.08 -0.95 -0.11 0.00 -1.36 0.00 0.00 55.97 53.63 1vkg s LYS 325 Cb -0.04 -2.22 -0.05 0.00 -1.68 0.00 0.00 37.83 33.84 1vkg s LYS 325 CO 0.10 0.55 0.24 0.99 -0.76 0.00 0.00 175.35 176.47 1vkg s THR 326 N -0.92 5.34 0.09 2.17 2.01 -1.26 -4.36 115.64 118.70 1vkg s THR 326 Ca 0.15 0.43 0.01 0.00 0.31 0.00 0.00 61.69 62.59 1vkg s THR 326 Cb -0.11 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.82 1vkg s THR 326 CO 0.05 0.50 0.22 -0.76 -0.69 0.00 0.00 174.62 173.95 1vkg s LEU 327 N -0.29 4.32 0.83 4.42 1.02 -1.26 -5.08 118.68 122.65 1vkg s LEU 327 Ca 0.16 0.22 -0.11 0.00 0.02 0.00 0.00 54.13 54.42 1vkg s LEU 327 Cb -0.13 -2.92 0.09 0.00 0.02 0.00 0.00 46.19 43.26 1vkg s LEU 327 CO 0.05 0.13 1.09 -0.55 0.02 0.00 0.00 176.35 177.09 1vkg s SER 328 N -2.73 3.97 0.00 2.29 0.15 -1.26 -4.94 113.70 111.18 1vkg s SER 328 Ca 0.35 1.68 0.13 0.00 0.70 0.00 0.00 55.95 58.81 1vkg s SER 328 Cb -0.12 -2.36 0.29 0.00 -1.71 0.00 0.00 66.02 62.12 1vkg s SER 328 CO 0.28 -2.35 1.20 -0.24 1.20 0.00 0.00 173.24 173.32 1vkg n SER 329 N -3.72 2.83 -4.55 5.45 2.88 -1.26 -4.69 113.62 110.57 1vkg n SER 329 Ca 0.08 -1.87 -0.37 0.00 -1.33 0.00 0.00 58.87 55.38 1vkg n SER 329 Cb 0.54 -0.20 -0.11 0.00 -0.75 0.00 0.00 64.21 63.69 1vkg n SER 329 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1vkg s GLU 330 N -1.03 3.85 -0.19 -1.46 2.02 -1.26 -2.40 118.70 118.23 1vkg s GLU 330 Ca 0.24 -0.38 -0.29 0.00 0.02 0.00 0.00 54.97 54.57 1vkg s GLU 330 Cb 0.14 -3.49 -0.02 0.00 0.10 0.00 0.00 34.13 30.85 1vkg s GLU 330 CO 0.18 -0.13 1.48 0.42 0.02 0.00 0.00 175.26 177.24 1vkg s ILE 331 N 1.53 3.89 1.09 -1.63 -1.09 -1.18 -4.89 121.20 118.93 1vkg s ILE 331 Ca 0.06 1.04 -0.18 0.00 -2.23 0.00 0.00 60.65 59.35 1vkg s ILE 331 Cb -0.15 -3.81 0.13 0.00 -1.58 0.00 0.00 42.46 37.05 1vkg s ILE 331 CO 0.07 -0.24 0.08 -2.65 -1.23 0.00 0.00 174.94 170.96 1vkg n PRO 332 N 7.24 -1.94 -3.08 2.79 -0.02 -1.26 -4.85 135.00 133.87 1vkg n PRO 332 Ca 0.17 -0.56 -0.45 0.00 -2.02 0.00 0.00 63.50 60.63 1vkg n PRO 332 Cb 0.45 -1.58 -0.03 0.00 -0.02 0.00 0.00 33.50 32.32 1vkg n PRO 332 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1vkg s ASP 333 N -1.90 6.63 0.32 2.55 2.15 -1.26 -4.76 116.67 120.41 1vkg s ASP 333 Ca 0.48 -2.20 0.09 0.00 0.43 0.00 0.00 52.55 51.36 1vkg s ASP 333 Cb -0.08 -2.33 -0.05 0.00 -0.30 0.00 0.00 42.92 40.16 1vkg s ASP 333 CO 0.53 -0.91 -0.00 -1.38 -0.17 0.00 0.00 175.17 173.24 1vkg s HIS 334 N 1.84 2.55 0.59 -5.34 -3.43 -1.26 -4.99 115.29 105.25 1vkg s HIS 334 Ca 0.26 -0.39 0.33 0.00 -0.80 0.00 0.00 55.06 54.46 1vkg s HIS 334 Cb -0.09 -1.40 1.29 0.00 -1.43 0.00 0.00 32.58 30.95 1vkg s HIS 334 CO -0.08 0.52 1.55 1.49 -2.00 0.00 0.00 174.74 176.22 1vkg h GLU 335 N 1.85 0.00 -0.34 -0.38 4.81 -1.93 0.24 114.58 118.83 1vkg h GLU 335 Ca -0.43 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1vkg h GLU 335 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1vkg h GLU 335 CO 0.65 0.00 0.00 1.19 -0.73 0.00 0.00 179.01 180.12 1vkg n PHE 336 N -3.60 0.84 -0.24 0.92 3.72 -1.26 -4.81 117.46 113.02 1vkg n PHE 336 Ca 0.24 -0.70 -0.01 0.00 -0.05 0.00 0.00 57.45 56.93 1vkg n PHE 336 Cb 1.40 -0.20 0.06 0.00 -0.94 0.00 0.00 39.48 39.80 1vkg n PHE 336 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 176.76 177.06 1vkg h PHE 337 N 2.15 -0.58 0.00 1.38 3.57 -1.24 -2.48 116.94 119.74 1vkg h PHE 337 Ca 0.00 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.57 1vkg h PHE 337 Cb 1.18 0.36 0.00 0.00 2.79 0.00 0.00 35.95 40.29 1vkg h PHE 337 CO 0.43 -0.34 0.35 1.79 -2.23 0.00 0.00 178.31 178.31 1vkg h THR 338 N -0.05 0.00 -0.01 4.41 1.35 -1.87 -0.78 112.91 115.96 1vkg h THR 338 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.17 1vkg h THR 338 Cb 0.54 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.37 1vkg h THR 338 CO -0.74 0.00 -0.10 0.00 -0.25 0.00 0.00 175.52 174.43 1vkg n ALA 339 N -1.67 2.78 -1.33 6.62 0.00 -0.93 -3.86 120.51 122.12 1vkg n ALA 339 Ca -0.01 -0.33 -0.30 0.00 0.00 0.00 0.00 53.44 52.80 1vkg n ALA 339 Cb 0.38 -1.27 0.12 0.00 0.00 0.00 0.00 19.45 18.68 1vkg n ALA 339 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1vkg n TYR 340 N -0.61 3.09 -0.70 0.00 4.02 -0.30 -4.77 117.16 117.89 1vkg n TYR 340 Ca 0.16 -2.55 -0.30 0.00 -0.01 0.00 0.00 57.90 55.21 1vkg n TYR 340 Cb 0.29 -1.21 0.26 0.00 -0.02 0.00 0.00 39.34 38.66 1vkg n TYR 340 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1vkg s GLY 341 N -1.74 1.50 0.00 2.72 0.00 -1.25 -0.06 107.32 108.50 1vkg s GLY 341 Ca 0.61 -0.70 0.19 0.00 0.00 0.00 0.00 44.72 44.81 1vkg s GLY 341 CO 0.03 0.18 1.44 -1.55 0.00 0.00 0.00 173.10 173.21 1vkg n PRO 342 N -5.11 1.98 -0.00 2.90 -0.04 -1.26 -4.23 135.00 129.24 1vkg n PRO 342 Ca 0.10 -1.49 0.07 0.00 -0.04 0.00 0.00 63.50 62.15 1vkg n PRO 342 Cb 0.59 -1.40 -0.10 0.00 -0.04 0.00 0.00 33.50 32.55 1vkg n PRO 342 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1vkg n ASP 343 N 0.70 1.20 -4.12 3.54 8.00 -1.25 -5.02 116.55 119.60 1vkg n ASP 343 Ca 0.16 -0.37 -0.36 0.00 0.71 0.00 0.00 54.79 54.93 1vkg n ASP 343 Cb 0.40 1.37 -0.03 0.00 -0.02 0.00 0.00 41.12 42.84 1vkg n ASP 343 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1vkg n TYR 344 N -1.71 -1.42 -4.36 1.24 4.02 0.91 -4.97 117.16 110.87 1vkg n TYR 344 Ca -0.00 0.42 -0.19 0.00 -0.01 0.00 0.00 57.90 58.12 1vkg n TYR 344 Cb 0.31 -3.00 -0.10 0.00 -0.02 0.00 0.00 39.34 36.53 1vkg n TYR 344 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 1vkg s VAL 345 N -3.94 0.69 -0.06 -0.72 -7.23 -1.26 -3.08 120.40 104.81 1vkg s VAL 345 Ca 0.22 -2.00 0.13 0.00 -1.81 0.00 0.00 61.98 58.52 1vkg s VAL 345 Cb -0.11 -2.65 -0.22 0.00 0.56 0.00 0.00 36.38 33.96 1vkg s VAL 345 CO 0.96 0.00 0.66 -0.11 -0.31 0.00 0.00 175.10 176.31 1vkg n LEU 346 N -0.56 0.84 -4.74 1.32 7.94 -1.01 -4.77 117.00 116.02 1vkg n LEU 346 Ca -0.01 0.40 -0.31 0.00 -1.11 0.00 0.00 56.01 54.98 1vkg n LEU 346 Cb 0.66 0.17 0.11 0.00 0.53 0.00 0.00 43.42 44.89 1vkg n LEU 346 CO 0.38 0.36 0.70 -1.61 -1.11 0.00 0.00 177.39 176.11 1vkg s GLU 347 N -2.63 1.95 0.02 1.96 8.01 -1.26 -4.92 118.70 121.83 1vkg s GLU 347 Ca -0.05 1.27 0.07 0.00 0.01 0.00 0.00 54.97 56.28 1vkg s GLU 347 Cb 0.08 -1.86 -0.02 0.00 -4.31 0.00 0.00 34.13 28.02 1vkg s GLU 347 CO 0.82 -1.89 -0.22 0.42 0.01 0.00 0.00 175.26 174.41 1vkg s ILE 348 N -2.83 1.76 -0.08 -1.63 1.01 -1.26 -5.11 121.20 113.06 1vkg s ILE 348 Ca 0.63 -1.13 0.00 0.00 0.00 0.00 0.00 60.65 60.15 1vkg s ILE 348 Cb -0.19 -1.50 -0.03 0.00 0.01 0.00 0.00 42.46 40.75 1vkg s ILE 348 CO 0.56 0.33 -0.06 -0.89 0.00 0.00 0.00 174.94 174.88 1vkg s THR 349 N -0.69 3.76 0.56 2.92 2.01 -1.26 -4.91 115.64 118.02 1vkg s THR 349 Ca 0.08 -0.45 -0.20 0.00 0.31 0.00 0.00 61.69 61.44 1vkg s THR 349 Cb -0.09 -2.55 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 1vkg s THR 349 CO 0.01 0.59 1.18 -2.84 -0.69 0.00 0.00 174.62 172.87 1vkg s PRO 350 N -0.66 3.21 0.86 4.92 0.02 -1.26 -4.89 135.00 137.20 1vkg s PRO 350 Ca 0.10 1.76 -0.12 0.00 0.02 0.00 0.00 61.00 62.76 1vkg s PRO 350 Cb -0.11 -2.03 0.11 0.00 0.02 0.00 0.00 34.50 32.49 1vkg s PRO 350 CO 0.02 -1.00 1.10 -1.12 -0.33 0.00 0.00 177.00 175.67 1vkg s SER 351 N -1.60 3.88 -1.22 2.53 0.01 -1.26 -4.90 113.70 111.13 1vkg s SER 351 Ca 0.74 1.34 -0.11 0.00 1.31 0.00 0.00 55.95 59.23 1vkg s SER 351 Cb -0.28 -2.04 0.19 0.00 0.21 0.00 0.00 66.02 64.10 1vkg s SER 351 CO 0.31 -2.36 1.56 0.00 0.41 0.00 0.00 173.24 173.17 1vkg s ARG 353 N 0.60 0.97 0.85 0.00 0.52 -1.26 -5.15 118.95 115.48 1vkg s ARG 353 Ca 0.40 -0.57 -0.12 0.00 -0.52 0.00 0.00 55.73 54.92 1vkg s ARG 353 Cb 0.01 -0.95 0.11 0.00 0.52 0.00 0.00 34.95 34.64 1vkg s ARG 353 CO 0.00 0.25 1.17 -1.25 0.02 0.00 0.00 175.30 175.49 1vkg s PRO 354 N -0.64 1.42 -0.25 3.54 0.04 -1.26 -4.90 135.00 132.95 1vkg s PRO 354 Ca 0.03 1.62 -0.09 0.00 0.04 0.00 0.00 61.00 62.60 1vkg s PRO 354 Cb -0.06 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 1vkg s PRO 354 CO 0.00 -2.35 0.12 0.34 0.04 0.00 0.00 177.00 175.16 1vkg s ASP 355 N -2.48 5.68 -0.27 6.66 2.15 -1.25 -3.76 116.67 123.40 1vkg s ASP 355 Ca 0.69 -0.04 0.13 0.00 0.43 0.00 0.00 52.55 53.76 1vkg s ASP 355 Cb -0.25 -2.03 0.77 0.00 -0.30 0.00 0.00 42.92 41.12 1vkg s ASP 355 CO 0.54 0.02 1.75 0.54 -0.17 0.00 0.00 175.17 177.84 1vkg n ARG 356 N 4.60 4.31 -3.39 4.34 5.12 -0.08 -4.82 116.66 126.74 1vkg n ARG 356 Ca -0.15 -3.12 -0.41 0.00 -1.93 0.00 0.00 57.85 52.23 1vkg n ARG 356 Cb 0.52 -2.22 -0.09 0.00 -1.16 0.00 0.00 32.46 29.51 1vkg n ARG 356 CO 0.00 0.00 0.00 -0.80 -1.93 0.00 0.00 177.63 174.90 1vkg s ASN 357 N -0.99 6.18 -0.33 0.55 -0.87 -1.26 -4.88 114.94 113.32 1vkg s ASN 357 Ca 0.54 -0.37 -0.26 0.00 -1.57 0.00 0.00 52.86 51.20 1vkg s ASN 357 Cb 0.42 -2.20 0.01 0.00 -0.02 0.00 0.00 41.25 39.46 1vkg s ASN 357 CO 0.14 -0.40 0.90 -1.61 -2.57 0.00 0.00 177.10 173.56 1vkg s GLU 358 N 2.03 3.93 0.63 -0.60 2.02 -1.26 -4.96 118.70 120.48 1vkg s GLU 358 Ca 0.11 0.68 0.33 0.00 0.02 0.00 0.00 54.97 56.11 1vkg s GLU 358 Cb -0.17 -3.76 1.80 0.00 0.10 0.00 0.00 34.13 32.10 1vkg s GLU 358 CO 0.12 -0.84 2.01 -1.00 0.02 0.00 0.00 175.26 175.57 1vkg h PRO 359 N 8.26 0.00 0.14 0.39 0.13 -2.00 -2.67 132.00 136.25 1vkg h PRO 359 Ca -0.23 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.55 1vkg h PRO 359 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 1vkg h PRO 359 CO 0.95 0.00 -1.82 1.12 -0.23 0.00 0.00 178.00 178.02 1vkg h HIS 360 N 0.00 0.54 -0.53 1.56 2.07 -1.99 -3.15 115.15 113.66 1vkg h HIS 360 Ca 0.00 -0.40 0.09 0.00 -2.85 0.00 0.00 60.37 57.21 1vkg h HIS 360 Cb 0.42 -0.02 -0.07 0.00 2.57 0.00 0.00 27.41 30.31 1vkg h HIS 360 CO 0.00 1.64 0.13 -0.09 -3.07 0.00 0.00 177.93 176.54 1vkg h ARG 361 N 0.08 0.27 -0.93 5.12 9.65 -1.90 0.41 114.38 127.08 1vkg h ARG 361 Ca -0.36 -0.02 0.12 0.00 -1.10 0.00 0.00 59.98 58.63 1vkg h ARG 361 Cb 2.06 -0.06 -0.07 0.00 -1.39 0.00 0.00 29.97 30.51 1vkg h ARG 361 CO 0.13 0.18 0.59 0.82 2.80 0.00 0.00 179.97 184.49 1vkg h ILE 362 N 0.27 0.90 -0.28 1.20 1.08 -1.66 0.30 117.51 119.32 1vkg h ILE 362 Ca 0.27 -0.29 -0.14 0.00 -0.39 0.00 0.00 64.86 64.31 1vkg h ILE 362 Cb 0.36 -0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.08 1vkg h ILE 362 CO -0.33 0.15 -0.39 -0.61 -0.69 0.00 0.00 178.15 176.28 1vkg h GLN 363 N 0.84 0.66 -0.19 2.37 5.75 -0.33 0.45 115.11 124.66 1vkg h GLN 363 Ca 0.45 -0.34 -0.00 0.00 -0.15 0.00 0.00 58.65 58.61 1vkg h GLN 363 Cb 0.56 0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.11 1vkg h GLN 363 CO -0.22 0.94 0.11 1.96 -2.65 0.00 0.00 178.83 178.98 1vkg h GLN 364 N 0.55 0.26 0.69 1.69 4.20 0.29 -0.57 115.11 122.22 1vkg h GLN 364 Ca 0.05 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.70 1vkg h GLN 364 Cb 0.92 -0.05 0.01 0.00 0.30 0.00 0.00 27.48 28.65 1vkg h GLN 364 CO 0.08 0.23 -0.33 0.82 -0.67 0.00 0.00 178.83 178.96 1vkg h ILE 365 N 0.22 0.32 -0.88 2.54 2.04 -0.71 -0.90 117.51 120.14 1vkg h ILE 365 Ca 0.07 -0.04 0.19 0.00 1.00 0.00 0.00 64.86 66.08 1vkg h ILE 365 Cb 0.04 0.33 -0.11 0.00 -0.74 0.00 0.00 36.82 36.34 1vkg h ILE 365 CO -0.01 0.00 0.42 -0.07 0.00 0.00 0.00 178.15 178.49 1vkg h LEU 366 N -0.95 0.41 0.70 1.44 3.38 -0.80 -0.06 115.31 119.44 1vkg h LEU 366 Ca -0.09 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1vkg h LEU 366 Cb 0.71 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1vkg h LEU 366 CO 0.15 0.08 -0.38 0.78 0.09 0.00 0.00 178.44 179.17 1vkg h ASN 367 N 0.49 -0.93 -0.63 -0.43 2.35 -0.82 -0.91 115.58 114.70 1vkg h ASN 367 Ca 0.53 0.04 0.09 0.00 -0.55 0.00 0.00 56.30 56.41 1vkg h ASN 367 Cb 0.92 0.26 -0.11 0.00 0.05 0.00 0.00 38.32 39.44 1vkg h ASN 367 CO -0.47 -0.62 -0.46 0.22 -1.65 0.00 0.00 177.43 174.46 1vkg h TYR 368 N -1.00 -1.36 0.09 1.19 3.20 0.11 -0.55 116.97 118.65 1vkg h TYR 368 Ca -0.09 0.09 0.02 0.00 3.14 0.00 0.00 58.73 61.88 1vkg h TYR 368 Cb 0.79 0.68 -0.05 0.00 1.54 0.00 0.00 36.73 39.69 1vkg h TYR 368 CO -0.06 -0.42 -0.49 0.82 -1.64 0.00 0.00 178.16 176.36 1vkg h ILE 369 N -0.21 0.06 -1.01 1.81 2.04 -0.96 0.18 117.51 119.42 1vkg h ILE 369 Ca 0.18 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.30 1vkg h ILE 369 Cb 0.55 0.06 -0.07 0.00 -0.74 0.00 0.00 36.82 36.62 1vkg h ILE 369 CO -0.73 0.00 0.68 0.11 0.00 0.00 0.00 178.15 178.21 1vkg h LYS 370 N -0.70 0.26 0.35 2.37 1.57 0.04 0.22 116.57 120.67 1vkg h LYS 370 Ca 0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1vkg h LYS 370 Cb 0.73 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1vkg h LYS 370 CO -0.29 0.17 -0.17 0.78 -0.57 0.00 0.00 179.45 179.37 1vkg h GLY 371 N 0.27 -0.48 -0.22 3.86 0.00 0.65 -2.24 103.07 104.90 1vkg h GLY 371 Ca 0.53 0.18 0.25 0.00 0.00 0.00 0.00 47.33 48.29 1vkg h GLY 371 CO -0.17 -0.18 0.52 3.43 0.00 0.00 0.00 176.54 180.14 1vkg h ASN 372 N -0.84 0.53 0.53 0.19 -0.26 0.20 0.51 115.58 116.44 1vkg h ASN 372 Ca -0.05 0.15 -0.05 0.00 -0.56 0.00 0.00 56.30 55.80 1vkg h ASN 372 Cb 0.53 0.08 -0.01 0.00 -1.06 0.00 0.00 38.32 37.86 1vkg h ASN 372 CO 0.08 0.03 -0.23 -0.07 -1.06 0.00 0.00 177.43 176.18 1vkg h LEU 373 N 0.48 0.00 -0.09 1.61 3.38 -0.61 -1.44 115.31 118.63 1vkg h LEU 373 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1vkg h LEU 373 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1vkg h LEU 373 CO -0.51 0.23 0.00 0.29 0.09 0.00 0.00 178.44 178.53 1vkg n LYS 374 N -3.69 0.01 -0.43 1.13 4.76 0.18 -0.48 118.16 119.64 1vkg n LYS 374 Ca -0.01 0.43 0.09 0.00 -2.87 0.00 0.00 58.31 55.95 1vkg n LYS 374 Cb 0.35 -1.53 0.29 0.00 -1.84 0.00 0.00 35.03 32.29 1vkg n LYS 374 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1vkg n HIS 375 N -1.56 1.06 -4.02 2.13 8.25 -0.54 -4.89 115.22 115.64 1vkg n HIS 375 Ca 0.01 -0.58 -0.35 0.00 -0.26 0.00 0.00 57.72 56.54 1vkg n HIS 375 Cb 0.06 -0.14 -0.12 0.00 1.12 0.00 0.00 29.99 30.91 1vkg n HIS 375 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1vkg s VAL 376 N -1.52 4.05 0.00 1.59 1.01 0.37 -4.93 120.40 120.96 1vkg s VAL 376 Ca 0.43 -0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1vkg s VAL 376 Cb 0.26 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1vkg s VAL 376 CO 0.23 0.42 0.36 1.33 0.00 0.00 0.00 175.10 177.44