#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pwv n GLU 34 N 0.00 0.11 -0.12 5.31 4.07 -1.26 -1.34 120.64 127.40 1pwv n GLU 34 Ca 0.00 0.12 -0.19 0.00 -0.06 0.00 0.00 57.16 57.03 1pwv n GLU 34 Cb 0.00 -1.64 -0.12 0.00 -0.06 0.00 0.00 31.44 29.62 1pwv n GLU 34 CO 0.00 0.00 0.00 1.58 -0.06 0.00 0.00 177.13 178.65 1pwv n HIS 35 N -1.83 0.08 0.21 4.31 -0.00 -1.26 -2.62 115.22 114.11 1pwv n HIS 35 Ca 0.06 0.02 0.07 0.00 0.46 0.00 0.00 57.72 58.32 1pwv n HIS 35 Cb 0.36 -1.01 0.45 0.00 -0.12 0.00 0.00 29.99 29.67 1pwv n HIS 35 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 1pwv h LEU 36 N -0.11 0.00 0.00 0.27 5.85 -1.95 -1.68 115.31 117.70 1pwv h LEU 36 Ca -0.58 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.00 1pwv h LEU 36 Cb 1.88 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.88 1pwv h LEU 36 CO -0.12 0.30 -2.02 1.17 -0.34 0.00 0.00 178.44 177.44 1pwv n LYS 37 N -3.76 0.66 0.34 1.25 4.81 -0.45 -3.39 118.16 117.62 1pwv n LYS 37 Ca -0.01 -0.08 -0.15 0.00 -0.87 0.00 0.00 58.31 57.20 1pwv n LYS 37 Cb 0.40 -1.56 -0.07 0.00 0.02 0.00 0.00 35.03 33.81 1pwv n LYS 37 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1pwv h GLU 38 N 0.00 -0.86 0.32 1.64 4.57 -1.27 -0.18 114.58 118.79 1pwv h GLU 38 Ca -0.19 0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 58.04 1pwv h GLU 38 Cb 1.45 0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 30.21 1pwv h GLU 38 CO 0.01 -0.55 -0.41 0.82 -1.18 0.00 0.00 179.01 177.71 1pwv h ILE 39 N -1.17 0.00 -0.88 2.32 2.04 -1.52 -2.61 117.51 115.69 1pwv h ILE 39 Ca -0.09 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.91 1pwv h ILE 39 Cb 0.71 0.00 -0.15 0.00 -0.74 0.00 0.00 36.82 36.65 1pwv h ILE 39 CO 0.15 0.00 -0.37 0.24 0.00 0.00 0.00 178.15 178.17 1pwv h MET 40 N -0.75 -0.05 0.00 2.37 2.86 -1.62 0.57 114.93 118.31 1pwv h MET 40 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1pwv h MET 40 Cb 0.67 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.34 1pwv h MET 40 CO -0.10 -0.03 0.65 -0.22 1.06 0.00 0.00 176.91 178.27 1pwv h LYS 41 N -0.05 0.00 0.00 1.72 3.64 -0.62 -0.98 116.57 120.28 1pwv h LYS 41 Ca 0.32 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.70 1pwv h LYS 41 Cb 0.59 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1pwv h LYS 41 CO -0.90 0.00 -0.98 1.58 -2.27 0.00 0.00 179.45 176.88 1pwv n HIS 42 N -2.36 0.00 -0.04 1.91 -0.00 0.18 -4.83 115.22 110.09 1pwv n HIS 42 Ca -0.01 0.00 -0.18 0.00 0.46 0.00 0.00 57.72 58.00 1pwv n HIS 42 Cb 0.66 0.00 -0.13 0.00 -0.12 0.00 0.00 29.99 30.40 1pwv n HIS 42 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 1pwv h ILE 43 N 0.00 1.49 -3.11 3.57 2.04 -0.01 -3.46 117.51 118.03 1pwv h ILE 43 Ca 0.00 -2.38 -0.58 0.00 1.00 0.00 0.00 64.86 62.91 1pwv h ILE 43 Cb 0.86 3.08 -0.06 0.00 -0.74 0.00 0.00 36.82 39.96 1pwv h ILE 43 CO 0.00 0.60 0.84 -0.69 0.00 0.00 0.00 178.15 178.90 1pwv s VAL 44 N -2.33 4.55 -0.28 1.67 1.01 -0.47 -1.61 120.40 122.94 1pwv s VAL 44 Ca -0.19 1.85 -0.09 0.00 0.00 0.00 0.00 61.98 63.55 1pwv s VAL 44 Cb 0.00 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.08 1pwv s VAL 44 CO 0.72 -0.26 0.12 -0.54 0.00 0.00 0.00 175.10 175.14 1pwv s LYS 45 N 3.40 3.52 -0.38 2.72 3.01 0.10 -4.82 119.74 127.29 1pwv s LYS 45 Ca 0.47 -0.59 -0.22 0.00 -1.01 0.00 0.00 55.97 54.62 1pwv s LYS 45 Cb -0.15 -3.47 0.01 0.00 -1.01 0.00 0.00 37.83 33.20 1pwv s LYS 45 CO 0.10 -0.30 0.74 0.42 0.51 0.00 0.00 175.35 176.82 1pwv s ILE 46 N 1.62 4.76 -0.46 2.17 -1.09 -1.26 -1.96 121.20 124.99 1pwv s ILE 46 Ca 0.05 0.69 0.07 0.00 -2.23 0.00 0.00 60.65 59.23 1pwv s ILE 46 Cb -0.16 -4.20 0.24 0.00 -1.58 0.00 0.00 42.46 36.76 1pwv s ILE 46 CO 0.06 -0.46 0.56 -0.62 -1.23 0.00 0.00 174.94 173.24 1pwv n GLU 47 N 6.37 1.14 -4.18 2.79 1.02 -0.26 -4.99 120.64 122.53 1pwv n GLU 47 Ca 0.02 -3.61 -0.28 0.00 -0.02 0.00 0.00 57.16 53.26 1pwv n GLU 47 Cb 0.48 -1.55 -0.04 0.00 -0.02 0.00 0.00 31.44 30.32 1pwv n GLU 47 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1pwv s VAL 48 N -1.39 1.67 -0.07 2.62 -7.23 -1.26 -4.06 120.40 110.67 1pwv s VAL 48 Ca 0.36 -1.68 -0.05 0.00 -1.81 0.00 0.00 61.98 58.80 1pwv s VAL 48 Cb 0.15 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.72 1pwv s VAL 48 CO -0.10 0.00 -0.10 1.17 -0.31 0.00 0.00 175.10 175.76 1pwv n LYS 49 N -1.51 0.24 -4.50 4.82 4.81 -1.26 -4.98 118.16 115.78 1pwv n LYS 49 Ca -0.06 0.35 -0.24 0.00 -0.87 0.00 0.00 58.31 57.48 1pwv n LYS 49 Cb 0.65 -1.19 -0.10 0.00 0.02 0.00 0.00 35.03 34.40 1pwv n LYS 49 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 1pwv s GLY 50 N -3.47 2.04 -1.21 3.14 0.00 -1.26 -4.87 107.32 101.69 1pwv s GLY 50 Ca -0.09 -2.01 -0.25 0.00 0.00 0.00 0.00 44.72 42.38 1pwv s GLY 50 CO 0.13 -1.97 0.68 -1.84 0.00 0.00 0.00 173.10 170.10 1pwv n GLU 51 N -0.71 -0.95 0.32 2.90 0.28 -1.26 -4.83 120.64 116.39 1pwv n GLU 51 Ca -0.05 0.27 0.20 0.00 -0.16 0.00 0.00 57.16 57.42 1pwv n GLU 51 Cb 0.63 -3.44 1.07 0.00 1.43 0.00 0.00 31.44 31.12 1pwv n GLU 51 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1pwv h GLU 52 N -2.21 0.00 0.00 3.44 5.08 -1.96 -3.26 114.58 115.67 1pwv h GLU 52 Ca -0.68 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.68 1pwv h GLU 52 Cb 1.38 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.63 1pwv h GLU 52 CO 0.52 0.01 0.00 0.00 -1.00 0.00 0.00 179.01 178.54 1pwv n ALA 53 N -2.15 0.00 0.26 3.43 0.00 -1.26 0.37 120.51 121.16 1pwv n ALA 53 Ca -0.03 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.56 1pwv n ALA 53 Cb 0.11 0.07 0.43 0.00 0.00 0.00 0.00 19.45 20.06 1pwv n ALA 53 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1pwv h VAL 54 N 0.00 0.00 0.00 0.00 3.04 -1.98 -2.88 116.25 114.43 1pwv h VAL 54 Ca 0.00 -0.73 -0.05 0.00 -1.01 0.00 0.00 66.70 64.91 1pwv h VAL 54 Cb 0.00 1.73 -0.01 0.00 -2.01 0.00 0.00 31.29 31.00 1pwv h VAL 54 CO 0.00 0.00 -0.24 0.11 -1.01 0.00 0.00 177.57 176.43 1pwv h LYS 55 N 0.00 0.00 0.18 4.17 1.57 -1.47 0.64 116.57 121.66 1pwv h LYS 55 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1pwv h LYS 55 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1pwv h LYS 55 CO 0.00 0.24 -0.08 -0.22 -0.57 0.00 0.00 179.45 178.81 1pwv h LYS 56 N 0.00 -0.23 -0.44 3.15 3.64 0.14 -3.06 116.57 119.77 1pwv h LYS 56 Ca -0.00 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1pwv h LYS 56 Cb 0.52 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1pwv h LYS 56 CO 0.03 -0.10 0.29 1.49 -2.27 0.00 0.00 179.45 178.89 1pwv h GLU 57 N -1.05 0.51 0.10 1.90 4.81 -1.50 -1.89 114.58 117.45 1pwv h GLU 57 Ca -0.02 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1pwv h GLU 57 Cb 0.23 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.47 1pwv h GLU 57 CO 0.04 0.33 -0.30 0.00 -0.73 0.00 0.00 179.01 178.36 1pwv h ALA 58 N 1.74 -0.83 -1.00 2.92 0.00 0.22 0.23 119.26 122.54 1pwv h ALA 58 Ca 0.17 -0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.15 1pwv h ALA 58 Cb 0.05 0.68 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 1pwv h ALA 58 CO -0.04 -0.90 0.62 0.00 0.00 0.00 0.00 179.25 178.94 1pwv h ALA 59 N -1.02 1.58 0.00 0.00 0.00 -1.39 0.40 119.26 118.83 1pwv h ALA 59 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1pwv h ALA 59 Cb 0.44 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1pwv h ALA 59 CO -0.15 0.15 0.00 -1.91 0.00 0.00 0.00 179.25 177.34 1pwv n GLU 60 N -4.64 0.26 -0.06 0.00 2.13 -0.61 -0.23 120.64 117.50 1pwv n GLU 60 Ca 0.20 0.12 -0.04 0.00 0.66 0.00 0.00 57.16 58.09 1pwv n GLU 60 Cb 0.41 -1.50 -0.11 0.00 0.27 0.00 0.00 31.44 30.51 1pwv n GLU 60 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1pwv n LYS 61 N -1.23 1.52 0.01 5.31 4.76 0.12 -3.53 118.16 125.14 1pwv n LYS 61 Ca 0.08 -0.03 -0.18 0.00 -2.87 0.00 0.00 58.31 55.31 1pwv n LYS 61 Cb 0.10 -1.35 -0.11 0.00 -1.84 0.00 0.00 35.03 31.83 1pwv n LYS 61 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1pwv h LEU 62 N 0.00 0.63 -0.06 -0.35 5.85 0.02 -3.34 115.31 118.06 1pwv h LEU 62 Ca -0.31 -0.76 -0.21 0.00 0.84 0.00 0.00 57.88 57.44 1pwv h LEU 62 Cb 1.65 -0.19 0.01 0.00 0.37 0.00 0.00 40.66 42.50 1pwv h LEU 62 CO 0.02 1.30 -0.78 -0.07 -0.34 0.00 0.00 178.44 178.58 1pwv h LEU 63 N 0.02 0.78 -0.12 2.25 3.38 -0.83 -3.24 115.31 117.55 1pwv h LEU 63 Ca -0.09 -0.70 0.00 0.00 0.09 0.00 0.00 57.88 57.18 1pwv h LEU 63 Cb 1.42 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1pwv h LEU 63 CO 0.14 1.37 0.48 1.21 0.09 0.00 0.00 178.44 181.72 1pwv n GLU 64 N -4.03 0.02 0.14 1.13 2.13 -1.23 0.56 120.64 119.36 1pwv n GLU 64 Ca -0.09 0.26 0.08 0.00 0.66 0.00 0.00 57.16 58.06 1pwv n GLU 64 Cb 0.75 -2.02 0.05 0.00 0.27 0.00 0.00 31.44 30.49 1pwv n GLU 64 CO 0.00 0.00 0.00 0.87 -0.41 0.00 0.00 177.13 177.59 1pwv h LYS 65 N 0.00 0.00 -5.62 5.31 1.79 -1.73 -3.45 116.57 112.87 1pwv h LYS 65 Ca 0.00 0.00 -0.60 0.00 -2.18 0.00 0.00 60.65 57.87 1pwv h LYS 65 Cb 0.95 0.00 -0.10 0.00 -1.58 0.00 0.00 32.23 31.50 1pwv h LYS 65 CO 0.00 0.16 0.06 0.08 -1.08 0.00 0.00 179.45 178.67 1pwv s VAL 66 N -3.15 5.05 -0.33 0.50 1.01 0.19 -4.95 120.40 118.73 1pwv s VAL 66 Ca 0.03 1.10 -0.33 0.00 0.00 0.00 0.00 61.98 62.78 1pwv s VAL 66 Cb 0.07 -3.91 -0.14 0.00 0.00 0.00 0.00 36.38 32.40 1pwv s VAL 66 CO 0.74 0.14 1.12 -2.65 0.00 0.00 0.00 175.10 174.44 1pwv n PRO 67 N 4.95 0.00 -0.31 2.72 -0.02 -1.26 -4.77 135.00 136.30 1pwv n PRO 67 Ca -0.03 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.53 1pwv n PRO 67 Cb 0.50 -1.08 0.18 0.00 -0.02 0.00 0.00 33.50 33.09 1pwv n PRO 67 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1pwv h SER 68 N 3.47 -0.60 -0.92 2.55 0.87 -1.93 0.35 113.55 117.34 1pwv h SER 68 Ca -0.32 0.26 0.22 0.00 -1.23 0.00 0.00 61.79 60.72 1pwv h SER 68 Cb 0.99 0.49 -0.12 0.00 -0.44 0.00 0.00 62.40 63.31 1pwv h SER 68 CO 0.68 -0.29 0.44 0.44 -0.53 0.00 0.00 176.83 177.58 1pwv h ASP 69 N 0.03 0.42 -0.38 6.23 3.32 -1.96 -0.44 116.42 123.64 1pwv h ASP 69 Ca 0.48 0.15 0.07 0.00 0.02 0.00 0.00 57.03 57.75 1pwv h ASP 69 Cb 0.86 0.10 -0.06 0.00 0.22 0.00 0.00 39.33 40.45 1pwv h ASP 69 CO -0.87 0.04 -0.03 0.58 -1.72 0.00 0.00 179.24 177.24 1pwv h VAL 70 N 0.45 0.68 -0.71 -1.35 2.07 -0.61 -0.07 116.25 116.72 1pwv h VAL 70 Ca 0.57 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 68.04 1pwv h VAL 70 Cb 1.08 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1pwv h VAL 70 CO -0.51 0.01 0.31 -0.07 0.02 0.00 0.00 177.57 177.34 1pwv h LEU 71 N 0.07 0.96 -0.88 2.57 3.38 -1.11 -0.92 115.31 119.37 1pwv h LEU 71 Ca 0.18 -0.15 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1pwv h LEU 71 Cb 0.27 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 1pwv h LEU 71 CO -0.34 0.85 0.41 -0.08 0.09 0.00 0.00 178.44 179.37 1pwv h GLU 72 N 1.01 1.22 -0.45 1.13 4.81 -0.85 0.15 114.58 121.60 1pwv h GLU 72 Ca 0.24 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.27 1pwv h GLU 72 Cb 0.17 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1pwv h GLU 72 CO -0.03 0.93 0.19 0.52 -0.73 0.00 0.00 179.01 179.90 1pwv h MET 73 N 1.21 0.67 -0.53 1.92 2.86 -0.59 -0.43 114.93 120.04 1pwv h MET 73 Ca 0.29 -0.11 0.04 0.00 -2.06 0.00 0.00 59.70 57.86 1pwv h MET 73 Cb 0.11 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 1pwv h MET 73 CO -0.04 0.60 0.28 -0.92 1.06 0.00 0.00 176.91 177.90 1pwv h TYR 74 N 0.59 0.52 -0.19 -0.22 3.20 -0.51 -0.62 116.97 119.74 1pwv h TYR 74 Ca 0.15 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.08 1pwv h TYR 74 Cb 0.17 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.24 1pwv h TYR 74 CO -0.00 0.27 -0.07 -0.22 -1.64 0.00 0.00 178.16 176.50 1pwv h LYS 75 N 0.55 -0.04 -0.64 1.82 3.64 -0.56 -0.80 116.57 120.54 1pwv h LYS 75 Ca 0.23 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.74 1pwv h LYS 75 Cb 0.11 0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 31.83 1pwv h LYS 75 CO -0.14 -0.03 0.07 0.00 -2.27 0.00 0.00 179.45 177.08 1pwv h ALA 76 N 1.14 0.70 0.00 5.00 0.00 0.24 0.62 119.26 126.96 1pwv h ALA 76 Ca 0.10 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1pwv h ALA 76 Cb 0.19 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1pwv h ALA 76 CO -0.22 -0.36 0.00 1.51 0.00 0.00 0.00 179.25 180.18 1pwv n ILE 77 N -5.22 1.02 0.00 0.00 0.13 -0.37 -4.86 119.36 110.06 1pwv n ILE 77 Ca 0.10 0.27 0.00 0.00 -1.10 0.00 0.00 62.75 62.02 1pwv n ILE 77 Cb 0.37 -1.09 0.00 0.00 -0.84 0.00 0.00 39.64 38.08 1pwv n ILE 77 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1pwv n GLY 78 N -0.13 3.04 3.02 4.50 0.00 0.22 -4.90 105.19 110.93 1pwv n GLY 78 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1pwv n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwv n GLY 79 N -1.43 -2.40 3.03 -0.02 0.00 -0.38 -4.86 105.19 99.14 1pwv n GLY 79 Ca 0.00 0.02 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 1pwv n GLY 79 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pwv s LYS 80 N -0.91 1.40 -0.11 1.61 -0.14 -1.04 -4.49 119.74 116.05 1pwv s LYS 80 Ca 0.55 -0.40 -0.04 0.00 -1.36 0.00 0.00 55.97 54.71 1pwv s LYS 80 Cb -0.61 -1.22 -0.04 0.00 -1.68 0.00 0.00 37.83 34.28 1pwv s LYS 80 CO 0.57 0.10 0.04 0.42 -0.76 0.00 0.00 175.35 175.71 1pwv s ILE 81 N 0.36 4.60 -0.11 2.17 1.01 -0.63 -1.45 121.20 127.15 1pwv s ILE 81 Ca -0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 60.65 60.44 1pwv s ILE 81 Cb -0.12 -2.98 0.02 0.00 0.01 0.00 0.00 42.46 39.39 1pwv s ILE 81 CO 0.02 0.57 -0.09 -0.31 0.00 0.00 0.00 174.94 175.13 1pwv s TYR 82 N -0.59 1.59 -0.19 3.97 1.51 0.13 0.02 117.35 123.78 1pwv s TYR 82 Ca 0.10 -0.80 -0.12 0.00 -1.01 0.00 0.00 57.07 55.24 1pwv s TYR 82 Cb -0.12 -1.28 -0.05 0.00 -0.11 0.00 0.00 41.96 40.41 1pwv s TYR 82 CO 0.02 -0.52 0.23 0.42 -1.11 0.00 0.00 175.55 174.60 1pwv s ILE 83 N 1.59 5.33 0.22 2.71 -1.09 -0.83 -0.68 121.20 128.46 1pwv s ILE 83 Ca 0.03 0.40 -0.19 0.00 -2.23 0.00 0.00 60.65 58.66 1pwv s ILE 83 Cb -0.13 -3.57 0.03 0.00 -1.58 0.00 0.00 42.46 37.21 1pwv s ILE 83 CO -0.08 0.38 0.59 0.54 -1.23 0.00 0.00 174.94 175.14 1pwv s VAL 84 N 0.66 0.01 0.03 2.92 0.11 -0.29 -1.11 120.40 122.73 1pwv s VAL 84 Ca 0.13 -0.80 -0.00 0.00 -2.93 0.00 0.00 61.98 58.37 1pwv s VAL 84 Cb -0.13 -1.69 -0.04 0.00 -1.53 0.00 0.00 36.38 32.99 1pwv s VAL 84 CO 0.03 -0.05 0.15 -1.81 -3.33 0.00 0.00 175.10 170.08 1pwv s ASP 85 N -2.88 6.06 0.00 3.54 1.01 -1.26 0.18 116.67 123.32 1pwv s ASP 85 Ca 0.10 0.22 0.00 0.00 0.71 0.00 0.00 52.55 53.58 1pwv s ASP 85 Cb -0.03 -1.82 0.00 0.00 1.01 0.00 0.00 42.92 42.09 1pwv s ASP 85 CO -0.00 0.22 0.00 0.61 0.21 0.00 0.00 175.17 176.21 1pwv n GLY 86 N 0.74 -0.25 3.54 0.21 0.00 -1.26 -4.80 105.19 103.37 1pwv n GLY 86 Ca -0.09 -1.50 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 1pwv n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pwv s ASP 87 N -4.00 6.24 0.35 1.61 3.68 -1.26 -4.90 116.67 118.39 1pwv s ASP 87 Ca 0.00 -0.76 0.15 0.00 2.13 0.00 0.00 52.55 54.07 1pwv s ASP 87 Cb 0.00 -2.54 1.12 0.00 -1.45 0.00 0.00 42.92 40.05 1pwv s ASP 87 CO 0.00 -1.70 1.65 0.16 0.13 0.00 0.00 175.17 175.41 1pwv h ILE 88 N 6.17 0.26 -0.12 4.11 3.07 -1.82 0.52 117.51 129.70 1pwv h ILE 88 Ca -0.17 -0.10 0.04 0.00 1.55 0.00 0.00 64.86 66.18 1pwv h ILE 88 Cb 1.04 -0.05 -0.00 0.00 -0.27 0.00 0.00 36.82 37.54 1pwv h ILE 88 CO 1.29 0.05 0.33 0.74 -1.05 0.00 0.00 178.15 179.52 1pwv h THR 89 N 0.28 0.14 -1.16 0.16 2.02 -1.86 -2.02 112.91 110.47 1pwv h THR 89 Ca 0.75 0.00 -0.58 0.00 0.77 0.00 0.00 66.41 67.35 1pwv h THR 89 Cb 1.75 0.69 -0.22 0.00 -1.74 0.00 0.00 68.15 68.63 1pwv h THR 89 CO -0.63 0.00 0.71 0.29 0.37 0.00 0.00 175.52 176.26 1pwv n LYS 90 N -3.19 2.44 -4.90 6.66 4.01 0.18 -4.21 118.16 119.16 1pwv n LYS 90 Ca 0.01 -2.74 -0.27 0.00 -0.51 0.00 0.00 58.31 54.80 1pwv n LYS 90 Cb 0.42 -2.10 -0.16 0.00 -0.51 0.00 0.00 35.03 32.68 1pwv n LYS 90 CO 0.00 0.00 0.00 -1.58 -1.11 0.00 0.00 177.40 174.71 1pwv s HIS 91 N -2.95 1.79 0.22 2.13 2.46 -0.76 -5.00 115.29 113.19 1pwv s HIS 91 Ca 0.53 -0.48 -0.15 0.00 0.47 0.00 0.00 55.06 55.43 1pwv s HIS 91 Cb 0.40 -1.19 0.26 0.00 -0.13 0.00 0.00 32.58 31.92 1pwv s HIS 91 CO -0.16 -0.15 1.44 -0.89 -2.47 0.00 0.00 174.74 172.51 1pwv n ILE 92 N 3.02 -0.47 -0.34 0.89 2.08 -1.26 0.44 119.36 123.71 1pwv n ILE 92 Ca -0.17 2.17 0.19 0.00 0.56 0.00 0.00 62.75 65.49 1pwv n ILE 92 Cb 0.53 -2.89 0.41 0.00 -0.75 0.00 0.00 39.64 36.94 1pwv n ILE 92 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1pwv h SER 93 N 0.00 0.63 -0.27 4.38 4.64 -1.96 0.21 113.55 121.19 1pwv h SER 93 Ca 0.34 0.12 0.00 0.00 -0.47 0.00 0.00 61.79 61.79 1pwv h SER 93 Cb 0.58 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1pwv h SER 93 CO -0.93 0.11 0.00 0.18 -0.87 0.00 0.00 176.83 175.32 1pwv n LEU 94 N -4.83 3.04 0.02 5.97 4.77 0.16 -4.50 117.00 121.63 1pwv n LEU 94 Ca 0.27 -1.41 0.22 0.00 -0.03 0.00 0.00 56.01 55.06 1pwv n LEU 94 Cb 0.77 -0.17 0.71 0.00 -2.33 0.00 0.00 43.42 42.41 1pwv n LEU 94 CO 0.18 0.64 1.20 1.05 -1.33 0.00 0.00 177.39 179.14 1pwv h GLU 95 N 3.72 0.00 -0.98 3.23 4.11 0.34 1.22 114.58 126.21 1pwv h GLU 95 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1pwv h GLU 95 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1pwv h GLU 95 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 179.01 179.08 1pwv n ALA 96 N -2.39 2.41 -0.99 1.06 0.00 -1.26 -4.85 120.51 114.50 1pwv n ALA 96 Ca 0.11 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.54 1pwv n ALA 96 Cb 0.76 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.21 1pwv n ALA 96 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1pwv n LEU 97 N 0.19 -1.96 -4.72 0.00 -0.00 0.42 -4.87 117.00 106.07 1pwv n LEU 97 Ca 0.00 -1.37 -0.36 0.00 -0.00 0.00 0.00 56.01 54.28 1pwv n LEU 97 Cb 0.31 -0.59 0.08 0.00 -0.00 0.00 0.00 43.42 43.23 1pwv n LEU 97 CO 0.00 -1.57 0.86 -0.55 -0.00 0.00 0.00 177.39 176.13 1pwv s SER 98 N 0.00 4.32 -0.01 1.45 0.15 -1.26 -4.94 113.70 113.41 1pwv s SER 98 Ca 0.02 2.54 -0.02 0.00 0.70 0.00 0.00 55.95 59.18 1pwv s SER 98 Cb -0.01 -2.61 -0.27 0.00 -1.71 0.00 0.00 66.02 61.42 1pwv s SER 98 CO 0.01 -2.19 0.78 -0.08 1.20 0.00 0.00 173.24 172.96 1pwv h GLU 99 N 0.12 0.22 -0.15 5.44 4.57 -1.96 -3.02 114.58 119.80 1pwv h GLU 99 Ca -0.49 -0.38 -0.07 0.00 -1.18 0.00 0.00 59.36 57.24 1pwv h GLU 99 Cb 1.32 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 30.04 1pwv h GLU 99 CO 0.51 1.06 -0.21 0.22 -1.18 0.00 0.00 179.01 179.41 1pwv h ASP 100 N 0.06 0.25 -0.41 1.04 3.58 -2.01 -2.27 116.42 116.67 1pwv h ASP 100 Ca -0.27 -0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.12 1pwv h ASP 100 Cb 2.02 -0.07 0.00 0.00 1.72 0.00 0.00 39.33 43.00 1pwv h ASP 100 CO 0.14 0.47 0.00 0.29 -2.88 0.00 0.00 179.24 177.27 1pwv n LYS 101 N -4.20 2.04 -1.74 0.28 5.02 -1.24 -4.31 118.16 114.01 1pwv n LYS 101 Ca -0.01 -1.60 -0.33 0.00 -2.02 0.00 0.00 58.31 54.35 1pwv n LYS 101 Cb 0.33 -1.37 0.05 0.00 -0.02 0.00 0.00 35.03 34.02 1pwv n LYS 101 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1pwv n LYS 102 N 0.80 2.99 -2.50 1.97 4.81 -0.85 -4.52 118.16 120.87 1pwv n LYS 102 Ca 0.16 -3.67 -0.07 0.00 -0.87 0.00 0.00 58.31 53.86 1pwv n LYS 102 Cb 0.39 -2.28 0.04 0.00 0.02 0.00 0.00 35.03 33.21 1pwv n LYS 102 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1pwv n LYS 103 N -0.74 2.19 -1.65 1.64 4.76 -1.26 -4.11 118.16 118.98 1pwv n LYS 103 Ca 0.54 -3.63 -0.44 0.00 -2.87 0.00 0.00 58.31 51.91 1pwv n LYS 103 Cb 0.64 -1.73 -0.02 0.00 -1.84 0.00 0.00 35.03 32.08 1pwv n LYS 103 CO 0.00 0.00 0.00 1.51 -1.37 0.00 0.00 177.40 177.54 1pwv n ILE 104 N -0.59 1.64 -4.00 -0.18 0.13 -1.23 -4.60 119.36 110.53 1pwv n ILE 104 Ca 0.18 -0.41 -0.24 0.00 -1.10 0.00 0.00 62.75 61.17 1pwv n ILE 104 Cb 0.86 -1.31 -0.03 0.00 -0.84 0.00 0.00 39.64 38.31 1pwv n ILE 104 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 1pwv s LYS 105 N -1.29 3.28 0.61 9.51 1.02 -1.26 -2.04 119.74 129.58 1pwv s LYS 105 Ca 0.61 -0.74 0.05 0.00 0.02 0.00 0.00 55.97 55.91 1pwv s LYS 105 Cb -0.65 -2.84 0.09 0.00 -0.52 0.00 0.00 37.83 33.91 1pwv s LYS 105 CO 0.58 0.48 0.85 0.16 -0.92 0.00 0.00 175.35 176.49 1pwv s ASP 106 N -3.45 4.87 0.65 2.83 3.84 -0.47 -4.90 116.67 120.04 1pwv s ASP 106 Ca 0.33 -0.54 0.18 0.00 -0.00 0.00 0.00 52.55 52.53 1pwv s ASP 106 Cb -0.10 -0.03 0.96 0.00 -1.38 0.00 0.00 42.92 42.37 1pwv s ASP 106 CO 0.27 -1.47 1.53 -0.29 -0.00 0.00 0.00 175.17 175.21 1pwv h ILE 107 N -0.07 0.03 -0.01 2.11 -0.00 -1.91 0.97 117.51 118.64 1pwv h ILE 107 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.52 1pwv h ILE 107 Cb 1.28 0.37 0.00 0.00 -0.00 0.00 0.00 36.82 38.47 1pwv h ILE 107 CO 0.42 0.00 -0.38 -1.22 -0.00 0.00 0.00 178.15 176.97 1pwv n TYR 108 N -2.84 0.00 -0.23 2.19 0.53 -1.26 -4.96 117.16 110.58 1pwv n TYR 108 Ca 0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.89 1pwv n TYR 108 Cb 0.72 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 39.03 1pwv n TYR 108 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1pwv n GLY 109 N 1.27 0.88 3.64 2.72 0.00 0.34 -5.05 105.19 108.99 1pwv n GLY 109 Ca 0.08 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 1pwv n GLY 109 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pwv s LYS 110 N -0.70 4.16 0.42 1.61 1.02 -1.26 -4.81 119.74 120.18 1pwv s LYS 110 Ca 0.00 0.56 -0.25 0.00 0.02 0.00 0.00 55.97 56.30 1pwv s LYS 110 Cb 0.00 -3.61 -0.08 0.00 -0.52 0.00 0.00 37.83 33.62 1pwv s LYS 110 CO 0.00 -0.31 1.17 -0.51 -0.92 0.00 0.00 175.35 174.79 1pwv s ASP 111 N 1.32 6.41 0.24 2.83 1.01 -1.26 -1.37 116.67 125.86 1pwv s ASP 111 Ca 0.27 2.35 -0.17 0.00 0.71 0.00 0.00 52.55 55.70 1pwv s ASP 111 Cb -0.16 -2.61 0.02 0.00 1.01 0.00 0.00 42.92 41.18 1pwv s ASP 111 CO 0.09 -0.75 0.58 0.00 0.21 0.00 0.00 175.17 175.30 1pwv s ALA 112 N -1.45 -0.84 -0.17 5.23 0.00 -0.86 -4.94 121.76 118.73 1pwv s ALA 112 Ca 0.59 -0.43 -0.13 0.00 0.00 0.00 0.00 51.96 51.99 1pwv s ALA 112 Cb -0.30 0.92 -0.05 0.00 0.00 0.00 0.00 23.12 23.69 1pwv s ALA 112 CO 0.38 -0.90 0.26 -0.51 0.00 0.00 0.00 175.76 174.99 1pwv s LEU 113 N -2.93 4.23 0.42 0.00 1.43 -1.26 -3.56 118.68 117.00 1pwv s LEU 113 Ca 0.14 0.44 0.15 0.00 -1.03 0.00 0.00 54.13 53.82 1pwv s LEU 113 Cb -0.03 -2.32 1.03 0.00 0.03 0.00 0.00 46.19 44.90 1pwv s LEU 113 CO 0.04 0.10 1.92 0.25 0.23 0.00 0.00 176.35 178.89 1pwv h LEU 114 N 6.76 0.42 -0.34 1.79 5.85 -1.88 -1.91 115.31 125.99 1pwv h LEU 114 Ca -0.41 0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.37 1pwv h LEU 114 Cb 1.16 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 1pwv h LEU 114 CO 0.75 0.22 -0.20 1.57 -0.34 0.00 0.00 178.44 180.44 1pwv n HIS 115 N -4.49 -0.15 -0.49 1.25 -0.00 -1.26 -0.48 115.22 109.61 1pwv n HIS 115 Ca 0.15 0.42 0.02 0.00 0.46 0.00 0.00 57.72 58.76 1pwv n HIS 115 Cb 0.52 -0.47 0.28 0.00 -0.12 0.00 0.00 29.99 30.21 1pwv n HIS 115 CO 0.00 0.00 0.00 -0.85 0.46 0.00 0.00 176.34 175.95 1pwv n GLU 116 N -3.72 3.68 -3.18 1.57 0.28 -0.75 -4.58 120.64 113.94 1pwv n GLU 116 Ca 0.01 -2.39 -0.20 0.00 -0.16 0.00 0.00 57.16 54.41 1pwv n GLU 116 Cb 0.09 -2.06 0.01 0.00 1.43 0.00 0.00 31.44 30.90 1pwv n GLU 116 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1pwv s HIS 117 N -2.37 3.07 -1.83 -1.84 2.46 0.37 -4.98 115.29 110.16 1pwv s HIS 117 Ca 0.42 -0.11 0.17 0.00 0.47 0.00 0.00 55.06 56.01 1pwv s HIS 117 Cb 0.33 -2.22 0.06 0.00 -0.13 0.00 0.00 32.58 30.62 1pwv s HIS 117 CO 0.12 -0.26 0.96 2.48 -2.47 0.00 0.00 174.74 175.56 1pwv n TYR 118 N -1.86 0.00 -3.54 3.88 4.11 -1.26 -4.64 117.16 113.85 1pwv n TYR 118 Ca 0.02 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.77 1pwv n TYR 118 Cb 0.58 0.00 -0.06 0.00 -0.00 0.00 0.00 39.34 39.87 1pwv n TYR 118 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1pwv s VAL 119 N -1.70 0.00 -0.29 -3.48 0.11 -1.26 0.60 120.40 114.39 1pwv s VAL 119 Ca 0.17 0.00 -0.18 0.00 -2.93 0.00 0.00 61.98 59.04 1pwv s VAL 119 Cb 0.14 -1.00 0.13 0.00 -1.53 0.00 0.00 36.38 34.12 1pwv s VAL 119 CO 0.32 0.00 0.93 -0.47 -3.33 0.00 0.00 175.10 172.55 1pwv s TYR 120 N -1.14 -0.65 -0.37 1.54 5.04 -0.76 -5.00 117.35 116.01 1pwv s TYR 120 Ca -0.08 1.34 -0.09 0.00 -2.44 0.00 0.00 57.07 55.81 1pwv s TYR 120 Cb -0.00 0.40 0.04 0.00 0.35 0.00 0.00 41.96 42.75 1pwv s TYR 120 CO 0.07 -0.32 0.17 0.00 -1.34 0.00 0.00 175.55 174.14 1pwv s ALA 121 N 1.18 3.18 0.12 3.97 0.00 -1.26 -0.68 121.76 128.26 1pwv s ALA 121 Ca -0.07 -1.82 -0.30 0.00 0.00 0.00 0.00 51.96 49.77 1pwv s ALA 121 Cb -0.04 -2.46 -0.07 0.00 0.00 0.00 0.00 23.12 20.54 1pwv s ALA 121 CO -0.14 -1.42 1.24 0.21 0.00 0.00 0.00 175.76 175.65 1pwv s LYS 122 N 1.46 4.43 0.00 0.00 2.20 0.16 -4.94 119.74 123.04 1pwv s LYS 122 Ca 0.01 1.88 0.00 0.00 -0.36 0.00 0.00 55.97 57.49 1pwv s LYS 122 Cb -0.20 -3.29 0.00 0.00 -1.51 0.00 0.00 37.83 32.83 1pwv s LYS 122 CO 0.04 -0.24 0.00 -1.91 -0.36 0.00 0.00 175.35 172.88 1pwv n GLU 123 N 3.43 2.98 -0.77 4.03 2.13 -1.26 -3.44 120.64 127.74 1pwv n GLU 123 Ca 0.08 0.00 0.10 0.00 0.66 0.00 0.00 57.16 58.00 1pwv n GLU 123 Cb 0.45 0.00 -0.03 0.00 0.27 0.00 0.00 31.44 32.13 1pwv n GLU 123 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1pwv n GLY 124 N 4.29 -1.97 2.05 8.31 0.00 -1.26 -3.90 105.19 112.70 1pwv n GLY 124 Ca 0.00 -1.31 -0.26 0.00 0.00 0.00 0.00 46.02 44.45 1pwv n GLY 124 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1pwv n TYR 125 N -3.10 2.76 -2.79 1.61 4.02 -1.26 -4.05 117.16 114.35 1pwv n TYR 125 Ca -0.01 -2.48 -0.10 0.00 -0.01 0.00 0.00 57.90 55.30 1pwv n TYR 125 Cb 0.35 -0.88 0.06 0.00 -0.02 0.00 0.00 39.34 38.86 1pwv n TYR 125 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1pwv n GLU 126 N -0.88 1.10 -1.33 -0.72 4.07 -1.26 -5.04 120.64 116.57 1pwv n GLU 126 Ca 0.52 -2.55 -0.35 0.00 -0.06 0.00 0.00 57.16 54.72 1pwv n GLU 126 Cb 0.88 -0.91 0.10 0.00 -0.06 0.00 0.00 31.44 31.45 1pwv n GLU 126 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 1pwv n PRO 127 N -0.08 0.51 -3.69 5.31 -0.02 -1.25 -4.97 135.00 130.81 1pwv n PRO 127 Ca 0.08 0.24 -0.13 0.00 -2.02 0.00 0.00 63.50 61.67 1pwv n PRO 127 Cb 0.77 -2.40 -0.07 0.00 -0.02 0.00 0.00 33.50 31.79 1pwv n PRO 127 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1pwv s VAL 128 N -1.85 0.06 -0.17 -1.45 -7.23 -1.22 -2.51 120.40 106.03 1pwv s VAL 128 Ca 0.76 -0.50 -0.01 0.00 -1.81 0.00 0.00 61.98 60.41 1pwv s VAL 128 Cb -0.33 -0.92 0.05 0.00 0.56 0.00 0.00 36.38 35.74 1pwv s VAL 128 CO 0.48 -0.28 -0.02 -0.22 -0.31 0.00 0.00 175.10 174.75 1pwv s LEU 129 N -1.93 1.51 -0.24 1.32 0.20 -0.52 0.36 118.68 119.38 1pwv s LEU 129 Ca -0.06 -0.72 -0.07 0.00 0.69 0.00 0.00 54.13 53.97 1pwv s LEU 129 Cb -0.01 -0.81 -0.03 0.00 -0.43 0.00 0.00 46.19 44.91 1pwv s LEU 129 CO -0.02 -0.23 0.06 -0.69 -0.29 0.00 0.00 176.35 175.19 1pwv s VAL 130 N 1.70 4.32 -0.07 1.68 1.01 0.15 0.18 120.40 129.37 1pwv s VAL 130 Ca -0.00 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.82 1pwv s VAL 130 Cb -0.16 -3.01 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 1pwv s VAL 130 CO -0.07 0.36 -0.09 -0.63 0.00 0.00 0.00 175.10 174.67 1pwv s ILE 131 N 1.45 3.54 -0.57 2.22 -1.09 0.15 -1.83 121.20 125.07 1pwv s ILE 131 Ca 0.05 -0.54 -0.23 0.00 -2.23 0.00 0.00 60.65 57.71 1pwv s ILE 131 Cb -0.15 -2.44 0.05 0.00 -1.58 0.00 0.00 42.46 38.34 1pwv s ILE 131 CO 0.03 0.59 0.90 -1.58 -1.23 0.00 0.00 174.94 173.65 1pwv s GLN 132 N -0.68 3.25 -0.02 2.79 0.74 0.20 -1.14 119.66 124.80 1pwv s GLN 132 Ca 0.10 -0.48 -0.31 0.00 0.05 0.00 0.00 55.36 54.72 1pwv s GLN 132 Cb -0.11 -4.10 -0.15 0.00 1.10 0.00 0.00 33.01 29.75 1pwv s GLN 132 CO 0.01 -1.51 0.85 0.45 -0.55 0.00 0.00 175.29 174.54 1pwv n SER 133 N 7.32 0.04 -2.94 6.67 2.88 0.49 -4.91 113.62 123.17 1pwv n SER 133 Ca -0.01 0.90 0.02 0.00 -1.33 0.00 0.00 58.87 58.45 1pwv n SER 133 Cb 0.47 -0.71 0.01 0.00 -0.75 0.00 0.00 64.21 63.23 1pwv n SER 133 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1pwv n SER 134 N 1.26 -0.84 -0.24 -3.46 7.64 -1.26 -4.88 113.62 111.84 1pwv n SER 134 Ca 0.16 -1.19 0.00 0.00 1.01 0.00 0.00 58.87 58.86 1pwv n SER 134 Cb 0.06 1.30 0.01 0.00 -1.01 0.00 0.00 64.21 64.56 1pwv n SER 134 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1pwv n GLU 135 N -0.63 0.19 0.20 1.43 4.71 -1.26 -4.77 120.64 120.51 1pwv n GLU 135 Ca 0.03 -0.87 0.04 0.00 -0.01 0.00 0.00 57.16 56.35 1pwv n GLU 135 Cb 0.40 -0.57 0.40 0.00 -1.01 0.00 0.00 31.44 30.66 1pwv n GLU 135 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 1pwv h ASP 136 N 0.00 0.00 -1.60 1.62 5.19 -1.96 -3.11 116.42 116.55 1pwv h ASP 136 Ca 0.00 0.00 0.51 0.00 -0.62 0.00 0.00 57.03 56.92 1pwv h ASP 136 Cb 1.17 0.00 -0.11 0.00 0.18 0.00 0.00 39.33 40.56 1pwv h ASP 136 CO 0.00 0.34 1.09 -1.22 -3.12 0.00 0.00 179.24 176.33 1pwv n TYR 137 N -3.92 0.40 0.00 4.55 0.53 -1.26 0.11 117.16 117.58 1pwv n TYR 137 Ca -0.02 0.41 0.00 0.00 -1.02 0.00 0.00 57.90 57.27 1pwv n TYR 137 Cb 0.41 -0.86 0.00 0.00 -1.03 0.00 0.00 39.34 37.85 1pwv n TYR 137 CO 0.00 0.00 0.00 0.28 -1.02 0.00 0.00 176.86 176.12 1pwv n VAL 138 N -4.35 0.00 0.38 -0.72 0.31 -1.18 -4.55 118.33 108.22 1pwv n VAL 138 Ca 0.41 0.37 -0.15 0.00 -0.01 0.00 0.00 64.34 64.97 1pwv n VAL 138 Cb 1.73 -0.86 -0.07 0.00 -0.91 0.00 0.00 33.84 33.73 1pwv n VAL 138 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1pwv h GLU 139 N 0.00 -0.95 -5.72 5.55 4.39 -1.65 -3.38 114.58 112.82 1pwv h GLU 139 Ca 0.00 0.06 -0.39 0.00 0.34 0.00 0.00 59.36 59.38 1pwv h GLU 139 Cb 0.00 0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 1pwv h GLU 139 CO 0.00 -0.63 1.19 1.21 -1.16 0.00 0.00 179.01 179.62 1pwv s ASN 140 N -3.51 4.75 0.01 1.42 3.84 0.30 -4.83 114.94 116.93 1pwv s ASN 140 Ca -0.15 0.43 0.28 0.00 0.21 0.00 0.00 52.86 53.63 1pwv s ASN 140 Cb 0.02 -2.53 1.01 0.00 -0.55 0.00 0.00 41.25 39.20 1pwv s ASN 140 CO 0.44 -2.82 1.77 0.35 -2.79 0.00 0.00 177.10 174.05 1pwv n THR 141 N 7.81 0.02 0.08 -5.21 -2.24 -1.26 -3.79 114.28 109.68 1pwv n THR 141 Ca 0.33 -0.01 0.03 0.00 -2.27 0.00 0.00 64.05 62.12 1pwv n THR 141 Cb 0.51 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 68.42 1pwv n THR 141 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1pwv h GLU 142 N 0.00 0.00 -0.19 -0.78 5.08 -1.93 -2.48 114.58 114.28 1pwv h GLU 142 Ca 0.00 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.18 1pwv h GLU 142 Cb 0.51 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1pwv h GLU 142 CO 0.00 0.28 -0.63 0.87 -1.00 0.00 0.00 179.01 178.54 1pwv h LYS 143 N 0.00 0.66 0.17 2.33 1.57 -1.93 -2.92 116.57 116.46 1pwv h LYS 143 Ca -0.09 -0.46 -0.01 0.00 -1.87 0.00 0.00 60.65 58.22 1pwv h LYS 143 Cb 1.42 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.80 1pwv h LYS 143 CO 0.04 1.08 -0.08 0.00 -0.57 0.00 0.00 179.45 179.92 1pwv h ALA 144 N 0.81 -0.23 -0.24 3.86 0.00 -1.68 -1.69 119.26 120.09 1pwv h ALA 144 Ca -0.01 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.77 1pwv h ALA 144 Cb 1.21 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1pwv h ALA 144 CO 0.12 -0.41 0.49 1.25 0.00 0.00 0.00 179.25 180.70 1pwv h LEU 145 N -0.66 0.00 0.12 0.00 7.12 -1.51 0.09 115.31 120.46 1pwv h LEU 145 Ca -0.02 0.00 -0.27 0.00 0.13 0.00 0.00 57.88 57.72 1pwv h LEU 145 Cb 0.48 0.00 -0.00 0.00 -0.53 0.00 0.00 40.66 40.61 1pwv h LEU 145 CO 0.04 0.00 -1.35 -1.13 -0.13 0.00 0.00 178.44 175.87 1pwv h ASN 146 N 0.00 0.38 -0.42 1.25 -0.73 -1.26 -2.90 115.58 111.90 1pwv h ASN 146 Ca 0.11 -0.86 -0.04 0.00 1.87 0.00 0.00 56.30 57.38 1pwv h ASN 146 Cb 1.09 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 39.53 1pwv h ASN 146 CO -0.00 1.59 0.13 0.58 -0.37 0.00 0.00 177.43 179.36 1pwv h VAL 147 N -0.32 1.20 -0.58 2.57 2.07 -0.11 -1.91 116.25 119.17 1pwv h VAL 147 Ca -0.29 -0.71 -0.06 0.00 0.82 0.00 0.00 66.70 66.46 1pwv h VAL 147 Cb 1.74 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1pwv h VAL 147 CO 0.07 0.27 0.13 1.88 0.02 0.00 0.00 177.57 179.93 1pwv h TYR 148 N 0.70 0.98 0.00 1.57 0.99 -1.29 -1.05 116.97 118.88 1pwv h TYR 148 Ca 0.16 -0.12 -0.03 0.00 2.00 0.00 0.00 58.73 60.74 1pwv h TYR 148 Cb 0.24 -0.28 -0.00 0.00 1.00 0.00 0.00 36.73 37.69 1pwv h TYR 148 CO 0.01 0.84 -0.15 -0.92 -0.00 0.00 0.00 178.16 177.94 1pwv h TYR 149 N 0.84 0.00 0.05 4.88 3.20 -1.22 0.71 116.97 125.44 1pwv h TYR 149 Ca 0.18 0.00 -0.25 0.00 3.14 0.00 0.00 58.73 61.80 1pwv h TYR 149 Cb 0.36 0.00 0.02 0.00 1.54 0.00 0.00 36.73 38.65 1pwv h TYR 149 CO 0.03 0.15 -1.03 1.49 -1.64 0.00 0.00 178.16 177.16 1pwv h GLU 150 N 0.00 0.60 -0.26 1.82 4.57 -0.77 -2.78 114.58 117.76 1pwv h GLU 150 Ca -0.00 -0.72 -0.05 0.00 -1.18 0.00 0.00 59.36 57.41 1pwv h GLU 150 Cb 0.32 0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.11 1pwv h GLU 150 CO 0.02 1.30 -0.07 0.82 -1.18 0.00 0.00 179.01 179.91 1pwv h ILE 151 N 0.21 1.19 0.00 2.32 2.04 0.01 0.82 117.51 124.10 1pwv h ILE 151 Ca -0.14 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 64.91 1pwv h ILE 151 Cb 1.71 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.86 1pwv h ILE 151 CO 0.20 0.27 0.00 1.23 0.00 0.00 0.00 178.15 179.84 1pwv h GLY 152 N 0.80 0.00 1.37 5.37 0.00 0.52 -0.86 103.07 110.28 1pwv h GLY 152 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.13 1pwv h GLY 152 CO 0.02 0.00 -1.44 0.50 0.00 0.00 0.00 176.54 175.62 1pwv h LYS 153 N 0.00 0.14 0.33 4.80 1.57 -0.57 -2.75 116.57 120.08 1pwv h LYS 153 Ca 0.00 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.53 1pwv h LYS 153 Cb 0.27 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1pwv h LYS 153 CO 0.00 0.96 -0.16 0.82 -0.57 0.00 0.00 179.45 180.51 1pwv h ILE 154 N 0.04 0.69 0.19 1.86 1.08 -0.65 -0.00 117.51 120.71 1pwv h ILE 154 Ca -0.19 -0.46 0.00 0.00 -0.39 0.00 0.00 64.86 63.82 1pwv h ILE 154 Cb 1.95 0.92 -0.03 0.00 -3.07 0.00 0.00 36.82 36.60 1pwv h ILE 154 CO 0.14 0.09 -0.41 0.25 -0.69 0.00 0.00 178.15 177.53 1pwv h LEU 155 N -0.70 -1.19 -0.89 1.44 5.85 -1.40 0.16 115.31 118.58 1pwv h LEU 155 Ca -0.04 0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.74 1pwv h LEU 155 Cb 0.48 0.43 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 1pwv h LEU 155 CO 0.07 -0.47 0.20 -1.28 -0.34 0.00 0.00 178.44 176.62 1pwv h SER 156 N -0.66 0.95 0.04 1.25 0.87 -1.55 0.44 113.55 114.89 1pwv h SER 156 Ca -0.02 -0.17 -0.37 0.00 -1.23 0.00 0.00 61.79 60.00 1pwv h SER 156 Cb 0.62 -0.25 -0.07 0.00 -0.44 0.00 0.00 62.40 62.27 1pwv h SER 156 CO -0.17 0.89 -2.34 -1.14 -0.53 0.00 0.00 176.83 173.54 1pwv n ARG 157 N -4.26 0.68 -0.10 2.24 0.63 -0.02 -3.95 116.66 111.87 1pwv n ARG 157 Ca 0.05 0.05 -0.12 0.00 -0.92 0.00 0.00 57.85 56.91 1pwv n ARG 157 Cb 0.22 -1.55 -0.13 0.00 0.45 0.00 0.00 32.46 31.45 1pwv n ARG 157 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1pwv n ASP 158 N -2.89 1.01 -0.01 6.15 10.43 0.37 -4.47 116.55 127.14 1pwv n ASP 158 Ca -0.34 -0.05 -0.01 0.00 2.57 0.00 0.00 54.79 56.96 1pwv n ASP 158 Cb 1.11 0.46 -0.00 0.00 1.84 0.00 0.00 41.12 44.54 1pwv n ASP 158 CO 0.00 0.00 0.00 -0.38 -1.07 0.00 0.00 177.20 175.75 1pwv n ILE 159 N -2.89 0.16 -0.17 0.53 2.08 -0.10 -4.43 119.36 114.54 1pwv n ILE 159 Ca -0.35 0.47 0.25 0.00 0.56 0.00 0.00 62.75 63.67 1pwv n ILE 159 Cb 1.05 -1.60 0.66 0.00 -0.75 0.00 0.00 39.64 39.01 1pwv n ILE 159 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1pwv h LEU 160 N -0.11 0.12 -1.09 1.39 3.38 -0.34 -1.60 115.31 117.06 1pwv h LEU 160 Ca 0.00 0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 1pwv h LEU 160 Cb 0.07 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1pwv h LEU 160 CO 0.00 0.05 -0.30 0.77 0.09 0.00 0.00 178.44 179.05 1pwv h SER 161 N 0.12 0.27 0.00 -0.43 4.64 -1.42 0.16 113.55 116.89 1pwv h SER 161 Ca 0.41 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1pwv h SER 161 Cb 1.45 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.47 1pwv h SER 161 CO -0.06 0.57 0.00 0.29 -0.87 0.00 0.00 176.83 176.76 1pwv n LYS 162 N -4.12 0.13 -1.28 4.77 4.76 -0.60 -1.36 118.16 120.47 1pwv n LYS 162 Ca -0.01 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.44 1pwv n LYS 162 Cb 0.40 -1.35 -0.00 0.00 -1.84 0.00 0.00 35.03 32.24 1pwv n LYS 162 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1pwv n ILE 163 N -0.85 0.00 -3.68 -0.18 -5.35 -0.93 -5.01 119.36 103.36 1pwv n ILE 163 Ca 0.02 -0.67 -0.21 0.00 -0.27 0.00 0.00 62.75 61.62 1pwv n ILE 163 Cb 0.01 0.82 0.04 0.00 -1.74 0.00 0.00 39.64 38.77 1pwv n ILE 163 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1pwv n ASN 164 N 0.34 -1.41 -4.13 7.28 5.03 -0.46 -4.89 115.26 117.01 1pwv n ASN 164 Ca -0.02 -0.80 -0.18 0.00 0.87 0.00 0.00 54.58 54.45 1pwv n ASN 164 Cb 1.00 -4.17 -0.13 0.00 -1.02 0.00 0.00 39.78 35.46 1pwv n ASN 164 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1pwv s GLN 165 N -5.94 0.82 0.78 3.52 -1.52 0.53 -4.13 119.66 113.72 1pwv s GLN 165 Ca 0.03 -0.79 -0.11 0.00 -1.95 0.00 0.00 55.36 52.54 1pwv s GLN 165 Cb -0.01 -0.79 0.06 0.00 -0.22 0.00 0.00 33.01 32.04 1pwv s GLN 165 CO 0.80 0.19 1.08 -1.25 -0.25 0.00 0.00 175.29 175.86 1pwv s PRO 166 N -1.34 2.22 0.00 2.91 0.04 -1.26 -1.58 135.00 135.98 1pwv s PRO 166 Ca -0.01 0.97 0.00 0.00 0.04 0.00 0.00 61.00 62.00 1pwv s PRO 166 Cb -0.09 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1pwv s PRO 166 CO 0.01 -1.61 0.00 0.98 0.04 0.00 0.00 177.00 176.42 1pwv n TYR 167 N -3.48 0.00 -0.30 0.56 9.36 -1.26 -4.99 117.16 117.06 1pwv n TYR 167 Ca 0.08 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.33 1pwv n TYR 167 Cb 0.54 0.00 0.10 0.00 -0.63 0.00 0.00 39.34 39.36 1pwv n TYR 167 CO 0.00 0.00 0.00 0.37 0.22 0.00 0.00 176.86 177.45 1pwv h GLN 168 N 0.00 -0.00 -0.17 2.98 5.75 -1.91 -1.97 115.11 119.79 1pwv h GLN 168 Ca 0.00 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.55 1pwv h GLN 168 Cb 0.00 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 28.48 1pwv h GLN 168 CO 0.00 -0.00 -0.40 -0.22 -2.65 0.00 0.00 178.83 175.56 1pwv h LYS 169 N -0.00 -0.43 -0.69 1.69 3.64 -1.96 -0.99 116.57 117.83 1pwv h LYS 169 Ca 0.40 0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.80 1pwv h LYS 169 Cb 0.61 0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.50 1pwv h LYS 169 CO -0.86 -0.29 0.37 0.35 -2.27 0.00 0.00 179.45 176.75 1pwv h PHE 170 N -0.45 0.95 -0.54 1.91 3.57 -1.77 -1.12 116.94 119.49 1pwv h PHE 170 Ca 0.09 -0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.70 1pwv h PHE 170 Cb 0.60 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 1pwv h PHE 170 CO -0.49 0.68 0.38 -0.07 -2.23 0.00 0.00 178.31 176.58 1pwv h LEU 171 N 0.95 0.11 -0.63 0.59 3.38 -0.78 0.10 115.31 119.03 1pwv h LEU 171 Ca 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 1pwv h LEU 171 Cb 0.05 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 1pwv h LEU 171 CO -0.04 0.06 0.35 0.44 0.09 0.00 0.00 178.44 179.34 1pwv h ASP 172 N 0.12 0.79 0.10 -0.43 3.32 0.13 -1.26 116.42 119.18 1pwv h ASP 172 Ca 0.26 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.22 1pwv h ASP 172 Cb 0.87 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.22 1pwv h ASP 172 CO -0.03 0.65 -0.05 0.58 -1.72 0.00 0.00 179.24 178.67 1pwv h VAL 173 N 0.86 0.91 -0.79 -1.35 2.07 -0.73 -0.64 116.25 116.58 1pwv h VAL 173 Ca 0.22 -0.01 0.17 0.00 0.82 0.00 0.00 66.70 67.90 1pwv h VAL 173 Cb 0.03 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 1pwv h VAL 173 CO -0.04 0.00 0.53 -0.07 0.02 0.00 0.00 177.57 178.02 1pwv h LEU 174 N -0.14 0.34 0.05 2.57 3.38 -1.03 0.38 115.31 120.87 1pwv h LEU 174 Ca -0.01 0.02 -0.25 0.00 0.09 0.00 0.00 57.88 57.73 1pwv h LEU 174 Cb 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1pwv h LEU 174 CO 0.02 0.16 -1.14 0.78 0.09 0.00 0.00 178.44 178.36 1pwv h ASN 175 N 0.36 0.30 0.01 -0.43 2.35 -0.62 -0.08 115.58 117.48 1pwv h ASN 175 Ca 0.39 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1pwv h ASN 175 Cb 1.00 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 1pwv h ASN 175 CO -0.12 1.23 -0.03 0.74 -1.65 0.00 0.00 177.43 177.60 1pwv h THR 176 N 0.06 0.92 0.54 2.81 2.02 0.56 -1.83 112.91 117.99 1pwv h THR 176 Ca -0.09 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 1pwv h THR 176 Cb 1.87 0.92 0.01 0.00 -1.74 0.00 0.00 68.15 69.20 1pwv h THR 176 CO 0.18 0.00 -0.26 0.40 0.37 0.00 0.00 175.52 176.21 1pwv h ILE 177 N -0.07 0.44 0.00 3.11 2.04 -1.19 0.04 117.51 121.89 1pwv h ILE 177 Ca 0.01 -0.15 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1pwv h ILE 177 Cb 0.08 0.51 0.00 0.00 -0.74 0.00 0.00 36.82 36.66 1pwv h ILE 177 CO -0.03 0.02 0.19 1.17 0.00 0.00 0.00 178.15 179.51 1pwv n LYS 178 N -5.37 0.00 0.00 2.37 4.81 -0.04 -0.40 118.16 119.53 1pwv n LYS 178 Ca -0.12 0.28 0.00 0.00 -0.87 0.00 0.00 58.31 57.60 1pwv n LYS 178 Cb 0.32 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.68 1pwv n LYS 178 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1pwv n ASN 179 N -1.27 1.03 -4.06 3.14 3.02 -0.70 -5.04 115.26 111.36 1pwv n ASN 179 Ca 0.00 -1.37 -0.29 0.00 -0.03 0.00 0.00 54.58 52.89 1pwv n ASN 179 Cb 0.19 0.00 0.28 0.00 -0.61 0.00 0.00 39.78 39.64 1pwv n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1pwv s ALA 180 N -0.37 -0.82 -0.15 5.41 0.00 0.47 -4.95 121.76 121.35 1pwv s ALA 180 Ca 0.00 -0.40 -0.21 0.00 0.00 0.00 0.00 51.96 51.35 1pwv s ALA 180 Cb 0.00 -3.14 -0.18 0.00 0.00 0.00 0.00 23.12 19.80 1pwv s ALA 180 CO 0.00 -4.30 0.43 1.03 0.00 0.00 0.00 175.76 172.92 1pwv h SER 181 N -3.05 0.00 -3.04 0.00 0.87 -1.91 -3.44 113.55 102.99 1pwv h SER 181 Ca -0.56 -0.64 -0.57 0.00 -1.23 0.00 0.00 61.79 58.79 1pwv h SER 181 Cb 1.34 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.25 1pwv h SER 181 CO 0.42 1.03 0.81 -0.62 -0.53 0.00 0.00 176.83 177.94 1pwv s ASP 182 N -6.25 7.06 -0.08 6.23 3.68 -1.26 -4.92 116.67 121.13 1pwv s ASP 182 Ca -0.18 1.51 0.06 0.00 2.13 0.00 0.00 52.55 56.07 1pwv s ASP 182 Cb 0.00 -2.54 0.32 0.00 -1.45 0.00 0.00 42.92 39.25 1pwv s ASP 182 CO 0.52 -0.68 1.04 -1.54 0.13 0.00 0.00 175.17 174.65 1pwv n SER 183 N 6.24 2.71 -0.27 -0.34 3.41 -1.26 -4.22 113.62 119.89 1pwv n SER 183 Ca 0.12 -2.32 -0.06 0.00 -0.26 0.00 0.00 58.87 56.35 1pwv n SER 183 Cb 0.46 -0.52 0.05 0.00 -0.26 0.00 0.00 64.21 63.95 1pwv n SER 183 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1pwv h ASP 184 N 1.65 1.00 -0.27 4.04 3.45 -1.91 -0.40 116.42 123.97 1pwv h ASP 184 Ca 0.00 -0.16 -0.05 0.00 0.43 0.00 0.00 57.03 57.25 1pwv h ASP 184 Cb 0.99 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.49 1pwv h ASP 184 CO 0.17 0.89 -0.02 1.23 -1.57 0.00 0.00 179.24 179.94 1pwv h GLY 185 N 1.05 0.53 0.25 2.75 0.00 -1.42 -0.55 103.07 105.68 1pwv h GLY 185 Ca 0.25 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1pwv h GLY 185 CO -0.02 0.37 -0.32 -1.61 0.00 0.00 0.00 176.54 174.95 1pwv h GLN 186 N 0.26 -0.57 -0.26 4.80 4.15 -1.77 -0.88 115.11 120.86 1pwv h GLN 186 Ca 0.07 0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.61 1pwv h GLN 186 Cb 0.45 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.26 1pwv h GLN 186 CO 0.02 -0.38 0.30 -0.44 -1.93 0.00 0.00 178.83 176.40 1pwv h ASP 187 N -0.59 0.00 0.53 -0.69 3.45 -1.10 0.20 116.42 118.23 1pwv h ASP 187 Ca -0.03 0.00 -0.24 0.00 0.43 0.00 0.00 57.03 57.19 1pwv h ASP 187 Cb 0.53 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.30 1pwv h ASP 187 CO -0.08 0.00 -1.04 0.25 -1.57 0.00 0.00 179.24 176.80 1pwv h LEU 188 N 0.00 0.41 0.00 1.55 5.85 0.01 -3.41 115.31 119.72 1pwv h LEU 188 Ca 0.12 -0.37 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 1pwv h LEU 188 Cb 0.72 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1pwv h LEU 188 CO -0.00 1.22 -1.27 0.18 -0.34 0.00 0.00 178.44 178.23 1pwv n LEU 189 N -3.63 0.00 -4.83 2.25 4.77 -0.44 -5.06 117.00 110.06 1pwv n LEU 189 Ca -0.06 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.58 1pwv n LEU 189 Cb 0.90 0.08 -0.06 0.00 -2.33 0.00 0.00 43.42 42.01 1pwv n LEU 189 CO 0.51 0.08 0.50 -0.36 -1.33 0.00 0.00 177.39 176.80 1pwv s PHE 190 N -2.14 3.43 0.77 -1.77 2.99 0.63 -4.75 117.98 117.15 1pwv s PHE 190 Ca -0.02 1.41 -0.06 0.00 0.00 0.00 0.00 56.93 58.26 1pwv s PHE 190 Cb 0.02 -2.67 0.13 0.00 0.00 0.00 0.00 43.02 40.49 1pwv s PHE 190 CO 0.17 0.09 1.08 0.95 -0.00 0.00 0.00 175.22 177.51 1pwv s THR 191 N -1.92 2.15 0.28 0.64 -4.23 -1.26 -4.79 115.64 106.51 1pwv s THR 191 Ca 0.54 -0.37 0.04 0.00 -1.18 0.00 0.00 61.69 60.71 1pwv s THR 191 Cb -0.12 -2.78 0.05 0.00 1.34 0.00 0.00 72.50 70.99 1pwv s THR 191 CO 0.17 0.00 1.70 0.78 -0.54 0.00 0.00 174.62 176.73 1pwv h ASN 192 N -0.82 0.40 -0.04 3.99 2.35 -1.98 -1.50 115.58 117.97 1pwv h ASN 192 Ca -0.40 -0.15 0.02 0.00 -0.55 0.00 0.00 56.30 55.21 1pwv h ASN 192 Cb 1.27 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.50 1pwv h ASN 192 CO 0.44 0.72 -0.09 -0.61 -1.65 0.00 0.00 177.43 176.24 1pwv h GLN 193 N 0.34 -0.12 -0.15 0.81 4.15 -1.99 -0.17 115.11 117.97 1pwv h GLN 193 Ca 0.04 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.46 1pwv h GLN 193 Cb 0.76 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.47 1pwv h GLN 193 CO 0.06 -0.08 0.04 -0.07 -1.93 0.00 0.00 178.83 176.85 1pwv h LEU 194 N -0.13 0.21 -0.48 -2.39 3.38 -1.91 -2.15 115.31 111.84 1pwv h LEU 194 Ca 0.05 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 57.90 1pwv h LEU 194 Cb 0.19 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 40.81 1pwv h LEU 194 CO -0.12 0.37 -0.01 0.11 0.09 0.00 0.00 178.44 178.88 1pwv h LYS 195 N 0.05 0.11 -0.53 1.13 1.57 -1.04 -2.66 116.57 115.19 1pwv h LYS 195 Ca 0.05 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1pwv h LYS 195 Cb 0.23 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1pwv h LYS 195 CO -0.00 0.07 0.22 0.93 -0.57 0.00 0.00 179.45 180.10 1pwv h GLU 196 N 0.11 0.79 -2.93 3.15 5.08 -0.90 -3.46 114.58 116.42 1pwv h GLU 196 Ca 0.24 -0.14 -0.38 0.00 -1.00 0.00 0.00 59.36 58.08 1pwv h GLU 196 Cb 0.36 -0.13 0.03 0.00 0.50 0.00 0.00 28.75 29.51 1pwv h GLU 196 CO -0.41 0.68 0.02 1.58 -1.00 0.00 0.00 179.01 179.88 1pwv n HIS 197 N -4.54 0.29 0.13 4.33 -0.00 -0.82 -4.88 115.22 109.73 1pwv n HIS 197 Ca 0.02 0.52 -0.01 0.00 0.46 0.00 0.00 57.72 58.71 1pwv n HIS 197 Cb 0.15 -1.02 0.11 0.00 -0.12 0.00 0.00 29.99 29.11 1pwv n HIS 197 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1pwv h PRO 198 N 1.42 0.00 -5.22 1.57 0.13 -1.89 -3.48 132.00 124.53 1pwv h PRO 198 Ca -0.24 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.26 1pwv h PRO 198 Cb 0.70 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.70 1pwv h PRO 198 CO 0.32 0.67 -0.53 0.95 -0.23 0.00 0.00 178.00 179.17 1pwv s THR 199 N -3.29 1.13 0.76 1.56 -4.23 -1.26 -5.12 115.64 105.19 1pwv s THR 199 Ca 0.00 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.37 1pwv s THR 199 Cb 0.11 -2.38 0.06 0.00 1.34 0.00 0.00 72.50 71.63 1pwv s THR 199 CO 0.76 0.00 1.22 -1.81 -0.54 0.00 0.00 174.62 174.25 1pwv s ASP 200 N -3.75 3.92 0.10 3.99 1.11 -1.26 -4.94 116.67 115.84 1pwv s ASP 200 Ca 0.17 2.39 -0.28 0.00 0.18 0.00 0.00 52.55 55.01 1pwv s ASP 200 Cb 0.04 -2.59 -0.06 0.00 1.07 0.00 0.00 42.92 41.38 1pwv s ASP 200 CO 0.09 -2.45 0.90 -0.36 1.18 0.00 0.00 175.17 174.53 1pwv s PHE 201 N -2.01 3.80 0.51 4.23 0.40 -1.26 -5.04 117.98 118.62 1pwv s PHE 201 Ca 0.75 1.71 0.05 0.00 -0.60 0.00 0.00 56.93 58.84 1pwv s PHE 201 Cb -0.30 -2.98 0.02 0.00 0.51 0.00 0.00 43.02 40.27 1pwv s PHE 201 CO 0.47 0.24 0.34 -1.54 0.70 0.00 0.00 175.22 175.44 1pwv s SER 202 N -0.07 4.60 0.49 1.36 1.04 -1.26 -4.93 113.70 114.93 1pwv s SER 202 Ca 0.44 -1.22 0.28 0.00 0.48 0.00 0.00 55.95 55.93 1pwv s SER 202 Cb -0.23 0.23 1.19 0.00 0.10 0.00 0.00 66.02 67.32 1pwv s SER 202 CO 0.28 -0.98 1.93 0.58 0.98 0.00 0.00 173.24 176.03 1pwv h VAL 203 N 0.90 0.39 0.01 5.02 2.07 -1.99 -1.69 116.25 120.97 1pwv h VAL 203 Ca -0.38 -0.82 -0.24 0.00 0.82 0.00 0.00 66.70 66.08 1pwv h VAL 203 Cb 1.29 1.60 0.02 0.00 -1.52 0.00 0.00 31.29 32.68 1pwv h VAL 203 CO 0.60 0.14 -0.96 -0.33 0.02 0.00 0.00 177.57 177.04 1pwv h GLU 204 N 0.00 0.63 -0.09 1.57 3.07 -1.99 -2.58 114.58 115.18 1pwv h GLU 204 Ca -0.00 -0.69 0.03 0.00 -0.50 0.00 0.00 59.36 58.20 1pwv h GLU 204 Cb 0.58 0.20 -0.04 0.00 -0.84 0.00 0.00 28.75 28.66 1pwv h GLU 204 CO 0.02 1.28 -0.13 0.35 -1.40 0.00 0.00 179.01 179.13 1pwv h PHE 205 N 0.26 -0.33 -0.93 4.33 3.04 -1.83 0.30 116.94 121.78 1pwv h PHE 205 Ca -0.12 0.02 0.25 0.00 3.98 0.00 0.00 57.97 62.10 1pwv h PHE 205 Cb 1.63 0.16 -0.05 0.00 2.56 0.00 0.00 35.95 40.25 1pwv h PHE 205 CO 0.12 -0.19 0.65 1.25 -2.02 0.00 0.00 178.31 178.11 1pwv h LEU 206 N -0.17 0.16 -0.39 0.59 7.12 -1.25 0.18 115.31 121.54 1pwv h LEU 206 Ca 0.08 0.02 -0.01 0.00 0.13 0.00 0.00 57.88 58.10 1pwv h LEU 206 Cb 0.28 -0.01 -0.00 0.00 -0.53 0.00 0.00 40.66 40.40 1pwv h LEU 206 CO -0.20 0.05 -0.06 -0.33 -0.13 0.00 0.00 178.44 177.77 1pwv h GLU 207 N 0.15 0.00 -0.03 1.25 4.39 -0.53 -1.97 114.58 117.84 1pwv h GLU 207 Ca 0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.17 1pwv h GLU 207 Cb 1.58 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.23 1pwv h GLU 207 CO -0.08 0.06 0.00 1.04 -1.16 0.00 0.00 179.01 178.87 1pwv n GLN 208 N -3.13 2.46 -0.98 2.33 1.13 -0.08 -4.58 117.38 114.54 1pwv n GLN 208 Ca 0.03 -1.91 -0.01 0.00 -1.94 0.00 0.00 57.00 53.17 1pwv n GLN 208 Cb 0.49 -1.20 -0.02 0.00 0.11 0.00 0.00 30.24 29.63 1pwv n GLN 208 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1pwv n ASN 209 N -0.73 0.01 0.21 1.08 3.02 -0.43 -4.93 115.26 113.49 1pwv n ASN 209 Ca 0.06 -1.82 0.11 0.00 -0.03 0.00 0.00 54.58 52.90 1pwv n ASN 209 Cb 0.40 -0.04 0.33 0.00 -0.61 0.00 0.00 39.78 39.86 1pwv n ASN 209 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1pwv h SER 210 N 0.32 0.00 0.03 6.41 4.64 -1.56 -0.15 113.55 123.24 1pwv h SER 210 Ca -0.25 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1pwv h SER 210 Cb 1.49 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1pwv h SER 210 CO -0.06 0.00 -0.01 -1.13 -0.87 0.00 0.00 176.83 174.76 1pwv h ASN 211 N 0.00 -0.03 -0.90 4.97 -0.73 -1.91 -3.05 115.58 113.93 1pwv h ASN 211 Ca 0.11 -0.38 0.16 0.00 1.87 0.00 0.00 56.30 58.06 1pwv h ASN 211 Cb 1.80 0.01 -0.07 0.00 0.27 0.00 0.00 38.32 40.33 1pwv h ASN 211 CO -0.00 0.65 0.58 -0.33 -0.37 0.00 0.00 177.43 177.95 1pwv h GLU 212 N -0.99 0.60 0.28 6.67 4.39 -1.43 -0.18 114.58 123.92 1pwv h GLU 212 Ca -0.00 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 1pwv h GLU 212 Cb 0.41 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1pwv h GLU 212 CO 0.01 0.40 -0.13 0.28 -1.16 0.00 0.00 179.01 178.40 1pwv h VAL 213 N 0.62 0.69 -1.00 3.13 2.07 -1.67 -2.95 116.25 117.15 1pwv h VAL 213 Ca 0.46 -0.73 0.35 0.00 0.82 0.00 0.00 66.70 67.60 1pwv h VAL 213 Cb 0.84 1.05 -0.16 0.00 -1.52 0.00 0.00 31.29 31.50 1pwv h VAL 213 CO -0.21 0.14 0.54 1.56 0.02 0.00 0.00 177.57 179.62 1pwv h GLN 214 N -0.81 0.20 -0.40 1.57 4.20 -1.07 0.21 115.11 119.01 1pwv h GLN 214 Ca -0.04 -0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 1pwv h GLN 214 Cb 0.51 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1pwv h GLN 214 CO 0.06 0.13 0.09 0.93 -0.67 0.00 0.00 178.83 179.38 1pwv h GLU 215 N 0.21 0.65 -0.76 1.46 4.39 -0.98 -0.00 114.58 119.55 1pwv h GLU 215 Ca 0.77 -0.16 -0.02 0.00 0.34 0.00 0.00 59.36 60.29 1pwv h GLU 215 Cb 1.85 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 30.38 1pwv h GLU 215 CO -0.67 0.67 0.41 0.28 -1.16 0.00 0.00 179.01 178.55 1pwv h VAL 216 N 0.51 1.23 0.72 3.13 2.07 -0.45 -0.12 116.25 123.33 1pwv h VAL 216 Ca 0.13 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 1pwv h VAL 216 Cb 0.32 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1pwv h VAL 216 CO 0.00 0.25 -0.48 0.15 0.02 0.00 0.00 177.57 177.52 1pwv h PHE 217 N 1.05 -1.29 -0.87 1.57 3.57 -1.06 -0.29 116.94 119.62 1pwv h PHE 217 Ca 0.27 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 61.89 1pwv h PHE 217 Cb 0.04 0.47 -0.14 0.00 2.79 0.00 0.00 35.95 39.10 1pwv h PHE 217 CO 0.00 -0.70 -0.38 0.00 -2.23 0.00 0.00 178.31 175.00 1pwv h ALA 218 N -1.15 0.07 0.39 2.41 0.00 -0.52 0.24 119.26 120.70 1pwv h ALA 218 Ca -0.10 0.24 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1pwv h ALA 218 Cb 0.92 0.96 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 1pwv h ALA 218 CO 0.07 -0.65 -0.22 0.87 0.00 0.00 0.00 179.25 179.32 1pwv h LYS 219 N -0.05 -0.55 -0.92 0.00 1.57 -0.79 -0.05 116.57 115.78 1pwv h LYS 219 Ca 0.31 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.22 1pwv h LYS 219 Cb 0.58 0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.94 1pwv h LYS 219 CO -0.89 -0.37 0.56 0.00 -0.57 0.00 0.00 179.45 178.18 1pwv h ALA 220 N 0.02 1.33 0.76 3.86 0.00 -0.29 0.23 119.26 125.17 1pwv h ALA 220 Ca -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1pwv h ALA 220 Cb 0.46 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1pwv h ALA 220 CO 0.06 0.22 -0.45 0.35 0.00 0.00 0.00 179.25 179.43 1pwv h PHE 221 N 0.94 -1.18 -0.21 0.00 3.57 -0.29 -2.29 116.94 117.48 1pwv h PHE 221 Ca 0.44 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.98 1pwv h PHE 221 Cb 0.35 0.42 -0.07 0.00 2.79 0.00 0.00 35.95 39.44 1pwv h PHE 221 CO -0.03 -0.68 -0.24 0.00 -2.23 0.00 0.00 178.31 175.13 1pwv h ALA 222 N -0.97 -0.15 0.00 2.41 0.00 -0.28 0.27 119.26 120.54 1pwv h ALA 222 Ca -0.10 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pwv h ALA 222 Cb 0.90 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1pwv h ALA 222 CO 0.11 -0.67 0.09 0.66 0.00 0.00 0.00 179.25 179.44 1pwv n TYR 223 N -5.37 0.22 -0.13 0.00 4.02 0.74 -1.57 117.16 115.07 1pwv n TYR 223 Ca -0.01 0.11 -0.19 0.00 -0.01 0.00 0.00 57.90 57.81 1pwv n TYR 223 Cb 0.29 -0.60 -0.11 0.00 -0.02 0.00 0.00 39.34 38.89 1pwv n TYR 223 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 176.86 176.83 1pwv n TYR 224 N -1.69 0.00 -0.18 -0.72 9.36 0.76 -2.07 117.16 122.62 1pwv n TYR 224 Ca -0.00 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.11 1pwv n TYR 224 Cb 0.10 -0.96 0.01 0.00 -0.63 0.00 0.00 39.34 37.86 1pwv n TYR 224 CO 0.00 0.00 0.00 0.82 0.22 0.00 0.00 176.86 177.90 1pwv h ILE 225 N -0.11 1.27 -2.90 2.97 1.08 -0.40 -3.40 117.51 116.01 1pwv h ILE 225 Ca -0.57 -1.21 -0.57 0.00 -0.39 0.00 0.00 64.86 62.13 1pwv h ILE 225 Cb 1.83 0.96 -0.03 0.00 -3.07 0.00 0.00 36.82 36.51 1pwv h ILE 225 CO -0.12 0.43 1.09 -0.70 -0.69 0.00 0.00 178.15 178.15 1pwv s GLU 226 N -4.90 3.80 0.13 2.37 -6.30 -0.61 -4.91 118.70 108.28 1pwv s GLU 226 Ca -0.12 1.49 -0.23 0.00 -2.50 0.00 0.00 54.97 53.62 1pwv s GLU 226 Cb 0.12 -4.00 -0.02 0.00 0.00 0.00 0.00 34.13 30.23 1pwv s GLU 226 CO 0.85 -1.28 1.66 -1.35 0.02 0.00 0.00 175.26 175.16 1pwv h PRO 227 N 10.40 -0.20 -0.75 4.30 0.11 -1.90 -1.55 132.00 142.42 1pwv h PRO 227 Ca -0.31 0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.85 1pwv h PRO 227 Cb 1.14 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1pwv h PRO 227 CO 1.02 -0.13 0.49 0.37 -0.21 0.00 0.00 178.00 179.54 1pwv h GLN 228 N -0.21 0.87 0.00 1.05 5.75 -1.94 -2.66 115.11 117.97 1pwv h GLN 228 Ca 0.09 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.45 1pwv h GLN 228 Cb 0.34 -0.20 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1pwv h GLN 228 CO -0.24 0.58 -0.85 0.45 -2.65 0.00 0.00 178.83 176.12 1pwv h HIS 229 N 0.90 0.00 -1.04 3.99 3.86 -1.80 -3.36 115.15 117.70 1pwv h HIS 229 Ca 0.30 0.00 0.33 0.00 -1.16 0.00 0.00 60.37 59.84 1pwv h HIS 229 Cb 0.07 0.00 -0.14 0.00 1.06 0.00 0.00 27.41 28.40 1pwv h HIS 229 CO -0.00 0.35 0.61 -0.09 0.86 0.00 0.00 177.93 179.67 1pwv h ARG 230 N 0.00 0.29 -0.54 2.45 2.43 -0.70 0.92 114.38 119.23 1pwv h ARG 230 Ca -0.06 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.03 1pwv h ARG 230 Cb 1.32 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 1pwv h ARG 230 CO 0.04 0.19 0.08 -0.44 -1.51 0.00 0.00 179.97 178.33 1pwv h ASP 231 N 0.29 0.82 -0.74 -3.80 5.19 -1.72 0.26 116.42 116.72 1pwv h ASP 231 Ca 0.74 -0.17 0.04 0.00 -0.62 0.00 0.00 57.03 57.02 1pwv h ASP 231 Cb 1.78 -0.21 -0.05 0.00 0.18 0.00 0.00 39.33 41.03 1pwv h ASP 231 CO -0.56 0.83 0.46 0.58 -3.12 0.00 0.00 179.24 177.43 1pwv h VAL 232 N 0.82 1.06 0.25 -1.35 2.07 0.62 0.15 116.25 119.87 1pwv h VAL 232 Ca 0.17 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1pwv h VAL 232 Cb 0.37 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.26 1pwv h VAL 232 CO 0.01 0.16 -0.12 0.25 0.02 0.00 0.00 177.57 177.89 1pwv h LEU 233 N 0.87 -0.28 -2.23 2.57 6.46 -0.70 -2.00 115.31 120.00 1pwv h LEU 233 Ca 0.31 -0.21 0.00 0.00 -0.12 0.00 0.00 57.88 57.86 1pwv h LEU 233 Cb 0.08 0.07 0.00 0.00 -0.73 0.00 0.00 40.66 40.09 1pwv h LEU 233 CO -0.14 0.08 0.00 -0.61 -0.62 0.00 0.00 178.44 177.15 1pwv h GLN 234 N -0.68 0.00 0.00 1.25 4.15 -0.33 0.24 115.11 119.74 1pwv h GLN 234 Ca -0.03 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.25 1pwv h GLN 234 Cb 0.47 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 1pwv h GLN 234 CO 0.06 0.00 -1.49 -0.11 -1.93 0.00 0.00 178.83 175.36 1pwv n LEU 235 N -2.90 0.70 0.00 -2.39 7.94 0.51 -4.18 117.00 116.69 1pwv n LEU 235 Ca -0.02 0.30 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 1pwv n LEU 235 Cb 0.13 0.08 0.00 0.00 0.53 0.00 0.00 43.42 44.16 1pwv n LEU 235 CO 0.20 0.10 -0.25 -1.22 -1.11 0.00 0.00 177.39 175.11 1pwv n TYR 236 N -2.77 0.00 -2.87 1.96 4.01 -0.77 -4.80 117.16 111.92 1pwv n TYR 236 Ca -0.09 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.44 1pwv n TYR 236 Cb 0.79 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.80 1pwv n TYR 236 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1pwv n ALA 237 N -0.91 3.68 -0.26 -0.72 0.00 0.83 -1.44 120.51 121.69 1pwv n ALA 237 Ca 0.00 -3.92 0.02 0.00 0.00 0.00 0.00 53.44 49.54 1pwv n ALA 237 Cb 0.00 -0.80 0.09 0.00 0.00 0.00 0.00 19.45 18.74 1pwv n ALA 237 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1pwv h PRO 238 N 2.91 0.00 -0.22 0.00 0.11 -1.71 0.32 132.00 133.41 1pwv h PRO 238 Ca 0.11 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.23 1pwv h PRO 238 Cb 0.86 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 1pwv h PRO 238 CO 0.66 0.00 0.10 0.93 -0.21 0.00 0.00 178.00 179.48 1pwv h GLU 239 N 0.00 0.21 -0.74 1.05 4.39 -1.93 0.28 114.58 117.85 1pwv h GLU 239 Ca 0.36 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 60.04 1pwv h GLU 239 Cb 0.55 -0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 1pwv h GLU 239 CO -0.77 0.14 0.45 0.00 -1.16 0.00 0.00 179.01 177.67 1pwv h ALA 240 N 1.12 0.94 0.33 3.43 0.00 -1.54 0.97 119.26 124.51 1pwv h ALA 240 Ca 0.09 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1pwv h ALA 240 Cb 0.03 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1pwv h ALA 240 CO -0.07 0.41 -0.42 0.35 0.00 0.00 0.00 179.25 179.52 1pwv h PHE 241 N 1.01 -1.16 -0.29 0.00 3.04 0.69 -0.13 116.94 120.09 1pwv h PHE 241 Ca 0.26 0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.30 1pwv h PHE 241 Cb -0.04 0.46 -0.08 0.00 2.56 0.00 0.00 35.95 38.86 1pwv h PHE 241 CO -0.01 -0.56 -0.24 -0.91 -2.02 0.00 0.00 178.31 174.57 1pwv h ASN 242 N -0.79 -0.77 0.00 0.41 -0.26 -0.16 0.32 115.58 114.32 1pwv h ASN 242 Ca -0.02 0.15 0.00 0.00 -0.56 0.00 0.00 56.30 55.87 1pwv h ASN 242 Cb 0.73 0.37 -0.00 0.00 -1.06 0.00 0.00 38.32 38.36 1pwv h ASN 242 CO -0.12 -0.27 -0.05 0.22 -1.06 0.00 0.00 177.43 176.15 1pwv h TYR 243 N -0.22 -0.14 -0.67 1.19 5.03 -0.58 -0.59 116.97 120.98 1pwv h TYR 243 Ca 0.15 0.00 0.19 0.00 2.58 0.00 0.00 58.73 61.66 1pwv h TYR 243 Cb 0.46 0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.77 1pwv h TYR 243 CO -0.42 -0.05 0.57 0.52 -1.32 0.00 0.00 178.16 177.47 1pwv h MET 244 N -0.06 0.00 0.61 1.82 2.86 -0.56 -0.09 114.93 119.51 1pwv h MET 244 Ca 0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1pwv h MET 244 Cb 0.07 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.73 1pwv h MET 244 CO -0.03 0.00 -0.29 0.22 1.06 0.00 0.00 176.91 177.86 1pwv h ASP 245 N 0.00 -0.70 -0.44 1.22 -0.00 0.90 -1.88 116.42 115.52 1pwv h ASP 245 Ca 0.32 0.02 -0.01 0.00 -0.00 0.00 0.00 57.03 57.36 1pwv h ASP 245 Cb 1.46 0.18 -0.02 0.00 -0.00 0.00 0.00 39.33 40.95 1pwv h ASP 245 CO -0.00 -0.35 0.25 0.50 -0.00 0.00 0.00 179.24 179.63 1pwv h LYS 246 N -1.11 0.64 0.33 0.28 3.64 -0.48 -1.88 116.57 117.99 1pwv h LYS 246 Ca -0.08 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.22 1pwv h LYS 246 Cb 0.63 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1pwv h LYS 246 CO 0.14 0.48 -0.16 0.35 -2.27 0.00 0.00 179.45 177.98 1pwv h PHE 247 N 0.65 -0.42 0.00 1.91 3.57 -1.04 -1.44 116.94 120.18 1pwv h PHE 247 Ca 0.17 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1pwv h PHE 247 Cb 0.03 0.14 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 1pwv h PHE 247 CO 0.00 -0.19 -0.10 -0.91 -2.23 0.00 0.00 178.31 174.88 1pwv h ASN 248 N -0.55 0.00 -0.21 0.41 2.35 -1.17 0.19 115.58 116.60 1pwv h ASN 248 Ca -0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1pwv h ASN 248 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1pwv h ASN 248 CO 0.08 0.10 0.00 -0.62 -1.65 0.00 0.00 177.43 175.33 1pwv n GLU 249 N -3.20 2.40 0.00 0.81 -0.58 -0.72 -4.77 120.64 114.59 1pwv n GLU 249 Ca 0.01 -2.11 0.00 0.00 -0.42 0.00 0.00 57.16 54.64 1pwv n GLU 249 Cb 0.40 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.79 1pwv n GLU 249 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1pwv n GLN 250 N 1.42 0.00 0.18 3.49 6.02 -0.56 -4.96 117.38 122.96 1pwv n GLN 250 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1pwv n GLN 250 Cb 0.60 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.86 1pwv n GLN 250 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1pwv n GLU 251 N -0.41 0.02 -0.23 -1.09 1.02 -1.09 -1.78 120.64 117.08 1pwv n GLU 251 Ca 0.00 0.51 -0.08 0.00 -0.02 0.00 0.00 57.16 57.57 1pwv n GLU 251 Cb 0.00 -2.08 0.03 0.00 -0.02 0.00 0.00 31.44 29.37 1pwv n GLU 251 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1pwv h ILE 252 N 0.00 1.27 0.00 -3.67 6.09 -0.88 -2.88 117.51 117.43 1pwv h ILE 252 Ca 0.00 -1.08 0.00 0.00 -1.37 0.00 0.00 64.86 62.41 1pwv h ILE 252 Cb 1.43 0.69 0.00 0.00 0.47 0.00 0.00 36.82 39.40 1pwv h ILE 252 CO 0.00 0.40 0.00 -0.46 -3.07 0.00 0.00 178.15 175.02 1pwv n ASN 253 N -4.20 0.18 0.07 2.19 0.23 -0.73 -2.09 115.26 110.91 1pwv n ASN 253 Ca 0.04 0.53 -0.21 0.00 -0.53 0.00 0.00 54.58 54.41 1pwv n ASN 253 Cb 0.31 -0.57 -0.13 0.00 -2.08 0.00 0.00 39.78 37.31 1pwv n ASN 253 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 1pwv h LEU 254 N 0.00 0.80 -0.79 -4.53 3.38 -1.71 -1.07 115.31 111.39 1pwv h LEU 254 Ca 0.00 -0.82 0.09 0.00 0.09 0.00 0.00 57.88 57.24 1pwv h LEU 254 Cb 0.41 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.84 1pwv h LEU 254 CO 0.00 1.53 0.45 0.28 0.09 0.00 0.00 178.44 180.79 1pwv h SER 255 N 0.18 0.65 -0.10 -0.43 0.02 -1.34 0.66 113.55 113.18 1pwv h SER 255 Ca -0.16 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.82 1pwv h SER 255 Cb 1.78 -0.08 -0.00 0.00 0.14 0.00 0.00 62.40 64.24 1pwv h SER 255 CO 0.21 0.38 0.03 0.25 -1.14 0.00 0.00 176.83 176.56 1pwv h LEU 256 N 0.77 0.15 0.06 5.07 6.46 -1.37 0.38 115.31 126.83 1pwv h LEU 256 Ca 0.37 -0.21 0.02 0.00 -0.12 0.00 0.00 57.88 57.95 1pwv h LEU 256 Cb 0.32 -0.04 -0.05 0.00 -0.73 0.00 0.00 40.66 40.16 1pwv h LEU 256 CO -0.23 0.32 -0.47 -0.08 -0.62 0.00 0.00 178.44 177.35 1pwv h GLU 257 N -0.02 -0.64 -0.78 1.25 4.57 0.43 -0.54 114.58 118.84 1pwv h GLU 257 Ca 0.03 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.35 1pwv h GLU 257 Cb 0.22 0.15 -0.07 0.00 -0.16 0.00 0.00 28.75 28.89 1pwv h GLU 257 CO -0.00 -0.43 0.43 0.93 -1.18 0.00 0.00 179.01 178.76 1pwv h GLU 258 N -0.67 0.70 -0.76 1.92 5.08 0.32 -0.50 114.58 120.68 1pwv h GLU 258 Ca 0.02 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1pwv h GLU 258 Cb 0.71 -0.16 -0.05 0.00 0.50 0.00 0.00 28.75 29.75 1pwv h GLU 258 CO -0.30 0.46 0.48 1.25 -1.00 0.00 0.00 179.01 179.90 1pwv h LEU 259 N 0.72 0.78 -1.53 1.33 5.85 -0.22 -1.45 115.31 120.79 1pwv h LEU 259 Ca 0.38 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.05 1pwv h LEU 259 Cb 0.36 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1pwv h LEU 259 CO -0.25 0.53 -0.25 0.11 -0.34 0.00 0.00 178.44 178.25 1pwv h LYS 260 N 0.92 0.00 -0.63 1.25 1.57 0.43 -2.42 116.57 117.70 1pwv h LYS 260 Ca 0.31 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 59.02 1pwv h LYS 260 Cb 0.04 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1pwv h LYS 260 CO -0.12 0.25 0.12 0.22 -0.57 0.00 0.00 179.45 179.35 1pwv h ASP 261 N 0.00 0.96 0.13 0.86 1.82 -0.19 -1.71 116.42 118.30 1pwv h ASP 261 Ca -0.00 -0.21 -0.01 0.00 -0.39 0.00 0.00 57.03 56.42 1pwv h ASP 261 Cb 0.47 -0.25 -0.00 0.00 0.68 0.00 0.00 39.33 40.22 1pwv h ASP 261 CO 0.03 0.95 -0.05 1.56 -1.61 0.00 0.00 179.24 180.12 1pwv h GLN 262 N 0.96 0.00 -6.05 0.28 1.08 -1.10 -3.43 115.11 106.85 1pwv h GLN 262 Ca 0.20 0.00 -0.57 0.00 -1.45 0.00 0.00 58.65 56.83 1pwv h GLN 262 Cb 0.39 0.00 -0.06 0.00 -0.05 0.00 0.00 27.48 27.76 1pwv h GLN 262 CO 0.01 0.05 0.34 1.03 -0.95 0.00 0.00 178.83 179.30 1pwv s ARG 263 N -4.49 4.37 0.00 1.46 0.52 -0.64 -4.99 118.95 115.19 1pwv s ARG 263 Ca -0.04 1.07 -0.01 0.00 -0.52 0.00 0.00 55.73 56.22 1pwv s ARG 263 Cb 0.14 -3.53 -0.01 0.00 0.52 0.00 0.00 34.95 32.08 1pwv s ARG 263 CO 0.57 -0.21 1.02 1.98 0.02 0.00 0.00 175.30 178.68 1pwv h MET 264 N 7.12 -0.04 -0.43 3.54 1.85 -1.84 -1.09 114.93 124.04 1pwv h MET 264 Ca -0.33 0.00 0.12 0.00 -0.61 0.00 0.00 59.70 58.88 1pwv h MET 264 Cb 1.16 0.01 -0.02 0.00 0.43 0.00 0.00 31.60 33.18 1pwv h MET 264 CO 0.81 -0.03 0.45 -0.07 -0.40 0.00 0.00 176.91 177.67 1pwv h LEU 265 N -0.04 0.00 0.08 3.39 4.07 -1.94 0.16 115.31 121.03 1pwv h LEU 265 Ca -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 1pwv h LEU 265 Cb 0.03 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.77 1pwv h LEU 265 CO -0.00 0.00 -0.04 0.28 -1.08 0.00 0.00 178.44 177.60 1pwv h SER 266 N 0.00 -0.09 -0.61 -0.43 0.02 -1.73 -0.91 113.55 109.80 1pwv h SER 266 Ca 0.20 -0.32 0.11 0.00 -0.84 0.00 0.00 61.79 60.94 1pwv h SER 266 Cb 1.10 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.63 1pwv h SER 266 CO -0.00 0.28 0.41 0.03 -1.14 0.00 0.00 176.83 176.41 1pwv h ARG 267 N -0.47 0.37 0.19 3.45 3.08 0.58 -1.68 114.38 119.90 1pwv h ARG 267 Ca -0.01 -0.02 -0.30 0.00 0.07 0.00 0.00 59.98 59.72 1pwv h ARG 267 Cb 0.40 -0.08 0.03 0.00 0.08 0.00 0.00 29.97 30.40 1pwv h ARG 267 CO 0.02 0.25 -1.29 -0.92 -1.07 0.00 0.00 179.97 176.95 1pwv h TYR 268 N 0.38 0.93 -0.68 3.04 3.20 -1.15 -2.77 116.97 119.93 1pwv h TYR 268 Ca 0.28 -0.65 -0.03 0.00 3.14 0.00 0.00 58.73 61.48 1pwv h TYR 268 Cb 0.60 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.79 1pwv h TYR 268 CO -0.00 1.49 0.29 1.49 -1.64 0.00 0.00 178.16 179.79 1pwv h GLU 269 N 0.11 1.00 0.14 1.82 4.81 -0.73 -0.42 114.58 121.31 1pwv h GLU 269 Ca -0.22 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1pwv h GLU 269 Cb 2.00 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 31.20 1pwv h GLU 269 CO 0.24 0.82 -0.11 -0.22 -0.73 0.00 0.00 179.01 179.01 1pwv h LYS 270 N 0.95 -0.26 -0.06 1.92 3.64 -1.39 -2.05 116.57 119.32 1pwv h LYS 270 Ca 0.23 0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.66 1pwv h LYS 270 Cb 0.18 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.00 1pwv h LYS 270 CO -0.02 -0.17 -0.30 2.35 -2.27 0.00 0.00 179.45 179.04 1pwv h TRP 271 N -0.27 -0.82 -0.60 1.91 2.91 -1.22 -1.73 115.95 116.13 1pwv h TRP 271 Ca -0.00 0.03 0.11 0.00 1.13 0.00 0.00 58.89 60.16 1pwv h TRP 271 Cb 0.24 0.37 -0.09 0.00 -0.51 0.00 0.00 29.16 29.18 1pwv h TRP 271 CO -0.11 -0.39 0.12 0.93 -1.03 0.00 0.00 178.44 177.96 1pwv h GLU 272 N -0.41 0.24 -0.50 2.65 4.39 -0.92 0.12 114.58 120.15 1pwv h GLU 272 Ca 0.08 -0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 1pwv h GLU 272 Cb 0.53 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.11 1pwv h GLU 272 CO -0.29 0.16 0.11 0.87 -1.16 0.00 0.00 179.01 178.69 1pwv h LYS 273 N 0.25 0.80 -0.43 2.33 1.57 -0.83 -0.79 116.57 119.48 1pwv h LYS 273 Ca 0.32 -0.20 -0.11 0.00 -1.87 0.00 0.00 60.65 58.78 1pwv h LYS 273 Cb 0.47 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1pwv h LYS 273 CO -0.41 0.79 -0.16 0.82 -0.57 0.00 0.00 179.45 179.92 1pwv h ILE 274 N 0.69 1.28 -0.93 1.86 2.04 -0.92 -2.02 117.51 119.51 1pwv h ILE 274 Ca 0.15 -1.29 0.03 0.00 1.00 0.00 0.00 64.86 64.75 1pwv h ILE 274 Cb 0.36 1.20 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 1pwv h ILE 274 CO 0.00 0.44 0.61 0.50 0.00 0.00 0.00 178.15 179.70 1pwv h LYS 275 N 0.69 1.15 0.50 2.37 3.64 -0.56 -2.96 116.57 121.41 1pwv h LYS 275 Ca 0.10 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 1pwv h LYS 275 Cb 0.71 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1pwv h LYS 275 CO 0.05 0.76 -0.24 0.37 -2.27 0.00 0.00 179.45 178.12 1pwv h GLN 276 N 1.19 -0.65 -0.79 1.90 4.15 -0.97 -2.47 115.11 117.46 1pwv h GLN 276 Ca 0.36 0.04 0.23 0.00 0.77 0.00 0.00 58.65 60.05 1pwv h GLN 276 Cb -0.03 0.15 -0.15 0.00 0.21 0.00 0.00 27.48 27.66 1pwv h GLN 276 CO -0.10 -0.38 0.05 1.58 -1.93 0.00 0.00 178.83 178.04 1pwv n HIS 277 N -5.24 0.54 1.48 3.99 -0.00 -0.77 0.22 115.22 115.44 1pwv n HIS 277 Ca -0.09 0.95 0.11 0.00 0.46 0.00 0.00 57.72 59.15 1pwv n HIS 277 Cb 0.29 -1.12 0.47 0.00 -0.12 0.00 0.00 29.99 29.52 1pwv n HIS 277 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1pwv n TYR 278 N -5.09 0.12 -0.09 1.57 4.02 -1.12 -4.48 117.16 112.09 1pwv n TYR 278 Ca 0.20 -0.06 -0.11 0.00 -0.01 0.00 0.00 57.90 57.92 1pwv n TYR 278 Cb 0.64 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.89 1pwv n TYR 278 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 176.86 176.22 1pwv h GLN 279 N 1.61 -0.32 -0.51 -0.72 5.75 0.31 0.27 115.11 121.50 1pwv h GLN 279 Ca 0.00 0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.61 1pwv h GLN 279 Cb 0.35 0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.90 1pwv h GLN 279 CO 0.00 -0.21 0.08 1.25 -2.65 0.00 0.00 178.83 177.30 1pwv h HIS 280 N -0.33 0.12 -0.72 3.99 2.76 -1.78 0.59 115.15 119.78 1pwv h HIS 280 Ca 0.05 0.03 0.11 0.00 -2.20 0.00 0.00 60.37 58.36 1pwv h HIS 280 Cb 0.47 0.02 -0.08 0.00 1.55 0.00 0.00 27.41 29.38 1pwv h HIS 280 CO -0.67 -0.03 0.33 2.35 -1.30 0.00 0.00 177.93 178.60 1pwv h TRP 281 N 0.21 0.59 -0.25 5.26 7.01 -1.62 -0.82 115.95 126.32 1pwv h TRP 281 Ca 0.26 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.19 1pwv h TRP 281 Cb 0.36 -0.15 -0.00 0.00 -2.10 0.00 0.00 29.16 27.26 1pwv h TRP 281 CO -0.25 0.17 -0.21 0.77 -2.79 0.00 0.00 178.44 176.14 1pwv h SER 282 N 0.55 0.62 0.41 2.65 0.02 0.14 -3.06 113.55 114.88 1pwv h SER 282 Ca 0.37 -0.46 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 1pwv h SER 282 Cb 0.45 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.81 1pwv h SER 282 CO -0.31 0.95 0.00 0.47 -1.14 0.00 0.00 176.83 176.80 1pwv n ASP 283 N -4.38 0.42 -1.36 3.07 8.00 0.19 -2.44 116.55 120.04 1pwv n ASP 283 Ca -0.04 0.63 0.07 0.00 0.71 0.00 0.00 54.79 56.16 1pwv n ASP 283 Cb 0.41 -0.71 0.32 0.00 -0.02 0.00 0.00 41.12 41.13 1pwv n ASP 283 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1pwv n SER 284 N -1.99 4.70 -4.64 -2.24 3.41 -0.39 -4.97 113.62 107.49 1pwv n SER 284 Ca 0.01 -3.01 -0.40 0.00 -0.26 0.00 0.00 58.87 55.21 1pwv n SER 284 Cb 0.14 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 63.42 1pwv n SER 284 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pwv s LEU 285 N -2.82 4.10 0.48 1.04 1.43 -1.02 -5.05 118.68 116.84 1pwv s LEU 285 Ca 0.48 0.80 -0.21 0.00 -1.03 0.00 0.00 54.13 54.17 1pwv s LEU 285 Cb 0.38 -2.90 -0.08 0.00 0.03 0.00 0.00 46.19 43.62 1pwv s LEU 285 CO 0.12 -0.34 1.06 -0.94 0.23 0.00 0.00 176.35 176.48 1pwv s SER 286 N 1.33 6.33 0.57 2.29 1.04 -1.26 -4.74 113.70 119.26 1pwv s SER 286 Ca 0.28 2.00 0.39 0.00 0.48 0.00 0.00 55.95 59.10 1pwv s SER 286 Cb -0.16 -2.57 1.45 0.00 0.10 0.00 0.00 66.02 64.85 1pwv s SER 286 CO 0.09 -0.79 1.58 -0.08 0.98 0.00 0.00 173.24 175.03 1pwv h GLU 287 N 1.70 0.00 0.08 4.02 4.81 -1.99 0.86 114.58 124.07 1pwv h GLU 287 Ca -0.49 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1pwv h GLU 287 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1pwv h GLU 287 CO 0.59 0.00 -0.04 1.49 -0.73 0.00 0.00 179.01 180.32 1pwv h GLU 288 N 0.00 -0.11 -0.07 1.92 4.81 -1.98 -1.76 114.58 117.39 1pwv h GLU 288 Ca 0.66 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.94 1pwv h GLU 288 Cb 2.96 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 32.30 1pwv h GLU 288 CO -0.01 0.44 -0.33 0.78 -0.73 0.00 0.00 179.01 179.17 1pwv h GLY 289 N -0.82 -0.50 0.43 1.92 0.00 0.35 0.27 103.07 104.72 1pwv h GLY 289 Ca -0.01 0.40 0.12 0.00 0.00 0.00 0.00 47.33 47.84 1pwv h GLY 289 CO 0.02 -0.23 0.59 3.21 0.00 0.00 0.00 176.54 180.13 1pwv h ARG 290 N -0.44 0.89 -0.80 4.80 3.08 -1.26 0.29 114.38 120.94 1pwv h ARG 290 Ca 0.08 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 1pwv h ARG 290 Cb 0.56 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 1pwv h ARG 290 CO -0.32 0.59 0.33 0.78 -1.07 0.00 0.00 179.97 180.28 1pwv h GLY 291 N 0.91 1.27 0.97 0.04 0.00 -0.15 -1.62 103.07 104.49 1pwv h GLY 291 Ca 0.48 -0.68 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 1pwv h GLY 291 CO -0.28 0.64 -0.20 -2.00 0.00 0.00 0.00 176.54 174.71 1pwv h LEU 292 N 1.15 -0.46 -0.92 3.11 6.46 0.15 -1.75 115.31 123.05 1pwv h LEU 292 Ca 0.27 -0.01 0.04 0.00 -0.12 0.00 0.00 57.88 58.06 1pwv h LEU 292 Cb 0.20 0.12 -0.06 0.00 -0.73 0.00 0.00 40.66 40.19 1pwv h LEU 292 CO -0.02 -0.30 0.59 -0.07 -0.62 0.00 0.00 178.44 178.02 1pwv h LEU 293 N -0.58 0.98 -1.00 2.25 3.38 -1.29 -0.68 115.31 118.36 1pwv h LEU 293 Ca -0.06 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1pwv h LEU 293 Cb 0.44 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.93 1pwv h LEU 293 CO 0.09 0.66 0.58 0.50 0.09 0.00 0.00 178.44 180.37 1pwv h LYS 294 N 1.13 1.27 -0.40 1.13 3.64 -1.15 -0.22 116.57 121.97 1pwv h LYS 294 Ca 0.37 -0.10 -0.07 0.00 -1.27 0.00 0.00 60.65 59.58 1pwv h LYS 294 Cb 0.04 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 1pwv h LYS 294 CO -0.13 0.87 -0.03 -0.22 -2.27 0.00 0.00 179.45 177.67 1pwv h LYS 295 N 1.29 0.67 -0.11 1.90 3.64 -0.35 0.75 116.57 124.36 1pwv h LYS 295 Ca 0.34 -0.18 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 1pwv h LYS 295 Cb -0.08 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 1pwv h LYS 295 CO -0.07 0.71 0.03 1.25 -2.27 0.00 0.00 179.45 179.10 1pwv h LEU 296 N 0.62 0.02 -0.31 5.20 5.85 0.36 -2.97 115.31 124.08 1pwv h LEU 296 Ca 0.12 0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.69 1pwv h LEU 296 Cb 0.44 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.49 1pwv h LEU 296 CO 0.02 0.03 -0.44 1.56 -0.34 0.00 0.00 178.44 179.27 1pwv h GLN 297 N 0.08 0.85 -4.51 1.25 4.20 -1.03 -3.42 115.11 112.53 1pwv h GLN 297 Ca 0.05 -0.50 -0.71 0.00 0.06 0.00 0.00 58.65 57.55 1pwv h GLN 297 Cb 0.04 0.04 -0.29 0.00 0.30 0.00 0.00 27.48 27.56 1pwv h GLN 297 CO -0.06 1.13 -0.51 0.42 -0.67 0.00 0.00 178.83 179.14 1pwv s ILE 298 N -4.24 3.92 0.74 2.54 -1.09 0.23 -5.09 121.20 118.21 1pwv s ILE 298 Ca -0.11 -1.48 -0.15 0.00 -2.23 0.00 0.00 60.65 56.68 1pwv s ILE 298 Cb 0.10 -3.41 0.04 0.00 -1.58 0.00 0.00 42.46 37.61 1pwv s ILE 298 CO 0.87 -0.47 1.22 -2.84 -1.23 0.00 0.00 174.94 172.50 1pwv s PRO 299 N 1.36 2.05 -0.23 2.79 0.02 -1.25 -4.49 135.00 135.25 1pwv s PRO 299 Ca 0.03 1.82 -0.18 0.00 0.02 0.00 0.00 61.00 62.68 1pwv s PRO 299 Cb -0.22 -1.82 -0.03 0.00 0.02 0.00 0.00 34.50 32.45 1pwv s PRO 299 CO 0.01 -1.92 0.52 0.42 -0.33 0.00 0.00 177.00 175.71 1pwv s ILE 300 N -1.92 5.08 0.18 2.83 -1.09 -0.38 -4.89 121.20 121.01 1pwv s ILE 300 Ca 0.76 0.94 -0.27 0.00 -2.23 0.00 0.00 60.65 59.84 1pwv s ILE 300 Cb -0.31 -3.84 -0.08 0.00 -1.58 0.00 0.00 42.46 36.65 1pwv s ILE 300 CO 0.46 0.13 0.84 -1.61 -1.23 0.00 0.00 174.94 173.53 1pwv s GLU 301 N 1.95 4.66 -0.09 2.79 0.41 -1.26 -0.50 118.70 126.66 1pwv s GLU 301 Ca 0.23 1.27 -0.30 0.00 -0.41 0.00 0.00 54.97 55.77 1pwv s GLU 301 Cb -0.15 -3.28 -0.03 0.00 -1.78 0.00 0.00 34.13 28.88 1pwv s GLU 301 CO 0.09 0.52 1.34 -1.25 -0.49 0.00 0.00 175.26 175.48 1pwv s PRO 302 N -1.05 4.26 -0.04 0.39 0.04 -1.26 -4.96 135.00 132.38 1pwv s PRO 302 Ca 0.38 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 62.93 1pwv s PRO 302 Cb -0.24 -3.72 -0.04 0.00 0.04 0.00 0.00 34.50 30.54 1pwv s PRO 302 CO 0.28 -0.65 1.27 0.15 0.04 0.00 0.00 177.00 178.09 1pwv s LYS 303 N 3.09 4.33 0.21 4.56 1.02 -1.26 -4.94 119.74 126.75 1pwv s LYS 303 Ca 0.60 1.77 -0.09 0.00 0.02 0.00 0.00 55.97 58.27 1pwv s LYS 303 Cb -0.26 -3.56 0.30 0.00 -0.52 0.00 0.00 37.83 33.78 1pwv s LYS 303 CO 0.21 -0.49 1.76 1.57 -0.92 0.00 0.00 175.35 177.48 1pwv h LYS 304 N 7.58 0.47 0.34 1.68 -0.00 -1.98 -1.35 116.57 123.31 1pwv h LYS 304 Ca -0.35 -0.03 -0.01 0.00 -0.00 0.00 0.00 60.65 60.26 1pwv h LYS 304 Cb 1.17 -0.11 -0.01 0.00 -0.00 0.00 0.00 32.23 33.28 1pwv h LYS 304 CO 0.89 0.31 -0.28 0.38 -0.00 0.00 0.00 179.45 180.75 1pwv h ASP 305 N 0.48 -0.74 -0.64 7.07 3.04 -2.00 -1.72 116.42 121.92 1pwv h ASP 305 Ca 0.32 0.06 0.10 0.00 -3.24 0.00 0.00 57.03 54.26 1pwv h ASP 305 Cb 0.37 0.24 -0.07 0.00 -1.04 0.00 0.00 39.33 38.82 1pwv h ASP 305 CO -0.29 -0.42 0.26 0.44 -2.04 0.00 0.00 179.24 177.19 1pwv h ASP 306 N -0.63 0.28 -0.13 4.15 3.32 -1.90 0.18 116.42 121.68 1pwv h ASP 306 Ca -0.03 0.08 0.04 0.00 0.02 0.00 0.00 57.03 57.14 1pwv h ASP 306 Cb 0.56 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.14 1pwv h ASP 306 CO -0.02 0.16 0.19 0.40 -1.72 0.00 0.00 179.24 178.25 1pwv h ILE 307 N 0.45 0.34 0.00 0.35 1.08 -0.71 -2.82 117.51 116.21 1pwv h ILE 307 Ca 0.32 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.70 1pwv h ILE 307 Cb 0.39 0.84 -0.01 0.00 -3.07 0.00 0.00 36.82 34.96 1pwv h ILE 307 CO -0.30 0.00 -0.49 0.40 -0.69 0.00 0.00 178.15 177.07 1pwv h ILE 308 N 0.00 1.45 -0.89 -0.67 2.04 0.23 -3.34 117.51 116.33 1pwv h ILE 308 Ca 0.06 -2.28 0.18 0.00 1.00 0.00 0.00 64.86 63.83 1pwv h ILE 308 Cb 0.45 2.93 -0.07 0.00 -0.74 0.00 0.00 36.82 39.38 1pwv h ILE 308 CO -0.00 0.49 0.58 0.45 0.00 0.00 0.00 178.15 179.67 1pwv h HIS 309 N -1.00 0.66 0.00 1.37 3.86 -1.30 0.47 115.15 119.20 1pwv h HIS 309 Ca -0.14 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.09 1pwv h HIS 309 Cb 1.12 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 29.38 1pwv h HIS 309 CO 0.21 0.20 0.00 -1.13 0.86 0.00 0.00 177.93 178.07 1pwv n SER 310 N -4.55 0.00 -4.87 2.45 3.41 -1.08 -4.72 113.62 104.26 1pwv n SER 310 Ca 0.19 -0.79 -0.37 0.00 -0.26 0.00 0.00 58.87 57.65 1pwv n SER 310 Cb 0.61 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.50 1pwv n SER 310 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1pwv s LEU 311 N -1.35 4.35 0.51 1.04 1.43 0.16 -5.09 118.68 119.74 1pwv s LEU 311 Ca 0.08 0.44 -0.15 0.00 -1.03 0.00 0.00 54.13 53.47 1pwv s LEU 311 Cb 0.04 -2.11 -0.07 0.00 0.03 0.00 0.00 46.19 44.07 1pwv s LEU 311 CO 0.06 0.39 0.97 -0.94 0.23 0.00 0.00 176.35 177.06 1pwv s SER 312 N -1.11 6.58 0.24 2.29 1.04 -1.26 -4.78 113.70 116.70 1pwv s SER 312 Ca 0.16 1.51 -0.05 0.00 0.48 0.00 0.00 55.95 58.06 1pwv s SER 312 Cb -0.12 -2.49 0.47 0.00 0.10 0.00 0.00 66.02 63.98 1pwv s SER 312 CO 0.05 -0.60 1.69 1.56 0.98 0.00 0.00 173.24 176.93 1pwv h GLN 313 N 0.83 0.28 -0.88 4.02 1.08 -1.97 0.44 115.11 118.92 1pwv h GLN 313 Ca -0.47 -0.02 0.15 0.00 -1.45 0.00 0.00 58.65 56.86 1pwv h GLN 313 Cb 1.19 -0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 28.46 1pwv h GLN 313 CO 0.62 0.19 0.47 1.49 -0.95 0.00 0.00 178.83 180.65 1pwv h GLU 314 N 0.29 0.66 -0.05 1.46 4.22 -2.01 -1.72 114.58 117.43 1pwv h GLU 314 Ca 0.42 -0.04 -0.03 0.00 0.08 0.00 0.00 59.36 59.79 1pwv h GLU 314 Cb 0.71 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 1pwv h GLU 314 CO -0.50 0.44 -0.08 0.93 -2.18 0.00 0.00 179.01 177.62 1pwv h GLU 315 N 0.68 0.15 -1.01 1.92 5.08 -0.60 -2.70 114.58 118.10 1pwv h GLU 315 Ca 0.47 -0.09 0.25 0.00 -1.00 0.00 0.00 59.36 58.99 1pwv h GLU 315 Cb 0.65 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.82 1pwv h GLU 315 CO -0.35 0.65 0.65 0.87 -1.00 0.00 0.00 179.01 179.83 1pwv h LYS 316 N -0.34 0.41 -0.03 2.33 1.57 0.03 0.89 116.57 121.43 1pwv h LYS 316 Ca 0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1pwv h LYS 316 Cb 0.63 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1pwv h LYS 316 CO 0.02 0.27 -0.04 1.49 -0.57 0.00 0.00 179.45 180.62 1pwv h GLU 317 N 0.42 0.07 -0.96 3.15 4.81 -1.37 -2.93 114.58 117.78 1pwv h GLU 317 Ca 0.57 -0.04 0.22 0.00 -0.13 0.00 0.00 59.36 59.97 1pwv h GLU 317 Cb 1.40 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.70 1pwv h GLU 317 CO -0.28 0.59 0.62 1.25 -0.73 0.00 0.00 179.01 180.46 1pwv h LEU 318 N -0.43 0.48 0.20 1.64 5.85 -0.55 -1.90 115.31 120.60 1pwv h LEU 318 Ca 0.00 0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1pwv h LEU 318 Cb 0.58 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.59 1pwv h LEU 318 CO 0.01 0.17 -0.10 0.25 -0.34 0.00 0.00 178.44 178.43 1pwv h LEU 319 N 0.47 -0.23 -1.42 2.25 5.85 -1.09 -2.20 115.31 118.94 1pwv h LEU 319 Ca 0.52 -0.26 0.27 0.00 0.84 0.00 0.00 57.88 59.26 1pwv h LEU 319 Cb 1.22 0.06 -0.09 0.00 0.37 0.00 0.00 40.66 42.22 1pwv h LEU 319 CO -0.24 0.17 0.68 0.11 -0.34 0.00 0.00 178.44 178.82 1pwv h LYS 320 N -0.67 0.34 -0.35 1.25 1.57 -1.16 -2.22 116.57 115.34 1pwv h LYS 320 Ca -0.03 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1pwv h LYS 320 Cb 0.47 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1pwv h LYS 320 CO 0.05 0.23 0.00 0.54 -0.57 0.00 0.00 179.45 179.69 1pwv n ARG 321 N -4.59 2.64 -3.43 3.15 1.74 -1.12 -4.99 116.66 110.06 1pwv n ARG 321 Ca 0.25 -2.03 -0.37 0.00 -0.77 0.00 0.00 57.85 54.93 1pwv n ARG 321 Cb 0.91 -1.29 -0.06 0.00 -1.02 0.00 0.00 32.46 31.00 1pwv n ARG 321 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1pwv s ILE 322 N -1.00 4.94 -0.59 0.55 2.07 -0.83 -5.04 121.20 121.30 1pwv s ILE 322 Ca 0.25 0.88 -0.17 0.00 -1.41 0.00 0.00 60.65 60.20 1pwv s ILE 322 Cb 0.13 -3.75 0.13 0.00 0.13 0.00 0.00 42.46 39.10 1pwv s ILE 322 CO 0.17 0.49 0.60 -1.58 -1.91 0.00 0.00 174.94 172.71 1pwv s GLN 323 N -1.32 3.08 0.19 3.50 -0.44 -1.26 -4.94 119.66 118.47 1pwv s GLN 323 Ca 0.28 -1.68 -0.14 0.00 -2.50 0.00 0.00 55.36 51.32 1pwv s GLN 323 Cb -0.17 -4.32 0.19 0.00 -1.64 0.00 0.00 33.01 27.07 1pwv s GLN 323 CO 0.16 -1.39 1.69 0.82 0.50 0.00 0.00 175.29 177.06 1pwv h ILE 324 N 5.78 0.62 -1.24 -2.34 5.03 -1.95 -3.29 117.51 120.12 1pwv h ILE 324 Ca -0.25 -0.04 -0.41 0.00 -0.12 0.00 0.00 64.86 64.04 1pwv h ILE 324 Cb 1.09 0.49 -0.05 0.00 -3.03 0.00 0.00 36.82 35.31 1pwv h ILE 324 CO 1.03 0.02 1.04 -1.81 -0.68 0.00 0.00 178.15 177.75 1pwv s ASP 325 N -5.26 5.46 0.00 1.72 1.01 -1.26 -2.45 116.67 115.89 1pwv s ASP 325 Ca -0.13 -0.50 0.00 0.00 0.71 0.00 0.00 52.55 52.62 1pwv s ASP 325 Cb 0.16 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.54 1pwv s ASP 325 CO 0.72 -2.39 0.00 -0.24 0.21 0.00 0.00 175.17 173.47 1pwv n SER 326 N 12.53 0.00 -4.88 0.27 2.88 -1.24 -5.14 113.62 118.05 1pwv n SER 326 Ca 0.31 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.49 1pwv n SER 326 Cb 0.49 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.89 1pwv n SER 326 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1pwv s SER 327 N 0.00 6.45 -0.17 -3.46 0.15 -1.03 -4.78 113.70 110.86 1pwv s SER 327 Ca 0.00 0.52 -0.22 0.00 0.70 0.00 0.00 55.95 56.95 1pwv s SER 327 Cb 0.00 -2.08 -0.22 0.00 -1.71 0.00 0.00 66.02 62.01 1pwv s SER 327 CO 0.00 0.36 0.40 0.44 1.20 0.00 0.00 173.24 175.64 1pwv h ASP 328 N 4.65 0.08 0.00 5.45 3.32 -2.01 -3.35 116.42 124.56 1pwv h ASP 328 Ca -0.53 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 55.83 1pwv h ASP 328 Cb 1.22 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.74 1pwv h ASP 328 CO 0.61 1.42 0.00 2.22 -1.72 0.00 0.00 179.24 181.77 1pwv n PHE 329 N -4.35 0.00 -4.51 4.55 -1.74 -1.26 -4.60 117.46 105.55 1pwv n PHE 329 Ca -0.26 0.00 -0.34 0.00 -0.56 0.00 0.00 57.45 56.29 1pwv n PHE 329 Cb 0.69 0.00 -0.12 0.00 1.52 0.00 0.00 39.48 41.57 1pwv n PHE 329 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 1pwv s LEU 330 N -1.24 3.18 0.33 5.98 1.43 -1.26 -5.03 118.68 122.07 1pwv s LEU 330 Ca 0.02 -0.11 -0.12 0.00 -1.03 0.00 0.00 54.13 52.90 1pwv s LEU 330 Cb 0.01 -1.74 -0.07 0.00 0.03 0.00 0.00 46.19 44.42 1pwv s LEU 330 CO 0.01 0.24 0.70 -0.94 0.23 0.00 0.00 176.35 176.59 1pwv s SER 331 N -0.05 6.64 0.40 2.29 1.04 -1.26 -4.84 113.70 117.91 1pwv s SER 331 Ca 0.01 1.12 0.10 0.00 0.48 0.00 0.00 55.95 57.65 1pwv s SER 331 Cb -0.13 -2.31 0.89 0.00 0.10 0.00 0.00 66.02 64.57 1pwv s SER 331 CO 0.03 -0.24 1.97 0.74 0.98 0.00 0.00 173.24 176.71 1pwv h THR 332 N 1.64 0.95 -0.20 2.02 2.02 -1.97 0.91 112.91 118.28 1pwv h THR 332 Ca -0.47 -0.20 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 1pwv h THR 332 Cb 1.18 0.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 1pwv h THR 332 CO 0.66 0.11 -0.17 -0.08 0.37 0.00 0.00 175.52 176.40 1pwv h GLU 333 N 0.58 0.34 0.09 6.66 4.81 -1.99 -0.56 114.58 124.50 1pwv h GLU 333 Ca 0.30 -0.10 -0.31 0.00 -0.13 0.00 0.00 59.36 59.12 1pwv h GLU 333 Cb 0.41 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1pwv h GLU 333 CO -0.09 0.51 -1.60 0.93 -0.73 0.00 0.00 179.01 178.02 1pwv h GLU 334 N 0.32 0.19 -0.60 1.92 5.08 -1.12 -3.26 114.58 117.11 1pwv h GLU 334 Ca 0.06 -0.32 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 1pwv h GLU 334 Cb 0.49 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1pwv h GLU 334 CO 0.03 1.00 0.24 0.87 -1.00 0.00 0.00 179.01 180.15 1pwv h LYS 335 N 0.05 0.89 0.00 2.33 1.57 0.93 -0.69 116.57 121.65 1pwv h LYS 335 Ca -0.26 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 1pwv h LYS 335 Cb 2.00 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 34.17 1pwv h LYS 335 CO 0.13 0.76 -0.05 0.93 -0.57 0.00 0.00 179.45 180.65 1pwv h GLU 336 N 0.83 0.00 0.01 3.15 5.08 -1.22 -0.46 114.58 121.97 1pwv h GLU 336 Ca 0.20 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1pwv h GLU 336 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1pwv h GLU 336 CO -0.02 0.05 -0.08 0.35 -1.00 0.00 0.00 179.01 178.31 1pwv h PHE 337 N 0.00 0.06 -0.63 4.33 3.57 -1.28 -3.24 116.94 119.74 1pwv h PHE 337 Ca -0.00 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1pwv h PHE 337 Cb 0.25 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1pwv h PHE 337 CO 0.00 1.01 0.37 -0.07 -2.23 0.00 0.00 178.31 177.38 1pwv h LEU 338 N -0.91 0.78 -2.43 0.59 3.38 -0.82 -0.63 115.31 115.27 1pwv h LEU 338 Ca -0.01 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1pwv h LEU 338 Cb 1.04 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.59 1pwv h LEU 338 CO 0.02 0.63 0.01 0.11 0.09 0.00 0.00 178.44 179.29 1pwv h LYS 339 N 0.86 0.00 0.11 1.13 1.57 -1.22 0.07 116.57 119.10 1pwv h LYS 339 Ca 0.23 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.68 1pwv h LYS 339 Cb 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1pwv h LYS 339 CO -0.04 0.00 -1.68 -0.22 -0.57 0.00 0.00 179.45 176.94 1pwv h LYS 340 N 0.00 0.23 0.47 3.15 3.64 -1.16 -3.24 116.57 119.66 1pwv h LYS 340 Ca 0.00 -0.40 -0.02 0.00 -1.27 0.00 0.00 60.65 58.96 1pwv h LYS 340 Cb 0.02 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 1pwv h LYS 340 CO 0.00 1.07 -0.24 -0.07 -2.27 0.00 0.00 179.45 177.94 1pwv h LEU 341 N 0.06 -0.59 -1.39 5.20 3.38 -0.46 -0.70 115.31 120.81 1pwv h LEU 341 Ca -0.30 0.03 0.45 0.00 0.09 0.00 0.00 57.88 58.15 1pwv h LEU 341 Cb 2.03 0.16 -0.13 0.00 0.09 0.00 0.00 40.66 42.81 1pwv h LEU 341 CO 0.14 -0.40 0.86 -0.61 0.09 0.00 0.00 178.44 178.51 1pwv h GLN 342 N -0.66 0.05 0.00 1.13 4.15 -1.36 0.73 115.11 119.16 1pwv h GLN 342 Ca -0.06 -0.00 -0.03 0.00 0.77 0.00 0.00 58.65 59.33 1pwv h GLN 342 Cb 0.52 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.20 1pwv h GLN 342 CO 0.09 0.04 -0.12 0.82 -1.93 0.00 0.00 178.83 177.72 1pwv h ILE 343 N 0.06 1.62 -0.86 2.39 2.04 -1.35 0.18 117.51 121.60 1pwv h ILE 343 Ca 0.84 -1.99 0.20 0.00 1.00 0.00 0.00 64.86 64.92 1pwv h ILE 343 Cb 2.66 2.93 -0.06 0.00 -0.74 0.00 0.00 36.82 41.62 1pwv h ILE 343 CO -0.45 0.53 0.58 0.44 0.00 0.00 0.00 178.15 179.25 1pwv h ASP 344 N -0.70 0.29 0.16 1.72 3.32 0.18 0.24 116.42 121.64 1pwv h ASP 344 Ca -0.02 0.03 -0.31 0.00 0.02 0.00 0.00 57.03 56.75 1pwv h ASP 344 Cb 0.93 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 40.46 1pwv h ASP 344 CO 0.02 0.12 -1.54 -0.29 -1.72 0.00 0.00 179.24 175.83 1pwv h ILE 345 N 0.30 1.02 0.00 0.35 2.10 -0.88 -3.35 117.51 117.05 1pwv h ILE 345 Ca 0.43 -2.47 -0.00 0.00 1.08 0.00 0.00 64.86 63.90 1pwv h ILE 345 Cb 1.23 2.78 -0.00 0.00 -1.09 0.00 0.00 36.82 39.74 1pwv h ILE 345 CO -0.12 0.78 -0.02 0.03 -1.08 0.00 0.00 178.15 177.74 1pwv h ARG 346 N -0.10 0.00 0.00 2.19 3.08 0.72 -3.05 114.38 117.22 1pwv h ARG 346 Ca -0.31 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.74 1pwv h ARG 346 Cb 1.93 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.98 1pwv h ARG 346 CO 0.13 0.02 0.00 -3.47 -1.07 0.00 0.00 179.97 175.58 1pwv n ASP 347 N -3.99 0.00 -4.38 7.04 -0.08 -0.09 -4.56 116.55 110.49 1pwv n ASP 347 Ca -0.03 -0.25 -0.45 0.00 -1.51 0.00 0.00 54.79 52.55 1pwv n ASP 347 Cb 0.10 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.52 1pwv n ASP 347 CO 0.00 0.00 0.00 -0.44 0.12 0.00 0.00 177.20 176.88 1pwv s SER 348 N -1.93 6.18 0.00 1.67 0.01 -1.16 -4.95 113.70 113.53 1pwv s SER 348 Ca 0.05 -1.40 0.00 0.00 1.31 0.00 0.00 55.95 55.91 1pwv s SER 348 Cb 0.02 -2.30 0.00 0.00 0.21 0.00 0.00 66.02 63.95 1pwv s SER 348 CO 0.04 -1.10 0.00 -0.11 0.41 0.00 0.00 173.24 172.48 1pwv n LEU 349 N 6.32 0.00 -0.03 2.44 7.94 -1.26 -4.86 117.00 127.55 1pwv n LEU 349 Ca -0.09 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.77 1pwv n LEU 349 Cb 0.43 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.35 1pwv n LEU 349 CO 0.58 0.00 -0.69 -0.24 -1.11 0.00 0.00 177.39 175.93 1pwv n SER 350 N 0.57 3.55 -0.02 1.96 2.88 -1.26 -4.70 113.62 116.60 1pwv n SER 350 Ca 0.00 -0.03 0.07 0.00 -1.33 0.00 0.00 58.87 57.58 1pwv n SER 350 Cb 0.00 -0.06 0.46 0.00 -0.75 0.00 0.00 64.21 63.86 1pwv n SER 350 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1pwv h GLU 351 N 0.00 0.47 0.00 -1.46 5.08 -2.00 -1.84 114.58 114.82 1pwv h GLU 351 Ca -0.13 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.12 1pwv h GLU 351 Cb 1.21 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.34 1pwv h GLU 351 CO -0.02 0.31 -0.39 0.93 -1.00 0.00 0.00 179.01 178.83 1pwv h GLU 352 N 0.48 0.00 0.03 2.33 3.07 -1.89 -2.60 114.58 116.00 1pwv h GLU 352 Ca 0.19 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.05 1pwv h GLU 352 Cb 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.06 1pwv h GLU 352 CO -0.05 0.39 -0.01 1.49 -1.40 0.00 0.00 179.01 179.43 1pwv h GLU 353 N 0.00 -0.04 -0.93 2.33 4.57 -1.62 -0.51 114.58 118.38 1pwv h GLU 353 Ca -0.00 0.00 0.11 0.00 -1.18 0.00 0.00 59.36 58.29 1pwv h GLU 353 Cb 0.85 0.01 -0.08 0.00 -0.16 0.00 0.00 28.75 29.37 1pwv h GLU 353 CO 0.05 0.64 0.57 0.87 -1.18 0.00 0.00 179.01 179.96 1pwv h LYS 354 N -0.80 0.89 -0.04 1.92 1.57 -1.56 0.34 116.57 118.89 1pwv h LYS 354 Ca -0.00 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.58 1pwv h LYS 354 Cb 0.70 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1pwv h LYS 354 CO 0.01 0.59 -0.62 1.05 -0.57 0.00 0.00 179.45 179.90 1pwv h GLU 355 N 0.92 0.15 0.00 3.15 4.11 -1.50 -2.68 114.58 118.73 1pwv h GLU 355 Ca 0.46 -0.11 0.00 0.00 0.07 0.00 0.00 59.36 59.78 1pwv h GLU 355 Cb 0.43 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1pwv h GLU 355 CO -0.26 0.73 0.00 1.28 0.07 0.00 0.00 179.01 180.83 1pwv n LEU 356 N -3.84 0.25 -4.31 3.06 4.77 0.05 -5.09 117.00 111.90 1pwv n LEU 356 Ca -0.02 0.58 -0.46 0.00 -0.03 0.00 0.00 56.01 56.08 1pwv n LEU 356 Cb 0.63 -0.57 -0.04 0.00 -2.33 0.00 0.00 43.42 41.11 1pwv n LEU 356 CO 0.44 -0.48 0.23 -0.22 -1.33 0.00 0.00 177.39 176.03 1pwv s LEU 357 N -3.60 6.37 0.00 2.23 2.96 -0.86 -5.06 118.68 120.72 1pwv s LEU 357 Ca 0.03 -2.11 0.00 0.00 -0.22 0.00 0.00 54.13 51.83 1pwv s LEU 357 Cb 0.07 -2.20 0.00 0.00 0.50 0.00 0.00 46.19 44.56 1pwv s LEU 357 CO 0.23 -0.75 0.00 0.59 -1.32 0.00 0.00 176.35 175.10 1pwv n ASN 366 N 4.79 0.00 -4.60 3.68 4.13 -1.26 -5.13 115.26 116.86 1pwv n ASN 366 Ca -0.04 0.00 -0.29 0.00 1.68 0.00 0.00 54.58 55.93 1pwv n ASN 366 Cb 0.42 -0.39 0.14 0.00 -1.54 0.00 0.00 39.78 38.41 1pwv n ASN 366 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 1pwv s PRO 367 N -0.86 1.06 0.38 3.52 0.02 -1.26 -5.05 135.00 132.81 1pwv s PRO 367 Ca 0.00 0.07 -0.08 0.00 0.02 0.00 0.00 61.00 61.01 1pwv s PRO 367 Cb 0.00 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.61 1pwv s PRO 367 CO 0.00 -2.21 0.71 -0.51 -0.33 0.00 0.00 177.00 174.66 1pwv s LEU 368 N -5.96 3.87 0.46 -5.54 1.43 -1.26 -5.07 118.68 106.61 1pwv s LEU 368 Ca 0.66 0.96 -0.21 0.00 -1.03 0.00 0.00 54.13 54.51 1pwv s LEU 368 Cb -0.11 -3.84 -0.09 0.00 0.03 0.00 0.00 46.19 42.18 1pwv s LEU 368 CO 0.52 -0.37 1.02 -0.94 0.23 0.00 0.00 176.35 176.81 1pwv s SER 369 N -3.35 6.55 0.53 2.29 1.04 -1.26 -4.82 113.70 114.69 1pwv s SER 369 Ca 0.48 1.88 0.27 0.00 0.48 0.00 0.00 55.95 59.06 1pwv s SER 369 Cb -0.10 -2.56 1.47 0.00 0.10 0.00 0.00 66.02 64.93 1pwv s SER 369 CO 0.33 -0.64 1.80 -0.33 0.98 0.00 0.00 173.24 175.39 1pwv h GLU 370 N 1.77 0.00 0.18 4.02 4.39 -1.99 0.27 114.58 123.21 1pwv h GLU 370 Ca -0.49 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 58.86 1pwv h GLU 370 Cb 1.21 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.87 1pwv h GLU 370 CO 0.60 0.00 -1.75 0.87 -1.16 0.00 0.00 179.01 177.57 1pwv h LYS 371 N 0.00 0.38 -0.29 2.33 1.57 -1.99 -3.11 116.57 115.46 1pwv h LYS 371 Ca 0.00 -0.65 -0.07 0.00 -1.87 0.00 0.00 60.65 58.06 1pwv h LYS 371 Cb 0.44 0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1pwv h LYS 371 CO 0.00 1.30 -0.09 0.93 -0.57 0.00 0.00 179.45 181.02 1pwv h GLU 372 N 0.10 0.56 0.10 3.15 5.08 -0.93 0.56 114.58 123.20 1pwv h GLU 372 Ca -0.34 -0.22 0.01 0.00 -1.00 0.00 0.00 59.36 57.81 1pwv h GLU 372 Cb 2.09 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 31.27 1pwv h GLU 372 CO 0.17 0.77 -0.52 0.87 -1.00 0.00 0.00 179.01 179.31 1pwv h LYS 373 N 0.32 -0.71 -0.47 2.33 1.57 -1.10 0.02 116.57 118.53 1pwv h LYS 373 Ca 0.07 0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.98 1pwv h LYS 373 Cb 0.58 0.16 -0.10 0.00 0.08 0.00 0.00 32.23 32.95 1pwv h LYS 373 CO 0.03 -0.47 -0.37 1.49 -0.57 0.00 0.00 179.45 179.56 1pwv h GLU 374 N -0.74 -0.24 -0.84 3.15 4.81 -1.46 0.47 114.58 119.73 1pwv h GLU 374 Ca 0.00 0.02 0.20 0.00 -0.13 0.00 0.00 59.36 59.45 1pwv h GLU 374 Cb 0.75 0.05 -0.12 0.00 0.63 0.00 0.00 28.75 30.06 1pwv h GLU 374 CO -0.30 -0.16 0.29 0.35 -0.73 0.00 0.00 179.01 178.47 1pwv h PHE 375 N -0.25 0.47 -0.00 0.92 3.57 0.15 -0.57 116.94 121.23 1pwv h PHE 375 Ca 0.18 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 1pwv h PHE 375 Cb 0.56 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 39.22 1pwv h PHE 375 CO -0.61 -0.09 -0.00 -0.07 -2.23 0.00 0.00 178.31 175.31 1pwv h LEU 376 N 0.32 0.01 -1.25 0.59 3.38 0.79 0.41 115.31 119.56 1pwv h LEU 376 Ca 0.51 -0.50 0.25 0.00 0.09 0.00 0.00 57.88 58.23 1pwv h LEU 376 Cb 0.96 -0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.60 1pwv h LEU 376 CO -0.55 0.51 0.64 0.11 0.09 0.00 0.00 178.44 179.24 1pwv h LYS 377 N -0.49 0.46 -0.19 1.13 1.57 -0.10 0.88 116.57 119.84 1pwv h LYS 377 Ca 0.00 -0.03 -0.21 0.00 -1.87 0.00 0.00 60.65 58.54 1pwv h LYS 377 Cb 0.51 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.72 1pwv h LYS 377 CO 0.00 0.31 -0.72 -0.22 -0.57 0.00 0.00 179.45 178.25 1pwv h LYS 378 N 0.48 0.80 -0.14 3.15 3.11 -0.90 -3.15 116.57 119.92 1pwv h LYS 378 Ca 0.60 -0.61 -0.13 0.00 -2.81 0.00 0.00 60.65 57.69 1pwv h LYS 378 Cb 1.36 0.11 -0.01 0.00 -1.00 0.00 0.00 32.23 32.69 1pwv h LYS 378 CO -0.34 1.22 -0.50 -0.07 -2.81 0.00 0.00 179.45 176.96 1pwv h LEU 379 N 0.56 0.40 -0.33 5.20 3.38 0.17 -3.09 115.31 121.60 1pwv h LEU 379 Ca -0.03 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 57.80 1pwv h LEU 379 Cb 1.34 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.92 1pwv h LEU 379 CO 0.15 0.83 -0.02 0.50 0.09 0.00 0.00 178.44 179.99 1pwv h LYS 380 N 0.29 0.07 0.00 1.13 3.64 0.63 0.36 116.57 122.69 1pwv h LYS 380 Ca 0.01 -0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1pwv h LYS 380 Cb 0.98 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.78 1pwv h LYS 380 CO 0.08 0.04 -0.20 -0.07 -2.27 0.00 0.00 179.45 177.04 1pwv h LEU 381 N 0.07 0.00 -0.15 5.20 3.38 -1.51 -2.93 115.31 119.38 1pwv h LEU 381 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1pwv h LEU 381 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1pwv h LEU 381 CO -0.29 0.20 -0.36 0.47 0.09 0.00 0.00 178.44 178.56 1pwv n ASP 382 N -3.88 0.58 -1.16 -0.43 8.00 -0.04 -3.78 116.55 115.85 1pwv n ASP 382 Ca -0.02 -0.37 0.08 0.00 0.71 0.00 0.00 54.79 55.19 1pwv n ASP 382 Cb 0.29 0.12 0.28 0.00 -0.02 0.00 0.00 41.12 41.80 1pwv n ASP 382 CO 0.00 0.00 0.00 2.30 -0.39 0.00 0.00 177.20 179.11 1pwv n ILE 383 N -1.23 1.90 -2.93 0.53 -5.35 -0.26 -4.95 119.36 107.06 1pwv n ILE 383 Ca 0.08 -1.41 -0.34 0.00 -0.27 0.00 0.00 62.75 60.81 1pwv n ILE 383 Cb 0.33 0.04 -0.07 0.00 -1.74 0.00 0.00 39.64 38.21 1pwv n ILE 383 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1pwv s GLN 384 N -2.09 4.25 0.51 6.28 -1.52 -1.24 -4.77 119.66 121.08 1pwv s GLN 384 Ca 0.42 1.02 -0.19 0.00 -1.95 0.00 0.00 55.36 54.66 1pwv s GLN 384 Cb 0.29 -2.47 -0.08 0.00 -0.22 0.00 0.00 33.01 30.54 1pwv s GLN 384 CO 0.16 0.14 1.02 -2.14 -0.25 0.00 0.00 175.29 174.22 1pwv s PRO 385 N -2.73 3.78 -0.64 2.91 0.02 -1.26 -4.57 135.00 132.50 1pwv s PRO 385 Ca 0.55 1.23 -0.28 0.00 0.02 0.00 0.00 61.00 62.53 1pwv s PRO 385 Cb -0.12 -2.10 0.03 0.00 0.02 0.00 0.00 34.50 32.33 1pwv s PRO 385 CO 0.17 -0.43 1.21 -0.47 -0.33 0.00 0.00 177.00 177.15 1pwv s TYR 386 N -2.21 2.49 -0.34 6.54 5.04 0.35 -4.87 117.35 124.35 1pwv s TYR 386 Ca 0.64 0.21 0.00 0.00 -2.44 0.00 0.00 57.07 55.49 1pwv s TYR 386 Cb -0.14 -4.54 0.11 0.00 0.35 0.00 0.00 41.96 37.74 1pwv s TYR 386 CO 0.24 -1.76 0.13 0.34 -1.34 0.00 0.00 175.55 173.16 1pwv s ASP 387 N 3.25 4.01 0.15 4.32 -1.08 -1.26 -1.25 116.67 124.81 1pwv s ASP 387 Ca 0.39 -1.93 -0.24 0.00 -0.52 0.00 0.00 52.55 50.25 1pwv s ASP 387 Cb -0.08 -0.98 0.02 0.00 -1.46 0.00 0.00 42.92 40.43 1pwv s ASP 387 CO 0.21 -0.38 1.60 0.40 0.52 0.00 0.00 175.17 177.53 1pwv h ILE 388 N 6.19 0.24 -0.65 4.11 1.08 -1.87 0.93 117.51 127.54 1pwv h ILE 388 Ca -0.09 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.40 1pwv h ILE 388 Cb 0.99 0.24 -0.04 0.00 -3.07 0.00 0.00 36.82 34.95 1pwv h ILE 388 CO 0.48 0.00 0.41 0.78 -0.69 0.00 0.00 178.15 179.13 1pwv h ASN 389 N -0.31 0.67 -0.41 1.72 2.35 -1.95 -0.34 115.58 117.32 1pwv h ASN 389 Ca 0.14 -0.00 0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1pwv h ASN 389 Cb 0.54 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.74 1pwv h ASN 389 CO -0.47 0.47 0.27 -0.61 -1.65 0.00 0.00 177.43 175.44 1pwv h GLN 390 N 0.81 0.50 -0.03 0.81 5.75 -1.69 -1.61 115.11 119.64 1pwv h GLN 390 Ca 0.26 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.73 1pwv h GLN 390 Cb 0.01 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 28.44 1pwv h GLN 390 CO -0.10 0.33 0.00 -0.09 -2.65 0.00 0.00 178.83 176.33 1pwv h ARG 391 N 0.52 0.06 -0.80 1.69 1.12 0.78 -1.42 114.38 116.33 1pwv h ARG 391 Ca 0.16 -0.02 0.03 0.00 -1.11 0.00 0.00 59.98 59.04 1pwv h ARG 391 Cb -0.00 -0.01 -0.05 0.00 -0.01 0.00 0.00 29.97 29.91 1pwv h ARG 391 CO -0.04 0.32 0.51 -0.07 -3.11 0.00 0.00 179.97 177.58 1pwv h LEU 392 N -0.21 0.86 -0.21 3.80 3.38 -0.76 -2.39 115.31 119.78 1pwv h LEU 392 Ca 0.01 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1pwv h LEU 392 Cb 0.29 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1pwv h LEU 392 CO 0.00 0.59 -0.14 -0.61 0.09 0.00 0.00 178.44 178.38 1pwv h GLN 393 N 1.01 0.46 -0.01 1.13 4.15 -1.22 0.51 115.11 121.13 1pwv h GLN 393 Ca 0.32 -0.22 -0.04 0.00 0.77 0.00 0.00 58.65 59.47 1pwv h GLN 393 Cb -0.01 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 1pwv h GLN 393 CO -0.11 0.77 -0.20 -0.44 -1.93 0.00 0.00 178.83 176.93 1pwv h ASP 394 N 0.15 0.02 0.02 -0.69 5.19 -1.14 -2.26 116.42 117.70 1pwv h ASP 394 Ca 0.04 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1pwv h ASP 394 Cb 0.66 -0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.16 1pwv h ASP 394 CO 0.04 0.22 -0.64 0.35 -3.12 0.00 0.00 179.24 176.09 1pwv n THR 395 N -4.29 0.00 -3.07 0.35 -2.24 -0.91 -1.98 114.28 102.13 1pwv n THR 395 Ca -0.02 -0.16 -0.21 0.00 -2.27 0.00 0.00 64.05 61.38 1pwv n THR 395 Cb 0.26 1.10 0.01 0.00 -2.10 0.00 0.00 70.33 69.60 1pwv n THR 395 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pwv n GLY 396 N 1.45 -0.50 0.60 3.38 0.00 0.16 -1.63 105.19 108.64 1pwv n GLY 396 Ca 0.08 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1pwv n GLY 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pwv n GLY 397 N -1.26 2.96 3.20 -0.02 0.00 -0.35 -4.90 105.19 104.82 1pwv n GLY 397 Ca -0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.54 1pwv n GLY 397 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1pwv n LEU 398 N 0.00 4.18 0.06 0.99 7.99 -0.64 -4.65 117.00 124.92 1pwv n LEU 398 Ca 0.00 -3.14 0.08 0.00 -0.01 0.00 0.00 56.01 52.94 1pwv n LEU 398 Cb 0.00 -1.35 0.35 0.00 -0.11 0.00 0.00 43.42 42.32 1pwv n LEU 398 CO 0.00 -0.53 0.75 2.30 -1.51 0.00 0.00 177.39 178.40 1pwv n ILE 399 N 6.35 1.11 0.15 -0.08 -5.35 -1.26 -2.21 119.36 118.07 1pwv n ILE 399 Ca 0.49 0.34 0.02 0.00 -0.27 0.00 0.00 62.75 63.33 1pwv n ILE 399 Cb 0.42 -1.23 0.17 0.00 -1.74 0.00 0.00 39.64 37.26 1pwv n ILE 399 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1pwv n ASP 400 N -1.84 3.12 -4.69 7.28 10.43 -1.26 -4.87 116.55 124.72 1pwv n ASP 400 Ca 0.02 -2.44 -0.42 0.00 2.57 0.00 0.00 54.79 54.51 1pwv n ASP 400 Cb 0.15 -0.59 -0.03 0.00 1.84 0.00 0.00 41.12 42.49 1pwv n ASP 400 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 1pwv s SER 401 N -0.30 7.17 0.00 -2.24 0.01 -0.94 -4.92 113.70 112.48 1pwv s SER 401 Ca 0.24 1.69 -0.00 0.00 1.31 0.00 0.00 55.95 59.19 1pwv s SER 401 Cb 0.19 -2.56 -0.00 0.00 0.21 0.00 0.00 66.02 63.85 1pwv s SER 401 CO 0.07 -0.49 1.00 -0.81 0.41 0.00 0.00 173.24 173.42 1pwv n PRO 402 N 4.94 0.50 0.00 12.44 -0.04 -1.26 -4.03 135.00 147.55 1pwv n PRO 402 Ca 0.09 -0.01 0.13 0.00 -0.04 0.00 0.00 63.50 63.68 1pwv n PRO 402 Cb 0.48 -1.27 0.42 0.00 -0.04 0.00 0.00 33.50 33.09 1pwv n PRO 402 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1pwv n SER 403 N 1.78 1.31 -4.03 3.54 3.41 -1.26 -4.83 113.62 113.53 1pwv n SER 403 Ca 0.01 -1.19 -0.10 0.00 -0.26 0.00 0.00 58.87 57.33 1pwv n SER 403 Cb 0.25 0.09 -0.08 0.00 -0.26 0.00 0.00 64.21 64.21 1pwv n SER 403 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 1pwv s ILE 404 N -2.28 0.06 0.20 -1.33 -4.36 -1.26 -4.93 121.20 107.31 1pwv s ILE 404 Ca 0.30 -1.58 -0.32 0.00 -0.26 0.00 0.00 60.65 58.78 1pwv s ILE 404 Cb 0.20 -1.98 -0.14 0.00 1.25 0.00 0.00 42.46 41.79 1pwv s ILE 404 CO 0.44 -0.29 1.37 0.59 0.24 0.00 0.00 174.94 177.29 1pwv n ASN 405 N -0.20 2.41 -0.37 4.36 3.02 -1.26 -4.75 115.26 118.47 1pwv n ASN 405 Ca -0.06 1.13 0.32 0.00 -0.03 0.00 0.00 54.58 55.94 1pwv n ASN 405 Cb 0.63 -1.36 0.64 0.00 -0.61 0.00 0.00 39.78 39.08 1pwv n ASN 405 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1pwv h LEU 406 N 4.31 0.23 0.03 3.41 5.85 -1.98 -1.23 115.31 125.93 1pwv h LEU 406 Ca -0.45 0.06 -0.22 0.00 0.84 0.00 0.00 57.88 58.11 1pwv h LEU 406 Cb 1.29 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 1pwv h LEU 406 CO 0.77 -0.00 -1.06 -2.24 -0.34 0.00 0.00 178.44 175.56 1pwv h ASP 407 N 0.18 0.09 0.39 1.25 2.03 -2.00 -2.88 116.42 115.47 1pwv h ASP 407 Ca 0.65 -0.09 -0.20 0.00 -0.73 0.00 0.00 57.03 56.66 1pwv h ASP 407 Cb 2.10 -0.03 -0.01 0.00 -0.83 0.00 0.00 39.33 40.57 1pwv h ASP 407 CO -0.20 1.07 -0.83 0.58 -1.03 0.00 0.00 179.24 178.82 1pwv h VAL 408 N 0.01 1.42 -0.26 4.15 2.07 -1.62 -2.62 116.25 119.40 1pwv h VAL 408 Ca -0.04 -2.38 0.02 0.00 0.82 0.00 0.00 66.70 65.13 1pwv h VAL 408 Cb 1.81 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 33.88 1pwv h VAL 408 CO 0.14 0.70 0.17 -0.09 0.02 0.00 0.00 177.57 178.52 1pwv h ARG 409 N 0.20 0.26 0.04 1.57 2.43 -1.33 -1.67 114.38 115.89 1pwv h ARG 409 Ca -0.05 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1pwv h ARG 409 Cb 1.44 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.93 1pwv h ARG 409 CO 0.14 0.17 -0.02 0.87 -1.51 0.00 0.00 179.97 179.62 1pwv h LYS 410 N 0.27 -0.06 -0.72 0.20 1.79 -1.26 -1.76 116.57 115.04 1pwv h LYS 410 Ca 0.10 0.00 0.05 0.00 -2.18 0.00 0.00 60.65 58.62 1pwv h LYS 410 Cb 0.09 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 30.71 1pwv h LYS 410 CO -0.02 0.57 0.47 -0.56 -1.08 0.00 0.00 179.45 178.83 1pwv h GLN 411 N -0.78 0.80 0.85 3.15 3.07 -1.21 0.32 115.11 121.30 1pwv h GLN 411 Ca -0.01 -0.05 -0.04 0.00 0.09 0.00 0.00 58.65 58.64 1pwv h GLN 411 Cb 0.65 -0.18 0.01 0.00 0.08 0.00 0.00 27.48 28.04 1pwv h GLN 411 CO 0.01 0.53 -0.41 1.88 0.09 0.00 0.00 178.83 180.93 1pwv h TYR 412 N 0.82 -1.06 -0.68 0.06 0.99 -1.33 0.06 116.97 115.83 1pwv h TYR 412 Ca 0.30 -0.02 0.18 0.00 2.00 0.00 0.00 58.73 61.18 1pwv h TYR 412 Cb 0.14 0.35 -0.03 0.00 1.00 0.00 0.00 36.73 38.19 1pwv h TYR 412 CO -0.00 -0.66 0.48 -0.22 -0.00 0.00 0.00 178.16 177.76 1pwv h LYS 413 N -1.18 0.10 0.08 4.88 3.64 -0.79 0.11 116.57 123.40 1pwv h LYS 413 Ca -0.12 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1pwv h LYS 413 Cb 0.87 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 1pwv h LYS 413 CO 0.19 0.06 -0.04 -0.09 -2.27 0.00 0.00 179.45 177.31 1pwv h ARG 414 N 0.10 -0.10 -0.16 1.90 2.43 0.03 -2.77 114.38 115.82 1pwv h ARG 414 Ca 0.33 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.48 1pwv h ARG 414 Cb 1.15 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 1pwv h ARG 414 CO -0.03 0.28 0.02 -0.44 -1.51 0.00 0.00 179.97 178.29 1pwv h ASP 415 N -0.50 0.26 -0.06 -3.80 3.32 0.13 -2.38 116.42 113.38 1pwv h ASP 415 Ca -0.01 -0.28 0.01 0.00 0.02 0.00 0.00 57.03 56.77 1pwv h ASP 415 Cb 0.43 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 1pwv h ASP 415 CO 0.02 0.47 -0.14 0.40 -1.72 0.00 0.00 179.24 178.27 1pwv h ILE 416 N 0.04 0.00 -0.87 0.35 1.08 -0.90 0.34 117.51 117.55 1pwv h ILE 416 Ca 0.05 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.76 1pwv h ILE 416 Cb 0.33 0.00 -0.04 0.00 -3.07 0.00 0.00 36.82 34.03 1pwv h ILE 416 CO 0.00 0.00 0.61 1.56 -0.69 0.00 0.00 178.15 179.64 1pwv h GLN 417 N -0.13 0.10 -0.20 2.37 4.20 -1.54 0.39 115.11 120.30 1pwv h GLN 417 Ca 0.01 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.65 1pwv h GLN 417 Cb 0.17 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 1pwv h GLN 417 CO -0.13 0.07 -0.15 -0.91 -0.67 0.00 0.00 178.83 177.04 1pwv h ASN 418 N 0.10 0.48 -0.82 1.46 2.35 -0.29 -2.28 115.58 116.57 1pwv h ASN 418 Ca 0.43 -0.45 -0.02 0.00 -0.55 0.00 0.00 56.30 55.71 1pwv h ASN 418 Cb 1.53 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 39.73 1pwv h ASN 418 CO -0.05 0.82 0.43 0.40 -1.65 0.00 0.00 177.43 177.38 1pwv h ILE 419 N 0.13 1.25 0.30 2.81 2.04 0.15 -0.66 117.51 123.54 1pwv h ILE 419 Ca 0.04 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.24 1pwv h ILE 419 Cb 0.67 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1pwv h ILE 419 CO 0.04 0.28 -0.25 0.44 0.00 0.00 0.00 178.15 178.67 1pwv h ASP 420 N 1.15 -0.65 -0.99 1.72 3.32 -0.96 0.23 116.42 120.24 1pwv h ASP 420 Ca 0.29 0.05 0.34 0.00 0.02 0.00 0.00 57.03 57.73 1pwv h ASP 420 Cb 0.06 0.21 -0.16 0.00 0.22 0.00 0.00 39.33 39.66 1pwv h ASP 420 CO -0.04 -0.34 0.48 0.00 -1.72 0.00 0.00 179.24 177.61 1pwv h ALA 421 N -1.42 1.89 -0.33 3.45 0.00 -1.25 0.52 119.26 122.12 1pwv h ALA 421 Ca -0.04 0.24 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1pwv h ALA 421 Cb 0.45 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1pwv h ALA 421 CO 0.00 -0.71 0.16 1.25 0.00 0.00 0.00 179.25 179.96 1pwv h LEU 422 N 0.16 0.43 -6.24 0.00 5.85 -0.15 -3.33 115.31 112.03 1pwv h LEU 422 Ca 0.75 -0.11 -0.75 0.00 0.84 0.00 0.00 57.88 58.60 1pwv h LEU 422 Cb 1.79 -0.11 -0.14 0.00 0.37 0.00 0.00 40.66 42.57 1pwv h LEU 422 CO -0.70 0.42 2.19 0.18 -0.34 0.00 0.00 178.44 180.19 1pwv n LEU 423 N -4.76 6.97 -0.02 2.25 4.77 0.17 -4.62 117.00 121.76 1pwv n LEU 423 Ca -0.01 -4.66 -0.10 0.00 -0.03 0.00 0.00 56.01 51.20 1pwv n LEU 423 Cb 0.10 -1.47 -0.14 0.00 -2.33 0.00 0.00 43.42 39.58 1pwv n LEU 423 CO 0.36 1.51 -0.58 0.00 -1.33 0.00 0.00 177.39 177.34 1pwv n HIS 424 N 3.56 0.99 -1.67 -1.77 1.44 -1.25 -4.45 115.22 112.07 1pwv n HIS 424 Ca 0.45 0.34 -0.43 0.00 -2.01 0.00 0.00 57.72 56.07 1pwv n HIS 424 Cb 0.34 -1.18 -0.03 0.00 0.12 0.00 0.00 29.99 29.24 1pwv n HIS 424 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1pwv s GLN 425 N -2.59 3.61 0.49 -1.40 -1.52 -1.26 -4.81 119.66 112.18 1pwv s GLN 425 Ca -0.07 2.25 -0.20 0.00 -1.95 0.00 0.00 55.36 55.40 1pwv s GLN 425 Cb 0.08 -4.26 -0.08 0.00 -0.22 0.00 0.00 33.01 28.52 1pwv s GLN 425 CO 0.82 -1.56 1.02 -1.54 -0.25 0.00 0.00 175.29 173.78 1pwv s SER 426 N 6.36 6.41 0.38 5.90 1.04 -1.26 -0.81 113.70 131.71 1pwv s SER 426 Ca 0.93 1.85 0.16 0.00 0.48 0.00 0.00 55.95 59.38 1pwv s SER 426 Cb -0.37 -2.55 0.74 0.00 0.10 0.00 0.00 66.02 63.95 1pwv s SER 426 CO 0.37 -0.73 1.79 -0.29 0.98 0.00 0.00 173.24 175.36 1pwv h ILE 427 N 1.46 1.07 -2.32 -1.02 6.09 -0.80 -3.46 117.51 118.54 1pwv h ILE 427 Ca -0.49 -1.40 -0.62 0.00 -1.37 0.00 0.00 64.86 60.99 1pwv h ILE 427 Cb 1.21 1.80 0.10 0.00 0.47 0.00 0.00 36.82 40.40 1pwv h ILE 427 CO 0.59 0.37 0.16 0.61 -3.07 0.00 0.00 178.15 176.82 1pwv n GLY 428 N -0.14 -0.19 3.64 8.18 0.00 -0.07 -4.98 105.19 111.64 1pwv n GLY 428 Ca -0.01 0.38 -0.09 0.00 0.00 0.00 0.00 46.02 46.30 1pwv n GLY 428 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pwv s SER 429 N -0.41 -0.39 0.38 1.61 0.15 -1.26 -5.03 113.70 108.76 1pwv s SER 429 Ca 0.62 -0.28 0.21 0.00 0.70 0.00 0.00 55.95 57.20 1pwv s SER 429 Cb -0.74 0.62 0.56 0.00 -1.71 0.00 0.00 66.02 64.75 1pwv s SER 429 CO 0.58 -1.08 1.67 0.00 1.20 0.00 0.00 173.24 175.60 1pwv h THR 430 N 2.00 0.63 0.00 6.45 1.03 -2.00 -3.28 112.91 117.73 1pwv h THR 430 Ca -0.26 -1.51 0.00 0.00 -0.01 0.00 0.00 66.41 64.63 1pwv h THR 430 Cb 1.27 2.02 0.00 0.00 -1.07 0.00 0.00 68.15 70.38 1pwv h THR 430 CO 0.30 0.30 0.00 0.18 -0.01 0.00 0.00 175.52 176.29 1pwv n LEU 431 N -3.31 0.15 -3.61 0.00 4.77 -1.26 -4.85 117.00 108.88 1pwv n LEU 431 Ca 0.01 0.53 -0.16 0.00 -0.03 0.00 0.00 56.01 56.36 1pwv n LEU 431 Cb 0.55 -0.51 -0.07 0.00 -2.33 0.00 0.00 43.42 41.06 1pwv n LEU 431 CO 0.36 -0.28 0.28 -0.72 -1.33 0.00 0.00 177.39 175.70 1pwv s TYR 432 N -3.06 -0.49 0.00 -1.77 -0.85 -1.24 -5.05 117.35 104.89 1pwv s TYR 432 Ca 0.07 0.86 0.00 0.00 -0.52 0.00 0.00 57.07 57.48 1pwv s TYR 432 Cb 0.11 0.29 0.00 0.00 0.38 0.00 0.00 41.96 42.73 1pwv s TYR 432 CO 0.33 -0.51 0.04 0.27 -1.52 0.00 0.00 175.55 174.16 1pwv n ASN 433 N 1.17 0.00 -4.96 -0.18 6.94 -1.26 -4.63 115.26 112.34 1pwv n ASN 433 Ca -0.19 0.04 -0.23 0.00 -0.02 0.00 0.00 54.58 54.18 1pwv n ASN 433 Cb 0.57 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.96 1pwv n ASN 433 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1pwv s LYS 434 N -0.09 3.44 -0.05 -3.83 1.02 -1.26 -4.98 119.74 113.99 1pwv s LYS 434 Ca 0.00 -0.70 -0.01 0.00 0.02 0.00 0.00 55.97 55.28 1pwv s LYS 434 Cb 0.00 -2.91 0.03 0.00 -0.52 0.00 0.00 37.83 34.43 1pwv s LYS 434 CO 0.00 0.45 0.01 0.42 -0.92 0.00 0.00 175.35 175.32 1pwv s ILE 435 N -1.91 0.21 -0.01 2.17 -1.09 -1.26 -5.09 121.20 114.22 1pwv s ILE 435 Ca 0.34 0.18 0.05 0.00 -2.23 0.00 0.00 60.65 58.99 1pwv s ILE 435 Cb -0.10 -0.37 -0.03 0.00 -1.58 0.00 0.00 42.46 40.38 1pwv s ILE 435 CO 0.29 0.21 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.74 1pwv s TYR 436 N 1.72 2.63 0.19 3.97 1.51 -1.26 -1.21 117.35 124.90 1pwv s TYR 436 Ca 0.00 -0.21 0.04 0.00 -1.01 0.00 0.00 57.07 55.89 1pwv s TYR 436 Cb -0.13 -1.55 -0.05 0.00 -0.11 0.00 0.00 41.96 40.13 1pwv s TYR 436 CO -0.03 0.21 -0.05 -0.51 -1.11 0.00 0.00 175.55 174.06 1pwv s LEU 437 N -1.07 2.33 0.18 -1.29 1.43 -0.48 -4.89 118.68 114.89 1pwv s LEU 437 Ca 0.13 -1.13 0.08 0.00 -1.03 0.00 0.00 54.13 52.19 1pwv s LEU 437 Cb -0.11 -0.30 -0.04 0.00 0.03 0.00 0.00 46.19 45.77 1pwv s LEU 437 CO 0.03 -0.43 -0.17 -0.31 0.23 0.00 0.00 176.35 175.69 1pwv s TYR 438 N -3.38 1.78 -0.24 0.29 1.51 0.12 -0.40 117.35 117.02 1pwv s TYR 438 Ca 0.23 -0.49 -0.04 0.00 -1.01 0.00 0.00 57.07 55.76 1pwv s TYR 438 Cb 0.04 -0.87 0.13 0.00 -0.11 0.00 0.00 41.96 41.15 1pwv s TYR 438 CO 0.05 0.34 0.43 -2.00 -1.11 0.00 0.00 175.55 173.25 1pwv s GLU 439 N -3.02 0.38 0.02 -0.62 2.12 -0.87 0.16 118.70 116.87 1pwv s GLU 439 Ca 0.17 0.75 -0.29 0.00 0.36 0.00 0.00 54.97 55.97 1pwv s GLU 439 Cb -0.04 -0.10 -0.04 0.00 0.26 0.00 0.00 34.13 34.21 1pwv s GLU 439 CO 0.07 -0.53 0.93 -0.80 -0.54 0.00 0.00 175.26 174.39 1pwv s ASN 440 N 2.61 7.34 0.01 -1.70 0.02 -1.26 -1.23 114.94 120.74 1pwv s ASN 440 Ca 0.10 1.62 0.00 0.00 -1.02 0.00 0.00 52.86 53.55 1pwv s ASN 440 Cb -0.14 -2.55 -0.01 0.00 0.02 0.00 0.00 41.25 38.57 1pwv s ASN 440 CO -0.16 -0.19 -0.02 -0.32 0.02 0.00 0.00 177.10 176.44 1pwv s MET 441 N 0.71 0.17 -0.05 -0.60 1.75 -0.58 -4.99 119.30 115.70 1pwv s MET 441 Ca 0.48 -0.32 -0.29 0.00 -1.25 0.00 0.00 55.69 54.32 1pwv s MET 441 Cb -0.21 0.04 -0.02 0.00 2.84 0.00 0.00 34.83 37.48 1pwv s MET 441 CO 0.27 -0.02 0.95 1.21 -0.65 0.00 0.00 175.02 176.77 1pwv s ASN 442 N -0.75 7.26 0.63 1.11 3.84 -1.26 -2.08 114.94 123.69 1pwv s ASN 442 Ca -0.08 1.54 0.40 0.00 0.21 0.00 0.00 52.86 54.93 1pwv s ASN 442 Cb -0.05 -2.54 2.16 0.00 -0.55 0.00 0.00 41.25 40.27 1pwv s ASN 442 CO -0.00 -0.31 2.30 -0.29 -2.79 0.00 0.00 177.10 176.00 1pwv h ILE 443 N 4.91 0.13 0.00 -5.21 2.10 -1.93 -1.20 117.51 116.31 1pwv h ILE 443 Ca -0.37 -0.09 0.00 0.00 1.08 0.00 0.00 64.86 65.48 1pwv h ILE 443 Cb 1.19 1.08 0.00 0.00 -1.09 0.00 0.00 36.82 38.00 1pwv h ILE 443 CO 0.79 0.01 0.00 0.59 -1.08 0.00 0.00 178.15 178.46 1pwv n ASN 444 N -3.25 0.02 0.02 2.19 5.03 -1.26 -0.10 115.26 117.91 1pwv n ASN 444 Ca -0.03 0.50 0.12 0.00 0.87 0.00 0.00 54.58 56.05 1pwv n ASN 444 Cb 0.11 -0.51 0.19 0.00 -1.02 0.00 0.00 39.78 38.55 1pwv n ASN 444 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1pwv n ASN 445 N -1.52 0.59 -0.09 6.41 5.03 -0.45 -3.40 115.26 121.83 1pwv n ASN 445 Ca 0.03 -0.13 -0.11 0.00 0.87 0.00 0.00 54.58 55.25 1pwv n ASN 445 Cb 0.16 0.31 -0.11 0.00 -1.02 0.00 0.00 39.78 39.12 1pwv n ASN 445 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1pwv n LEU 446 N -1.77 1.60 -3.15 3.41 4.32 -0.18 -4.90 117.00 116.33 1pwv n LEU 446 Ca 0.04 -0.06 0.05 0.00 -0.02 0.00 0.00 56.01 56.03 1pwv n LEU 446 Cb 0.38 -0.20 -0.00 0.00 -1.62 0.00 0.00 43.42 41.99 1pwv n LEU 446 CO 0.36 0.63 0.49 0.28 -1.22 0.00 0.00 177.39 177.93 1pwv s THR 447 N -2.39 -0.31 0.15 -5.08 -1.32 0.86 -4.31 115.64 103.23 1pwv s THR 447 Ca -0.18 0.00 0.35 0.00 -1.21 0.00 0.00 61.69 60.65 1pwv s THR 447 Cb 0.06 -0.33 0.38 0.00 -1.51 0.00 0.00 72.50 71.10 1pwv s THR 447 CO 0.54 0.00 2.03 0.00 -2.21 0.00 0.00 174.62 174.98 1pwv h ALA 448 N 7.33 1.00 -0.09 11.08 0.00 -1.10 -1.67 119.26 135.81 1pwv h ALA 448 Ca -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1pwv h ALA 448 Cb 1.18 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1pwv h ALA 448 CO -0.08 0.00 -0.00 1.15 0.00 0.00 0.00 179.25 180.32 1pwv h THR 449 N 0.00 1.26 -0.04 0.00 2.02 -1.79 -2.61 112.91 111.75 1pwv h THR 449 Ca 0.00 -0.82 -0.25 0.00 0.77 0.00 0.00 66.41 66.11 1pwv h THR 449 Cb 0.35 1.64 0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1pwv h THR 449 CO 0.00 0.23 -0.96 -0.07 0.37 0.00 0.00 175.52 175.09 1pwv h LEU 450 N -0.13 0.91 -0.93 2.58 3.38 -1.89 -3.14 115.31 116.09 1pwv h LEU 450 Ca 0.02 -0.71 0.00 0.00 0.09 0.00 0.00 57.88 57.28 1pwv h LEU 450 Cb 0.36 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1pwv h LEU 450 CO 0.01 1.50 0.39 1.23 0.09 0.00 0.00 178.44 181.65 1pwv h GLY 451 N 0.41 0.00 1.22 0.83 0.00 -1.23 0.33 103.07 104.64 1pwv h GLY 451 Ca -0.11 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.04 1pwv h GLY 451 CO 0.19 0.00 -0.53 0.00 0.00 0.00 0.00 176.54 176.20 1pwv h ALA 452 N 1.02 0.53 -0.13 3.60 0.00 -1.41 -3.31 119.26 119.56 1pwv h ALA 452 Ca 0.00 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1pwv h ALA 452 Cb 0.78 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.49 1pwv h ALA 452 CO 0.00 0.68 -0.01 -0.25 0.00 0.00 0.00 179.25 179.67 1pwv n ASP 453 N -4.00 3.09 -0.04 0.00 8.00 0.11 -4.74 116.55 118.97 1pwv n ASP 453 Ca -0.04 -3.08 -0.13 0.00 0.71 0.00 0.00 54.79 52.25 1pwv n ASP 453 Cb 0.62 -0.49 -0.08 0.00 -0.02 0.00 0.00 41.12 41.15 1pwv n ASP 453 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 1pwv h LEU 454 N 0.91 0.22-10.00 0.64 5.85 -1.47 -3.42 115.31 108.04 1pwv h LEU 454 Ca 0.00 -0.42 -0.45 0.00 0.84 0.00 0.00 57.88 57.86 1pwv h LEU 454 Cb 1.23 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 1pwv h LEU 454 CO 0.12 0.58 0.34 -0.69 -0.34 0.00 0.00 178.44 178.45 1pwv s VAL 455 N -4.55 4.33 -0.14 1.05 1.01 -1.26 -0.55 120.40 120.28 1pwv s VAL 455 Ca -0.15 1.60 -0.29 0.00 0.00 0.00 0.00 61.98 63.14 1pwv s VAL 455 Cb 0.04 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1pwv s VAL 455 CO 0.71 -0.16 1.53 -0.62 0.00 0.00 0.00 175.10 176.56 1pwv s ASP 456 N -1.99 6.65 0.30 3.32 3.68 0.37 -4.61 116.67 124.38 1pwv s ASP 456 Ca 0.58 1.86 0.05 0.00 2.13 0.00 0.00 52.55 57.17 1pwv s ASP 456 Cb -0.12 -2.53 0.75 0.00 -1.45 0.00 0.00 42.92 39.56 1pwv s ASP 456 CO 0.17 -0.99 1.72 0.28 0.13 0.00 0.00 175.17 176.47 1pwv h SER 457 N 9.56 0.49 0.20 -0.34 0.02 -1.93 -3.05 113.55 118.49 1pwv h SER 457 Ca -0.34 0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 1pwv h SER 457 Cb 1.15 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1pwv h SER 457 CO 0.98 0.08 -0.10 0.74 -1.14 0.00 0.00 176.83 177.39 1pwv h THR 458 N 0.51 0.00 -3.58 -2.27 2.02 -1.97 -3.43 112.91 104.19 1pwv h THR 458 Ca 0.57 -0.53 -0.70 0.00 0.77 0.00 0.00 66.41 66.52 1pwv h THR 458 Cb 1.04 0.00 -0.29 0.00 -1.74 0.00 0.00 68.15 67.16 1pwv h THR 458 CO -0.48 0.00 -0.55 -0.62 0.37 0.00 0.00 175.52 174.24 1pwv s ASP 459 N -4.48 5.43 0.50 4.18 3.68 -1.15 -4.97 116.67 119.86 1pwv s ASP 459 Ca -0.04 -1.34 0.22 0.00 2.13 0.00 0.00 52.55 53.52 1pwv s ASP 459 Cb 0.00 -1.91 1.29 0.00 -1.45 0.00 0.00 42.92 40.86 1pwv s ASP 459 CO 0.12 -0.42 2.00 0.78 0.13 0.00 0.00 175.17 177.78 1pwv h ASN 460 N 8.27 0.09 0.61 -0.34 4.21 -1.85 -0.34 115.58 126.23 1pwv h ASN 460 Ca -0.22 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.29 1pwv h ASN 460 Cb 1.08 -0.02 0.00 0.00 -1.12 0.00 0.00 38.32 38.26 1pwv h ASN 460 CO 0.66 0.05 0.00 0.35 -1.29 0.00 0.00 177.43 177.21 1pwv n THR 461 N -4.42 0.90 -4.08 2.81 -2.24 -1.26 -4.62 114.28 101.37 1pwv n THR 461 Ca 0.09 0.29 -0.28 0.00 -2.27 0.00 0.00 64.05 61.87 1pwv n THR 461 Cb 0.51 -1.20 -0.06 0.00 -2.10 0.00 0.00 70.33 67.48 1pwv n THR 461 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1pwv s LYS 462 N -3.28 2.83 -0.16 -0.78 1.02 -0.14 -0.47 119.74 118.77 1pwv s LYS 462 Ca 0.04 -0.81 -0.03 0.00 0.02 0.00 0.00 55.97 55.18 1pwv s LYS 462 Cb 0.09 -2.65 -0.02 0.00 -0.52 0.00 0.00 37.83 34.72 1pwv s LYS 462 CO 0.34 0.52 -0.04 0.42 -0.92 0.00 0.00 175.35 175.67 1pwv s ILE 463 N -1.57 3.79 -0.42 2.17 1.01 -1.26 -0.48 121.20 124.44 1pwv s ILE 463 Ca 0.30 -0.39 -0.27 0.00 0.00 0.00 0.00 60.65 60.28 1pwv s ILE 463 Cb -0.11 -2.66 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 1pwv s ILE 463 CO 0.22 0.49 2.21 0.20 0.00 0.00 0.00 174.94 178.05 1pwv s ASN 464 N 0.47 5.00 0.48 3.58 0.01 0.29 -4.83 114.94 119.93 1pwv s ASN 464 Ca -0.04 1.21 0.33 0.00 -0.71 0.00 0.00 52.86 53.66 1pwv s ASN 464 Cb -0.14 -2.51 1.46 0.00 0.41 0.00 0.00 41.25 40.46 1pwv s ASN 464 CO 0.03 -2.43 1.68 0.03 -1.51 0.00 0.00 177.10 174.90 1pwv h ARG 465 N 16.92 0.10 0.23 -0.60 -0.00 -1.95 0.46 114.38 129.55 1pwv h ARG 465 Ca -0.30 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.16 1pwv h ARG 465 Cb 1.23 -0.02 0.00 0.00 0.00 0.00 0.00 29.97 31.18 1pwv h ARG 465 CO 1.10 0.07 -0.11 0.78 0.00 0.00 0.00 179.97 181.81 1pwv h GLY 466 N 0.10 -0.32 0.64 0.04 0.00 -1.96 -0.94 103.07 100.63 1pwv h GLY 466 Ca 0.75 0.12 0.08 0.00 0.00 0.00 0.00 47.33 48.28 1pwv h GLY 466 CO -0.23 -0.12 0.62 -2.22 0.00 0.00 0.00 176.54 174.59 1pwv h ILE 467 N -0.79 1.02 0.15 2.60 5.03 -1.45 -1.50 117.51 122.58 1pwv h ILE 467 Ca -0.03 -0.37 0.02 0.00 -0.12 0.00 0.00 64.86 64.35 1pwv h ILE 467 Cb 0.51 -0.15 -0.03 0.00 -3.03 0.00 0.00 36.82 34.11 1pwv h ILE 467 CO 0.05 0.20 -0.29 0.15 -0.68 0.00 0.00 178.15 177.58 1pwv h PHE 468 N 1.08 -0.77 -0.59 1.37 3.57 -0.90 -0.89 116.94 119.81 1pwv h PHE 468 Ca 0.45 0.01 0.10 0.00 3.53 0.00 0.00 57.97 62.06 1pwv h PHE 468 Cb 0.27 0.32 -0.08 0.00 2.79 0.00 0.00 35.95 39.26 1pwv h PHE 468 CO -0.01 -0.40 0.17 -0.91 -2.23 0.00 0.00 178.31 174.94 1pwv h ASN 469 N -0.52 0.11 -0.50 0.41 2.35 -0.18 -1.55 115.58 115.70 1pwv h ASN 469 Ca 0.02 0.09 -0.07 0.00 -0.55 0.00 0.00 56.30 55.80 1pwv h ASN 469 Cb 0.54 0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.99 1pwv h ASN 469 CO -0.14 0.07 0.06 -0.08 -1.65 0.00 0.00 177.43 175.69 1pwv h GLU 470 N 0.33 0.85 -0.84 0.81 4.81 -1.04 -0.94 114.58 118.54 1pwv h GLU 470 Ca 0.30 -0.24 0.13 0.00 -0.13 0.00 0.00 59.36 59.42 1pwv h GLU 470 Cb 0.41 -0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.63 1pwv h GLU 470 CO -0.34 0.85 0.55 0.35 -0.73 0.00 0.00 179.01 179.69 1pwv h PHE 471 N 0.72 0.75 0.00 0.92 3.57 -0.31 -1.75 116.94 120.84 1pwv h PHE 471 Ca 0.15 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.49 1pwv h PHE 471 Cb 0.43 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1pwv h PHE 471 CO 0.03 0.30 -0.88 -0.22 -2.23 0.00 0.00 178.31 175.31 1pwv h LYS 472 N 0.66 0.00 -0.80 1.11 3.64 -0.90 -3.40 116.57 116.87 1pwv h LYS 472 Ca 0.41 0.00 0.25 0.00 -1.27 0.00 0.00 60.65 60.05 1pwv h LYS 472 Cb 0.67 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.34 1pwv h LYS 472 CO -0.17 0.84 0.13 1.17 -2.27 0.00 0.00 179.45 179.15 1pwv n LYS 473 N -3.30 -0.06 -1.19 1.90 4.81 -0.40 -2.38 118.16 117.54 1pwv n LYS 473 Ca 0.00 1.17 0.05 0.00 -0.87 0.00 0.00 58.31 58.66 1pwv n LYS 473 Cb 0.88 -1.93 0.08 0.00 0.02 0.00 0.00 35.03 34.08 1pwv n LYS 473 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1pwv n ASN 474 N -5.05 1.22 -4.43 3.14 5.03 -1.26 -4.97 115.26 108.94 1pwv n ASN 474 Ca 0.22 -2.61 -0.44 0.00 0.87 0.00 0.00 54.58 52.62 1pwv n ASN 474 Cb 0.73 -0.37 -0.01 0.00 -1.02 0.00 0.00 39.78 39.11 1pwv n ASN 474 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1pwv s PHE 475 N -1.04 3.46 -0.27 3.10 5.36 -1.00 -3.30 117.98 124.30 1pwv s PHE 475 Ca 0.35 -1.87 -0.05 0.00 -0.96 0.00 0.00 56.93 54.39 1pwv s PHE 475 Cb 0.38 -4.18 -0.14 0.00 -0.34 0.00 0.00 43.02 38.73 1pwv s PHE 475 CO -0.13 -1.33 -0.29 1.63 -1.46 0.00 0.00 175.22 173.64 1pwv n LYS 476 N 5.47 0.61 -4.08 10.12 4.76 -1.26 -4.75 118.16 129.03 1pwv n LYS 476 Ca 0.27 0.20 -0.09 0.00 -2.87 0.00 0.00 58.31 55.82 1pwv n LYS 476 Cb 0.46 -1.50 -0.10 0.00 -1.84 0.00 0.00 35.03 32.05 1pwv n LYS 476 CO 0.00 0.00 0.00 1.52 -1.37 0.00 0.00 177.40 177.55 1pwv s TYR 477 N -2.51 0.57 0.07 2.13 -0.85 -1.26 0.10 117.35 115.61 1pwv s TYR 477 Ca -0.36 -0.85 -0.07 0.00 -0.52 0.00 0.00 57.07 55.27 1pwv s TYR 477 Cb 0.12 -0.38 -0.01 0.00 0.38 0.00 0.00 41.96 42.07 1pwv s TYR 477 CO 0.54 -0.25 0.13 -1.54 -1.52 0.00 0.00 175.55 172.91 1pwv s SER 478 N -2.49 0.20 0.08 -0.18 1.04 0.13 -1.75 113.70 110.73 1pwv s SER 478 Ca 0.01 -0.70 0.07 0.00 0.48 0.00 0.00 55.95 55.82 1pwv s SER 478 Cb 0.01 0.29 -0.03 0.00 0.10 0.00 0.00 66.02 66.40 1pwv s SER 478 CO -0.06 -0.67 -0.20 -0.63 0.98 0.00 0.00 173.24 172.67 1pwv s ILE 479 N -3.66 1.59 -0.34 -1.02 1.01 -0.63 0.35 121.20 118.51 1pwv s ILE 479 Ca 0.04 -1.37 0.02 0.00 0.00 0.00 0.00 60.65 59.34 1pwv s ILE 479 Cb 0.05 -1.43 0.09 0.00 0.01 0.00 0.00 42.46 41.17 1pwv s ILE 479 CO -0.10 0.01 0.05 -0.55 0.00 0.00 0.00 174.94 174.35 1pwv s SER 480 N -1.60 4.81 0.26 3.58 0.15 -0.35 -0.41 113.70 120.14 1pwv s SER 480 Ca 0.06 -1.93 0.25 0.00 0.70 0.00 0.00 55.95 55.02 1pwv s SER 480 Cb -0.09 -1.66 0.58 0.00 -1.71 0.00 0.00 66.02 63.13 1pwv s SER 480 CO 0.03 -0.37 1.63 0.28 1.20 0.00 0.00 173.24 176.02 1pwv h SER 481 N 7.75 0.00 -3.83 5.45 0.02 -1.86 -1.23 113.55 119.84 1pwv h SER 481 Ca -0.10 -0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.75 1pwv h SER 481 Cb 1.03 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.57 1pwv h SER 481 CO 0.54 0.01 -0.04 -0.46 -1.14 0.00 0.00 176.83 175.75 1pwv n ASN 482 N -2.49 1.19 -4.52 3.07 0.23 -1.26 -4.25 115.26 107.23 1pwv n ASN 482 Ca 0.05 -1.25 -0.43 0.00 -0.53 0.00 0.00 54.58 52.42 1pwv n ASN 482 Cb 0.46 -0.01 -0.05 0.00 -2.08 0.00 0.00 39.78 38.11 1pwv n ASN 482 CO 0.00 0.00 0.00 -0.31 -0.93 0.00 0.00 177.26 176.02 1pwv s TYR 483 N -0.32 2.90 0.19 -2.53 1.51 -1.26 -4.32 117.35 113.52 1pwv s TYR 483 Ca 0.04 -0.03 -0.31 0.00 -1.01 0.00 0.00 57.07 55.76 1pwv s TYR 483 Cb -0.00 -3.86 -0.10 0.00 -0.11 0.00 0.00 41.96 37.90 1pwv s TYR 483 CO 0.03 -1.18 1.48 -1.64 -1.11 0.00 0.00 175.55 173.12 1pwv s MET 484 N 3.52 4.26 -0.32 -0.62 -1.94 -1.25 -4.74 119.30 118.22 1pwv s MET 484 Ca 0.28 2.28 -0.03 0.00 -1.71 0.00 0.00 55.69 56.51 1pwv s MET 484 Cb -0.13 -3.15 0.06 0.00 2.01 0.00 0.00 34.83 33.61 1pwv s MET 484 CO 0.19 -0.49 0.04 0.42 -0.01 0.00 0.00 175.02 175.18 1pwv s ILE 485 N 0.65 3.15 0.32 2.53 1.01 -1.26 -0.21 121.20 127.38 1pwv s ILE 485 Ca 0.64 -1.44 0.10 0.00 0.00 0.00 0.00 60.65 59.96 1pwv s ILE 485 Cb -0.41 -2.86 -0.06 0.00 0.01 0.00 0.00 42.46 39.14 1pwv s ILE 485 CO 0.36 -0.20 -0.13 0.68 0.00 0.00 0.00 174.94 175.65 1pwv s VAL 486 N 1.26 2.29 0.07 2.92 -7.23 -0.76 -4.92 120.40 114.02 1pwv s VAL 486 Ca -0.03 -2.27 -0.07 0.00 -1.81 0.00 0.00 61.98 57.81 1pwv s VAL 486 Cb -0.20 -2.53 -0.05 0.00 0.56 0.00 0.00 36.38 34.16 1pwv s VAL 486 CO -0.01 -0.27 0.34 -1.81 -0.31 0.00 0.00 175.10 173.04 1pwv s ASP 487 N -3.57 6.54 0.06 4.85 1.01 0.12 -1.30 116.67 124.38 1pwv s ASP 487 Ca 0.31 0.63 -0.17 0.00 0.71 0.00 0.00 52.55 54.04 1pwv s ASP 487 Cb 0.00 -2.11 -0.18 0.00 1.01 0.00 0.00 42.92 41.64 1pwv s ASP 487 CO 0.16 0.18 1.24 0.40 0.21 0.00 0.00 175.17 177.35 1pwv h ILE 488 N 2.71 1.34 -4.32 0.77 2.04 -1.83 0.37 117.51 118.59 1pwv h ILE 488 Ca -0.49 -1.89 -0.69 0.00 1.00 0.00 0.00 64.86 62.79 1pwv h ILE 488 Cb 1.19 2.18 -0.27 0.00 -0.74 0.00 0.00 36.82 39.18 1pwv h ILE 488 CO 0.68 0.58 -0.86 0.20 0.00 0.00 0.00 178.15 178.75 1pwv s ASN 489 N -6.81 3.34 0.37 1.72 0.01 -1.26 -4.71 114.94 107.59 1pwv s ASN 489 Ca -0.12 -0.47 -0.28 0.00 -0.71 0.00 0.00 52.86 51.28 1pwv s ASN 489 Cb 0.06 -0.43 -0.11 0.00 0.41 0.00 0.00 41.25 41.18 1pwv s ASN 489 CO 0.85 0.29 1.49 -0.70 -1.51 0.00 0.00 177.10 177.52 1pwv s GLU 490 N -0.98 4.12 0.17 -0.60 2.12 -1.26 -4.88 118.70 117.40 1pwv s GLU 490 Ca 0.12 2.56 0.06 0.00 0.36 0.00 0.00 54.97 58.06 1pwv s GLU 490 Cb -0.10 -2.98 -0.05 0.00 0.26 0.00 0.00 34.13 31.27 1pwv s GLU 490 CO 0.01 -0.53 -0.12 1.03 -0.54 0.00 0.00 175.26 175.11 1pwv s ARG 491 N -1.95 1.18 0.28 4.30 0.52 -1.26 -5.09 118.95 116.94 1pwv s ARG 491 Ca 0.53 -1.51 -0.30 0.00 -0.52 0.00 0.00 55.73 53.94 1pwv s ARG 491 Cb -0.46 -0.86 -0.10 0.00 0.52 0.00 0.00 34.95 34.04 1pwv s ARG 491 CO 0.61 0.13 1.42 -1.25 0.02 0.00 0.00 175.30 176.24 1pwv s PRO 492 N -3.66 4.26 0.58 3.54 0.04 -1.26 -4.94 135.00 133.56 1pwv s PRO 492 Ca 0.19 2.32 -0.01 0.00 0.04 0.00 0.00 61.00 63.55 1pwv s PRO 492 Cb 0.01 -3.08 0.04 0.00 0.04 0.00 0.00 34.50 31.50 1pwv s PRO 492 CO 0.03 -0.39 0.83 0.00 0.04 0.00 0.00 177.00 177.51 1pwv s ALA 493 N -0.35 3.71 0.25 8.56 0.00 -1.26 -5.09 121.76 127.57 1pwv s ALA 493 Ca 0.57 -1.20 -0.08 0.00 0.00 0.00 0.00 51.96 51.24 1pwv s ALA 493 Cb -0.42 -2.21 -0.07 0.00 0.00 0.00 0.00 23.12 20.42 1pwv s ALA 493 CO 0.47 -0.85 0.55 -0.51 0.00 0.00 0.00 175.76 175.43 1pwv s LEU 494 N -4.87 4.13 0.27 0.00 1.43 -1.26 -4.94 118.68 113.45 1pwv s LEU 494 Ca 0.57 0.87 0.11 0.00 -1.03 0.00 0.00 54.13 54.66 1pwv s LEU 494 Cb -0.10 -3.65 0.89 0.00 0.03 0.00 0.00 46.19 43.36 1pwv s LEU 494 CO 0.40 -0.11 1.22 0.47 0.23 0.00 0.00 176.35 178.56 1pwv n ASP 495 N -0.35 0.15 -0.03 2.29 9.92 -1.26 0.18 116.55 127.45 1pwv n ASP 495 Ca 0.00 1.29 0.14 0.00 -0.53 0.00 0.00 54.79 55.69 1pwv n ASP 495 Cb 0.53 -0.58 0.56 0.00 -0.64 0.00 0.00 41.12 40.99 1pwv n ASP 495 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1pwv n ASN 496 N -4.85 0.24 -4.39 -2.24 2.04 -1.26 -4.59 115.26 100.22 1pwv n ASN 496 Ca 0.26 -0.05 -0.45 0.00 -0.44 0.00 0.00 54.58 53.90 1pwv n ASN 496 Cb 0.87 -0.19 -0.04 0.00 -2.53 0.00 0.00 39.78 37.89 1pwv n ASN 496 CO 0.00 0.00 0.00 -1.61 -0.44 0.00 0.00 177.26 175.21 1pwv s GLU 497 N -2.80 3.28 0.00 -3.83 2.02 0.47 -4.06 118.70 113.78 1pwv s GLU 497 Ca 0.19 -1.61 0.14 0.00 0.02 0.00 0.00 54.97 53.71 1pwv s GLU 497 Cb 0.19 -4.44 0.14 0.00 0.10 0.00 0.00 34.13 30.12 1pwv s GLU 497 CO 0.54 -1.56 0.98 0.54 0.02 0.00 0.00 175.26 175.78 1pwv n ARG 498 N 6.01 1.14 -4.07 1.61 5.12 -1.18 -4.49 116.66 120.81 1pwv n ARG 498 Ca 0.03 -1.42 -0.35 0.00 -1.93 0.00 0.00 57.85 54.17 1pwv n ARG 498 Cb 0.45 -1.27 -0.08 0.00 -1.16 0.00 0.00 32.46 30.39 1pwv n ARG 498 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1pwv s LEU 499 N -1.14 3.95 -0.37 0.55 1.02 -0.89 -0.56 118.68 121.23 1pwv s LEU 499 Ca 0.18 0.24 0.02 0.00 0.02 0.00 0.00 54.13 54.58 1pwv s LEU 499 Cb 0.12 -1.96 0.11 0.00 0.02 0.00 0.00 46.19 44.48 1pwv s LEU 499 CO 0.18 0.32 0.13 -0.54 0.02 0.00 0.00 176.35 176.46 1pwv s LYS 500 N -0.51 1.19 0.14 1.70 1.02 0.50 -1.53 119.74 122.24 1pwv s LYS 500 Ca 0.10 -1.67 -0.30 0.00 0.02 0.00 0.00 55.97 54.12 1pwv s LYS 500 Cb -0.12 -2.54 -0.07 0.00 -0.52 0.00 0.00 37.83 34.58 1pwv s LYS 500 CO 0.02 -1.03 1.06 -1.58 -0.92 0.00 0.00 175.35 172.90 1pwv s TRP 501 N 0.93 3.66 -0.18 3.18 0.52 -0.36 -1.28 118.94 125.41 1pwv s TRP 501 Ca 0.13 1.65 0.01 0.00 0.02 0.00 0.00 56.10 57.90 1pwv s TRP 501 Cb -0.20 -3.21 0.02 0.00 -1.15 0.00 0.00 33.47 28.93 1pwv s TRP 501 CO -0.12 -0.37 -0.18 0.50 0.02 0.00 0.00 176.95 176.80 1pwv s ARG 502 N -0.10 2.79 -0.16 4.98 3.52 0.11 -2.05 118.95 128.05 1pwv s ARG 502 Ca 0.49 -0.79 -0.01 0.00 -0.13 0.00 0.00 55.73 55.30 1pwv s ARG 502 Cb -0.27 -2.48 -0.01 0.00 -1.56 0.00 0.00 34.95 30.63 1pwv s ARG 502 CO 0.32 -0.23 -0.13 0.42 -0.81 0.00 0.00 175.30 174.88 1pwv s ILE 503 N 1.33 2.94 -0.48 4.11 -1.09 0.46 -0.98 121.20 127.49 1pwv s ILE 503 Ca 0.04 -0.68 -0.21 0.00 -2.23 0.00 0.00 60.65 57.57 1pwv s ILE 503 Cb -0.13 -2.26 0.04 0.00 -1.58 0.00 0.00 42.46 38.53 1pwv s ILE 503 CO -0.12 0.50 0.71 -1.58 -1.23 0.00 0.00 174.94 173.23 1pwv s GLN 504 N 0.73 3.27 0.90 2.79 0.74 0.23 -1.38 119.66 126.94 1pwv s GLN 504 Ca -0.06 -0.45 -0.12 0.00 0.05 0.00 0.00 55.36 54.79 1pwv s GLN 504 Cb -0.15 -4.01 0.13 0.00 1.10 0.00 0.00 33.01 30.08 1pwv s GLN 504 CO 0.02 -1.17 1.09 -0.51 -0.55 0.00 0.00 175.29 174.17 1pwv s LEU 505 N 3.05 2.20 0.03 3.68 1.43 -0.35 -0.36 118.68 128.35 1pwv s LEU 505 Ca 0.23 1.46 0.01 0.00 -1.03 0.00 0.00 54.13 54.80 1pwv s LEU 505 Cb -0.15 -3.86 -0.04 0.00 0.03 0.00 0.00 46.19 42.17 1pwv s LEU 505 CO 0.18 -2.68 0.08 -0.55 0.23 0.00 0.00 176.35 173.60 1pwv s SER 506 N -3.42 5.60 0.48 2.29 0.15 -1.26 -4.75 113.70 112.78 1pwv s SER 506 Ca 0.64 0.08 0.31 0.00 0.70 0.00 0.00 55.95 57.68 1pwv s SER 506 Cb -0.18 -1.56 1.22 0.00 -1.71 0.00 0.00 66.02 63.79 1pwv s SER 506 CO 0.57 0.23 1.91 1.55 1.20 0.00 0.00 173.24 178.70 1pwv h PRO 507 N 3.80 0.00 0.00 5.44 0.13 -1.97 -2.62 132.00 136.79 1pwv h PRO 507 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1pwv h PRO 507 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1pwv h PRO 507 CO 0.64 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 177.97 1pwv h ASP 508 N 0.00 0.00 -2.66 1.44 3.45 -1.95 -0.14 116.42 116.55 1pwv h ASP 508 Ca 0.00 0.00 -0.54 0.00 0.43 0.00 0.00 57.03 56.92 1pwv h ASP 508 Cb 0.52 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.29 1pwv h ASP 508 CO 0.00 0.00 1.03 -0.89 -1.57 0.00 0.00 179.24 177.81 1pwv s THR 509 N -3.15 3.44 0.28 0.35 2.01 -0.99 -4.76 115.64 112.82 1pwv s THR 509 Ca 0.09 0.68 -0.24 0.00 0.31 0.00 0.00 61.69 62.53 1pwv s THR 509 Cb 0.11 -3.44 -0.09 0.00 0.01 0.00 0.00 72.50 69.09 1pwv s THR 509 CO 0.59 -0.04 0.87 -0.13 -0.69 0.00 0.00 174.62 175.22 1pwv s ARG 510 N 3.46 4.50 0.23 4.92 0.52 -1.26 -0.49 118.95 130.83 1pwv s ARG 510 Ca 0.73 1.19 -0.22 0.00 -0.52 0.00 0.00 55.73 56.90 1pwv s ARG 510 Cb -0.35 -2.87 0.04 0.00 0.52 0.00 0.00 34.95 32.29 1pwv s ARG 510 CO 0.30 0.34 0.69 0.00 0.02 0.00 0.00 175.30 176.66 1pwv s ALA 511 N -1.54 -1.37 0.05 2.13 0.00 0.01 -1.96 121.76 119.09 1pwv s ALA 511 Ca 0.47 -0.01 0.08 0.00 0.00 0.00 0.00 51.96 52.50 1pwv s ALA 511 Cb -0.19 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.75 1pwv s ALA 511 CO 0.23 -0.95 -0.23 0.20 0.00 0.00 0.00 175.76 175.02 1pwv s GLY 512 N -2.86 1.24 0.13 0.00 0.00 0.11 -4.46 107.32 101.48 1pwv s GLY 512 Ca 0.08 -1.16 -0.17 0.00 0.00 0.00 0.00 44.72 43.47 1pwv s GLY 512 CO 0.00 -1.08 0.59 -0.47 0.00 0.00 0.00 173.10 172.13 1pwv s TYR 513 N -0.85 3.68 -0.06 1.90 5.04 -1.26 0.12 117.35 125.92 1pwv s TYR 513 Ca 0.09 1.19 0.05 0.00 -2.44 0.00 0.00 57.07 55.95 1pwv s TYR 513 Cb -0.09 -2.45 -0.00 0.00 0.35 0.00 0.00 41.96 39.76 1pwv s TYR 513 CO 0.02 0.47 -0.21 -0.51 -1.34 0.00 0.00 175.55 173.98 1pwv s LEU 514 N -1.68 1.98 0.36 6.97 1.43 -0.08 -4.92 118.68 122.74 1pwv s LEU 514 Ca 0.36 -0.44 0.19 0.00 -1.03 0.00 0.00 54.13 53.20 1pwv s LEU 514 Cb -0.17 -1.18 1.26 0.00 0.03 0.00 0.00 46.19 46.13 1pwv s LEU 514 CO 0.19 0.18 1.59 -0.33 0.23 0.00 0.00 176.35 178.21 1pwv h GLU 515 N 6.33 0.05 -1.06 1.70 4.39 -1.99 -1.18 114.58 122.83 1pwv h GLU 515 Ca -0.30 -0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.35 1pwv h GLU 515 Cb 1.19 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 29.80 1pwv h GLU 515 CO 0.47 0.04 0.06 0.27 -1.16 0.00 0.00 179.01 178.69 1pwv n ASN 516 N -5.24 3.22 -2.90 1.42 2.04 -1.26 -4.82 115.26 107.72 1pwv n ASN 516 Ca 0.36 -2.17 -0.14 0.00 -0.44 0.00 0.00 54.58 52.18 1pwv n ASN 516 Cb 1.20 -0.57 0.07 0.00 -2.53 0.00 0.00 39.78 37.95 1pwv n ASN 516 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1pwv n GLY 517 N 0.40 -0.19 3.24 4.83 0.00 -0.46 -4.99 105.19 108.02 1pwv n GLY 517 Ca 0.06 -0.01 -0.14 0.00 0.00 0.00 0.00 46.02 45.93 1pwv n GLY 517 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pwv s LYS 518 N -5.26 1.08 0.10 1.61 1.02 -1.11 -2.79 119.74 114.39 1pwv s LYS 518 Ca 0.09 -1.50 0.08 0.00 0.02 0.00 0.00 55.97 54.67 1pwv s LYS 518 Cb -0.04 -0.42 -0.03 0.00 -0.52 0.00 0.00 37.83 36.82 1pwv s LYS 518 CO 0.57 -0.04 -0.21 -0.51 -0.92 0.00 0.00 175.35 174.24 1pwv s LEU 519 N -3.17 2.29 -0.19 3.17 1.43 -0.42 -0.90 118.68 120.89 1pwv s LEU 519 Ca 0.20 -0.67 -0.02 0.00 -1.03 0.00 0.00 54.13 52.61 1pwv s LEU 519 Cb 0.05 -0.88 -0.00 0.00 0.03 0.00 0.00 46.19 45.38 1pwv s LEU 519 CO 0.02 0.06 -0.10 -0.51 0.23 0.00 0.00 176.35 176.05 1pwv s ILE 520 N -1.13 2.98 0.37 -0.59 1.10 0.12 -1.83 121.20 122.21 1pwv s ILE 520 Ca 0.06 -0.64 -0.03 0.00 -0.51 0.00 0.00 60.65 59.53 1pwv s ILE 520 Cb -0.10 -2.31 -0.04 0.00 0.15 0.00 0.00 42.46 40.15 1pwv s ILE 520 CO 0.04 0.47 0.63 -0.76 -2.11 0.00 0.00 174.94 173.21 1pwv s LEU 521 N 1.20 3.91 0.55 8.50 1.43 0.70 0.07 118.68 135.05 1pwv s LEU 521 Ca 0.02 0.70 -0.19 0.00 -1.03 0.00 0.00 54.13 53.63 1pwv s LEU 521 Cb -0.14 -3.58 -0.05 0.00 0.03 0.00 0.00 46.19 42.45 1pwv s LEU 521 CO -0.04 -0.34 1.12 0.00 0.23 0.00 0.00 176.35 177.32 1pwv s GLN 522 N -4.15 3.33 1.07 1.70 -2.07 -0.83 -3.86 119.66 114.85 1pwv s GLN 522 Ca 0.44 1.55 -0.15 0.00 -1.82 0.00 0.00 55.36 55.38 1pwv s GLN 522 Cb -0.10 -2.01 0.22 0.00 -1.09 0.00 0.00 33.01 30.03 1pwv s GLN 522 CO 0.36 -0.85 1.11 -0.98 -1.32 0.00 0.00 175.29 173.61 1pwv s ARG 523 N -3.39 -0.14 -1.26 9.60 1.70 -1.26 -4.29 118.95 119.91 1pwv s ARG 523 Ca 0.71 0.25 -0.04 0.00 -0.47 0.00 0.00 55.73 56.18 1pwv s ARG 523 Cb -0.23 -1.69 -0.01 0.00 -0.57 0.00 0.00 34.95 32.45 1pwv s ARG 523 CO 0.28 -3.05 0.71 0.09 -1.08 0.00 0.00 175.30 172.25 1pwv n ASN 524 N -4.35 -2.34 -4.88 -2.89 4.13 -0.48 -5.00 115.26 99.44 1pwv n ASN 524 Ca 0.08 -0.86 -0.35 0.00 1.68 0.00 0.00 54.58 55.13 1pwv n ASN 524 Cb 0.58 -3.95 -0.05 0.00 -1.54 0.00 0.00 39.78 34.82 1pwv n ASN 524 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1pwv s ILE 525 N -3.63 5.38 -0.07 2.41 1.01 -1.10 -4.50 121.20 120.68 1pwv s ILE 525 Ca 0.13 0.16 -0.00 0.00 0.00 0.00 0.00 60.65 60.94 1pwv s ILE 525 Cb -0.04 -3.52 -0.03 0.00 0.01 0.00 0.00 42.46 38.88 1pwv s ILE 525 CO 0.82 0.45 -0.04 -0.83 0.00 0.00 0.00 174.94 175.35 1pwv s GLY 526 N -1.49 1.77 -0.12 6.18 0.00 -1.06 -1.22 107.32 111.38 1pwv s GLY 526 Ca 0.23 -0.86 0.01 0.00 0.00 0.00 0.00 44.72 44.10 1pwv s GLY 526 CO 0.13 -0.63 -0.13 1.08 0.00 0.00 0.00 173.10 173.54 1pwv s LEU 527 N -0.87 1.61 -0.20 0.66 1.43 0.16 -0.54 118.68 120.92 1pwv s LEU 527 Ca 0.13 -0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 52.70 1pwv s LEU 527 Cb -0.11 -1.05 -0.05 0.00 0.03 0.00 0.00 46.19 45.02 1pwv s LEU 527 CO 0.02 -0.03 0.24 -0.70 0.23 0.00 0.00 176.35 176.12 1pwv s GLU 528 N 1.23 4.18 -0.25 1.70 2.12 -0.03 0.23 118.70 127.87 1pwv s GLU 528 Ca -0.02 -0.05 -0.27 0.00 0.36 0.00 0.00 54.97 54.99 1pwv s GLU 528 Cb -0.14 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.78 1pwv s GLU 528 CO -0.05 0.15 0.93 0.42 -0.54 0.00 0.00 175.26 176.17 1pwv s ILE 529 N 0.77 4.75 -0.11 -3.70 1.09 0.28 -0.93 121.20 123.36 1pwv s ILE 529 Ca 0.13 1.75 0.15 0.00 -1.10 0.00 0.00 60.65 61.57 1pwv s ILE 529 Cb -0.13 -4.21 -0.24 0.00 -1.06 0.00 0.00 42.46 36.82 1pwv s ILE 529 CO 0.03 -0.15 0.44 0.29 -0.10 0.00 0.00 174.94 175.45 1pwv n LYS 530 N 6.19 0.65 -3.63 2.79 4.76 0.11 -4.88 118.16 124.15 1pwv n LYS 530 Ca 0.08 0.17 -0.11 0.00 -2.87 0.00 0.00 58.31 55.58 1pwv n LYS 530 Cb 0.47 -1.69 -0.07 0.00 -1.84 0.00 0.00 35.03 31.90 1pwv n LYS 530 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1pwv s ASP 531 N -5.82 -0.67 -0.34 4.39 3.68 -1.16 -5.00 116.67 111.75 1pwv s ASP 531 Ca -0.07 1.25 0.01 0.00 2.13 0.00 0.00 52.55 55.87 1pwv s ASP 531 Cb 0.07 1.27 0.11 0.00 -1.45 0.00 0.00 42.92 42.92 1pwv s ASP 531 CO 0.83 -0.21 0.11 -0.69 0.13 0.00 0.00 175.17 175.33 1pwv s VAL 532 N 0.54 1.35 0.11 1.11 1.01 -1.26 -1.44 120.40 121.82 1pwv s VAL 532 Ca -0.01 -1.85 0.05 0.00 0.00 0.00 0.00 61.98 60.18 1pwv s VAL 532 Cb -0.05 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.29 1pwv s VAL 532 CO -0.05 -0.69 -0.13 0.00 0.00 0.00 0.00 175.10 174.23 1pwv s GLN 533 N 1.21 0.96 -0.18 2.72 -2.07 -1.06 -4.97 119.66 116.27 1pwv s GLN 533 Ca 0.11 -1.20 -0.28 0.00 -1.82 0.00 0.00 55.36 52.18 1pwv s GLN 533 Cb -0.19 -0.79 -0.00 0.00 -1.09 0.00 0.00 33.01 30.94 1pwv s GLN 533 CO -0.17 0.15 0.97 0.42 -1.32 0.00 0.00 175.29 175.34 1pwv s ILE 534 N -2.17 4.76 0.51 3.63 1.01 -1.26 0.20 121.20 127.88 1pwv s ILE 534 Ca 0.07 1.93 0.01 0.00 0.00 0.00 0.00 60.65 62.66 1pwv s ILE 534 Cb -0.05 -4.27 -0.00 0.00 0.01 0.00 0.00 42.46 38.16 1pwv s ILE 534 CO 0.02 -0.07 0.03 0.27 0.00 0.00 0.00 174.94 175.19 1pwv s ILE 535 N 2.57 0.90 -0.17 2.92 -4.36 0.05 -4.37 121.20 118.75 1pwv s ILE 535 Ca 0.44 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 58.80 1pwv s ILE 535 Cb -0.16 -2.05 0.05 0.00 1.25 0.00 0.00 42.46 41.55 1pwv s ILE 535 CO 0.11 0.00 0.02 -0.75 0.24 0.00 0.00 174.94 174.56 1pwv s LYS 536 N -3.86 0.74 -0.06 0.37 2.20 -1.26 -1.75 119.74 116.12 1pwv s LYS 536 Ca 0.04 -0.35 0.04 0.00 -0.36 0.00 0.00 55.97 55.34 1pwv s LYS 536 Cb 0.00 -1.91 -0.00 0.00 -1.51 0.00 0.00 37.83 34.41 1pwv s LYS 536 CO 0.03 -0.56 -0.18 -1.14 -0.36 0.00 0.00 175.35 173.13 1pwv s GLN 537 N 1.85 2.04 -1.62 4.03 0.74 -0.00 -4.68 119.66 122.01 1pwv s GLN 537 Ca 0.00 -0.65 -0.16 0.00 0.05 0.00 0.00 55.36 54.60 1pwv s GLN 537 Cb -0.16 -1.70 0.12 0.00 1.10 0.00 0.00 33.01 32.37 1pwv s GLN 537 CO -0.07 0.22 0.84 0.43 -0.55 0.00 0.00 175.29 176.15 1pwv n SER 538 N 3.28 -3.67 -0.77 6.67 7.64 -1.26 -1.45 113.62 124.06 1pwv n SER 538 Ca -0.19 -0.93 -0.10 0.00 1.01 0.00 0.00 58.87 58.67 1pwv n SER 538 Cb 0.53 -3.20 -0.04 0.00 -1.01 0.00 0.00 64.21 60.49 1pwv n SER 538 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1pwv n GLU 539 N -4.49 -1.12 -4.38 1.43 -0.58 -1.26 -5.01 120.64 105.23 1pwv n GLU 539 Ca 0.04 0.81 -0.26 0.00 -0.42 0.00 0.00 57.16 57.32 1pwv n GLU 539 Cb 0.52 -4.89 -0.13 0.00 -0.57 0.00 0.00 31.44 26.36 1pwv n GLU 539 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1pwv s LYS 540 N -2.66 1.29 0.20 3.49 2.20 -0.53 -4.91 119.74 118.83 1pwv s LYS 540 Ca 0.00 -1.23 -0.13 0.00 -0.36 0.00 0.00 55.97 54.25 1pwv s LYS 540 Cb 0.00 -1.64 -0.07 0.00 -1.51 0.00 0.00 37.83 34.60 1pwv s LYS 540 CO 0.00 0.39 0.58 -1.21 -0.36 0.00 0.00 175.35 174.75 1pwv s GLU 541 N -1.90 3.92 0.07 4.03 2.02 0.39 -0.82 118.70 126.40 1pwv s GLU 541 Ca 0.10 0.44 -0.08 0.00 0.02 0.00 0.00 54.97 55.45 1pwv s GLU 541 Cb -0.10 -2.75 -0.01 0.00 0.10 0.00 0.00 34.13 31.37 1pwv s GLU 541 CO 0.05 0.37 0.16 0.71 0.02 0.00 0.00 175.26 176.57 1pwv s TYR 542 N -1.67 0.17 -0.29 1.61 1.51 -0.71 -4.87 117.35 113.10 1pwv s TYR 542 Ca 0.44 -0.58 -0.14 0.00 -1.01 0.00 0.00 57.07 55.78 1pwv s TYR 542 Cb -0.13 -0.09 -0.03 0.00 -0.11 0.00 0.00 41.96 41.60 1pwv s TYR 542 CO 0.20 -0.50 0.34 0.42 -1.11 0.00 0.00 175.55 174.90 1pwv s ILE 543 N -3.60 5.20 -0.04 2.71 1.01 0.27 -0.77 121.20 125.97 1pwv s ILE 543 Ca 0.03 0.38 -0.25 0.00 0.00 0.00 0.00 60.65 60.81 1pwv s ILE 543 Cb 0.04 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.78 1pwv s ILE 543 CO -0.09 0.12 0.77 -0.60 0.00 0.00 0.00 174.94 175.13 1pwv s ARG 544 N 2.01 4.47 -0.24 2.79 6.06 0.13 -0.37 118.95 133.79 1pwv s ARG 544 Ca 0.13 1.01 0.02 0.00 -2.50 0.00 0.00 55.73 54.39 1pwv s ARG 544 Cb -0.16 -3.45 0.05 0.00 0.06 0.00 0.00 34.95 31.46 1pwv s ARG 544 CO 0.11 0.05 -0.10 0.42 -2.50 0.00 0.00 175.30 173.27 1pwv s ILE 545 N 0.80 1.97 -0.27 4.11 1.01 -0.41 -2.56 121.20 125.85 1pwv s ILE 545 Ca 0.41 -1.43 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 1pwv s ILE 545 Cb -0.19 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.16 1pwv s ILE 545 CO 0.21 0.02 0.36 -1.81 0.00 0.00 0.00 174.94 173.72 1pwv s ASP 546 N 1.21 6.23 0.02 3.58 1.01 -0.52 0.04 116.67 128.23 1pwv s ASP 546 Ca -0.06 0.23 0.04 0.00 0.71 0.00 0.00 52.55 53.47 1pwv s ASP 546 Cb -0.19 -2.20 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 1pwv s ASP 546 CO -0.06 -0.18 -0.13 0.00 0.21 0.00 0.00 175.17 175.01 1pwv s ALA 547 N 2.04 1.07 -0.17 5.23 0.00 -0.15 0.03 121.76 129.81 1pwv s ALA 547 Ca 0.14 -0.71 -0.05 0.00 0.00 0.00 0.00 51.96 51.34 1pwv s ALA 547 Cb -0.16 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 1pwv s ALA 547 CO 0.10 0.21 -0.01 0.21 0.00 0.00 0.00 175.76 176.28 1pwv s LYS 548 N -0.88 3.73 0.29 0.00 2.20 -0.11 0.75 119.74 125.72 1pwv s LYS 548 Ca 0.02 -0.48 -0.29 0.00 -0.36 0.00 0.00 55.97 54.86 1pwv s LYS 548 Cb -0.07 -3.02 -0.10 0.00 -1.51 0.00 0.00 37.83 33.13 1pwv s LYS 548 CO 0.01 0.19 1.14 0.08 -0.36 0.00 0.00 175.35 176.41 1pwv s VAL 549 N 0.52 3.32 0.30 4.02 1.01 0.51 -0.85 120.40 129.23 1pwv s VAL 549 Ca -0.01 1.33 -0.06 0.00 0.00 0.00 0.00 61.98 63.24 1pwv s VAL 549 Cb -0.14 -3.85 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 1pwv s VAL 549 CO 0.02 0.32 0.46 0.68 0.00 0.00 0.00 175.10 176.57 1pwv s VAL 550 N -1.16 0.00 0.01 2.92 -7.23 0.30 -4.64 120.40 110.59 1pwv s VAL 550 Ca 0.45 -1.55 -0.30 0.00 -1.81 0.00 0.00 61.98 58.78 1pwv s VAL 550 Cb -0.34 -2.49 -0.08 0.00 0.56 0.00 0.00 36.38 34.04 1pwv s VAL 550 CO 0.44 0.00 1.85 -2.84 -0.31 0.00 0.00 175.10 174.23 1pwv s PRO 551 N -3.45 4.16 0.19 4.82 0.02 -1.26 -2.57 135.00 136.91 1pwv s PRO 551 Ca 0.28 2.46 -0.13 0.00 0.02 0.00 0.00 61.00 63.63 1pwv s PRO 551 Cb 0.00 -4.08 0.22 0.00 0.02 0.00 0.00 34.50 30.66 1pwv s PRO 551 CO 0.15 -0.91 1.67 -0.22 -0.33 0.00 0.00 177.00 177.37 1pwv h LYS 552 N 10.15 0.10 -1.26 5.54 3.64 -1.87 0.14 116.57 133.01 1pwv h LYS 552 Ca -0.46 -0.01 0.38 0.00 -1.27 0.00 0.00 60.65 59.30 1pwv h LYS 552 Cb 1.22 -0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 32.90 1pwv h LYS 552 CO 0.95 0.07 0.83 0.66 -2.27 0.00 0.00 179.45 179.68 1pwv h SER 553 N 0.11 0.27 -0.31 4.20 4.64 -1.91 0.82 113.55 121.36 1pwv h SER 553 Ca 0.27 0.10 -0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1pwv h SER 553 Cb 0.42 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 1pwv h SER 553 CO -0.46 -0.07 0.18 0.50 -0.87 0.00 0.00 176.83 176.10 1pwv h LYS 554 N 0.17 0.43 -0.38 4.77 3.64 -1.09 -1.75 116.57 122.36 1pwv h LYS 554 Ca 0.73 -0.05 -0.15 0.00 -1.27 0.00 0.00 60.65 59.91 1pwv h LYS 554 Cb 2.28 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 34.01 1pwv h LYS 554 CO -0.32 0.36 -0.37 0.82 -2.27 0.00 0.00 179.45 177.66 1pwv h ILE 555 N 0.39 1.27 0.01 2.00 5.03 0.58 -3.07 117.51 123.72 1pwv h ILE 555 Ca 0.11 -1.55 0.03 0.00 -0.12 0.00 0.00 64.86 63.33 1pwv h ILE 555 Cb 0.05 1.38 -0.06 0.00 -3.03 0.00 0.00 36.82 35.16 1pwv h ILE 555 CO -0.02 0.52 -0.45 0.44 -0.68 0.00 0.00 178.15 177.96 1pwv h ASP 556 N 0.74 -1.37 -0.09 1.72 3.45 -0.74 -0.97 116.42 119.16 1pwv h ASP 556 Ca 0.06 0.16 0.03 0.00 0.43 0.00 0.00 57.03 57.71 1pwv h ASP 556 Cb 0.96 0.53 -0.00 0.00 -0.56 0.00 0.00 39.33 40.25 1pwv h ASP 556 CO 0.09 -0.48 0.07 0.71 -1.57 0.00 0.00 179.24 178.06 1pwv h THR 557 N -0.61 0.84 0.34 0.35 1.35 -1.35 0.45 112.91 114.29 1pwv h THR 557 Ca 0.04 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.88 1pwv h THR 557 Cb 0.68 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 1pwv h THR 557 CO -0.32 0.00 -0.16 0.11 -0.25 0.00 0.00 175.52 174.89 1pwv h LYS 558 N 0.00 -0.44 -0.40 4.72 1.79 -1.13 0.21 116.57 121.32 1pwv h LYS 558 Ca 0.04 0.03 0.04 0.00 -2.18 0.00 0.00 60.65 58.58 1pwv h LYS 558 Cb 0.18 0.10 -0.04 0.00 -1.58 0.00 0.00 32.23 30.89 1pwv h LYS 558 CO -0.00 -0.25 0.18 0.82 -1.08 0.00 0.00 179.45 179.12 1pwv h ILE 559 N -0.53 0.94 -0.29 1.86 2.04 0.19 0.20 117.51 121.91 1pwv h ILE 559 Ca -0.05 -0.13 0.07 0.00 1.00 0.00 0.00 64.86 65.76 1pwv h ILE 559 Cb 0.40 0.54 -0.08 0.00 -0.74 0.00 0.00 36.82 36.94 1pwv h ILE 559 CO 0.08 0.07 -0.27 -0.61 0.00 0.00 0.00 178.15 177.41 1pwv h GLN 560 N 0.37 -0.25 -0.73 2.37 -0.00 0.20 0.06 115.11 117.13 1pwv h GLN 560 Ca 0.17 0.02 -0.01 0.00 -0.00 0.00 0.00 58.65 58.83 1pwv h GLN 560 Cb 0.11 0.06 -0.03 0.00 0.00 0.00 0.00 27.48 27.61 1pwv h GLN 560 CO -0.14 -0.17 0.43 0.93 0.00 0.00 0.00 178.83 179.88 1pwv h GLU 561 N -0.26 1.00 0.21 1.69 5.08 0.06 -2.59 114.58 119.77 1pwv h GLU 561 Ca 0.15 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1pwv h GLU 561 Cb 0.50 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1pwv h GLU 561 CO -0.44 0.72 -0.50 0.00 -1.00 0.00 0.00 179.01 177.79 1pwv h ALA 562 N 1.22 -1.02 -0.77 3.43 0.00 0.89 0.38 119.26 123.39 1pwv h ALA 562 Ca 0.26 -0.13 0.11 0.00 0.00 0.00 0.00 54.91 55.16 1pwv h ALA 562 Cb -0.01 0.83 -0.13 0.00 0.00 0.00 0.00 17.79 18.48 1pwv h ALA 562 CO -0.05 -1.12 -0.41 0.37 0.00 0.00 0.00 179.25 178.04 1pwv h GLN 563 N -0.78 -0.11 -0.52 0.00 4.15 -0.86 0.35 115.11 117.34 1pwv h GLN 563 Ca -0.02 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.50 1pwv h GLN 563 Cb 0.75 0.02 -0.07 0.00 0.21 0.00 0.00 27.48 28.39 1pwv h GLN 563 CO -0.21 -0.07 0.11 1.25 -1.93 0.00 0.00 178.83 177.98 1pwv h LEU 564 N -0.11 0.02 0.41 -2.39 5.85 -1.05 -2.34 115.31 115.70 1pwv h LEU 564 Ca 0.25 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 1pwv h LEU 564 Cb 0.56 0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.70 1pwv h LEU 564 CO -0.82 0.03 -0.28 -1.13 -0.34 0.00 0.00 178.44 175.90 1pwv h ASN 565 N 0.25 -0.73 -0.32 1.25 -0.73 0.18 -1.52 115.58 113.96 1pwv h ASN 565 Ca 0.26 0.05 0.09 0.00 1.87 0.00 0.00 56.30 58.57 1pwv h ASN 565 Cb 0.36 0.22 -0.01 0.00 0.27 0.00 0.00 38.32 39.16 1pwv h ASN 565 CO -0.34 -0.42 0.49 -0.29 -0.37 0.00 0.00 177.43 176.51 1pwv h ILE 566 N -0.66 0.22 0.21 2.57 2.10 -0.83 0.17 117.51 121.29 1pwv h ILE 566 Ca -0.05 0.00 -0.29 0.00 1.08 0.00 0.00 64.86 65.60 1pwv h ILE 566 Cb 0.54 0.58 0.03 0.00 -1.09 0.00 0.00 36.82 36.88 1pwv h ILE 566 CO 0.04 0.00 -1.29 0.78 -1.08 0.00 0.00 178.15 176.60 1pwv h ASN 567 N 0.00 0.70 -0.85 2.19 2.35 -1.10 -2.60 115.58 116.26 1pwv h ASN 567 Ca 0.15 -0.93 -0.02 0.00 -0.55 0.00 0.00 56.30 54.95 1pwv h ASN 567 Cb 1.13 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 39.23 1pwv h ASN 567 CO -0.00 1.62 0.46 1.56 -1.65 0.00 0.00 177.43 179.41 1pwv h GLN 568 N -0.04 1.19 0.59 0.81 4.20 0.32 -0.04 115.11 122.14 1pwv h GLN 568 Ca -0.23 -0.14 -0.03 0.00 0.06 0.00 0.00 58.65 58.31 1pwv h GLN 568 Cb 1.98 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 29.54 1pwv h GLN 568 CO 0.22 0.88 -0.28 1.49 -0.67 0.00 0.00 178.83 180.47 1pwv h GLU 569 N 1.19 -0.76 0.00 1.46 4.81 -1.22 -3.13 114.58 116.93 1pwv h GLU 569 Ca 0.30 0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.48 1pwv h GLU 569 Cb 0.04 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 1pwv h GLU 569 CO -0.05 -0.49 -0.47 -1.49 -0.73 0.00 0.00 179.01 175.79 1pwv h TRP 570 N -0.85 0.00 0.00 0.92 4.06 -1.44 -1.95 115.95 116.68 1pwv h TRP 570 Ca -0.08 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.86 1pwv h TRP 570 Cb 0.63 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.79 1pwv h TRP 570 CO -0.02 0.47 -0.06 -0.91 -3.56 0.00 0.00 178.44 174.35 1pwv h ASN 571 N 0.00 0.00 0.15 -3.49 -0.26 -1.03 0.20 115.58 111.15 1pwv h ASN 571 Ca -0.00 0.00 -0.36 0.00 -0.56 0.00 0.00 56.30 55.37 1pwv h ASN 571 Cb 1.04 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.29 1pwv h ASN 571 CO 0.06 0.06 -1.93 0.50 -1.06 0.00 0.00 177.43 175.06 1pwv h LYS 572 N 0.00 0.30 0.00 0.81 3.64 -1.43 0.10 116.57 119.98 1pwv h LYS 572 Ca -0.00 -0.51 -0.03 0.00 -1.27 0.00 0.00 60.65 58.84 1pwv h LYS 572 Cb 0.11 0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1pwv h LYS 572 CO 0.01 1.23 -0.15 0.00 -2.27 0.00 0.00 179.45 178.28 1pwv h ALA 573 N 0.10 1.31 -0.17 5.00 0.00 -0.89 -2.53 119.26 122.08 1pwv h ALA 573 Ca -0.40 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1pwv h ALA 573 Cb 2.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.82 1pwv h ALA 573 CO 0.11 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.82 1pwv n LEU 574 N -3.71 2.66 -3.50 0.00 4.77 0.66 -4.98 117.00 112.90 1pwv n LEU 574 Ca -0.02 -1.32 -0.24 0.00 -0.03 0.00 0.00 56.01 54.41 1pwv n LEU 574 Cb 0.26 -0.11 0.07 0.00 -2.33 0.00 0.00 43.42 41.32 1pwv n LEU 574 CO 0.31 0.55 0.22 0.61 -1.33 0.00 0.00 177.39 177.75 1pwv n GLY 575 N 0.92 -0.53 3.94 -0.72 0.00 -0.96 -4.92 105.19 102.93 1pwv n GLY 575 Ca 0.12 0.23 -0.24 0.00 0.00 0.00 0.00 46.02 46.13 1pwv n GLY 575 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1pwv s LEU 576 N -7.18 3.77 0.47 0.99 1.43 0.34 -5.03 118.68 113.48 1pwv s LEU 576 Ca 0.55 0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 53.91 1pwv s LEU 576 Cb -0.24 -3.39 -0.07 0.00 0.03 0.00 0.00 46.19 42.51 1pwv s LEU 576 CO 0.68 -0.54 1.42 -2.84 0.23 0.00 0.00 176.35 175.31 1pwv s PRO 577 N -4.52 3.55 0.40 1.29 0.02 -1.26 -4.70 135.00 129.77 1pwv s PRO 577 Ca 0.45 2.39 -0.27 0.00 0.02 0.00 0.00 61.00 63.60 1pwv s PRO 577 Cb -0.10 -2.56 -0.10 0.00 0.02 0.00 0.00 34.50 31.75 1pwv s PRO 577 CO 0.39 -0.92 1.36 1.17 -0.33 0.00 0.00 177.00 178.67 1pwv n LYS 578 N -0.39 2.21 -1.00 5.54 4.81 -1.26 -2.41 118.16 125.65 1pwv n LYS 578 Ca 0.06 0.78 -0.00 0.00 -0.87 0.00 0.00 58.31 58.28 1pwv n LYS 578 Cb 0.42 -2.48 -0.00 0.00 0.02 0.00 0.00 35.03 32.99 1pwv n LYS 578 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1pwv n TYR 579 N 0.07 0.00 -2.05 5.64 4.02 -1.26 -5.02 117.16 118.56 1pwv n TYR 579 Ca 0.05 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.57 1pwv n TYR 579 Cb 0.39 -0.20 0.02 0.00 -0.02 0.00 0.00 39.34 39.53 1pwv n TYR 579 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1pwv s THR 580 N -1.93 2.69 -0.63 -0.72 2.01 -1.01 -4.97 115.64 111.07 1pwv s THR 580 Ca 0.00 0.45 -0.00 0.00 0.31 0.00 0.00 61.69 62.45 1pwv s THR 580 Cb 0.00 -3.20 0.16 0.00 0.01 0.00 0.00 72.50 69.47 1pwv s THR 580 CO 0.00 -0.07 0.43 -0.54 -0.69 0.00 0.00 174.62 173.75 1pwv s LYS 581 N -3.16 2.47 -0.27 4.92 1.02 -1.26 -4.88 119.74 118.58 1pwv s LYS 581 Ca 0.74 -2.73 -0.15 0.00 0.02 0.00 0.00 55.97 53.85 1pwv s LYS 581 Cb -0.31 -3.61 -0.13 0.00 -0.52 0.00 0.00 37.83 33.26 1pwv s LYS 581 CO 0.35 -1.18 -0.26 -0.11 -0.92 0.00 0.00 175.35 173.23 1pwv n LEU 582 N 3.09 1.94 -4.88 3.17 7.94 -1.26 -4.81 117.00 122.20 1pwv n LEU 582 Ca 0.10 0.35 -0.34 0.00 -1.11 0.00 0.00 56.01 55.01 1pwv n LEU 582 Cb 0.36 -0.84 -0.05 0.00 0.53 0.00 0.00 43.42 43.41 1pwv n LEU 582 CO 0.33 0.51 0.06 -0.63 -1.11 0.00 0.00 177.39 176.55 1pwv s ILE 583 N -2.49 5.13 0.01 1.96 1.01 -1.26 0.06 121.20 125.61 1pwv s ILE 583 Ca -0.37 0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.62 1pwv s ILE 583 Cb 0.13 -3.63 -0.01 0.00 0.01 0.00 0.00 42.46 38.96 1pwv s ILE 583 CO 0.50 0.24 -0.04 -0.89 0.00 0.00 0.00 174.94 174.76 1pwv s THR 584 N -1.45 0.24 -0.24 2.92 2.01 0.27 -4.88 115.64 114.51 1pwv s THR 584 Ca 0.34 -0.42 0.01 0.00 0.31 0.00 0.00 61.69 61.93 1pwv s THR 584 Cb -0.13 -0.26 0.04 0.00 0.01 0.00 0.00 72.50 72.15 1pwv s THR 584 CO 0.19 -0.12 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.52 1pwv s PHE 585 N -0.55 3.09 -0.80 4.92 2.99 -1.26 -1.50 117.98 124.87 1pwv s PHE 585 Ca -0.04 -1.96 0.02 0.00 0.00 0.00 0.00 56.93 54.95 1pwv s PHE 585 Cb -0.04 -1.96 0.27 0.00 0.00 0.00 0.00 43.02 41.29 1pwv s PHE 585 CO -0.00 -0.83 1.02 -1.71 -0.00 0.00 0.00 175.22 173.71 1pwv n ASN 586 N 4.54 4.77 -4.74 1.36 2.85 -0.66 -5.00 115.26 118.38 1pwv n ASN 586 Ca -0.16 -3.44 -0.36 0.00 -0.11 0.00 0.00 54.58 50.50 1pwv n ASN 586 Cb 0.45 -0.89 -0.07 0.00 1.24 0.00 0.00 39.78 40.51 1pwv n ASN 586 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1pwv s VAL 587 N -2.65 5.37 0.00 3.44 1.01 -1.26 -2.88 120.40 123.43 1pwv s VAL 587 Ca 0.37 0.33 0.00 0.00 0.00 0.00 0.00 61.98 62.68 1pwv s VAL 587 Cb 0.12 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1pwv s VAL 587 CO 0.03 0.44 0.00 1.41 0.00 0.00 0.00 175.10 176.98 1pwv n HIS 588 N 3.40 0.00 -3.83 5.22 8.25 -1.26 -5.00 115.22 121.99 1pwv n HIS 588 Ca -0.15 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.29 1pwv n HIS 588 Cb 0.52 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.63 1pwv n HIS 588 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1pwv n ASN 589 N 0.00 1.69 0.00 0.41 4.13 -1.26 -3.56 115.26 116.68 1pwv n ASN 589 Ca 0.00 -1.15 0.00 0.00 1.68 0.00 0.00 54.58 55.11 1pwv n ASN 589 Cb 0.08 0.01 0.00 0.00 -1.54 0.00 0.00 39.78 38.34 1pwv n ASN 589 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1pwv n ARG 590 N -0.30 0.00 -2.52 3.52 5.12 0.45 -1.61 116.66 121.32 1pwv n ARG 590 Ca -0.01 0.15 -0.10 0.00 -1.93 0.00 0.00 57.85 55.96 1pwv n ARG 590 Cb 0.04 -1.52 0.04 0.00 -1.16 0.00 0.00 32.46 29.86 1pwv n ARG 590 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 1pwv n TYR 591 N -1.12 1.88 0.02 -1.55 9.36 -1.26 -4.60 117.16 119.88 1pwv n TYR 591 Ca 0.00 -2.25 -0.04 0.00 3.32 0.00 0.00 57.90 58.93 1pwv n TYR 591 Cb 0.02 -0.27 -0.02 0.00 -0.63 0.00 0.00 39.34 38.43 1pwv n TYR 591 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1pwv h ALA 592 N 2.48 -0.64 -1.06 2.98 0.00 -1.50 -2.92 119.26 118.61 1pwv h ALA 592 Ca 0.06 -0.02 0.28 0.00 0.00 0.00 0.00 54.91 55.23 1pwv h ALA 592 Cb 1.34 0.59 -0.11 0.00 0.00 0.00 0.00 17.79 19.62 1pwv h ALA 592 CO 0.44 -0.67 0.67 0.66 0.00 0.00 0.00 179.25 180.34 1pwv h SER 593 N -0.18 0.48 0.42 0.00 4.64 -1.62 0.10 113.55 117.40 1pwv h SER 593 Ca 0.00 0.11 -0.11 0.00 -0.47 0.00 0.00 61.79 61.32 1pwv h SER 593 Cb 0.18 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1pwv h SER 593 CO -0.08 0.05 -0.49 -1.13 -0.87 0.00 0.00 176.83 174.30 1pwv h ASN 594 N 0.40 0.09 -0.43 4.97 -0.73 -1.52 -0.43 115.58 117.93 1pwv h ASN 594 Ca 0.64 -0.04 -0.03 0.00 1.87 0.00 0.00 56.30 58.74 1pwv h ASN 594 Cb 1.57 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 40.12 1pwv h ASN 594 CO -0.37 0.57 0.16 0.40 -0.37 0.00 0.00 177.43 177.82 1pwv h ILE 595 N 0.07 1.21 0.03 2.57 1.08 -0.62 0.16 117.51 122.01 1pwv h ILE 595 Ca 0.00 -0.65 -0.00 0.00 -0.39 0.00 0.00 64.86 63.81 1pwv h ILE 595 Cb 0.89 0.84 0.00 0.00 -3.07 0.00 0.00 36.82 35.48 1pwv h ILE 595 CO 0.07 0.24 -0.01 0.58 -0.69 0.00 0.00 178.15 178.33 1pwv h VAL 596 N 0.55 1.24 -0.52 1.67 2.07 -1.24 -2.85 116.25 117.17 1pwv h VAL 596 Ca 0.14 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 1pwv h VAL 596 Cb 0.22 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.79 1pwv h VAL 596 CO -0.01 0.22 0.31 -0.33 0.02 0.00 0.00 177.57 177.79 1pwv h GLU 597 N -0.43 0.70 -0.82 1.57 4.39 -1.06 -2.57 114.58 116.36 1pwv h GLU 597 Ca -0.00 -0.06 0.12 0.00 0.34 0.00 0.00 59.36 59.76 1pwv h GLU 597 Cb 0.40 -0.15 -0.08 0.00 -0.10 0.00 0.00 28.75 28.82 1pwv h GLU 597 CO 0.01 0.50 0.43 0.66 -1.16 0.00 0.00 179.01 179.45 1pwv h SER 598 N 0.69 0.56 -1.11 1.42 4.64 -0.98 -0.64 113.55 118.13 1pwv h SER 598 Ca 0.19 0.07 0.32 0.00 -0.47 0.00 0.00 61.79 61.90 1pwv h SER 598 Cb -0.02 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.01 1pwv h SER 598 CO -0.04 0.27 0.86 0.00 -0.87 0.00 0.00 176.83 177.06 1pwv h ALA 599 N 1.51 3.01 0.08 5.18 0.00 -1.21 0.41 119.26 128.25 1pwv h ALA 599 Ca 0.43 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 55.13 1pwv h ALA 599 Cb 0.53 0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.42 1pwv h ALA 599 CO -0.32 -1.43 -0.70 1.88 0.00 0.00 0.00 179.25 178.69 1pwv h TYR 600 N 0.00 0.55 -0.47 0.00 -1.99 -1.20 -2.82 116.97 111.04 1pwv h TYR 600 Ca 0.53 -0.36 -0.05 0.00 2.00 0.00 0.00 58.73 60.85 1pwv h TYR 600 Cb 2.24 -0.04 -0.02 0.00 2.00 0.00 0.00 36.73 40.91 1pwv h TYR 600 CO 0.00 1.23 0.09 -0.07 -0.00 0.00 0.00 178.16 179.41 1pwv h LEU 601 N -0.29 0.73 -0.23 3.88 3.38 -0.33 -2.12 115.31 120.32 1pwv h LEU 601 Ca -0.11 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.63 1pwv h LEU 601 Cb 1.48 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 42.01 1pwv h LEU 601 CO 0.13 0.80 0.08 0.40 0.09 0.00 0.00 178.44 179.94 1pwv h ILE 602 N 0.64 0.94 -0.34 1.22 2.04 -0.50 -1.40 117.51 120.10 1pwv h ILE 602 Ca 0.14 -0.06 -0.03 0.00 1.00 0.00 0.00 64.86 65.91 1pwv h ILE 602 Cb 0.37 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1pwv h ILE 602 CO 0.01 0.03 0.08 -0.07 0.00 0.00 0.00 178.15 178.20 1pwv h LEU 603 N 0.18 0.45 -0.54 1.44 3.38 -1.38 -1.63 115.31 117.22 1pwv h LEU 603 Ca 0.10 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1pwv h LEU 603 Cb 0.07 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 1pwv h LEU 603 CO -0.11 0.46 -0.00 0.78 0.09 0.00 0.00 178.44 179.66 1pwv h ASN 604 N 0.49 0.93 0.37 -0.43 2.35 -0.82 0.12 115.58 118.59 1pwv h ASN 604 Ca 0.12 -0.31 -0.00 0.00 -0.55 0.00 0.00 56.30 55.55 1pwv h ASN 604 Cb 0.19 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.29 1pwv h ASN 604 CO -0.00 1.01 -0.38 -0.33 -1.65 0.00 0.00 177.43 176.08 1pwv h GLU 605 N 0.82 -0.74 -0.82 0.81 4.39 -0.84 0.38 114.58 118.58 1pwv h GLU 605 Ca 0.15 0.05 0.20 0.00 0.34 0.00 0.00 59.36 60.10 1pwv h GLU 605 Cb 0.54 0.17 -0.14 0.00 -0.10 0.00 0.00 28.75 29.21 1pwv h GLU 605 CO 0.03 -0.49 0.03 2.35 -1.16 0.00 0.00 179.01 179.76 1pwv h TRP 606 N -0.77 -0.01 -0.14 4.33 7.01 -1.01 -1.62 115.95 123.74 1pwv h TRP 606 Ca -0.03 0.06 -0.22 0.00 2.11 0.00 0.00 58.89 60.81 1pwv h TRP 606 Cb 0.69 0.14 0.01 0.00 -2.10 0.00 0.00 29.16 27.90 1pwv h TRP 606 CO -0.22 -0.28 -0.78 -0.22 -2.79 0.00 0.00 178.44 174.16 1pwv h LYS 607 N 0.10 0.77 -1.92 2.65 1.63 -0.12 -2.77 116.57 116.91 1pwv h LYS 607 Ca 0.47 -0.65 -0.41 0.00 -0.85 0.00 0.00 60.65 59.21 1pwv h LYS 607 Cb 0.86 0.14 -0.15 0.00 -0.60 0.00 0.00 32.23 32.48 1pwv h LYS 607 CO -0.72 1.25 0.25 0.09 -3.45 0.00 0.00 179.45 176.87 1pwv n ASN 608 N -3.96 6.24 0.00 4.20 5.03 0.13 -3.84 115.26 123.06 1pwv n ASN 608 Ca -0.08 -3.04 0.00 0.00 0.87 0.00 0.00 54.58 52.33 1pwv n ASN 608 Cb 0.75 -1.23 0.00 0.00 -1.02 0.00 0.00 39.78 38.27 1pwv n ASN 608 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1pwv n ASN 609 N 1.08 0.00 -4.43 6.41 3.02 -1.09 -4.90 115.26 115.35 1pwv n ASN 609 Ca 0.44 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.68 1pwv n ASN 609 Cb 0.62 0.00 -0.13 0.00 -0.61 0.00 0.00 39.78 39.65 1pwv n ASN 609 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1pwv s ILE 610 N -0.61 2.71 -0.23 2.41 1.01 -1.04 -4.82 121.20 120.63 1pwv s ILE 610 Ca 0.00 -1.07 -0.40 0.00 0.00 0.00 0.00 60.65 59.18 1pwv s ILE 610 Cb 0.00 -2.09 -0.16 0.00 0.01 0.00 0.00 42.46 40.22 1pwv s ILE 610 CO 0.00 0.44 1.70 1.67 0.00 0.00 0.00 174.94 178.75 1pwv n GLN 611 N 1.89 1.19 -0.34 2.79 0.00 -1.26 -4.80 117.38 116.85 1pwv n GLN 611 Ca -0.16 0.44 0.24 0.00 -0.00 0.00 0.00 57.00 57.51 1pwv n GLN 611 Cb 0.52 -2.12 0.52 0.00 0.00 0.00 0.00 30.24 29.16 1pwv n GLN 611 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 1pwv h SER 612 N 6.98 0.43 0.17 1.69 0.87 -1.97 0.20 113.55 121.92 1pwv h SER 612 Ca -0.47 0.09 -0.12 0.00 -1.23 0.00 0.00 61.79 60.07 1pwv h SER 612 Cb 1.32 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.30 1pwv h SER 612 CO 0.94 0.05 -0.43 -0.78 -0.53 0.00 0.00 176.83 176.08 1pwv h ASP 613 N 0.36 0.34 0.06 6.23 -0.00 -1.99 -2.12 116.42 119.30 1pwv h ASP 613 Ca 0.63 -0.15 -0.00 0.00 -0.00 0.00 0.00 57.03 57.50 1pwv h ASP 613 Cb 1.63 -0.10 0.00 0.00 -0.00 0.00 0.00 39.33 40.87 1pwv h ASP 613 CO -0.32 0.73 -0.03 0.25 -0.00 0.00 0.00 179.24 179.87 1pwv h LEU 614 N 0.27 -0.07 -0.76 2.28 5.85 -0.99 -2.03 115.31 119.85 1pwv h LEU 614 Ca 0.02 -0.46 0.16 0.00 0.84 0.00 0.00 57.88 58.45 1pwv h LEU 614 Cb 0.87 0.02 -0.14 0.00 0.37 0.00 0.00 40.66 41.78 1pwv h LEU 614 CO 0.07 0.45 -0.11 0.40 -0.34 0.00 0.00 178.44 178.91 1pwv h ILE 615 N -0.61 0.27 0.00 4.05 1.08 -1.26 -0.20 117.51 120.84 1pwv h ILE 615 Ca -0.01 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.45 1pwv h ILE 615 Cb 0.52 0.23 0.00 0.00 -3.07 0.00 0.00 36.82 34.50 1pwv h ILE 615 CO 0.01 0.01 0.00 0.29 -0.69 0.00 0.00 178.15 177.77 1pwv n LYS 616 N -5.44 0.00 -0.27 2.37 4.01 -0.80 -2.34 118.16 115.68 1pwv n LYS 616 Ca 0.12 0.08 -0.01 0.00 -0.51 0.00 0.00 58.31 57.99 1pwv n LYS 616 Cb 0.44 -1.06 0.02 0.00 -0.51 0.00 0.00 35.03 33.92 1pwv n LYS 616 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1pwv n LYS 617 N -0.74 -0.18 -0.03 1.97 4.76 -0.77 -0.97 118.16 122.21 1pwv n LYS 617 Ca 0.00 1.08 -0.11 0.00 -2.87 0.00 0.00 58.31 56.41 1pwv n LYS 617 Cb 0.00 -1.60 -0.04 0.00 -1.84 0.00 0.00 35.03 31.55 1pwv n LYS 617 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1pwv h VAL 618 N 0.00 1.06 -0.69 -0.18 2.07 -1.14 -3.04 116.25 114.33 1pwv h VAL 618 Ca 0.23 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.60 1pwv h VAL 618 Cb 0.41 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1pwv h VAL 618 CO -0.69 0.06 0.45 0.74 0.02 0.00 0.00 177.57 178.14 1pwv h THR 619 N 0.18 1.18 -0.92 2.57 2.02 -0.65 -1.81 112.91 115.48 1pwv h THR 619 Ca 0.05 -0.35 0.09 0.00 0.77 0.00 0.00 66.41 66.98 1pwv h THR 619 Cb 0.02 0.19 -0.07 0.00 -1.74 0.00 0.00 68.15 66.54 1pwv h THR 619 CO -0.01 0.18 0.60 0.78 0.37 0.00 0.00 175.52 177.43 1pwv h ASN 620 N 0.93 0.87 0.49 4.18 2.35 -1.34 0.70 115.58 123.75 1pwv h ASN 620 Ca 0.25 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 56.00 1pwv h ASN 620 Cb -0.09 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.12 1pwv h ASN 620 CO -0.05 0.52 -0.30 0.22 -1.65 0.00 0.00 177.43 176.17 1pwv h TYR 621 N 0.96 -0.78 -0.83 1.19 3.20 -1.24 0.63 116.97 120.10 1pwv h TYR 621 Ca 0.42 -0.01 0.11 0.00 3.14 0.00 0.00 58.73 62.40 1pwv h TYR 621 Cb 0.35 0.28 -0.08 0.00 1.54 0.00 0.00 36.73 38.82 1pwv h TYR 621 CO -0.00 -0.46 0.46 -0.07 -1.64 0.00 0.00 178.16 176.45 1pwv h LEU 622 N -0.75 0.62 -0.32 2.82 3.38 -0.28 -1.64 115.31 119.13 1pwv h LEU 622 Ca -0.06 0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 1pwv h LEU 622 Cb 0.61 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.31 1pwv h LEU 622 CO 0.06 0.32 -0.24 0.58 0.09 0.00 0.00 178.44 179.25 1pwv h VAL 623 N 0.72 1.29 -0.67 1.22 2.07 0.81 0.22 116.25 121.91 1pwv h VAL 623 Ca 0.42 -1.39 0.19 0.00 0.82 0.00 0.00 66.70 66.74 1pwv h VAL 623 Cb 0.48 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1pwv h VAL 623 CO -0.29 0.45 0.57 0.44 0.02 0.00 0.00 177.57 178.76 1pwv h ASP 624 N 0.50 0.00 -0.82 0.57 3.32 0.12 0.99 116.42 121.10 1pwv h ASP 624 Ca 0.06 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.78 1pwv h ASP 624 Cb 0.80 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.16 1pwv h ASP 624 CO 0.06 0.00 0.40 0.61 -1.72 0.00 0.00 179.24 178.60 1pwv n GLY 625 N -1.62 4.02 4.04 2.75 0.00 -1.05 -4.91 105.19 108.43 1pwv n GLY 625 Ca 0.13 -1.04 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 1pwv n GLY 625 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1pwv n ASN 626 N -0.56 -2.96 -4.54 1.61 5.15 0.34 -4.71 115.26 109.59 1pwv n ASN 626 Ca 0.48 -0.93 -0.29 0.00 -0.60 0.00 0.00 54.58 53.24 1pwv n ASN 626 Cb 1.49 -3.25 0.14 0.00 -0.53 0.00 0.00 39.78 37.63 1pwv n ASN 626 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1pwv s GLY 627 N -3.61 1.65 0.02 8.20 0.00 0.75 -4.97 107.32 109.36 1pwv s GLY 627 Ca 0.51 -0.82 -0.07 0.00 0.00 0.00 0.00 44.72 44.34 1pwv s GLY 627 CO 0.88 -0.19 0.13 0.50 0.00 0.00 0.00 173.10 174.42 1pwv s ARG 628 N -5.59 0.54 -0.36 2.90 1.81 -1.25 -4.66 118.95 112.35 1pwv s ARG 628 Ca 0.67 -0.55 -0.09 0.00 -1.72 0.00 0.00 55.73 54.04 1pwv s ARG 628 Cb -0.10 0.22 0.04 0.00 -0.45 0.00 0.00 34.95 34.66 1pwv s ARG 628 CO 0.52 -0.14 0.16 -0.06 -0.68 0.00 0.00 175.30 175.10 1pwv s PHE 629 N -1.95 3.25 -0.34 -0.53 2.99 0.11 -1.05 117.98 120.46 1pwv s PHE 629 Ca -0.10 -1.21 -0.09 0.00 0.00 0.00 0.00 56.93 55.53 1pwv s PHE 629 Cb -0.05 -2.38 0.02 0.00 0.00 0.00 0.00 43.02 40.62 1pwv s PHE 629 CO -0.01 -0.70 0.15 0.08 -0.00 0.00 0.00 175.22 174.74 1pwv s VAL 630 N 1.48 4.29 -0.36 -0.44 1.01 0.09 -0.57 120.40 125.91 1pwv s VAL 630 Ca 0.00 -0.81 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 1pwv s VAL 630 Cb -0.19 -3.33 -0.01 0.00 0.00 0.00 0.00 36.38 32.85 1pwv s VAL 630 CO 0.05 -0.11 0.27 -0.36 0.00 0.00 0.00 175.10 174.95 1pwv s PHE 631 N 1.52 3.23 0.22 5.22 0.40 -0.56 -0.98 117.98 127.03 1pwv s PHE 631 Ca 0.02 -0.26 0.03 0.00 -0.60 0.00 0.00 56.93 56.12 1pwv s PHE 631 Cb -0.18 -2.53 -0.05 0.00 0.51 0.00 0.00 43.02 40.76 1pwv s PHE 631 CO 0.05 -0.42 0.00 -0.08 0.70 0.00 0.00 175.22 175.47 1pwv s THR 632 N 1.76 0.95 -0.06 0.64 -1.32 -0.76 -1.65 115.64 115.20 1pwv s THR 632 Ca 0.07 -2.02 0.09 0.00 -1.21 0.00 0.00 61.69 58.62 1pwv s THR 632 Cb -0.18 -2.33 0.14 0.00 -1.51 0.00 0.00 72.50 68.63 1pwv s THR 632 CO 0.11 -0.33 1.03 -0.90 -2.21 0.00 0.00 174.62 172.32 1pwv n ASP 633 N -0.39 1.72 -4.45 8.08 5.75 -1.14 -1.88 116.55 124.23 1pwv n ASP 633 Ca -0.05 -2.46 -0.29 0.00 -0.01 0.00 0.00 54.79 51.97 1pwv n ASP 633 Cb 0.64 -0.24 -0.12 0.00 -1.03 0.00 0.00 41.12 40.36 1pwv n ASP 633 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1pwv s ILE 634 N -1.71 2.64 0.05 2.12 -4.36 -1.26 -4.74 121.20 113.93 1pwv s ILE 634 Ca 0.16 -1.53 -0.37 0.00 -0.26 0.00 0.00 60.65 58.65 1pwv s ILE 634 Cb 0.14 -2.18 -0.16 0.00 1.25 0.00 0.00 42.46 41.51 1pwv s ILE 634 CO 0.01 0.14 1.44 0.35 0.24 0.00 0.00 174.94 177.12 1pwv n THR 635 N 0.97 0.05 -0.47 8.37 -2.24 -0.84 -4.84 114.28 115.28 1pwv n THR 635 Ca -0.16 -0.01 0.42 0.00 -2.27 0.00 0.00 64.05 62.03 1pwv n THR 635 Cb 0.53 -1.01 0.77 0.00 -2.10 0.00 0.00 70.33 68.52 1pwv n THR 635 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1pwv h LEU 636 N 5.22 0.00 0.00 3.22 4.07 -1.88 0.96 115.31 126.90 1pwv h LEU 636 Ca -0.47 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.49 1pwv h LEU 636 Cb 1.32 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.06 1pwv h LEU 636 CO 0.82 0.00 0.00 -2.65 -1.08 0.00 0.00 178.44 175.53 1pwv n PRO 637 N -4.03 0.24 -0.47 1.13 -0.02 -1.23 -2.37 135.00 128.25 1pwv n PRO 637 Ca 0.33 0.13 0.08 0.00 -2.02 0.00 0.00 63.50 62.02 1pwv n PRO 637 Cb 1.56 -1.50 0.27 0.00 -0.02 0.00 0.00 33.50 33.81 1pwv n PRO 637 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1pwv n ASN 638 N -1.26 4.03 -4.38 2.55 4.13 0.33 -4.62 115.26 116.04 1pwv n ASN 638 Ca 0.07 -2.78 -0.41 0.00 1.68 0.00 0.00 54.58 53.15 1pwv n ASN 638 Cb 0.11 -0.51 -0.11 0.00 -1.54 0.00 0.00 39.78 37.73 1pwv n ASN 638 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1pwv s ILE 639 N -2.42 4.61 0.30 2.41 1.01 -1.00 -4.97 121.20 121.14 1pwv s ILE 639 Ca 0.41 -0.87 0.11 0.00 0.00 0.00 0.00 60.65 60.30 1pwv s ILE 639 Cb 0.31 -3.59 0.34 0.00 0.01 0.00 0.00 42.46 39.53 1pwv s ILE 639 CO 0.12 -0.25 1.39 0.00 0.00 0.00 0.00 174.94 176.20 1pwv n ALA 640 N 5.01 0.69 0.30 9.38 0.00 -1.26 0.17 120.51 134.80 1pwv n ALA 640 Ca -0.12 0.92 0.11 0.00 0.00 0.00 0.00 53.44 54.36 1pwv n ALA 640 Cb 0.46 -0.80 0.60 0.00 0.00 0.00 0.00 19.45 19.71 1pwv n ALA 640 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1pwv h GLU 641 N 0.00 0.00 0.00 0.00 3.07 -1.95 -0.15 114.58 115.56 1pwv h GLU 641 Ca 0.65 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.50 1pwv h GLU 641 Cb 1.57 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 29.48 1pwv h GLU 641 CO -0.75 0.00 -0.81 0.94 -1.40 0.00 0.00 179.01 176.99 1pwv n GLN 642 N -2.66 0.42 0.18 2.33 7.27 0.45 -4.67 117.38 120.70 1pwv n GLN 642 Ca -0.01 0.17 0.04 0.00 0.07 0.00 0.00 57.00 57.26 1pwv n GLN 642 Cb 0.47 -1.24 0.46 0.00 2.41 0.00 0.00 30.24 32.34 1pwv n GLN 642 CO 0.00 0.00 0.00 0.10 0.07 0.00 0.00 177.06 177.23 1pwv h TYR 643 N -0.80 0.11 0.00 3.69 -0.00 -1.12 -2.29 116.97 116.56 1pwv h TYR 643 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 58.73 58.71 1pwv h TYR 643 Cb 0.80 -0.03 0.00 0.00 0.00 0.00 0.00 36.73 37.50 1pwv h TYR 643 CO -0.34 0.26 0.00 0.25 -0.00 0.00 0.00 178.16 178.33 1pwv n THR 644 N -4.31 0.00 -1.05 -0.90 -2.24 -0.10 -1.83 114.28 103.86 1pwv n THR 644 Ca -0.02 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.82 1pwv n THR 644 Cb 0.25 -0.63 0.08 0.00 -2.10 0.00 0.00 70.33 67.93 1pwv n THR 644 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1pwv n HIS 645 N -0.90 0.00 -3.46 4.78 8.25 -0.86 -5.04 115.22 117.97 1pwv n HIS 645 Ca 0.11 -0.67 -0.28 0.00 -0.26 0.00 0.00 57.72 56.62 1pwv n HIS 645 Cb 0.05 -0.11 -0.03 0.00 1.12 0.00 0.00 29.99 31.02 1pwv n HIS 645 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1pwv s GLN 646 N -1.85 3.58 -0.22 -0.41 -0.21 -0.76 -5.01 119.66 114.78 1pwv s GLN 646 Ca 0.19 -0.15 -0.14 0.00 0.02 0.00 0.00 55.36 55.27 1pwv s GLN 646 Cb 0.16 -2.71 -0.18 0.00 1.00 0.00 0.00 33.01 31.28 1pwv s GLN 646 CO 0.02 0.27 0.02 -0.25 -2.12 0.00 0.00 175.29 173.22 1pwv n ASP 647 N -0.94 1.95 -4.21 5.90 8.00 -1.26 -4.96 116.55 121.02 1pwv n ASP 647 Ca -0.03 0.30 -0.23 0.00 0.71 0.00 0.00 54.79 55.54 1pwv n ASP 647 Cb 0.54 -0.85 -0.13 0.00 -0.02 0.00 0.00 41.12 40.66 1pwv n ASP 647 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1pwv s GLU 648 N -2.46 1.13 0.14 -1.24 0.41 -1.26 -5.05 118.70 110.37 1pwv s GLU 648 Ca -0.32 -0.93 -0.21 0.00 -0.41 0.00 0.00 54.97 53.11 1pwv s GLU 648 Cb 0.09 -1.23 -0.00 0.00 -1.78 0.00 0.00 34.13 31.21 1pwv s GLU 648 CO 0.59 0.30 1.67 0.82 -0.49 0.00 0.00 175.26 178.15 1pwv h ILE 649 N 4.34 0.60 0.00 -1.63 1.08 -1.93 -0.98 117.51 119.00 1pwv h ILE 649 Ca -0.42 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.05 1pwv h ILE 649 Cb 1.17 0.60 0.00 0.00 -3.07 0.00 0.00 36.82 35.53 1pwv h ILE 649 CO 0.43 0.00 0.04 0.00 -0.69 0.00 0.00 178.15 177.93 1pwv n TYR 650 N -5.29 0.00 1.46 1.37 0.18 -1.26 -1.53 117.16 112.08 1pwv n TYR 650 Ca -0.02 0.00 0.14 0.00 1.88 0.00 0.00 57.90 59.90 1pwv n TYR 650 Cb 0.21 -0.19 0.65 0.00 -0.38 0.00 0.00 39.34 39.63 1pwv n TYR 650 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1pwv n GLU 651 N -1.14 0.72 -0.79 -3.48 1.02 -0.37 -4.71 120.64 111.89 1pwv n GLU 651 Ca 0.00 -0.21 -0.33 0.00 -0.02 0.00 0.00 57.16 56.59 1pwv n GLU 651 Cb 0.04 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.09 1pwv n GLU 651 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1pwv n GLN 652 N -0.95 -0.57 -3.80 3.49 10.64 -0.58 -5.06 117.38 120.55 1pwv n GLN 652 Ca 0.15 -0.13 -0.13 0.00 -1.83 0.00 0.00 57.00 55.06 1pwv n GLN 652 Cb 0.26 -1.72 -0.13 0.00 -0.86 0.00 0.00 30.24 27.79 1pwv n GLN 652 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 1pwv s VAL 653 N -2.31 -0.01 -0.18 -0.39 1.01 -1.26 -5.08 120.40 112.17 1pwv s VAL 653 Ca 0.55 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.56 1pwv s VAL 653 Cb -0.18 -0.24 0.05 0.00 0.00 0.00 0.00 36.38 36.01 1pwv s VAL 653 CO 0.69 0.02 -0.02 -2.28 0.00 0.00 0.00 175.10 173.51 1pwv s HIS 654 N 0.40 1.56 0.13 5.22 5.04 -1.26 -3.47 115.29 122.91 1pwv s HIS 654 Ca -0.03 -1.09 0.02 0.00 -1.54 0.00 0.00 55.06 52.42 1pwv s HIS 654 Cb -0.04 -1.24 -0.01 0.00 0.04 0.00 0.00 32.58 31.33 1pwv s HIS 654 CO -0.02 -0.63 0.13 -1.13 -2.34 0.00 0.00 174.74 170.76 1pwv n SER 655 N 4.91 -0.35 -0.07 9.88 3.41 -1.26 -5.02 113.62 125.12 1pwv n SER 655 Ca -0.11 -1.82 -0.15 0.00 -0.26 0.00 0.00 58.87 56.53 1pwv n SER 655 Cb 0.47 0.75 -0.05 0.00 -0.26 0.00 0.00 64.21 65.12 1pwv n SER 655 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1pwv h LYS 656 N 0.00 0.75 -4.80 4.33 1.63 -1.93 -3.41 116.57 113.15 1pwv h LYS 656 Ca -0.10 -0.48 -0.31 0.00 -0.85 0.00 0.00 60.65 58.92 1pwv h LYS 656 Cb 0.47 0.06 -0.15 0.00 -0.60 0.00 0.00 32.23 32.01 1pwv h LYS 656 CO 0.14 1.10 -0.63 0.20 -3.45 0.00 0.00 179.45 176.81 1pwv s GLY 657 N -3.86 1.49 -0.27 5.01 0.00 -1.26 -0.74 107.32 107.69 1pwv s GLY 657 Ca -0.12 -1.74 -0.25 0.00 0.00 0.00 0.00 44.72 42.62 1pwv s GLY 657 CO 0.86 -1.54 0.94 -2.27 0.00 0.00 0.00 173.10 171.09 1pwv s LEU 658 N -3.23 -0.53 -0.22 0.66 2.96 -0.69 -4.98 118.68 112.64 1pwv s LEU 658 Ca 0.33 1.01 0.02 0.00 -0.22 0.00 0.00 54.13 55.26 1pwv s LEU 658 Cb 0.07 2.05 0.04 0.00 0.50 0.00 0.00 46.19 48.85 1pwv s LEU 658 CO 0.10 -0.19 -0.14 -0.47 -1.32 0.00 0.00 176.35 174.32 1pwv s TYR 659 N 0.20 3.02 -0.43 5.38 5.04 -1.26 -0.40 117.35 128.90 1pwv s TYR 659 Ca 0.02 -2.02 -0.15 0.00 -2.44 0.00 0.00 57.07 52.48 1pwv s TYR 659 Cb -0.05 -1.91 0.03 0.00 0.35 0.00 0.00 41.96 40.39 1pwv s TYR 659 CO -0.04 -0.84 0.33 0.08 -1.34 0.00 0.00 175.55 173.74 1pwv s VAL 660 N 1.19 5.25 0.13 3.14 1.01 -0.92 -4.96 120.40 125.24 1pwv s VAL 660 Ca -0.03 -0.76 -0.19 0.00 0.00 0.00 0.00 61.98 61.01 1pwv s VAL 660 Cb -0.17 -3.99 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 1pwv s VAL 660 CO -0.08 -0.39 1.78 -0.65 0.00 0.00 0.00 175.10 175.76 1pwv h PRO 661 N 8.67 0.33 0.00 2.72 0.11 -1.95 -1.05 132.00 140.83 1pwv h PRO 661 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1pwv h PRO 661 Cb 1.12 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1pwv h PRO 661 CO 0.77 0.22 0.08 0.93 -0.21 0.00 0.00 178.00 179.79 1pwv h GLU 662 N 0.34 0.00 0.00 1.05 3.07 -1.94 -0.58 114.58 116.51 1pwv h GLU 662 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1pwv h GLU 662 Cb -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1pwv h GLU 662 CO -0.03 0.00 -0.19 -1.13 -1.40 0.00 0.00 179.01 176.26 1pwv n SER 663 N -2.37 1.26 -3.13 1.42 3.41 -1.01 -5.01 113.62 108.20 1pwv n SER 663 Ca -0.02 -2.44 -0.19 0.00 -0.26 0.00 0.00 58.87 55.97 1pwv n SER 663 Cb 0.12 -0.28 -0.04 0.00 -0.26 0.00 0.00 64.21 63.75 1pwv n SER 663 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1pwv n ARG 664 N -0.71 -0.90 -4.14 4.33 1.74 -0.23 -4.26 116.66 112.50 1pwv n ARG 664 Ca 0.07 0.06 -0.16 0.00 -0.77 0.00 0.00 57.85 57.05 1pwv n ARG 664 Cb 0.62 -2.12 -0.12 0.00 -1.02 0.00 0.00 32.46 29.82 1pwv n ARG 664 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1pwv s SER 665 N -2.65 1.38 -0.14 0.55 1.04 -1.09 -3.83 113.70 108.98 1pwv s SER 665 Ca 0.27 -0.59 -0.07 0.00 0.48 0.00 0.00 55.95 56.04 1pwv s SER 665 Cb -0.16 -0.02 -0.04 0.00 0.10 0.00 0.00 66.02 65.90 1pwv s SER 665 CO 0.50 -0.12 0.11 -0.63 0.98 0.00 0.00 173.24 174.08 1pwv s ILE 666 N -1.30 5.26 0.09 -1.02 1.01 -0.21 -2.17 121.20 122.86 1pwv s ILE 666 Ca -0.05 0.12 0.09 0.00 0.00 0.00 0.00 60.65 60.82 1pwv s ILE 666 Cb -0.10 -3.31 -0.04 0.00 0.01 0.00 0.00 42.46 39.02 1pwv s ILE 666 CO 0.02 0.56 -0.22 -0.76 0.00 0.00 0.00 174.94 174.54 1pwv s LEU 667 N -0.56 2.47 -0.09 2.97 1.43 0.46 -0.73 118.68 124.63 1pwv s LEU 667 Ca 0.12 -0.59 -0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1pwv s LEU 667 Cb -0.12 -1.40 0.04 0.00 0.03 0.00 0.00 46.19 44.75 1pwv s LEU 667 CO 0.02 0.21 0.10 -0.22 0.23 0.00 0.00 176.35 176.69 1pwv s LEU 668 N -1.80 0.13 -0.07 1.79 2.96 -0.15 -1.71 118.68 119.84 1pwv s LEU 668 Ca 0.15 -0.06 -0.19 0.00 -0.22 0.00 0.00 54.13 53.81 1pwv s LEU 668 Cb -0.10 -0.05 -0.05 0.00 0.50 0.00 0.00 46.19 46.49 1pwv s LEU 668 CO 0.06 -0.28 0.52 -2.28 -1.32 0.00 0.00 176.35 173.05 1pwv s HIS 669 N 2.20 3.59 0.00 5.38 5.65 0.08 -1.82 115.29 130.37 1pwv s HIS 669 Ca 0.04 1.02 0.00 0.00 0.25 0.00 0.00 55.06 56.37 1pwv s HIS 669 Cb -0.13 -2.56 0.00 0.00 -1.18 0.00 0.00 32.58 28.71 1pwv s HIS 669 CO -0.06 0.27 0.02 0.41 -0.65 0.00 0.00 174.74 174.73 1pwv n GLY 670 N 2.85 -0.43 0.21 1.59 0.00 -0.79 -4.41 105.19 104.22 1pwv n GLY 670 Ca -0.07 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.11 1pwv n GLY 670 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1pwv n PRO 671 N -1.87 -0.04 -1.24 1.61 -0.02 -1.26 -4.60 135.00 127.57 1pwv n PRO 671 Ca 0.00 0.91 -0.29 0.00 -2.02 0.00 0.00 63.50 62.09 1pwv n PRO 671 Cb 0.00 -1.55 0.15 0.00 -0.02 0.00 0.00 33.50 32.08 1pwv n PRO 671 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1pwv s SER 672 N -4.82 3.26 -0.25 2.55 1.04 -1.26 -1.04 113.70 113.18 1pwv s SER 672 Ca -0.07 1.34 0.02 0.00 0.48 0.00 0.00 55.95 57.72 1pwv s SER 672 Cb 0.20 -2.01 0.05 0.00 0.10 0.00 0.00 66.02 64.36 1pwv s SER 672 CO 0.50 -2.75 -0.11 -0.75 0.98 0.00 0.00 173.24 171.10 1pwv s LYS 673 N -4.98 2.40 0.47 4.02 2.47 -1.26 -4.51 119.74 118.35 1pwv s LYS 673 Ca 0.64 -1.24 -0.24 0.00 -1.56 0.00 0.00 55.97 53.57 1pwv s LYS 673 Cb -0.18 -2.86 -0.08 0.00 -1.46 0.00 0.00 37.83 33.25 1pwv s LYS 673 CO 0.57 -0.51 1.29 0.41 0.16 0.00 0.00 175.35 177.27 1pwv n GLY 674 N 4.49 0.60 3.66 5.54 0.00 -1.26 -4.86 105.19 113.35 1pwv n GLY 674 Ca -0.15 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 1pwv n GLY 674 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pwv s VAL 675 N -1.25 3.55 -1.08 1.61 1.01 -1.26 -2.99 120.40 119.99 1pwv s VAL 675 Ca 0.65 0.66 -0.11 0.00 0.00 0.00 0.00 61.98 63.17 1pwv s VAL 675 Cb -0.47 -3.45 -0.05 0.00 0.00 0.00 0.00 36.38 32.42 1pwv s VAL 675 CO 0.55 -0.08 0.88 -0.62 0.00 0.00 0.00 175.10 175.82 1pwv n GLU 676 N 7.26 -1.99 -3.73 2.72 -0.58 -1.26 -5.02 120.64 118.03 1pwv n GLU 676 Ca 0.18 0.73 -0.12 0.00 -0.42 0.00 0.00 57.16 57.53 1pwv n GLU 676 Cb 0.43 -5.27 -0.13 0.00 -0.57 0.00 0.00 31.44 25.91 1pwv n GLU 676 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1pwv s LEU 677 N -5.77 0.43 0.07 -4.62 1.43 -1.16 -5.06 118.68 104.00 1pwv s LEU 677 Ca 0.46 0.54 0.06 0.00 -1.03 0.00 0.00 54.13 54.15 1pwv s LEU 677 Cb -0.10 0.78 -0.23 0.00 0.03 0.00 0.00 46.19 46.67 1pwv s LEU 677 CO 0.78 -0.16 1.11 0.08 0.23 0.00 0.00 176.35 178.39 1pwv h ARG 678 N 7.09 0.06 -4.26 1.70 0.11 -1.96 -3.43 114.38 113.70 1pwv h ARG 678 Ca -0.39 -0.10 -0.16 0.00 0.10 0.00 0.00 59.98 59.42 1pwv h ARG 678 Cb 1.16 0.04 -0.14 0.00 1.11 0.00 0.00 29.97 32.14 1pwv h ARG 678 CO 0.37 0.95 -0.51 0.54 0.10 0.00 0.00 179.97 181.41 1pwv s ASN 679 N -6.68 0.17 0.51 0.08 6.03 -1.26 -5.00 114.94 108.79 1pwv s ASN 679 Ca -0.02 -1.14 0.25 0.00 -1.03 0.00 0.00 52.86 50.93 1pwv s ASN 679 Cb 0.09 0.37 1.37 0.00 -3.03 0.00 0.00 41.25 40.05 1pwv s ASN 679 CO 0.83 -0.83 2.06 0.44 -2.03 0.00 0.00 177.10 177.57 1pwv h ASP 680 N 2.68 0.00 -0.79 3.54 3.45 -1.97 -2.94 116.42 120.38 1pwv h ASP 680 Ca -0.34 0.00 0.05 0.00 0.43 0.00 0.00 57.03 57.17 1pwv h ASP 680 Cb 1.22 0.00 -0.05 0.00 -0.56 0.00 0.00 39.33 39.94 1pwv h ASP 680 CO 0.53 0.13 0.49 0.28 -1.57 0.00 0.00 179.24 179.10 1pwv h SER 681 N 0.00 0.79 -0.19 6.45 0.02 -1.96 -0.02 113.55 118.64 1pwv h SER 681 Ca -0.00 0.01 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 1pwv h SER 681 Cb 0.33 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.70 1pwv h SER 681 CO 0.02 0.52 0.11 -0.33 -1.14 0.00 0.00 176.83 176.01 1pwv h GLU 682 N 0.93 0.23 -0.42 3.45 5.08 -1.93 1.00 114.58 122.92 1pwv h GLU 682 Ca 0.34 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.76 1pwv h GLU 682 Cb 0.10 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.24 1pwv h GLU 682 CO -0.15 0.15 0.03 0.78 -1.00 0.00 0.00 179.01 178.82 1pwv h GLY 683 N 0.24 0.45 0.91 -3.84 0.00 -1.40 0.20 103.07 99.63 1pwv h GLY 683 Ca 0.07 0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.42 1pwv h GLY 683 CO -0.03 -0.09 -0.05 -2.75 0.00 0.00 0.00 176.54 173.62 1pwv h PHE 684 N 0.14 -0.14 -0.75 5.60 3.57 -0.62 -1.33 116.94 123.41 1pwv h PHE 684 Ca 0.21 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.80 1pwv h PHE 684 Cb 0.29 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.02 1pwv h PHE 684 CO -0.26 -0.00 0.49 0.82 -2.23 0.00 0.00 178.31 177.13 1pwv h ILE 685 N -0.24 0.93 0.29 1.41 2.04 -0.36 0.63 117.51 122.20 1pwv h ILE 685 Ca -0.02 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1pwv h ILE 685 Cb 0.20 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 1pwv h ILE 685 CO 0.02 0.12 -0.14 -0.74 0.00 0.00 0.00 178.15 177.41 1pwv h HIS 686 N 0.65 -0.36 -0.94 1.37 2.76 -0.34 -0.82 115.15 117.46 1pwv h HIS 686 Ca 0.35 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.55 1pwv h HIS 686 Cb 0.49 0.12 -0.06 0.00 1.55 0.00 0.00 27.41 29.51 1pwv h HIS 686 CO -0.00 -0.09 0.61 0.93 -1.30 0.00 0.00 177.93 178.08 1pwv h GLU 687 N -0.59 1.12 -0.64 5.26 4.39 -0.04 0.31 114.58 124.38 1pwv h GLU 687 Ca -0.04 -0.07 0.06 0.00 0.34 0.00 0.00 59.36 59.66 1pwv h GLU 687 Cb 0.43 -0.25 -0.04 0.00 -0.10 0.00 0.00 28.75 28.79 1pwv h GLU 687 CO 0.07 0.74 0.42 0.35 -1.16 0.00 0.00 179.01 179.43 1pwv h PHE 688 N 1.15 0.63 0.17 4.33 3.57 0.47 -1.40 116.94 125.87 1pwv h PHE 688 Ca 0.39 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.92 1pwv h PHE 688 Cb 0.06 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.56 1pwv h PHE 688 CO -0.01 0.33 -0.33 0.78 -2.23 0.00 0.00 178.31 176.85 1pwv h GLY 689 N 0.62 -0.66 -0.08 2.40 0.00 0.11 -0.54 103.07 104.92 1pwv h GLY 689 Ca 0.28 0.39 0.27 0.00 0.00 0.00 0.00 47.33 48.26 1pwv h GLY 689 CO -0.09 -0.26 0.69 0.45 0.00 0.00 0.00 176.54 177.33 1pwv h HIS 690 N -0.59 0.48 -0.03 5.60 3.86 -0.89 0.51 115.15 124.10 1pwv h HIS 690 Ca 0.02 0.02 -0.14 0.00 -1.16 0.00 0.00 60.37 59.11 1pwv h HIS 690 Cb 0.59 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.91 1pwv h HIS 690 CO -0.27 0.06 -0.63 0.00 0.86 0.00 0.00 177.93 177.95 1pwv h ALA 691 N 1.58 0.90 -0.08 2.45 0.00 -0.75 -0.72 119.26 122.64 1pwv h ALA 691 Ca 0.56 -0.56 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 1pwv h ALA 691 Cb 1.59 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.28 1pwv h ALA 691 CO -0.21 0.76 -0.52 0.28 0.00 0.00 0.00 179.25 179.56 1pwv h VAL 692 N 0.08 1.36 0.33 0.00 2.07 0.13 -1.73 116.25 118.47 1pwv h VAL 692 Ca -0.01 -1.79 -0.02 0.00 0.82 0.00 0.00 66.70 65.70 1pwv h VAL 692 Cb 1.12 1.87 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 1pwv h VAL 692 CO 0.09 0.53 -0.16 -0.78 0.02 0.00 0.00 177.57 177.27 1pwv h ASP 693 N 0.18 -0.38 -0.93 0.57 -0.00 -0.58 -0.61 116.42 114.68 1pwv h ASP 693 Ca 0.00 -0.10 0.14 0.00 -0.00 0.00 0.00 57.03 57.07 1pwv h ASP 693 Cb 0.98 0.10 -0.09 0.00 -0.00 0.00 0.00 39.33 40.32 1pwv h ASP 693 CO 0.08 -0.12 0.55 -0.78 -0.00 0.00 0.00 179.24 178.97 1pwv h ASP 694 N -0.63 0.75 0.03 2.28 1.82 -0.91 -2.27 116.42 117.49 1pwv h ASP 694 Ca -0.05 0.07 -0.06 0.00 -0.39 0.00 0.00 57.03 56.60 1pwv h ASP 694 Cb 0.45 -0.07 0.01 0.00 0.68 0.00 0.00 39.33 40.40 1pwv h ASP 694 CO 0.07 0.36 -0.26 0.22 -1.61 0.00 0.00 179.24 178.02 1pwv h TYR 695 N 0.82 0.20 -0.88 0.28 3.20 -1.24 -2.29 116.97 117.06 1pwv h TYR 695 Ca 0.49 -0.13 0.18 0.00 3.14 0.00 0.00 58.73 62.41 1pwv h TYR 695 Cb 0.59 -0.01 -0.11 0.00 1.54 0.00 0.00 36.73 38.74 1pwv h TYR 695 CO -0.04 1.04 0.43 0.00 -1.64 0.00 0.00 178.16 177.95 1pwv h ALA 696 N 0.11 1.38 -0.16 1.82 0.00 -1.00 0.15 119.26 121.56 1pwv h ALA 696 Ca -0.04 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1pwv h ALA 696 Cb 1.13 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 1pwv h ALA 696 CO 0.05 -0.21 0.05 0.78 0.00 0.00 0.00 179.25 179.92 1pwv h GLY 697 N 0.53 0.27 1.11 0.00 0.00 -1.45 -2.60 103.07 100.92 1pwv h GLY 697 Ca 0.52 -0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.74 1pwv h GLY 697 CO -0.44 0.15 0.47 -1.82 0.00 0.00 0.00 176.54 174.90 1pwv h TYR 698 N 0.08 0.79 0.00 5.60 5.03 -0.43 -0.18 116.97 127.87 1pwv h TYR 698 Ca 0.05 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.35 1pwv h TYR 698 Cb 0.23 -0.26 -0.00 0.00 1.55 0.00 0.00 36.73 38.24 1pwv h TYR 698 CO 0.00 0.44 -0.14 -0.07 -1.32 0.00 0.00 178.16 177.07 1pwv h LEU 699 N 0.80 0.00 0.38 2.82 3.38 -0.49 -1.61 115.31 120.59 1pwv h LEU 699 Ca 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 1pwv h LEU 699 Cb 0.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1pwv h LEU 699 CO -0.09 0.14 -0.18 -0.07 0.09 0.00 0.00 178.44 178.32 1pwv h LEU 700 N 0.00 -0.44 -7.02 1.67 3.38 -0.66 -3.42 115.31 108.82 1pwv h LEU 700 Ca -0.00 -0.13 -0.55 0.00 0.09 0.00 0.00 57.88 57.29 1pwv h LEU 700 Cb 0.47 0.11 -0.40 0.00 0.09 0.00 0.00 40.66 40.93 1pwv h LEU 700 CO 0.02 -0.04 -0.77 -1.81 0.09 0.00 0.00 178.44 175.94 1pwv s ASP 701 N -4.98 3.58 0.60 -0.43 1.01 -1.11 -4.95 116.67 110.38 1pwv s ASP 701 Ca -0.13 -1.32 0.40 0.00 0.71 0.00 0.00 52.55 52.20 1pwv s ASP 701 Cb 0.02 -0.59 2.11 0.00 1.01 0.00 0.00 42.92 45.47 1pwv s ASP 701 CO 0.48 -0.41 2.22 0.11 0.21 0.00 0.00 175.17 177.78 1pwv h LYS 702 N 8.26 0.00 -0.66 8.23 6.56 -1.55 0.16 116.57 137.57 1pwv h LYS 702 Ca -0.17 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.42 1pwv h LYS 702 Cb 1.04 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.70 1pwv h LYS 702 CO 0.43 0.00 0.00 0.09 -2.06 0.00 0.00 179.45 177.91 1pwv n ASN 703 N -2.95 2.96 -3.97 0.86 3.02 -1.26 -4.87 115.26 109.05 1pwv n ASN 703 Ca -0.02 -2.32 -0.10 0.00 -0.03 0.00 0.00 54.58 52.11 1pwv n ASN 703 Cb 0.10 -0.48 -0.11 0.00 -0.61 0.00 0.00 39.78 38.67 1pwv n ASN 703 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1pwv s GLN 704 N -1.77 0.29 -0.69 3.52 -0.21 0.56 -5.07 119.66 116.29 1pwv s GLN 704 Ca 0.27 -0.55 0.01 0.00 0.02 0.00 0.00 55.36 55.11 1pwv s GLN 704 Cb 0.19 0.08 0.37 0.00 1.00 0.00 0.00 33.01 34.64 1pwv s GLN 704 CO 0.11 -0.04 1.56 0.43 -2.12 0.00 0.00 175.29 175.23 1pwv n SER 705 N 1.76 6.18 -4.59 5.90 7.64 -1.26 -4.69 113.62 124.56 1pwv n SER 705 Ca -0.23 -3.76 -0.26 0.00 1.01 0.00 0.00 58.87 55.63 1pwv n SER 705 Cb 0.56 -0.81 -0.10 0.00 -1.01 0.00 0.00 64.21 62.85 1pwv n SER 705 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1pwv s ASP 706 N -2.25 3.92 0.41 6.43 1.01 -1.26 -5.08 116.67 119.85 1pwv s ASP 706 Ca 0.49 -1.14 -0.03 0.00 0.71 0.00 0.00 52.55 52.57 1pwv s ASP 706 Cb 0.38 -0.42 -0.04 0.00 1.01 0.00 0.00 42.92 43.85 1pwv s ASP 706 CO -0.27 -0.25 0.68 -0.76 0.21 0.00 0.00 175.17 174.78 1pwv s LEU 707 N -3.67 3.81 0.24 1.23 1.43 -1.26 -3.97 118.68 116.49 1pwv s LEU 707 Ca 0.34 0.75 0.18 0.00 -1.03 0.00 0.00 54.13 54.37 1pwv s LEU 707 Cb 0.02 -3.66 0.05 0.00 0.03 0.00 0.00 46.19 42.63 1pwv s LEU 707 CO 0.18 -0.44 1.27 1.62 0.23 0.00 0.00 176.35 179.21 1pwv h VAL 708 N 0.55 0.51 0.00 -1.59 3.04 -1.89 -2.99 116.25 113.88 1pwv h VAL 708 Ca -0.48 -1.79 0.00 0.00 -1.01 0.00 0.00 66.70 63.42 1pwv h VAL 708 Cb 1.21 2.13 0.00 0.00 -2.01 0.00 0.00 31.29 32.62 1pwv h VAL 708 CO 0.62 0.29 0.00 0.35 -1.01 0.00 0.00 177.57 177.82 1pwv n THR 709 N -3.05 0.11 0.74 3.17 -2.24 -1.26 -1.81 114.28 109.94 1pwv n THR 709 Ca -0.01 0.03 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 1pwv n THR 709 Cb 0.70 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 1pwv n THR 709 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1pwv n ASN 710 N -1.12 0.67 -4.75 3.42 4.05 -1.13 -4.38 115.26 112.02 1pwv n ASN 710 Ca 0.16 -0.46 -0.36 0.00 0.45 0.00 0.00 54.58 54.37 1pwv n ASN 710 Cb 0.13 0.85 0.05 0.00 1.23 0.00 0.00 39.78 42.04 1pwv n ASN 710 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 177.26 173.27 1pwv s SER 711 N -3.51 4.96 0.22 1.20 1.04 -0.75 -4.81 113.70 112.05 1pwv s SER 711 Ca 0.05 2.46 -0.08 0.00 0.48 0.00 0.00 55.95 58.86 1pwv s SER 711 Cb 0.15 -2.60 0.25 0.00 0.10 0.00 0.00 66.02 63.92 1pwv s SER 711 CO 0.81 -1.75 1.84 0.11 0.98 0.00 0.00 173.24 175.23 1pwv h LYS 712 N 0.71 0.82 -0.57 4.02 6.56 -1.92 -1.34 116.57 124.85 1pwv h LYS 712 Ca -0.50 -0.05 0.07 0.00 -1.06 0.00 0.00 60.65 59.11 1pwv h LYS 712 Cb 1.31 -0.18 -0.06 0.00 -0.57 0.00 0.00 32.23 32.73 1pwv h LYS 712 CO 0.54 0.54 0.25 -0.22 -2.06 0.00 0.00 179.45 178.51 1pwv h LYS 713 N 0.84 0.46 -0.08 3.15 3.64 -1.93 -2.60 116.57 120.04 1pwv h LYS 713 Ca 0.32 -0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.45 1pwv h LYS 713 Cb 0.12 -0.10 0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1pwv h LYS 713 CO -0.15 0.30 -0.83 0.35 -2.27 0.00 0.00 179.45 176.85 1pwv h PHE 714 N 0.47 0.82 -1.03 1.91 3.57 -1.75 -3.09 116.94 117.85 1pwv h PHE 714 Ca 0.27 -0.39 0.26 0.00 3.53 0.00 0.00 57.97 61.65 1pwv h PHE 714 Cb 0.26 -0.12 -0.08 0.00 2.79 0.00 0.00 35.95 38.81 1pwv h PHE 714 CO -0.13 1.20 0.67 0.82 -2.23 0.00 0.00 178.31 178.64 1pwv h ILE 715 N 0.38 0.54 -0.00 1.41 2.04 -0.86 0.13 117.51 121.15 1pwv h ILE 715 Ca -0.06 -0.12 -0.06 0.00 1.00 0.00 0.00 64.86 65.62 1pwv h ILE 715 Cb 1.45 0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 1pwv h ILE 715 CO 0.16 0.06 -0.24 0.44 0.00 0.00 0.00 178.15 178.57 1pwv h ASP 716 N 0.34 0.21 -0.79 1.72 3.45 -1.50 -2.40 116.42 117.45 1pwv h ASP 716 Ca 0.56 -0.78 0.17 0.00 0.43 0.00 0.00 57.03 57.41 1pwv h ASP 716 Cb 1.53 -0.06 -0.11 0.00 -0.56 0.00 0.00 39.33 40.13 1pwv h ASP 716 CO -0.24 0.96 0.30 0.40 -1.57 0.00 0.00 179.24 179.09 1pwv h ILE 717 N -0.52 0.57 -0.67 0.35 1.08 -0.87 0.37 117.51 117.82 1pwv h ILE 717 Ca -0.03 -0.14 -0.07 0.00 -0.39 0.00 0.00 64.86 64.24 1pwv h ILE 717 Cb 1.00 0.15 -0.03 0.00 -3.07 0.00 0.00 36.82 34.87 1pwv h ILE 717 CO 0.05 0.07 0.15 0.15 -0.69 0.00 0.00 178.15 177.88 1pwv h PHE 718 N 0.39 1.14 -0.95 1.37 3.04 -0.87 0.47 116.94 121.53 1pwv h PHE 718 Ca 0.45 -0.14 0.04 0.00 3.98 0.00 0.00 57.97 62.30 1pwv h PHE 718 Cb 0.76 -0.32 -0.06 0.00 2.56 0.00 0.00 35.95 38.89 1pwv h PHE 718 CO -0.18 0.94 0.62 0.87 -2.02 0.00 0.00 178.31 178.54 1pwv h LYS 719 N 1.01 1.15 0.19 1.11 1.57 0.18 0.50 116.57 122.28 1pwv h LYS 719 Ca 0.21 -0.07 -0.34 0.00 -1.87 0.00 0.00 60.65 58.58 1pwv h LYS 719 Cb 0.39 -0.26 0.01 0.00 0.08 0.00 0.00 32.23 32.45 1pwv h LYS 719 CO 0.01 0.76 -1.66 1.49 -0.57 0.00 0.00 179.45 179.48 1pwv h GLU 720 N 1.19 0.39 -0.01 3.15 4.81 -0.61 -3.39 114.58 120.11 1pwv h GLU 720 Ca 0.38 -0.67 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1pwv h GLU 720 Cb 0.03 0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1pwv h GLU 720 CO -0.13 1.30 -0.22 0.39 -0.73 0.00 0.00 179.01 179.62 1pwv n GLU 721 N -3.59 1.89 -0.16 1.92 1.02 0.12 -4.78 120.64 117.06 1pwv n GLU 721 Ca -0.21 -0.69 0.21 0.00 -0.02 0.00 0.00 57.16 56.44 1pwv n GLU 721 Cb 1.08 -1.14 0.32 0.00 -0.02 0.00 0.00 31.44 31.68 1pwv n GLU 721 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1pwv n GLY 722 N 0.94 -0.57 2.48 0.62 0.00 0.17 -1.06 105.19 107.77 1pwv n GLY 722 Ca 0.05 0.27 -0.16 0.00 0.00 0.00 0.00 46.02 46.19 1pwv n GLY 722 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1pwv n SER 723 N -2.75 3.30 -0.00 1.61 3.41 -1.26 -3.63 113.62 114.29 1pwv n SER 723 Ca 0.18 -3.09 0.04 0.00 -0.26 0.00 0.00 58.87 55.74 1pwv n SER 723 Cb 1.15 -0.45 -0.05 0.00 -0.26 0.00 0.00 64.21 64.60 1pwv n SER 723 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1pwv n ASN 724 N -0.48 0.75 0.00 4.04 4.13 -0.22 -4.96 115.26 118.52 1pwv n ASN 724 Ca 0.26 -0.62 0.00 0.00 1.68 0.00 0.00 54.58 55.90 1pwv n ASN 724 Cb 0.82 1.06 0.00 0.00 -1.54 0.00 0.00 39.78 40.11 1pwv n ASN 724 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1pwv n LEU 725 N -1.29 0.00 -5.01 3.41 4.77 -1.26 -4.91 117.00 112.71 1pwv n LEU 725 Ca 0.01 0.00 -0.17 0.00 -0.03 0.00 0.00 56.01 55.82 1pwv n LEU 725 Cb 0.15 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.25 1pwv n LEU 725 CO 0.19 0.00 0.15 0.42 -1.33 0.00 0.00 177.39 176.82 1pwv s THR 726 N 1.58 2.96 -0.02 -5.08 -4.23 -1.26 -5.03 115.64 104.55 1pwv s THR 726 Ca 0.00 -1.01 -0.15 0.00 -1.18 0.00 0.00 61.69 59.35 1pwv s THR 726 Cb 0.00 -2.97 -0.08 0.00 1.34 0.00 0.00 72.50 70.79 1pwv s THR 726 CO 0.00 0.00 0.69 0.28 -0.54 0.00 0.00 174.62 175.05 1pwv h SER 727 N 0.64 -0.45 -0.74 3.99 0.02 -1.97 -3.09 113.55 111.96 1pwv h SER 727 Ca -0.40 0.02 0.21 0.00 -0.84 0.00 0.00 61.79 60.78 1pwv h SER 727 Cb 1.28 0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.91 1pwv h SER 727 CO 0.45 -0.10 0.70 0.22 -1.14 0.00 0.00 176.83 176.96 1pwv h TYR 728 N -0.96 0.00 0.00 3.45 3.20 -1.96 0.42 116.97 121.11 1pwv h TYR 728 Ca -0.05 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.79 1pwv h TYR 728 Cb 0.40 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.67 1pwv h TYR 728 CO 0.02 0.00 -0.12 0.78 -1.64 0.00 0.00 178.16 177.20 1pwv h GLY 729 N 0.00 0.00 1.54 1.82 0.00 -1.82 -2.43 103.07 102.19 1pwv h GLY 729 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1pwv h GLY 729 CO -0.00 0.00 0.00 -2.13 0.00 0.00 0.00 176.54 174.41 1pwv n ARG 730 N -3.82 0.39 -0.23 4.80 3.00 0.15 -2.63 116.66 118.32 1pwv n ARG 730 Ca -0.02 0.04 -0.02 0.00 -0.00 0.00 0.00 57.85 57.85 1pwv n ARG 730 Cb 0.22 -1.50 0.09 0.00 0.00 0.00 0.00 32.46 31.27 1pwv n ARG 730 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.63 178.78 1pwv h THR 731 N 0.00 0.98 -1.30 5.15 2.02 -1.57 -3.47 112.91 114.72 1pwv h THR 731 Ca 0.00 -0.24 0.37 0.00 0.77 0.00 0.00 66.41 67.31 1pwv h THR 731 Cb 0.23 0.22 -0.12 0.00 -1.74 0.00 0.00 68.15 66.74 1pwv h THR 731 CO 0.00 0.13 0.93 0.54 0.37 0.00 0.00 175.52 177.49 1pwv s ASN 732 N -5.60 -0.02 0.26 4.18 2.20 -1.25 -5.01 114.94 109.70 1pwv s ASN 732 Ca -0.13 -0.06 -0.01 0.00 -0.94 0.00 0.00 52.86 51.72 1pwv s ASN 732 Cb 0.16 0.07 0.53 0.00 -2.00 0.00 0.00 41.25 40.00 1pwv s ASN 732 CO 0.76 -0.13 1.75 1.05 -2.94 0.00 0.00 177.10 177.59 1pwv h GLU 733 N 2.00 0.56 0.20 3.55 9.09 -1.88 0.16 114.58 128.26 1pwv h GLU 733 Ca -0.31 -0.03 -0.01 0.00 0.05 0.00 0.00 59.36 59.06 1pwv h GLU 733 Cb 1.19 -0.13 -0.00 0.00 -1.65 0.00 0.00 28.75 28.16 1pwv h GLU 733 CO 0.29 0.37 -0.13 0.00 0.05 0.00 0.00 179.01 179.60 1pwv h ALA 734 N 1.56 -0.30 -0.10 1.06 0.00 -1.94 -0.25 119.26 119.29 1pwv h ALA 734 Ca 0.46 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 55.13 1pwv h ALA 734 Cb 0.67 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 1pwv h ALA 734 CO -0.38 -0.68 -0.68 0.93 0.00 0.00 0.00 179.25 178.44 1pwv h GLU 735 N -0.32 0.44 -0.33 0.00 4.39 -1.74 -2.85 114.58 114.17 1pwv h GLU 735 Ca -0.02 -0.34 -0.00 0.00 0.34 0.00 0.00 59.36 59.34 1pwv h GLU 735 Cb 0.27 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.96 1pwv h GLU 735 CO 0.02 0.96 0.19 0.35 -1.16 0.00 0.00 179.01 179.37 1pwv h PHE 736 N 0.31 0.44 -0.48 4.33 3.57 -0.44 0.13 116.94 124.80 1pwv h PHE 736 Ca -0.02 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.54 1pwv h PHE 736 Cb 1.24 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 39.79 1pwv h PHE 736 CO 0.04 0.34 0.17 0.35 -2.23 0.00 0.00 178.31 176.98 1pwv h PHE 737 N 0.41 0.30 -0.53 0.41 3.57 -1.02 -0.18 116.94 119.91 1pwv h PHE 737 Ca 0.12 0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.54 1pwv h PHE 737 Cb 0.04 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.70 1pwv h PHE 737 CO -0.03 0.10 -0.09 0.00 -2.23 0.00 0.00 178.31 176.06 1pwv h ALA 738 N 1.32 0.85 -0.63 2.41 0.00 -1.23 -0.89 119.26 121.09 1pwv h ALA 738 Ca 0.23 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1pwv h ALA 738 Cb 0.23 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1pwv h ALA 738 CO -0.23 0.65 0.08 0.93 0.00 0.00 0.00 179.25 180.69 1pwv h GLU 739 N 0.87 1.04 -0.26 0.00 4.39 -0.49 0.19 114.58 120.32 1pwv h GLU 739 Ca 0.14 -0.28 -0.06 0.00 0.34 0.00 0.00 59.36 59.50 1pwv h GLU 739 Cb 0.63 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1pwv h GLU 739 CO 0.04 0.97 -0.09 0.00 -1.16 0.00 0.00 179.01 178.77 1pwv h ALA 740 N 1.11 0.36 -0.74 3.43 0.00 -0.81 -0.90 119.26 121.70 1pwv h ALA 740 Ca 0.19 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1pwv h ALA 740 Cb 0.44 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1pwv h ALA 740 CO 0.01 0.19 0.39 0.35 0.00 0.00 0.00 179.25 180.20 1pwv h PHE 741 N 0.26 1.03 -0.17 0.00 3.57 -1.00 0.17 116.94 120.80 1pwv h PHE 741 Ca 0.06 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1pwv h PHE 741 Cb 0.57 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.97 1pwv h PHE 741 CO 0.06 0.74 -0.12 -0.09 -2.23 0.00 0.00 178.31 176.66 1pwv h ARG 742 N 1.03 0.27 0.07 1.11 1.12 -0.39 -1.86 114.38 115.72 1pwv h ARG 742 Ca 0.26 -0.06 -0.31 0.00 -1.11 0.00 0.00 59.98 58.75 1pwv h ARG 742 Cb 0.06 -0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 29.95 1pwv h ARG 742 CO -0.04 0.40 -1.72 -0.07 -3.11 0.00 0.00 179.97 175.43 1pwv h LEU 743 N 0.26 0.22 -0.90 3.80 3.38 -0.87 -3.24 115.31 117.95 1pwv h LEU 743 Ca 0.05 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1pwv h LEU 743 Cb 0.37 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1pwv h LEU 743 CO 0.02 1.36 0.00 0.23 0.09 0.00 0.00 178.44 180.14 1pwv n MET 744 N -3.28 0.14 -1.45 1.13 2.81 0.57 -1.72 117.12 115.32 1pwv n MET 744 Ca -0.20 0.51 -0.05 0.00 -1.81 0.00 0.00 57.70 56.14 1pwv n MET 744 Cb 1.04 -1.86 0.10 0.00 -0.71 0.00 0.00 33.22 31.80 1pwv n MET 744 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 1pwv n HIS 745 N -2.14 1.04 -2.62 2.03 8.25 -0.72 -4.92 115.22 116.13 1pwv n HIS 745 Ca 0.01 -1.66 -0.31 0.00 -0.26 0.00 0.00 57.72 55.49 1pwv n HIS 745 Cb 0.13 -0.26 -0.03 0.00 1.12 0.00 0.00 29.99 30.94 1pwv n HIS 745 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1pwv s SER 746 N -3.24 6.58 0.04 0.41 0.15 -0.70 -4.82 113.70 112.11 1pwv s SER 746 Ca 0.40 1.37 -0.22 0.00 0.70 0.00 0.00 55.95 58.19 1pwv s SER 746 Cb 0.38 -2.42 -0.15 0.00 -1.71 0.00 0.00 66.02 62.12 1pwv s SER 746 CO -0.04 -0.49 1.44 0.74 1.20 0.00 0.00 173.24 176.08 1pwv h THR 747 N 1.02 1.28 -2.86 6.45 2.02 -1.91 -3.41 112.91 115.50 1pwv h THR 747 Ca -0.47 -0.89 -0.55 0.00 0.77 0.00 0.00 66.41 65.28 1pwv h THR 747 Cb 1.19 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 1pwv h THR 747 CO 0.63 0.25 0.88 -0.62 0.37 0.00 0.00 175.52 177.02 1pwv s ASP 748 N -5.73 6.83 0.00 4.18 2.15 -1.26 -4.88 116.67 117.96 1pwv s ASP 748 Ca -0.15 2.09 0.27 0.00 0.43 0.00 0.00 52.55 55.19 1pwv s ASP 748 Cb 0.05 -2.55 1.17 0.00 -0.30 0.00 0.00 42.92 41.28 1pwv s ASP 748 CO 0.70 -0.75 1.86 1.41 -0.17 0.00 0.00 175.17 178.22 1pwv n HIS 749 N 5.75 0.00 -0.02 -5.34 8.25 -1.26 -3.11 115.22 119.48 1pwv n HIS 749 Ca 0.14 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.47 1pwv n HIS 749 Cb 0.44 -0.46 -0.09 0.00 1.12 0.00 0.00 29.99 30.99 1pwv n HIS 749 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1pwv h ALA 750 N 2.97 0.05 -0.46 -1.41 0.00 -1.95 -2.25 119.26 116.21 1pwv h ALA 750 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1pwv h ALA 750 Cb 0.42 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1pwv h ALA 750 CO 0.00 -0.19 0.29 0.93 0.00 0.00 0.00 179.25 180.29 1pwv h GLU 751 N -0.36 0.61 -0.49 0.00 4.39 -1.88 -0.34 114.58 116.50 1pwv h GLU 751 Ca 0.01 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.66 1pwv h GLU 751 Cb 0.51 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 29.00 1pwv h GLU 751 CO 0.01 0.42 0.31 0.00 -1.16 0.00 0.00 179.01 178.59 1pwv h ARG 752 N 0.63 0.66 -0.13 2.33 3.08 -1.47 -2.83 114.38 116.65 1pwv h ARG 752 Ca 0.17 -0.05 -0.18 0.00 0.07 0.00 0.00 59.98 59.99 1pwv h ARG 752 Cb -0.05 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 1pwv h ARG 752 CO -0.03 0.47 -0.65 -0.07 -1.07 0.00 0.00 179.97 178.62 1pwv h LEU 753 N 0.66 0.57 -0.96 3.04 3.38 -0.75 -3.21 115.31 118.05 1pwv h LEU 753 Ca 0.18 -0.34 0.23 0.00 0.09 0.00 0.00 57.88 58.04 1pwv h LEU 753 Cb -0.03 -0.17 -0.12 0.00 0.09 0.00 0.00 40.66 40.43 1pwv h LEU 753 CO -0.04 1.07 0.52 0.50 0.09 0.00 0.00 178.44 180.58 1pwv h LYS 754 N 0.36 0.50 0.29 1.13 3.64 -0.84 -1.77 116.57 119.89 1pwv h LYS 754 Ca -0.01 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1pwv h LYS 754 Cb 1.21 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 1pwv h LYS 754 CO 0.12 0.33 -0.14 0.28 -2.27 0.00 0.00 179.45 177.77 1pwv h VAL 755 N 0.52 0.55 -0.97 2.00 2.07 -1.55 -3.23 116.25 115.64 1pwv h VAL 755 Ca 0.61 -0.81 0.30 0.00 0.82 0.00 0.00 66.70 67.61 1pwv h VAL 755 Cb 1.15 0.87 -0.17 0.00 -1.52 0.00 0.00 31.29 31.62 1pwv h VAL 755 CO -0.49 0.12 0.19 -0.61 0.02 0.00 0.00 177.57 176.80 1pwv h GLN 756 N -0.93 0.05 -2.42 1.57 4.15 -1.39 0.88 115.11 117.02 1pwv h GLN 756 Ca -0.04 -0.00 -0.72 0.00 0.77 0.00 0.00 58.65 58.65 1pwv h GLN 756 Cb 0.51 -0.01 -0.33 0.00 0.21 0.00 0.00 27.48 27.85 1pwv h GLN 756 CO 0.07 0.03 0.30 0.36 -1.93 0.00 0.00 178.83 177.66 1pwv n LYS 757 N -5.38 4.19 0.00 1.69 2.85 -0.77 -3.38 118.16 117.35 1pwv n LYS 757 Ca 0.26 -4.69 0.00 0.00 -1.05 0.00 0.00 58.31 52.83 1pwv n LYS 757 Cb 0.86 -2.39 0.00 0.00 -0.65 0.00 0.00 35.03 32.85 1pwv n LYS 757 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1pwv n ASN 758 N 0.41 0.00 -2.74 -5.58 4.13 -0.43 -4.89 115.26 106.16 1pwv n ASN 758 Ca 0.35 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.52 1pwv n ASN 758 Cb 0.33 0.00 0.09 0.00 -1.54 0.00 0.00 39.78 38.67 1pwv n ASN 758 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1pwv n ALA 759 N 0.00 0.30 -0.15 5.41 0.00 0.17 -4.74 120.51 121.51 1pwv n ALA 759 Ca 0.00 -1.57 0.10 0.00 0.00 0.00 0.00 53.44 51.97 1pwv n ALA 759 Cb 0.00 -1.08 0.42 0.00 0.00 0.00 0.00 19.45 18.79 1pwv n ALA 759 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1pwv h PRO 760 N 2.62 0.58 -0.06 0.00 0.11 -1.68 0.13 132.00 133.70 1pwv h PRO 760 Ca -0.16 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 1pwv h PRO 760 Cb 1.17 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1pwv h PRO 760 CO 0.09 0.38 0.01 0.87 -0.21 0.00 0.00 178.00 179.14 1pwv h LYS 761 N 0.59 0.09 0.65 1.05 1.79 -1.93 -2.70 116.57 116.11 1pwv h LYS 761 Ca 0.32 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.73 1pwv h LYS 761 Cb 0.46 -0.01 0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1pwv h LYS 761 CO -0.11 0.31 -0.31 1.15 -1.08 0.00 0.00 179.45 179.41 1pwv h THR 762 N -0.14 0.32 -0.77 -0.16 2.02 -1.73 -1.18 112.91 111.27 1pwv h THR 762 Ca 0.02 -0.12 0.07 0.00 0.77 0.00 0.00 66.41 67.14 1pwv h THR 762 Cb 0.26 0.36 -0.10 0.00 -1.74 0.00 0.00 68.15 66.93 1pwv h THR 762 CO 0.00 0.02 -0.52 0.15 0.37 0.00 0.00 175.52 175.54 1pwv h PHE 763 N -0.96 -1.66 -0.92 3.16 3.57 -0.81 0.17 116.94 119.49 1pwv h PHE 763 Ca -0.09 0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1pwv h PHE 763 Cb 0.70 0.82 -0.04 0.00 2.79 0.00 0.00 35.95 40.22 1pwv h PHE 763 CO -0.01 -0.36 0.52 0.37 -2.23 0.00 0.00 178.31 176.60 1pwv h GLN 764 N -0.08 1.26 -0.78 1.11 4.15 -1.49 -0.87 115.11 118.41 1pwv h GLN 764 Ca 0.12 -0.13 0.06 0.00 0.77 0.00 0.00 58.65 59.47 1pwv h GLN 764 Cb 0.40 -0.25 -0.06 0.00 0.21 0.00 0.00 27.48 27.78 1pwv h GLN 764 CO -0.77 0.91 0.46 0.35 -1.93 0.00 0.00 178.83 177.85 1pwv h PHE 765 N 1.27 0.86 -0.36 3.99 3.57 0.36 0.18 116.94 126.81 1pwv h PHE 765 Ca 0.33 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.77 1pwv h PHE 765 Cb -0.01 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 1pwv h PHE 765 CO 0.01 0.43 -0.08 0.82 -2.23 0.00 0.00 178.31 177.25 1pwv h ILE 766 N 0.85 1.28 0.00 1.41 2.04 -0.20 -2.00 117.51 120.88 1pwv h ILE 766 Ca 0.34 -1.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.05 1pwv h ILE 766 Cb 0.18 1.28 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1pwv h ILE 766 CO -0.18 0.38 -0.04 0.78 0.00 0.00 0.00 178.15 179.09 1pwv h ASN 767 N 0.48 0.00 0.11 1.72 -0.26 -0.36 -0.77 115.58 116.50 1pwv h ASN 767 Ca 0.09 0.00 -0.20 0.00 -0.56 0.00 0.00 56.30 55.64 1pwv h ASN 767 Cb 0.58 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.84 1pwv h ASN 767 CO 0.03 0.04 -0.74 0.44 -1.06 0.00 0.00 177.43 176.15 1pwv h ASP 768 N 0.00 0.65 0.32 5.81 3.32 0.04 -2.78 116.42 123.77 1pwv h ASP 768 Ca -0.00 -0.42 -0.02 0.00 0.02 0.00 0.00 57.03 56.61 1pwv h ASP 768 Cb 0.21 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.57 1pwv h ASP 768 CO 0.01 1.18 -0.15 1.56 -1.72 0.00 0.00 179.24 180.11 1pwv h GLN 769 N 0.37 -0.41 -1.08 3.56 1.08 -0.63 -2.06 115.11 115.95 1pwv h GLN 769 Ca -0.04 0.03 0.36 0.00 -1.45 0.00 0.00 58.65 57.55 1pwv h GLN 769 Cb 1.33 0.09 -0.14 0.00 -0.05 0.00 0.00 27.48 28.71 1pwv h GLN 769 CO 0.14 -0.09 0.64 0.82 -0.95 0.00 0.00 178.83 179.39 1pwv h ILE 770 N -0.92 0.23 -0.00 2.54 2.04 -1.31 0.22 117.51 120.30 1pwv h ILE 770 Ca -0.04 -0.08 -0.25 0.00 1.00 0.00 0.00 64.86 65.49 1pwv h ILE 770 Cb 0.52 -0.01 0.02 0.00 -0.74 0.00 0.00 36.82 36.60 1pwv h ILE 770 CO 0.07 0.04 -0.97 0.50 0.00 0.00 0.00 178.15 177.79 1pwv h LYS 771 N 0.22 0.66 -0.11 2.37 3.64 -1.45 -1.57 116.57 120.34 1pwv h LYS 771 Ca 0.76 -0.71 0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1pwv h LYS 771 Cb 1.98 0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 33.99 1pwv h LYS 771 CO -0.56 1.29 0.12 0.35 -2.27 0.00 0.00 179.45 178.38 1pwv h PHE 772 N 0.32 0.00 0.00 1.91 3.57 0.16 0.12 116.94 123.02 1pwv h PHE 772 Ca -0.12 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.32 1pwv h PHE 772 Cb 1.63 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 40.36 1pwv h PHE 772 CO 0.11 0.00 -0.54 0.82 -2.23 0.00 0.00 178.31 176.47 1pwv h ILE 773 N 0.00 0.38 -0.95 1.41 2.04 -1.33 -3.22 117.51 115.84 1pwv h ILE 773 Ca 0.05 -1.41 0.27 0.00 1.00 0.00 0.00 64.86 64.78 1pwv h ILE 773 Cb 0.30 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1pwv h ILE 773 CO -0.00 0.13 0.68 0.40 0.00 0.00 0.00 178.15 179.36 1pwv h ILE 774 N -1.00 0.53 -0.48 -0.67 2.04 -1.01 0.95 117.51 117.87 1pwv h ILE 774 Ca -0.08 -0.01 -0.13 0.00 1.00 0.00 0.00 64.86 65.64 1pwv h ILE 774 Cb 0.64 0.50 -0.08 0.00 -0.74 0.00 0.00 36.82 37.15 1pwv h ILE 774 CO -0.05 0.01 0.09 0.59 0.00 0.00 0.00 178.15 178.79 1pwv n ASN 775 N -4.28 3.99 0.00 1.72 3.02 0.00 -5.04 115.26 114.67 1pwv n ASN 775 Ca 0.20 -3.27 0.00 0.00 -0.03 0.00 0.00 54.58 51.48 1pwv n ASN 775 Cb 0.99 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1pwv n ASN 775 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40