#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a6e h ASP 21 N 0.00 0.10 -0.99 3.14 5.19 -1.98 -1.05 116.42 120.82 1a6e h ASP 21 Ca 0.00 -0.55 0.21 0.00 -0.62 0.00 0.00 57.03 56.07 1a6e h ASP 21 Cb 0.00 -0.03 -0.12 0.00 0.18 0.00 0.00 39.33 39.37 1a6e h ASP 21 CO 0.00 0.63 0.58 0.00 -3.12 0.00 0.00 179.24 177.34 1a6e h ALA 22 N 0.47 1.69 0.28 3.45 0.00 -1.95 0.30 119.26 123.50 1a6e h ALA 22 Ca 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1a6e h ALA 22 Cb 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1a6e h ALA 22 CO 0.01 -0.16 -0.13 1.98 0.00 0.00 0.00 179.25 180.95 1a6e h MET 23 N 0.66 -0.36 -0.66 0.00 -1.53 -1.79 -0.36 114.93 110.89 1a6e h MET 23 Ca 0.60 0.02 0.14 0.00 -3.44 0.00 0.00 59.70 57.03 1a6e h MET 23 Cb 1.04 0.08 -0.11 0.00 -0.55 0.00 0.00 31.60 32.07 1a6e h MET 23 CO -0.43 -0.01 0.05 -0.22 0.14 0.00 0.00 176.91 176.44 1a6e h LYS 24 N -0.83 0.15 -0.50 0.39 3.11 0.30 0.20 116.57 119.39 1a6e h LYS 24 Ca -0.04 -0.01 -0.04 0.00 -2.81 0.00 0.00 60.65 57.75 1a6e h LYS 24 Cb 0.51 -0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.69 1a6e h LYS 24 CO 0.06 0.10 0.14 1.49 -2.81 0.00 0.00 179.45 178.43 1a6e h GLU 25 N 0.16 0.79 -0.02 1.90 4.81 -0.47 -2.16 114.58 119.59 1a6e h GLU 25 Ca 0.36 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.40 1a6e h GLU 25 Cb 0.59 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 1a6e h GLU 25 CO -0.54 0.75 0.01 -0.91 -0.73 0.00 0.00 179.01 177.59 1a6e h ASN 26 N 0.68 0.04 -0.37 1.04 -0.26 0.60 -1.36 115.58 115.95 1a6e h ASN 26 Ca 0.16 -0.23 0.05 0.00 -0.56 0.00 0.00 56.30 55.72 1a6e h ASN 26 Cb 0.31 -0.01 -0.04 0.00 -1.06 0.00 0.00 38.32 37.51 1a6e h ASN 26 CO -0.00 0.26 0.12 0.40 -1.06 0.00 0.00 177.43 177.14 1a6e h ILE 27 N -0.18 0.88 0.24 2.81 2.04 -0.63 -0.97 117.51 121.69 1a6e h ILE 27 Ca 0.01 -0.09 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 1a6e h ILE 27 Cb 0.23 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1a6e h ILE 27 CO 0.00 0.05 -0.11 -0.33 0.00 0.00 0.00 178.15 177.75 1a6e h GLU 28 N 0.26 -0.30 -0.77 2.37 5.08 -1.34 0.38 114.58 120.25 1a6e h GLU 28 Ca 0.17 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 58.72 1a6e h GLU 28 Cb 0.16 0.07 -0.11 0.00 0.50 0.00 0.00 28.75 29.37 1a6e h GLU 28 CO -0.18 -0.16 0.25 0.00 -1.00 0.00 0.00 179.01 177.92 1a6e h ALA 29 N 0.37 1.07 0.75 3.43 0.00 -0.98 0.43 119.26 124.34 1a6e h ALA 29 Ca -0.03 0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1a6e h ALA 29 Cb 0.29 0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.26 1a6e h ALA 29 CO 0.05 -0.30 -0.36 0.00 0.00 0.00 0.00 179.25 178.64 1a6e h ALA 30 N 1.61 -1.01 -0.85 0.00 0.00 -0.80 -2.86 119.26 115.35 1a6e h ALA 30 Ca 0.44 -0.23 0.22 0.00 0.00 0.00 0.00 54.91 55.35 1a6e h ALA 30 Cb 0.75 0.39 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 1a6e h ALA 30 CO -0.49 -1.02 0.59 0.82 0.00 0.00 0.00 179.25 179.15 1a6e h ILE 31 N -1.09 0.62 -0.13 0.00 2.04 -0.24 0.87 117.51 119.58 1a6e h ILE 31 Ca -0.10 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1a6e h ILE 31 Cb 0.79 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1a6e h ILE 31 CO 0.17 0.03 0.08 0.00 0.00 0.00 0.00 178.15 178.43 1a6e h ALA 32 N 1.60 0.17 -0.86 1.87 0.00 -0.71 -1.04 119.26 120.29 1a6e h ALA 32 Ca 0.42 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 1a6e h ALA 32 Cb 1.41 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1a6e h ALA 32 CO -0.07 -0.34 0.45 0.82 0.00 0.00 0.00 179.25 180.10 1a6e h ILE 33 N 0.17 1.26 0.34 0.00 1.08 -0.73 -2.04 117.51 117.59 1a6e h ILE 33 Ca 0.05 -0.67 -0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1a6e h ILE 33 Cb -0.01 0.11 -0.03 0.00 -3.07 0.00 0.00 36.82 33.83 1a6e h ILE 33 CO -0.01 0.30 -0.44 0.28 -0.69 0.00 0.00 178.15 177.58 1a6e h SER 34 N 1.21 -1.24 -0.71 1.72 0.02 -0.85 -1.99 113.55 111.72 1a6e h SER 34 Ca 0.30 0.11 0.17 0.00 -0.84 0.00 0.00 61.79 61.53 1a6e h SER 34 Cb 0.06 0.43 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 1a6e h SER 34 CO -0.04 -0.57 0.49 0.78 -1.14 0.00 0.00 176.83 176.34 1a6e h ASN 35 N -0.83 0.21 0.07 3.07 -0.26 -0.78 0.20 115.58 117.25 1a6e h ASN 35 Ca -0.03 0.01 -0.00 0.00 -0.56 0.00 0.00 56.30 55.73 1a6e h ASN 35 Cb 0.76 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 38.00 1a6e h ASN 35 CO -0.12 0.10 -0.01 0.77 -1.06 0.00 0.00 177.43 177.11 1a6e h SER 36 N 0.22 0.00 0.00 5.81 4.64 -0.65 -2.73 113.55 120.83 1a6e h SER 36 Ca 0.34 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.60 1a6e h SER 36 Cb 1.04 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.12 1a6e h SER 36 CO -0.07 0.01 -1.74 0.52 -0.87 0.00 0.00 176.83 174.68 1a6e n VAL 37 N -3.43 0.24 -0.26 0.95 0.31 0.64 -4.67 118.33 112.12 1a6e n VAL 37 Ca -0.03 -0.40 0.02 0.00 -0.01 0.00 0.00 64.34 63.92 1a6e n VAL 37 Cb 0.10 -0.04 0.10 0.00 -0.91 0.00 0.00 33.84 33.09 1a6e n VAL 37 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1a6e h ARG 38 N 0.00 0.02 0.00 5.55 2.43 -1.08 -1.24 114.38 120.06 1a6e h ARG 38 Ca -0.09 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.07 1a6e h ARG 38 Cb 0.97 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.52 1a6e h ARG 38 CO 0.01 0.01 0.00 -1.13 -1.51 0.00 0.00 179.97 177.35 1a6e n SER 39 N -5.46 0.00 -1.02 -3.80 3.41 -1.26 -1.72 113.62 103.76 1a6e n SER 39 Ca 0.11 0.21 0.12 0.00 -0.26 0.00 0.00 58.87 59.05 1a6e n SER 39 Cb 0.40 -0.28 0.15 0.00 -0.26 0.00 0.00 64.21 64.22 1a6e n SER 39 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1a6e n SER 40 N -1.28 3.15 -4.72 4.04 3.41 -0.47 -0.58 113.62 117.18 1a6e n SER 40 Ca 0.02 -1.99 -0.42 0.00 -0.26 0.00 0.00 58.87 56.22 1a6e n SER 40 Cb 0.03 -0.09 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 1a6e n SER 40 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1a6e s LEU 41 N -1.82 4.40 0.00 1.04 2.96 -0.70 -4.44 118.68 120.12 1a6e s LEU 41 Ca 0.32 1.78 0.00 0.00 -0.22 0.00 0.00 54.13 56.01 1a6e s LEU 41 Cb 0.21 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 43.32 1a6e s LEU 41 CO 0.31 -0.25 0.00 0.61 -1.32 0.00 0.00 176.35 175.69 1a6e n GLY 42 N 2.76 -2.45 0.21 7.98 0.00 -1.26 -3.92 105.19 108.51 1a6e n GLY 42 Ca 0.06 -1.71 0.15 0.00 0.00 0.00 0.00 46.02 44.51 1a6e n GLY 42 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a6e h PRO 43 N 0.00 0.00 -0.41 1.61 0.11 -1.88 -2.36 132.00 129.07 1a6e h PRO 43 Ca 0.00 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.97 1a6e h PRO 43 Cb 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 31.03 1a6e h PRO 43 CO 0.00 0.00 0.05 0.54 -0.21 0.00 0.00 178.00 178.38 1a6e n ARG 44 N -2.72 2.54 -1.78 1.05 5.12 -1.26 -4.89 116.66 114.72 1a6e n ARG 44 Ca 0.02 -3.03 -0.33 0.00 -1.93 0.00 0.00 57.85 52.58 1a6e n ARG 44 Cb 0.30 -1.91 0.05 0.00 -1.16 0.00 0.00 32.46 29.74 1a6e n ARG 44 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1a6e s GLY 45 N -2.02 2.25 0.36 -0.13 0.00 -0.89 -4.61 107.32 102.28 1a6e s GLY 45 Ca 0.46 0.64 0.08 0.00 0.00 0.00 0.00 44.72 45.89 1a6e s GLY 45 CO 0.06 1.00 0.16 1.06 0.00 0.00 0.00 173.10 175.37 1a6e s MET 46 N -3.95 2.34 0.37 2.90 -1.94 0.25 -4.93 119.30 114.35 1a6e s MET 46 Ca 0.69 -1.61 0.08 0.00 -1.71 0.00 0.00 55.69 53.13 1a6e s MET 46 Cb -0.22 -2.14 -0.04 0.00 2.01 0.00 0.00 34.83 34.44 1a6e s MET 46 CO 0.40 0.05 0.19 -0.51 -0.01 0.00 0.00 175.02 175.13 1a6e s ASP 47 N -3.87 4.65 0.12 3.03 1.11 -1.26 -4.13 116.67 116.32 1a6e s ASP 47 Ca 0.39 -0.86 0.10 0.00 0.18 0.00 0.00 52.55 52.36 1a6e s ASP 47 Cb -0.01 -0.63 -0.04 0.00 1.07 0.00 0.00 42.92 43.31 1a6e s ASP 47 CO 0.23 -0.43 -0.25 -0.54 1.18 0.00 0.00 175.17 175.36 1a6e s LYS 48 N -3.90 1.50 -0.15 8.23 -0.14 0.16 -4.95 119.74 120.49 1a6e s LYS 48 Ca 0.40 -1.30 -0.01 0.00 -1.36 0.00 0.00 55.97 53.70 1a6e s LYS 48 Cb -0.01 -1.94 -0.01 0.00 -1.68 0.00 0.00 37.83 34.19 1a6e s LYS 48 CO 0.23 0.46 -0.11 1.41 -0.76 0.00 0.00 175.35 176.59 1a6e s MET 49 N -1.99 3.41 -0.12 1.68 -2.45 -1.26 -0.44 119.30 118.12 1a6e s MET 49 Ca 0.14 -0.66 0.01 0.00 -1.25 0.00 0.00 55.69 53.93 1a6e s MET 49 Cb -0.10 -2.72 0.02 0.00 1.25 0.00 0.00 34.83 33.28 1a6e s MET 49 CO 0.06 0.15 -0.12 -0.51 1.05 0.00 0.00 175.02 175.65 1a6e s LEU 50 N 0.53 1.54 -0.30 4.11 1.43 0.16 -4.97 118.68 121.18 1a6e s LEU 50 Ca -0.07 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1a6e s LEU 50 Cb -0.15 -1.04 0.07 0.00 0.03 0.00 0.00 46.19 45.10 1a6e s LEU 50 CO 0.04 -0.05 -0.01 -0.69 0.23 0.00 0.00 176.35 175.86 1a6e s VAL 51 N 1.40 2.65 0.73 -1.59 1.01 -1.25 -0.18 120.40 123.16 1a6e s VAL 51 Ca 0.01 -1.68 -0.12 0.00 0.00 0.00 0.00 61.98 60.19 1a6e s VAL 51 Cb -0.13 -2.63 0.18 0.00 0.00 0.00 0.00 36.38 33.80 1a6e s VAL 51 CO -0.07 -0.21 0.70 -0.90 0.00 0.00 0.00 175.10 174.62 1a6e n ASP 52 N 4.50 -1.38 -0.17 3.32 5.68 0.07 -4.84 116.55 123.73 1a6e n ASP 52 Ca -0.10 -0.98 -0.06 0.00 -0.50 0.00 0.00 54.79 53.15 1a6e n ASP 52 Cb 0.42 -0.62 0.03 0.00 -1.14 0.00 0.00 41.12 39.81 1a6e n ASP 52 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1a6e h SER 53 N -1.90 0.53 0.14 -1.12 4.64 -2.00 -0.88 113.55 112.95 1a6e h SER 53 Ca -0.26 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 1a6e h SER 53 Cb 0.77 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1a6e h SER 53 CO 0.17 0.37 0.00 0.18 -0.87 0.00 0.00 176.83 176.69 1a6e n LEU 54 N -4.77 0.00 0.00 5.97 4.32 -1.26 -4.82 117.00 116.43 1a6e n LEU 54 Ca 0.03 0.19 0.00 0.00 -0.02 0.00 0.00 56.01 56.21 1a6e n LEU 54 Cb 0.06 -0.19 0.00 0.00 -1.62 0.00 0.00 43.42 41.67 1a6e n LEU 54 CO 0.33 -0.12 0.00 0.61 -1.22 0.00 0.00 177.39 176.99 1a6e n GLY 55 N -0.32 0.63 3.71 -0.72 0.00 -0.34 -5.02 105.19 103.12 1a6e n GLY 55 Ca 0.06 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1a6e n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a6e s ASP 56 N -2.10 7.05 -0.13 1.61 1.01 -1.26 -4.76 116.67 118.09 1a6e s ASP 56 Ca 0.00 2.00 -0.03 0.00 0.71 0.00 0.00 52.55 55.23 1a6e s ASP 56 Cb 0.00 -2.57 -0.03 0.00 1.01 0.00 0.00 42.92 41.33 1a6e s ASP 56 CO 0.00 -0.52 -0.02 -0.63 0.21 0.00 0.00 175.17 174.21 1a6e s ILE 57 N 1.38 4.05 -0.21 0.77 1.01 -1.26 -0.75 121.20 126.20 1a6e s ILE 57 Ca 0.59 -0.32 -0.01 0.00 0.00 0.00 0.00 60.65 60.91 1a6e s ILE 57 Cb -0.29 -2.75 0.06 0.00 0.01 0.00 0.00 42.46 39.49 1a6e s ILE 57 CO 0.28 0.53 0.00 0.54 0.00 0.00 0.00 174.94 176.29 1a6e s VAL 58 N -0.08 0.91 -0.34 2.92 0.11 0.75 -4.96 120.40 119.70 1a6e s VAL 58 Ca 0.03 -0.82 -0.08 0.00 -2.93 0.00 0.00 61.98 58.17 1a6e s VAL 58 Cb -0.13 -1.33 0.03 0.00 -1.53 0.00 0.00 36.38 33.42 1a6e s VAL 58 CO 0.02 -0.18 0.14 -0.63 -3.33 0.00 0.00 175.10 171.13 1a6e s ILE 59 N 1.68 4.15 0.34 7.04 1.01 -1.26 0.41 121.20 134.57 1a6e s ILE 59 Ca -0.03 -0.91 -0.07 0.00 0.00 0.00 0.00 60.65 59.65 1a6e s ILE 59 Cb -0.18 -3.28 0.01 0.00 0.01 0.00 0.00 42.46 39.02 1a6e s ILE 59 CO -0.07 -0.14 0.55 0.28 0.00 0.00 0.00 174.94 175.56 1a6e s THR 60 N 1.49 0.00 -0.00 2.92 -1.32 0.41 -4.78 115.64 114.36 1a6e s THR 60 Ca 0.01 -1.44 0.00 0.00 -1.21 0.00 0.00 61.69 59.05 1a6e s THR 60 Cb -0.19 -2.64 -0.00 0.00 -1.51 0.00 0.00 72.50 68.16 1a6e s THR 60 CO 0.04 0.00 0.00 -3.20 -2.21 0.00 0.00 174.62 169.25 1a6e n ASN 61 N -1.29 4.98 -4.51 8.08 2.85 -1.26 0.37 115.26 124.47 1a6e n ASN 61 Ca -0.01 0.00 -0.43 0.00 -0.11 0.00 0.00 54.58 54.02 1a6e n ASN 61 Cb 0.61 0.70 -0.06 0.00 1.24 0.00 0.00 39.78 42.27 1a6e n ASN 61 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1a6e n ASP 62 N -1.81 2.15 -0.19 1.20 2.03 -1.26 -4.83 116.55 113.84 1a6e n ASP 62 Ca -0.00 0.03 0.18 0.00 0.52 0.00 0.00 54.79 55.52 1a6e n ASP 62 Cb 0.30 -1.38 0.54 0.00 -0.72 0.00 0.00 41.12 39.87 1a6e n ASP 62 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1a6e h GLY 63 N 15.25 0.66 0.97 0.27 0.00 -1.94 0.42 103.07 118.71 1a6e h GLY 63 Ca -0.26 -0.15 -0.03 0.00 0.00 0.00 0.00 47.33 46.89 1a6e h GLY 63 CO 1.11 0.02 0.21 -2.08 0.00 0.00 0.00 176.54 175.80 1a6e h VAL 64 N 0.35 1.21 -0.17 4.60 2.07 -1.88 0.14 116.25 122.57 1a6e h VAL 64 Ca 0.41 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 1a6e h VAL 64 Cb 1.06 0.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 1a6e h VAL 64 CO -0.12 0.24 -0.03 0.74 0.02 0.00 0.00 177.57 178.42 1a6e h THR 65 N 0.67 1.28 -0.80 2.57 2.02 -1.55 0.43 112.91 117.52 1a6e h THR 65 Ca 0.17 -0.96 0.12 0.00 0.77 0.00 0.00 66.41 66.51 1a6e h THR 65 Cb 0.18 1.57 -0.08 0.00 -1.74 0.00 0.00 68.15 68.08 1a6e h THR 65 CO -0.01 0.29 0.42 0.40 0.37 0.00 0.00 175.52 176.98 1a6e h ILE 66 N 0.04 0.80 0.27 3.11 2.04 -0.77 0.14 117.51 123.14 1a6e h ILE 66 Ca 0.04 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1a6e h ILE 66 Cb 0.45 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1a6e h ILE 66 CO 0.01 0.12 -0.13 -0.07 0.00 0.00 0.00 178.15 178.08 1a6e h LEU 67 N 0.65 -0.31 -2.22 1.44 -0.00 -0.81 -1.12 115.31 112.94 1a6e h LEU 67 Ca 0.42 -0.19 0.06 0.00 -0.00 0.00 0.00 57.88 58.16 1a6e h LEU 67 Cb 0.51 0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.24 1a6e h LEU 67 CO -0.31 0.18 0.22 0.11 -0.00 0.00 0.00 178.44 178.63 1a6e h LYS 68 N -0.96 0.00 0.00 1.13 1.57 0.01 -3.04 116.57 115.28 1a6e h LYS 68 Ca -0.04 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1a6e h LYS 68 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1a6e h LYS 68 CO 0.06 0.00 -0.37 1.49 -0.57 0.00 0.00 179.45 180.06 1a6e h GLU 69 N 0.00 0.00 -6.68 3.15 4.57 -0.72 -3.48 114.58 111.42 1a6e h GLU 69 Ca 0.09 0.00 -0.55 0.00 -1.18 0.00 0.00 59.36 57.72 1a6e h GLU 69 Cb 0.53 0.00 0.20 0.00 -0.16 0.00 0.00 28.75 29.31 1a6e h GLU 69 CO -0.00 0.64 -0.46 0.00 -1.18 0.00 0.00 179.01 178.01 1a6e n MET 70 N -4.61 0.14 -3.02 1.92 0.00 -0.43 -4.90 117.12 106.23 1a6e n MET 70 Ca -0.13 0.09 -0.44 0.00 0.00 0.00 0.00 57.70 57.22 1a6e n MET 70 Cb 0.39 -1.83 -0.01 0.00 0.00 0.00 0.00 33.22 31.78 1a6e n MET 70 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1a6e s ASP 71 N -1.61 6.92 -0.04 3.17 2.15 -1.26 -5.00 116.67 121.01 1a6e s ASP 71 Ca 0.63 -2.72 -0.13 0.00 0.43 0.00 0.00 52.55 50.76 1a6e s ASP 71 Cb -0.31 -2.36 -0.05 0.00 -0.30 0.00 0.00 42.92 39.90 1a6e s ASP 71 CO 0.61 -0.79 0.35 0.68 -0.17 0.00 0.00 175.17 175.86 1a6e s VAL 72 N 1.50 5.15 -0.04 1.11 -7.23 -1.26 -4.99 120.40 114.64 1a6e s VAL 72 Ca 0.36 0.71 -0.02 0.00 -1.81 0.00 0.00 61.98 61.22 1a6e s VAL 72 Cb -0.05 -3.65 -0.02 0.00 0.56 0.00 0.00 36.38 33.22 1a6e s VAL 72 CO -0.05 0.55 -0.05 1.21 -0.31 0.00 0.00 175.10 176.45 1a6e n GLU 73 N 2.12 0.09 -1.63 4.82 0.00 -1.26 -4.84 120.64 119.94 1a6e n GLU 73 Ca -0.14 0.04 -0.48 0.00 0.00 0.00 0.00 57.16 56.58 1a6e n GLU 73 Cb 0.53 -0.72 -0.04 0.00 0.00 0.00 0.00 31.44 31.21 1a6e n GLU 73 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.13 178.71 1a6e n HIS 74 N -3.10 1.83 -0.36 4.31 -0.00 -1.26 -4.78 115.22 111.85 1a6e n HIS 74 Ca -0.08 0.50 0.04 0.00 0.46 0.00 0.00 57.72 58.64 1a6e n HIS 74 Cb 0.56 -2.41 0.20 0.00 -0.12 0.00 0.00 29.99 28.22 1a6e n HIS 74 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1a6e h PRO 75 N 4.48 1.09 -0.47 1.57 0.13 -1.99 -1.05 132.00 135.75 1a6e h PRO 75 Ca -0.45 -0.07 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1a6e h PRO 75 Cb 1.30 -0.25 -0.03 0.00 0.13 0.00 0.00 31.00 32.16 1a6e h PRO 75 CO 0.78 0.72 0.31 0.00 -0.23 0.00 0.00 178.00 179.58 1a6e h ALA 76 N 1.48 0.60 -0.65 -0.56 0.00 -1.89 -0.25 119.26 117.99 1a6e h ALA 76 Ca 0.44 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.35 1a6e h ALA 76 Cb 0.25 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 1a6e h ALA 76 CO -0.19 0.03 0.41 0.00 0.00 0.00 0.00 179.25 179.50 1a6e h ALA 77 N 1.18 0.84 -0.96 0.00 0.00 -1.61 -0.32 119.26 118.40 1a6e h ALA 77 Ca 0.18 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.08 1a6e h ALA 77 Cb -0.05 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.47 1a6e h ALA 77 CO -0.05 0.17 0.63 0.87 0.00 0.00 0.00 179.25 180.87 1a6e h LYS 78 N 0.80 1.23 -0.73 0.00 1.57 -0.48 -1.92 116.57 117.04 1a6e h LYS 78 Ca 0.26 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.94 1a6e h LYS 78 Cb 0.01 -0.28 -0.03 0.00 0.08 0.00 0.00 32.23 32.01 1a6e h LYS 78 CO -0.10 0.81 0.34 0.52 -0.57 0.00 0.00 179.45 180.46 1a6e h MET 79 N 1.27 1.05 -0.75 3.15 2.86 0.52 0.15 114.93 123.18 1a6e h MET 79 Ca 0.36 -0.15 -0.06 0.00 -2.06 0.00 0.00 59.70 57.79 1a6e h MET 79 Cb -0.10 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.34 1a6e h MET 79 CO -0.09 0.82 0.24 1.98 1.06 0.00 0.00 176.91 180.92 1a6e h MET 80 N 1.04 1.16 -0.13 1.72 -1.53 -0.64 -1.88 114.93 114.68 1a6e h MET 80 Ca 0.25 -0.25 -0.09 0.00 -3.44 0.00 0.00 59.70 56.17 1a6e h MET 80 Cb 0.12 -0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 30.99 1a6e h MET 80 CO -0.03 0.98 -0.33 0.28 0.14 0.00 0.00 176.91 177.95 1a6e h VAL 81 N 1.12 1.28 -0.78 -5.77 2.07 -0.59 -1.39 116.25 112.19 1a6e h VAL 81 Ca 0.24 -1.34 0.11 0.00 0.82 0.00 0.00 66.70 66.53 1a6e h VAL 81 Cb 0.30 1.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.56 1a6e h VAL 81 CO -0.01 0.40 0.51 -0.08 0.02 0.00 0.00 177.57 178.41 1a6e h GLU 82 N 0.23 0.63 0.46 1.57 4.81 0.11 -1.61 114.58 120.79 1a6e h GLU 82 Ca 0.03 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 1a6e h GLU 82 Cb 0.71 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1a6e h GLU 82 CO 0.05 0.42 -0.51 0.28 -0.73 0.00 0.00 179.01 178.52 1a6e h VAL 83 N 0.65 0.00 -0.59 0.32 2.07 -1.02 -2.81 116.25 114.87 1a6e h VAL 83 Ca 0.37 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.94 1a6e h VAL 83 Cb 0.53 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.23 1a6e h VAL 83 CO -0.14 0.00 -0.42 -1.28 0.02 0.00 0.00 177.57 175.75 1a6e h SER 84 N -0.98 -1.49 -0.79 0.57 0.87 -1.25 -1.20 113.55 109.27 1a6e h SER 84 Ca -0.06 0.22 0.12 0.00 -1.23 0.00 0.00 61.79 60.84 1a6e h SER 84 Cb 0.86 0.65 -0.08 0.00 -0.44 0.00 0.00 62.40 63.39 1a6e h SER 84 CO -0.09 -0.20 0.40 0.11 -0.53 0.00 0.00 176.83 176.51 1a6e h LYS 85 N -0.09 0.60 -0.38 2.24 1.57 -1.47 -1.12 116.57 117.93 1a6e h LYS 85 Ca 0.10 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1a6e h LYS 85 Cb 0.34 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 1a6e h LYS 85 CO -0.60 0.40 0.13 0.00 -0.57 0.00 0.00 179.45 178.81 1a6e h THR 86 N 0.62 1.21 -0.85 -0.16 1.03 -1.03 0.35 112.91 114.07 1a6e h THR 86 Ca 0.41 -0.67 -0.03 0.00 -0.01 0.00 0.00 66.41 66.11 1a6e h THR 86 Cb 0.50 0.93 -0.04 0.00 -1.07 0.00 0.00 68.15 68.47 1a6e h THR 86 CO -0.32 0.24 0.41 -0.61 -0.01 0.00 0.00 175.52 175.23 1a6e h GLN 87 N 0.47 1.23 -0.12 0.00 5.75 -0.78 -1.84 115.11 119.82 1a6e h GLN 87 Ca 0.12 -0.18 -0.00 0.00 -0.15 0.00 0.00 58.65 58.44 1a6e h GLN 87 Cb 0.24 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.56 1a6e h GLN 87 CO -0.01 0.94 0.07 0.22 -2.65 0.00 0.00 178.83 177.41 1a6e h ASP 88 N 1.22 0.15 0.15 -0.69 3.58 -0.78 -2.33 116.42 117.72 1a6e h ASP 88 Ca 0.29 -0.06 0.02 0.00 0.42 0.00 0.00 57.03 57.71 1a6e h ASP 88 Cb 0.12 -0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.09 1a6e h ASP 88 CO -0.04 0.16 -0.35 -1.28 -2.88 0.00 0.00 179.24 174.85 1a6e h SER 89 N 0.12 -1.01 -0.00 2.28 0.87 0.27 -1.96 113.55 114.12 1a6e h SER 89 Ca 0.04 0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1a6e h SER 89 Cb 0.04 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1a6e h SER 89 CO -0.01 -0.44 -0.01 -0.26 -0.53 0.00 0.00 176.83 175.58 1a6e h PHE 90 N -0.60 0.01 0.00 2.24 0.04 -1.38 -3.43 116.94 113.82 1a6e h PHE 90 Ca 0.02 -0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.49 1a6e h PHE 90 Cb 0.62 -0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.72 1a6e h PHE 90 CO -0.30 0.62 -1.96 1.55 -0.60 0.00 0.00 178.31 177.63 1a6e n VAL 91 N -4.79 1.20 0.00 -0.55 3.14 -0.89 -5.06 118.33 111.39 1a6e n VAL 91 Ca -0.09 -0.22 0.00 0.00 -2.96 0.00 0.00 64.34 61.08 1a6e n VAL 91 Cb 0.31 -1.85 0.00 0.00 -1.06 0.00 0.00 33.84 31.24 1a6e n VAL 91 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1a6e n GLY 92 N 1.72 2.21 2.99 7.55 0.00 -0.73 -4.79 105.19 114.14 1a6e n GLY 92 Ca -0.37 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1a6e n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1a6e s ASP 93 N -0.83 1.23 0.00 1.61 2.15 -1.26 -4.85 116.67 114.73 1a6e s ASP 93 Ca 0.00 -0.19 0.00 0.00 0.43 0.00 0.00 52.55 52.79 1a6e s ASP 93 Cb 0.00 -0.37 0.00 0.00 -0.30 0.00 0.00 42.92 42.25 1a6e s ASP 93 CO 0.00 0.05 0.00 0.61 -0.17 0.00 0.00 175.17 175.66 1a6e n GLY 94 N 3.38 1.49 0.17 2.66 0.00 -1.26 -4.75 105.19 106.88 1a6e n GLY 94 Ca -0.19 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 1a6e n GLY 94 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1a6e h THR 95 N 0.00 1.39 -0.30 2.61 1.35 -1.89 -0.70 112.91 115.37 1a6e h THR 95 Ca 0.00 -1.94 -0.14 0.00 -0.55 0.00 0.00 66.41 63.78 1a6e h THR 95 Cb 0.00 1.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 1a6e h THR 95 CO 0.00 0.57 -0.40 0.74 -0.25 0.00 0.00 175.52 176.18 1a6e h THR 96 N 0.14 1.29 -0.14 6.82 2.02 -1.95 -2.89 112.91 118.19 1a6e h THR 96 Ca -0.00 -1.57 -0.00 0.00 0.77 0.00 0.00 66.41 65.60 1a6e h THR 96 Cb 1.06 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 68.95 1a6e h THR 96 CO 0.09 0.51 0.07 0.74 0.37 0.00 0.00 175.52 177.29 1a6e h THR 97 N 0.58 1.12 -0.54 3.16 2.02 -1.87 -1.51 112.91 115.87 1a6e h THR 97 Ca 0.05 -0.35 0.06 0.00 0.77 0.00 0.00 66.41 66.94 1a6e h THR 97 Cb 0.93 1.10 -0.05 0.00 -1.74 0.00 0.00 68.15 68.39 1a6e h THR 97 CO 0.08 0.11 0.26 0.00 0.37 0.00 0.00 175.52 176.35 1a6e h ALA 98 N 0.94 0.70 -0.15 6.16 0.00 -1.14 -2.45 119.26 123.32 1a6e h ALA 98 Ca 0.05 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1a6e h ALA 98 Cb 0.12 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1a6e h ALA 98 CO -0.01 -0.10 0.06 0.28 0.00 0.00 0.00 179.25 179.48 1a6e h VAL 99 N 0.50 1.16 -1.00 0.00 2.07 -1.37 -1.17 116.25 116.43 1a6e h VAL 99 Ca 0.25 -0.47 0.11 0.00 0.82 0.00 0.00 66.70 67.40 1a6e h VAL 99 Cb 0.19 1.20 -0.08 0.00 -1.52 0.00 0.00 31.29 31.07 1a6e h VAL 99 CO -0.19 0.15 0.64 0.40 0.02 0.00 0.00 177.57 178.58 1a6e h ILE 100 N 0.08 0.95 -0.18 4.57 2.04 -1.02 -1.79 117.51 122.17 1a6e h ILE 100 Ca 0.05 -0.35 -0.12 0.00 1.00 0.00 0.00 64.86 65.44 1a6e h ILE 100 Cb 0.18 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 36.09 1a6e h ILE 100 CO -0.00 0.19 -0.35 0.40 0.00 0.00 0.00 178.15 178.39 1a6e h ILE 101 N 1.03 1.34 -0.53 -0.67 2.04 -1.21 -1.87 117.51 117.64 1a6e h ILE 101 Ca 0.49 -1.59 0.08 0.00 1.00 0.00 0.00 64.86 64.84 1a6e h ILE 101 Cb 0.43 1.91 -0.03 0.00 -0.74 0.00 0.00 36.82 38.38 1a6e h ILE 101 CO -0.25 0.49 0.36 0.00 0.00 0.00 0.00 178.15 178.74 1a6e h ALA 102 N 0.58 1.99 -0.11 1.87 0.00 -0.65 0.10 119.26 123.04 1a6e h ALA 102 Ca 0.01 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1a6e h ALA 102 Cb 0.95 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1a6e h ALA 102 CO 0.08 -0.09 -0.41 0.78 0.00 0.00 0.00 179.25 179.60 1a6e h GLY 103 N 0.39 0.52 0.19 0.00 0.00 -1.21 -2.48 103.07 100.48 1a6e h GLY 103 Ca 0.24 -0.70 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 1a6e h GLY 103 CO -0.06 0.62 -0.27 -1.33 0.00 0.00 0.00 176.54 175.51 1a6e h GLY 104 N 0.05 -1.06 -0.62 4.60 0.00 -0.35 0.32 103.07 106.01 1a6e h GLY 104 Ca -0.02 0.50 0.24 0.00 0.00 0.00 0.00 47.33 48.05 1a6e h GLY 104 CO 0.09 -0.34 0.13 1.41 0.00 0.00 0.00 176.54 177.83 1a6e h LEU 105 N -0.48 -0.22 -0.42 3.11 4.07 -0.95 0.34 115.31 120.77 1a6e h LEU 105 Ca -0.02 0.23 -0.13 0.00 0.08 0.00 0.00 57.88 58.03 1a6e h LEU 105 Cb 0.43 0.35 -0.01 0.00 1.08 0.00 0.00 40.66 42.52 1a6e h LEU 105 CO -0.07 -0.24 -0.24 -0.07 -1.08 0.00 0.00 178.44 176.74 1a6e h LEU 106 N 0.11 0.94 -0.69 1.67 4.07 -0.94 0.60 115.31 121.07 1a6e h LEU 106 Ca 0.55 -0.42 -0.12 0.00 0.08 0.00 0.00 57.88 57.97 1a6e h LEU 106 Cb 1.11 -0.26 -0.01 0.00 1.08 0.00 0.00 40.66 42.58 1a6e h LEU 106 CO -0.75 1.15 -0.28 -0.61 -1.08 0.00 0.00 178.44 176.87 1a6e h GLN 107 N 0.72 0.71 -0.14 1.13 4.15 0.19 -1.88 115.11 119.99 1a6e h GLN 107 Ca 0.09 -0.31 -0.05 0.00 0.77 0.00 0.00 58.65 59.15 1a6e h GLN 107 Cb 0.82 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.48 1a6e h GLN 107 CO 0.07 0.91 -0.12 1.96 -1.93 0.00 0.00 178.83 179.71 1a6e h GLN 108 N 0.61 0.33 -0.27 1.69 1.08 -0.27 -2.74 115.11 115.55 1a6e h GLN 108 Ca 0.08 -0.17 0.08 0.00 -1.45 0.00 0.00 58.65 57.18 1a6e h GLN 108 Cb 0.79 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.21 1a6e h GLN 108 CO 0.06 0.71 0.20 0.00 -0.95 0.00 0.00 178.83 178.86 1a6e h ALA 109 N 0.62 2.20 -0.91 3.87 0.00 -0.79 0.22 119.26 124.46 1a6e h ALA 109 Ca 0.02 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1a6e h ALA 109 Cb 0.64 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.40 1a6e h ALA 109 CO 0.03 -0.34 0.59 0.37 0.00 0.00 0.00 179.25 179.91 1a6e h GLN 110 N 0.00 1.12 0.59 0.00 5.75 -1.03 0.39 115.11 121.93 1a6e h GLN 110 Ca 0.13 -0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.53 1a6e h GLN 110 Cb 0.52 -0.25 0.01 0.00 1.07 0.00 0.00 27.48 28.83 1a6e h GLN 110 CO -0.00 0.74 -0.28 0.78 -2.65 0.00 0.00 178.83 177.41 1a6e h GLY 111 N 1.15 -0.83 -0.08 2.39 0.00 -0.53 -3.06 103.07 102.12 1a6e h GLY 111 Ca 0.36 0.31 0.23 0.00 0.00 0.00 0.00 47.33 48.23 1a6e h GLY 111 CO -0.12 -0.30 0.60 1.41 0.00 0.00 0.00 176.54 178.14 1a6e h LEU 112 N -1.19 0.69 -1.87 3.11 3.38 -1.16 0.35 115.31 118.62 1a6e h LEU 112 Ca -0.08 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1a6e h LEU 112 Cb 0.63 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1a6e h LEU 112 CO 0.13 0.14 -0.01 0.40 0.09 0.00 0.00 178.44 179.19 1a6e h ILE 113 N 0.61 1.04 -0.03 1.22 2.04 -0.23 -1.31 117.51 120.85 1a6e h ILE 113 Ca 0.63 -0.16 -0.08 0.00 1.00 0.00 0.00 64.86 66.25 1a6e h ILE 113 Cb 1.17 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.26 1a6e h ILE 113 CO -0.44 0.05 -0.35 0.78 0.00 0.00 0.00 178.15 178.19 1a6e h ASN 114 N 0.06 0.05 -0.28 1.72 2.35 -0.18 -2.77 115.58 116.53 1a6e h ASN 114 Ca 0.02 -0.02 -0.04 0.00 -0.55 0.00 0.00 56.30 55.71 1a6e h ASN 114 Cb 0.07 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 1a6e h ASN 114 CO 0.00 0.40 0.05 0.00 -1.65 0.00 0.00 177.43 176.23 1a6e n GLN 115 N -4.11 2.48 -3.00 0.81 6.02 -0.51 -4.86 117.38 114.20 1a6e n GLN 115 Ca -0.02 -1.35 -0.22 0.00 -0.01 0.00 0.00 57.00 55.40 1a6e n GLN 115 Cb 0.40 -1.77 0.04 0.00 1.02 0.00 0.00 30.24 29.92 1a6e n GLN 115 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1a6e n ASN 116 N 0.18 -6.14 -4.69 1.08 5.03 -1.04 -4.96 115.26 104.72 1a6e n ASN 116 Ca 0.15 -0.28 -0.40 0.00 0.87 0.00 0.00 54.58 54.92 1a6e n ASN 116 Cb 0.73 -4.95 -0.05 0.00 -1.02 0.00 0.00 39.78 34.48 1a6e n ASN 116 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1a6e s VAL 117 N -3.18 5.04 0.16 2.41 1.01 -1.14 -5.01 120.40 119.68 1a6e s VAL 117 Ca 0.30 1.29 -0.31 0.00 0.00 0.00 0.00 61.98 63.25 1a6e s VAL 117 Cb -0.13 -3.98 -0.09 0.00 0.00 0.00 0.00 36.38 32.18 1a6e s VAL 117 CO 0.37 0.18 1.43 -2.28 0.00 0.00 0.00 175.10 174.79 1a6e s HIS 118 N 1.41 3.17 -0.23 5.22 2.46 -1.26 -4.52 115.29 121.54 1a6e s HIS 118 Ca 0.32 0.93 0.10 0.00 0.47 0.00 0.00 55.06 56.87 1a6e s HIS 118 Cb -0.16 -3.75 0.53 0.00 -0.13 0.00 0.00 32.58 29.07 1a6e s HIS 118 CO 0.13 -2.59 1.19 -2.30 -2.47 0.00 0.00 174.74 168.69 1a6e n PRO 119 N 3.53 0.07 0.02 2.88 -0.02 -1.26 0.48 135.00 140.69 1a6e n PRO 119 Ca 0.11 0.50 -0.19 0.00 -2.02 0.00 0.00 63.50 61.89 1a6e n PRO 119 Cb 0.41 -1.94 -0.14 0.00 -0.02 0.00 0.00 33.50 31.81 1a6e n PRO 119 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1a6e h THR 120 N 0.00 1.50 0.09 3.45 2.02 -1.90 -2.24 112.91 115.83 1a6e h THR 120 Ca 0.00 -2.49 0.00 0.00 0.77 0.00 0.00 66.41 64.70 1a6e h THR 120 Cb 0.44 3.17 -0.01 0.00 -1.74 0.00 0.00 68.15 70.01 1a6e h THR 120 CO 0.00 0.69 -0.09 0.58 0.37 0.00 0.00 175.52 177.07 1a6e h VAL 121 N -0.48 0.79 -0.86 3.16 2.07 -0.35 -0.06 116.25 120.52 1a6e h VAL 121 Ca -0.14 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.46 1a6e h VAL 121 Cb 1.54 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 32.03 1a6e h VAL 121 CO 0.11 0.00 0.52 0.40 0.02 0.00 0.00 177.57 178.62 1a6e h ILE 122 N -0.20 0.96 -0.44 4.57 2.04 -1.43 0.78 117.51 123.79 1a6e h ILE 122 Ca 0.01 -0.30 -0.10 0.00 1.00 0.00 0.00 64.86 65.46 1a6e h ILE 122 Cb 0.20 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.26 1a6e h ILE 122 CO -0.03 0.16 -0.13 0.28 0.00 0.00 0.00 178.15 178.42 1a6e h SER 123 N 0.89 0.81 0.00 1.72 0.02 -0.77 -0.03 113.55 116.19 1a6e h SER 123 Ca 0.40 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.09 1a6e h SER 123 Cb 0.30 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1a6e h SER 123 CO -0.22 0.96 -0.00 -0.33 -1.14 0.00 0.00 176.83 176.10 1a6e h GLU 124 N 0.73 -0.00 -0.66 3.45 5.08 -0.28 -0.81 114.58 122.08 1a6e h GLU 124 Ca 0.12 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.57 1a6e h GLU 124 Cb 0.63 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.81 1a6e h GLU 124 CO 0.04 0.42 0.29 0.78 -1.00 0.00 0.00 179.01 179.54 1a6e h GLY 125 N -0.42 0.97 1.03 -3.84 0.00 -0.79 0.24 103.07 100.25 1a6e h GLY 125 Ca -0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 47.33 47.11 1a6e h GLY 125 CO 0.00 0.02 0.26 -0.97 0.00 0.00 0.00 176.54 175.84 1a6e h TYR 126 N 0.50 1.09 -0.02 5.60 -1.99 -0.96 -0.02 116.97 121.18 1a6e h TYR 126 Ca 0.33 -0.09 -0.00 0.00 2.00 0.00 0.00 58.73 60.97 1a6e h TYR 126 Cb 0.38 -0.32 -0.00 0.00 2.00 0.00 0.00 36.73 38.79 1a6e h TYR 126 CO -0.14 0.85 0.01 -0.09 -0.00 0.00 0.00 178.16 178.79 1a6e h ARG 127 N 1.01 0.02 -0.48 4.88 2.43 0.54 -1.23 114.38 121.55 1a6e h ARG 127 Ca 0.23 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.39 1a6e h ARG 127 Cb 0.24 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1a6e h ARG 127 CO -0.01 0.16 0.27 0.52 -1.51 0.00 0.00 179.97 179.39 1a6e h MET 128 N -0.11 0.67 -0.11 0.20 2.86 -0.46 -1.61 114.93 116.37 1a6e h MET 128 Ca 0.01 -0.08 0.02 0.00 -2.06 0.00 0.00 59.70 57.59 1a6e h MET 128 Cb 0.14 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.65 1a6e h MET 128 CO -0.00 0.52 -0.02 0.00 1.06 0.00 0.00 176.91 178.47 1a6e h ALA 129 N 1.11 0.08 -0.39 6.32 0.00 -0.91 -1.49 119.26 123.97 1a6e h ALA 129 Ca 0.17 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.20 1a6e h ALA 129 Cb 0.04 0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 1a6e h ALA 129 CO -0.03 -0.48 -0.20 1.03 0.00 0.00 0.00 179.25 179.57 1a6e h SER 130 N 0.01 -0.68 -0.01 0.00 0.87 -0.87 0.39 113.55 113.25 1a6e h SER 130 Ca 0.05 0.15 0.03 0.00 -1.23 0.00 0.00 61.79 60.80 1a6e h SER 130 Cb 0.08 0.36 -0.04 0.00 -0.44 0.00 0.00 62.40 62.36 1a6e h SER 130 CO -0.11 -0.23 -0.24 -0.33 -0.53 0.00 0.00 176.83 175.39 1a6e h GLU 131 N -0.13 -0.36 -0.65 2.24 3.07 -1.01 -0.96 114.58 116.79 1a6e h GLU 131 Ca 0.19 0.02 0.05 0.00 -0.50 0.00 0.00 59.36 59.13 1a6e h GLU 131 Cb 0.43 0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.38 1a6e h GLU 131 CO -0.47 -0.24 0.43 1.49 -1.40 0.00 0.00 179.01 178.81 1a6e h GLU 132 N -0.37 0.69 -0.69 2.33 4.57 -0.16 -2.10 114.58 118.85 1a6e h GLU 132 Ca 0.07 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1a6e h GLU 132 Cb 0.46 -0.15 -0.03 0.00 -0.16 0.00 0.00 28.75 28.86 1a6e h GLU 132 CO -0.22 0.45 0.34 0.00 -1.18 0.00 0.00 179.01 178.40 1a6e h ALA 133 N 1.64 0.89 -0.33 2.92 0.00 0.99 -0.52 119.26 124.84 1a6e h ALA 133 Ca 0.27 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.90 1a6e h ALA 133 Cb 0.18 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1a6e h ALA 133 CO -0.08 0.45 -0.34 0.87 0.00 0.00 0.00 179.25 180.15 1a6e h LYS 134 N 0.96 0.74 0.55 0.00 1.57 -0.64 -2.39 116.57 117.37 1a6e h LYS 134 Ca 0.24 -0.36 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1a6e h LYS 134 Cb 0.11 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 1a6e h LYS 134 CO -0.03 0.97 -0.45 -0.09 -0.57 0.00 0.00 179.45 179.28 1a6e h ARG 135 N 0.62 -0.95 -0.77 3.15 2.43 -0.94 -1.75 114.38 116.17 1a6e h ARG 135 Ca 0.06 0.06 0.16 0.00 -0.81 0.00 0.00 59.98 59.46 1a6e h ARG 135 Cb 0.87 0.22 -0.14 0.00 -0.42 0.00 0.00 29.97 30.49 1a6e h ARG 135 CO 0.08 -0.64 -0.15 0.28 -1.51 0.00 0.00 179.97 178.04 1a6e h VAL 136 N -0.99 0.24 -0.71 0.20 2.07 -1.03 0.23 116.25 116.26 1a6e h VAL 136 Ca -0.06 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.51 1a6e h VAL 136 Cb 0.84 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 1a6e h VAL 136 CO -0.01 0.00 0.41 0.40 0.02 0.00 0.00 177.57 178.39 1a6e h ILE 137 N 0.02 0.98 -0.64 4.57 2.04 -0.96 0.43 117.51 123.94 1a6e h ILE 137 Ca 0.39 -0.26 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1a6e h ILE 137 Cb 0.62 0.17 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1a6e h ILE 137 CO -0.77 0.14 0.40 0.44 0.00 0.00 0.00 178.15 178.36 1a6e h ASP 138 N 0.74 0.75 0.86 1.72 3.32 0.23 0.06 116.42 124.10 1a6e h ASP 138 Ca 0.32 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.28 1a6e h ASP 138 Cb 0.19 -0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.56 1a6e h ASP 138 CO -0.18 0.57 -0.41 -0.08 -1.72 0.00 0.00 179.24 177.41 1a6e h GLU 139 N 0.86 -1.11 0.00 3.56 4.81 0.95 -2.96 114.58 120.70 1a6e h GLU 139 Ca 0.23 0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.54 1a6e h GLU 139 Cb -0.06 0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.57 1a6e h GLU 139 CO -0.05 -0.74 0.00 0.44 -0.73 0.00 0.00 179.01 177.93 1a6e n ILE 140 N -5.40 0.07 -0.98 2.32 -5.35 0.13 -4.82 119.36 105.33 1a6e n ILE 140 Ca -0.14 0.02 -0.30 0.00 -0.27 0.00 0.00 62.75 62.05 1a6e n ILE 140 Cb 0.46 -0.76 0.24 0.00 -1.74 0.00 0.00 39.64 37.84 1a6e n ILE 140 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1a6e s SER 141 N -2.07 0.83 -0.12 7.28 1.04 0.00 -4.79 113.70 115.87 1a6e s SER 141 Ca 0.24 0.75 -0.05 0.00 0.48 0.00 0.00 55.95 57.37 1a6e s SER 141 Cb 0.11 -1.08 0.06 0.00 0.10 0.00 0.00 66.02 65.21 1a6e s SER 141 CO 0.20 -4.19 0.25 -0.89 0.98 0.00 0.00 173.24 169.59 1a6e s THR 142 N -2.89 -0.27 0.39 2.02 2.01 -0.39 -4.93 115.64 111.59 1a6e s THR 142 Ca 0.70 0.23 -0.27 0.00 0.31 0.00 0.00 61.69 62.67 1a6e s THR 142 Cb -0.12 -0.41 -0.09 0.00 0.01 0.00 0.00 72.50 71.89 1a6e s THR 142 CO 0.57 0.10 1.36 -0.54 -0.69 0.00 0.00 174.62 175.42 1a6e s LYS 143 N 1.98 4.02 -0.28 4.92 -0.14 -1.26 -0.45 119.74 128.53 1a6e s LYS 143 Ca -0.03 2.29 -0.29 0.00 -1.36 0.00 0.00 55.97 56.59 1a6e s LYS 143 Cb -0.11 -2.84 0.01 0.00 -1.68 0.00 0.00 37.83 33.21 1a6e s LYS 143 CO -0.08 -0.50 1.06 0.42 -0.76 0.00 0.00 175.35 175.49 1a6e s ILE 144 N -1.20 4.58 0.00 2.17 1.01 0.25 -4.86 121.20 123.16 1a6e s ILE 144 Ca 0.55 1.87 0.00 0.00 0.00 0.00 0.00 60.65 63.07 1a6e s ILE 144 Cb -0.41 -4.36 0.00 0.00 0.01 0.00 0.00 42.46 37.70 1a6e s ILE 144 CO 0.54 -0.34 0.00 0.61 0.00 0.00 0.00 174.94 175.75 1a6e n GLY 145 N 3.62 1.15 0.00 6.18 0.00 -1.26 -4.89 105.19 109.98 1a6e n GLY 145 Ca 0.12 -1.56 0.08 0.00 0.00 0.00 0.00 46.02 44.67 1a6e n GLY 145 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6e n ALA 146 N -3.00 1.88 0.98 4.61 0.00 -1.26 -2.51 120.51 121.21 1a6e n ALA 146 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 53.44 53.38 1a6e n ALA 146 Cb 0.00 -1.27 0.05 0.00 0.00 0.00 0.00 19.45 18.24 1a6e n ALA 146 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1a6e n ASP 147 N -1.33 1.38 -0.24 0.00 8.00 -1.26 -4.50 116.55 118.60 1a6e n ASP 147 Ca 0.07 -2.10 0.03 0.00 0.71 0.00 0.00 54.79 53.50 1a6e n ASP 147 Cb 0.15 -0.41 0.07 0.00 -0.02 0.00 0.00 41.12 40.91 1a6e n ASP 147 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1a6e n GLU 148 N 0.01 -0.09 0.08 -1.24 2.13 -1.04 -0.56 120.64 119.94 1a6e n GLU 148 Ca 0.04 1.02 -0.05 0.00 0.66 0.00 0.00 57.16 58.83 1a6e n GLU 148 Cb 0.31 -1.53 -0.03 0.00 0.27 0.00 0.00 31.44 30.46 1a6e n GLU 148 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 1a6e h LYS 149 N 0.00 -0.29 0.00 5.31 1.63 -1.91 0.19 116.57 121.50 1a6e h LYS 149 Ca 0.29 0.02 -0.07 0.00 -0.85 0.00 0.00 60.65 60.04 1a6e h LYS 149 Cb 0.46 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.14 1a6e h LYS 149 CO -0.67 -0.19 -0.35 0.00 -3.45 0.00 0.00 179.45 174.79 1a6e h ALA 150 N -1.47 1.29 0.41 5.00 0.00 -1.76 0.65 119.26 123.38 1a6e h ALA 150 Ca -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.56 1a6e h ALA 150 Cb 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1a6e h ALA 150 CO -0.03 0.43 -0.20 -0.07 0.00 0.00 0.00 179.25 179.39 1a6e h LEU 151 N 0.00 -0.46 -1.23 0.00 3.38 -0.69 -0.44 115.31 115.86 1a6e h LEU 151 Ca -0.00 -0.11 0.05 0.00 0.09 0.00 0.00 57.88 57.91 1a6e h LEU 151 Cb 0.67 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.49 1a6e h LEU 151 CO 0.04 -0.13 0.54 -0.07 0.09 0.00 0.00 178.44 178.91 1a6e h LEU 152 N -0.82 0.84 -0.44 1.67 3.38 -0.44 -0.47 115.31 119.03 1a6e h LEU 152 Ca -0.06 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 1a6e h LEU 152 Cb 0.54 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1a6e h LEU 152 CO 0.09 0.56 0.21 -0.07 0.09 0.00 0.00 178.44 179.32 1a6e h LEU 153 N 0.96 0.58 -1.28 1.67 4.07 -0.74 -0.34 115.31 120.24 1a6e h LEU 153 Ca 0.34 -0.13 -0.01 0.00 0.08 0.00 0.00 57.88 58.16 1a6e h LEU 153 Cb 0.12 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.68 1a6e h LEU 153 CO -0.11 0.55 0.36 0.11 -1.08 0.00 0.00 178.44 178.26 1a6e h LYS 154 N 0.57 0.85 0.33 1.13 1.57 0.32 -1.11 116.57 120.23 1a6e h LYS 154 Ca 0.15 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.84 1a6e h LYS 154 Cb 0.12 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1a6e h LYS 154 CO -0.02 0.61 -0.16 0.52 -0.57 0.00 0.00 179.45 179.83 1a6e h MET 155 N 0.86 -0.43 -0.78 3.15 2.86 -0.52 -2.38 114.93 117.70 1a6e h MET 155 Ca 0.22 0.03 0.18 0.00 -2.06 0.00 0.00 59.70 58.07 1a6e h MET 155 Cb -0.00 0.10 -0.13 0.00 0.06 0.00 0.00 31.60 31.63 1a6e h MET 155 CO -0.04 -0.12 0.12 0.00 1.06 0.00 0.00 176.91 177.92 1a6e h ALA 156 N -0.21 0.95 0.00 6.32 0.00 -0.59 -2.11 119.26 123.63 1a6e h ALA 156 Ca -0.05 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a6e h ALA 156 Cb 0.50 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1a6e h ALA 156 CO 0.07 -0.41 -0.00 1.96 0.00 0.00 0.00 179.25 180.88 1a6e h GLN 157 N 0.18 -0.00 -0.99 0.00 4.20 -1.17 -2.37 115.11 114.97 1a6e h GLN 157 Ca 0.44 0.00 0.19 0.00 0.06 0.00 0.00 58.65 59.35 1a6e h GLN 157 Cb 0.81 0.00 -0.11 0.00 0.30 0.00 0.00 27.48 28.48 1a6e h GLN 157 CO -0.61 0.17 0.58 1.15 -0.67 0.00 0.00 178.83 179.45 1a6e h THR 158 N -0.17 0.68 0.28 -0.54 2.02 -0.84 0.38 112.91 114.70 1a6e h THR 158 Ca -0.00 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 1a6e h THR 158 Cb 0.17 -0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.48 1a6e h THR 158 CO 0.00 0.13 -0.15 -1.28 0.37 0.00 0.00 175.52 174.59 1a6e h SER 159 N 0.71 -0.36 0.16 4.18 0.87 -1.23 -1.72 113.55 116.16 1a6e h SER 159 Ca 0.58 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 61.15 1a6e h SER 159 Cb 0.92 0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1a6e h SER 159 CO -0.40 -0.25 -0.02 -0.07 -0.53 0.00 0.00 176.83 175.56 1a6e h LEU 160 N -0.40 0.00 -1.38 2.23 3.38 -0.56 -2.87 115.31 115.72 1a6e h LEU 160 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1a6e h LEU 160 Cb 0.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1a6e h LEU 160 CO 0.05 0.02 0.20 0.78 0.09 0.00 0.00 178.44 179.58 1a6e h ASN 161 N 0.00 0.56 0.26 -0.43 -0.26 0.63 -2.87 115.58 113.48 1a6e h ASN 161 Ca -0.00 -0.05 -0.26 0.00 -0.56 0.00 0.00 56.30 55.42 1a6e h ASN 161 Cb 0.11 -0.14 0.01 0.00 -1.06 0.00 0.00 38.32 37.24 1a6e h ASN 161 CO 0.00 0.49 -1.10 0.28 -1.06 0.00 0.00 177.43 176.04 1a6e h SER 162 N 0.62 0.69 -4.31 5.81 0.02 -1.56 -3.40 113.55 111.43 1a6e h SER 162 Ca 0.16 -0.61 -0.50 0.00 -0.84 0.00 0.00 61.79 60.00 1a6e h SER 162 Cb 0.09 -0.22 0.11 0.00 0.14 0.00 0.00 62.40 62.52 1a6e h SER 162 CO -0.02 1.42 0.35 -0.54 -1.14 0.00 0.00 176.83 176.90 1a6e s LYS 163 N -3.09 2.41 0.04 3.45 3.01 -1.10 -4.73 119.74 119.72 1a6e s LYS 163 Ca -0.07 0.75 0.14 0.00 -1.01 0.00 0.00 55.97 55.78 1a6e s LYS 163 Cb 0.07 -1.95 0.62 0.00 -1.01 0.00 0.00 37.83 35.56 1a6e s LYS 163 CO 0.90 -1.42 1.46 -1.13 0.51 0.00 0.00 175.35 175.66 1a6e n SER 164 N -3.32 0.09 0.00 2.83 3.41 -1.26 -2.29 113.62 113.09 1a6e n SER 164 Ca 0.07 0.52 0.06 0.00 -0.26 0.00 0.00 58.87 59.26 1a6e n SER 164 Cb 0.55 -0.54 0.28 0.00 -0.26 0.00 0.00 64.21 64.24 1a6e n SER 164 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a6e n ALA 165 N -1.54 1.63 -0.33 7.33 0.00 -1.26 -3.22 120.51 123.11 1a6e n ALA 165 Ca 0.03 -0.05 0.21 0.00 0.00 0.00 0.00 53.44 53.63 1a6e n ALA 165 Cb 0.16 -1.20 0.43 0.00 0.00 0.00 0.00 19.45 18.85 1a6e n ALA 165 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1a6e h SER 166 N 0.00 0.50 -0.87 0.00 4.64 -1.29 0.40 113.55 116.94 1a6e h SER 166 Ca 0.00 0.18 0.36 0.00 -0.47 0.00 0.00 61.79 61.85 1a6e h SER 166 Cb 0.16 0.12 -0.16 0.00 -0.31 0.00 0.00 62.40 62.22 1a6e h SER 166 CO 0.00 -0.07 0.44 0.52 -0.87 0.00 0.00 176.83 176.84 1a6e n VAL 167 N -5.03 -0.36 -2.42 0.95 0.31 -1.20 0.13 118.33 110.72 1a6e n VAL 167 Ca 0.29 1.77 -0.11 0.00 -0.01 0.00 0.00 64.34 66.29 1a6e n VAL 167 Cb 0.89 -2.86 0.04 0.00 -0.91 0.00 0.00 33.84 31.00 1a6e n VAL 167 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1a6e n ALA 168 N -2.42 3.72 -0.09 3.52 0.00 0.14 -4.85 120.51 120.53 1a6e n ALA 168 Ca 0.32 -3.23 0.04 0.00 0.00 0.00 0.00 53.44 50.57 1a6e n ALA 168 Cb 1.09 -0.60 0.38 0.00 0.00 0.00 0.00 19.45 20.31 1a6e n ALA 168 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1a6e h LYS 169 N 2.31 0.67 -0.50 0.00 2.10 0.22 -0.71 116.57 120.66 1a6e h LYS 169 Ca 0.09 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.70 1a6e h LYS 169 Cb 1.41 -0.15 -0.02 0.00 -0.90 0.00 0.00 32.23 32.56 1a6e h LYS 169 CO 0.44 0.44 0.31 -0.44 -2.00 0.00 0.00 179.45 178.20 1a6e h ASP 170 N 0.69 0.59 0.05 7.07 3.32 -1.89 0.26 116.42 126.51 1a6e h ASP 170 Ca 0.22 -0.04 -0.12 0.00 0.02 0.00 0.00 57.03 57.10 1a6e h ASP 170 Cb 0.02 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 39.44 1a6e h ASP 170 CO -0.05 0.46 -0.51 0.50 -1.72 0.00 0.00 179.24 177.92 1a6e h LYS 171 N 0.67 0.25 -0.76 3.56 3.64 -1.84 -2.91 116.57 119.18 1a6e h LYS 171 Ca 0.18 -0.34 0.02 0.00 -1.27 0.00 0.00 60.65 59.24 1a6e h LYS 171 Cb -0.03 0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 1a6e h LYS 171 CO -0.04 1.10 0.51 -0.07 -2.27 0.00 0.00 179.45 178.68 1a6e h LEU 172 N -0.43 0.84 -0.56 5.20 3.38 -1.12 -1.42 115.31 121.21 1a6e h LEU 172 Ca -0.08 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 1a6e h LEU 172 Cb 1.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1a6e h LEU 172 CO 0.10 0.60 -0.06 0.00 0.09 0.00 0.00 178.44 179.17 1a6e h ALA 173 N 1.54 0.76 -0.25 1.53 0.00 -1.00 0.22 119.26 122.05 1a6e h ALA 173 Ca 0.29 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1a6e h ALA 173 Cb -0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1a6e h ALA 173 CO -0.07 0.63 0.12 1.49 0.00 0.00 0.00 179.25 181.42 1a6e h GLU 174 N 0.90 0.36 -0.59 0.00 4.57 -1.26 0.83 114.58 119.40 1a6e h GLU 174 Ca 0.15 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1a6e h GLU 174 Cb 0.62 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.11 1a6e h GLU 174 CO 0.04 0.35 0.38 0.82 -1.18 0.00 0.00 179.01 179.42 1a6e h ILE 175 N 0.28 1.16 -0.52 2.32 2.04 -0.94 0.41 117.51 122.25 1a6e h ILE 175 Ca 0.09 -0.30 -0.01 0.00 1.00 0.00 0.00 64.86 65.63 1a6e h ILE 175 Cb 0.11 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 1a6e h ILE 175 CO -0.01 0.15 0.27 0.28 0.00 0.00 0.00 178.15 178.85 1a6e h SER 176 N 0.80 0.67 -0.10 1.72 0.02 -0.39 0.00 113.55 116.26 1a6e h SER 176 Ca 0.21 -0.11 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 1a6e h SER 176 Cb -0.08 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.29 1a6e h SER 176 CO -0.05 0.58 0.02 0.22 -1.14 0.00 0.00 176.83 176.47 1a6e h TYR 177 N 0.70 0.18 0.23 3.45 3.20 -0.30 -2.65 116.97 121.78 1a6e h TYR 177 Ca 0.18 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.03 1a6e h TYR 177 Cb 0.08 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 1a6e h TYR 177 CO -0.01 0.36 -0.21 1.49 -1.64 0.00 0.00 178.16 178.15 1a6e h GLU 178 N -0.06 -0.45 -0.21 1.82 4.57 -0.09 -1.69 114.58 118.46 1a6e h GLU 178 Ca 0.03 0.03 0.05 0.00 -1.18 0.00 0.00 59.36 58.29 1a6e h GLU 178 Cb 0.28 0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.92 1a6e h GLU 178 CO 0.00 -0.30 -0.12 0.00 -1.18 0.00 0.00 179.01 177.41 1a6e h ALA 179 N 0.23 0.04 -0.14 2.92 0.00 -1.00 -1.78 119.26 119.53 1a6e h ALA 179 Ca -0.01 0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1a6e h ALA 179 Cb 0.43 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1a6e h ALA 179 CO -0.04 -0.55 -0.05 0.28 0.00 0.00 0.00 179.25 178.90 1a6e h VAL 180 N -0.11 1.30 -1.00 0.00 2.07 -1.50 -2.94 116.25 114.07 1a6e h VAL 180 Ca 0.12 -1.04 0.22 0.00 0.82 0.00 0.00 66.70 66.81 1a6e h VAL 180 Cb 0.29 1.70 -0.12 0.00 -1.52 0.00 0.00 31.29 31.63 1a6e h VAL 180 CO -0.28 0.30 0.60 0.50 0.02 0.00 0.00 177.57 178.71 1a6e h LYS 181 N -0.03 0.65 0.19 1.57 3.11 -1.10 -1.15 116.57 119.80 1a6e h LYS 181 Ca 0.03 -0.04 -0.01 0.00 -2.81 0.00 0.00 60.65 57.83 1a6e h LYS 181 Cb 0.49 -0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.58 1a6e h LYS 181 CO 0.02 0.43 -0.09 0.77 -2.81 0.00 0.00 179.45 177.77 1a6e h SER 182 N 0.67 -0.21 -0.02 4.20 0.02 -1.20 -3.09 113.55 113.91 1a6e h SER 182 Ca 0.61 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.48 1a6e h SER 182 Cb 1.05 0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.65 1a6e h SER 182 CO -0.43 -0.06 0.00 1.33 -1.14 0.00 0.00 176.83 176.53 1a6e n VAL 183 N -5.15 0.02 -2.70 2.27 0.24 -0.77 -4.67 118.33 107.56 1a6e n VAL 183 Ca -0.09 -0.11 -0.43 0.00 -2.04 0.00 0.00 64.34 61.67 1a6e n VAL 183 Cb 0.16 -0.09 -0.03 0.00 -1.47 0.00 0.00 33.84 32.41 1a6e n VAL 183 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1a6e s ALA 184 N -1.98 3.43 -0.28 2.33 0.00 -0.51 -4.24 121.76 120.52 1a6e s ALA 184 Ca 0.40 -0.25 -0.15 0.00 0.00 0.00 0.00 51.96 51.96 1a6e s ALA 184 Cb 0.20 -3.64 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 1a6e s ALA 184 CO 0.32 -1.60 0.36 -1.21 0.00 0.00 0.00 175.76 173.63 1a6e s GLU 185 N 3.65 3.96 -0.88 0.00 2.02 0.46 -4.84 118.70 123.07 1a6e s GLU 185 Ca 0.43 -0.04 -0.19 0.00 0.02 0.00 0.00 54.97 55.19 1a6e s GLU 185 Cb -0.12 -3.67 0.12 0.00 0.10 0.00 0.00 34.13 30.56 1a6e s GLU 185 CO 0.18 -0.30 1.09 -1.17 0.02 0.00 0.00 175.26 175.08 1a6e s LEU 186 N 2.05 4.94 0.00 1.80 2.96 -1.26 0.45 118.68 129.62 1a6e s LEU 186 Ca 0.14 -1.85 0.00 0.00 -0.22 0.00 0.00 54.13 52.20 1a6e s LEU 186 Cb -0.16 -2.40 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1a6e s LEU 186 CO 0.10 -1.13 0.00 0.54 -1.32 0.00 0.00 176.35 174.54 1a6e n ARG 187 N 6.76 0.00 -0.69 1.98 1.74 0.20 -4.55 116.66 122.10 1a6e n ARG 187 Ca 0.19 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.16 1a6e n ARG 187 Cb 0.48 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.83 1a6e n ARG 187 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1a6e n ASP 188 N 0.00 3.83 0.00 0.55 8.00 -1.26 -4.18 116.55 123.49 1a6e n ASP 188 Ca 0.00 -2.18 0.00 0.00 0.71 0.00 0.00 54.79 53.32 1a6e n ASP 188 Cb 0.00 -0.97 0.00 0.00 -0.02 0.00 0.00 41.12 40.13 1a6e n ASP 188 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a6e n GLY 189 N 2.87 0.23 3.22 0.44 0.00 -1.26 -4.96 105.19 105.73 1a6e n GLY 189 Ca 0.32 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.07 1a6e n GLY 189 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a6e s LYS 190 N -1.08 1.63 0.39 1.61 -0.14 -1.26 -5.08 119.74 115.80 1a6e s LYS 190 Ca 0.00 -0.76 -0.09 0.00 -1.36 0.00 0.00 55.97 53.76 1a6e s LYS 190 Cb 0.00 -1.59 -0.06 0.00 -1.68 0.00 0.00 37.83 34.50 1a6e s LYS 190 CO 0.00 0.43 0.73 0.71 -0.76 0.00 0.00 175.35 176.47 1a6e s TYR 191 N -0.52 3.47 -0.08 3.18 2.02 -1.26 0.61 117.35 124.77 1a6e s TYR 191 Ca 0.08 0.97 -0.04 0.00 -0.37 0.00 0.00 57.07 57.72 1a6e s TYR 191 Cb -0.08 -2.38 0.04 0.00 -0.40 0.00 0.00 41.96 39.14 1a6e s TYR 191 CO -0.00 -0.06 0.17 1.52 -1.57 0.00 0.00 175.55 175.61 1a6e s TYR 192 N -2.32 -0.21 -0.28 2.71 1.13 0.17 -4.67 117.35 113.88 1a6e s TYR 192 Ca 0.50 0.58 -0.00 0.00 -1.41 0.00 0.00 57.07 56.73 1a6e s TYR 192 Cb -0.10 -0.06 0.05 0.00 -1.10 0.00 0.00 41.96 40.74 1a6e s TYR 192 CO 0.31 -0.20 -0.04 0.08 -2.51 0.00 0.00 175.55 173.19 1a6e s VAL 193 N 1.31 2.74 -0.40 -3.49 1.01 -1.26 -0.41 120.40 119.90 1a6e s VAL 193 Ca -0.08 -1.37 -0.18 0.00 0.00 0.00 0.00 61.98 60.35 1a6e s VAL 193 Cb -0.11 -2.54 0.01 0.00 0.00 0.00 0.00 36.38 33.74 1a6e s VAL 193 CO -0.07 -0.01 0.50 -0.62 0.00 0.00 0.00 175.10 174.90 1a6e s ASP 194 N 1.23 6.25 0.23 3.32 2.15 -1.26 -4.93 116.67 123.66 1a6e s ASP 194 Ca -0.05 -0.41 0.20 0.00 0.43 0.00 0.00 52.55 52.73 1a6e s ASP 194 Cb -0.19 -2.26 0.93 0.00 -0.30 0.00 0.00 42.92 41.10 1a6e s ASP 194 CO -0.03 -0.59 1.62 0.49 -0.17 0.00 0.00 175.17 176.49 1a6e n PHE 195 N 5.78 0.64 1.28 -5.34 3.01 -1.26 -1.78 117.46 119.80 1a6e n PHE 195 Ca -0.05 0.28 0.00 0.00 1.01 0.00 0.00 57.45 58.69 1a6e n PHE 195 Cb 0.48 -0.95 0.00 0.00 -0.01 0.00 0.00 39.48 39.00 1a6e n PHE 195 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1a6e n ASP 196 N -2.11 0.19 -0.15 4.37 8.00 -1.26 -0.63 116.55 124.96 1a6e n ASP 196 Ca 0.01 -1.47 0.03 0.00 0.71 0.00 0.00 54.79 54.06 1a6e n ASP 196 Cb 0.15 -0.10 0.01 0.00 -0.02 0.00 0.00 41.12 41.16 1a6e n ASP 196 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1a6e n ASN 197 N -0.33 1.09 -4.00 -2.24 4.13 -0.73 -4.65 115.26 108.53 1a6e n ASN 197 Ca 0.00 -1.05 -0.31 0.00 1.68 0.00 0.00 54.58 54.90 1a6e n ASN 197 Cb 0.05 0.29 -0.15 0.00 -1.54 0.00 0.00 39.78 38.43 1a6e n ASN 197 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1a6e s ILE 198 N -0.73 2.11 -0.23 2.41 1.01 0.20 -0.30 121.20 125.65 1a6e s ILE 198 Ca 0.05 -2.10 -0.21 0.00 0.00 0.00 0.00 60.65 58.38 1a6e s ILE 198 Cb 0.04 -2.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 1a6e s ILE 198 CO 0.10 -0.49 0.68 -1.58 0.00 0.00 0.00 174.94 173.65 1a6e s GLN 199 N 1.02 4.16 -0.22 2.79 2.00 0.29 -4.97 119.66 124.73 1a6e s GLN 199 Ca 0.07 0.66 -0.00 0.00 -2.00 0.00 0.00 55.36 54.09 1a6e s GLN 199 Cb -0.19 -3.63 0.03 0.00 0.80 0.00 0.00 33.01 30.02 1a6e s GLN 199 CO -0.09 -0.39 -0.11 0.08 -0.50 0.00 0.00 175.29 174.28 1a6e s VAL 200 N 2.40 2.55 0.11 1.34 1.01 -1.26 0.08 120.40 126.63 1a6e s VAL 200 Ca 0.29 -1.03 0.10 0.00 0.00 0.00 0.00 61.98 61.34 1a6e s VAL 200 Cb -0.16 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1a6e s VAL 200 CO 0.09 0.31 -0.23 -0.69 0.00 0.00 0.00 175.10 174.57 1a6e s VAL 201 N 1.30 2.47 -0.10 2.92 1.01 0.25 -4.97 120.40 123.28 1a6e s VAL 201 Ca 0.01 -1.58 0.03 0.00 0.00 0.00 0.00 61.98 60.44 1a6e s VAL 201 Cb -0.16 -2.09 0.01 0.00 0.00 0.00 0.00 36.38 34.14 1a6e s VAL 201 CO -0.07 0.15 -0.18 -1.59 0.00 0.00 0.00 175.10 173.41 1a6e s LYS 202 N -1.93 2.46 -0.08 2.72 -2.85 -1.26 0.37 119.74 119.18 1a6e s LYS 202 Ca 0.15 -0.66 -0.02 0.00 -1.00 0.00 0.00 55.97 54.44 1a6e s LYS 202 Cb -0.10 -1.98 0.03 0.00 -2.06 0.00 0.00 37.83 33.72 1a6e s LYS 202 CO 0.07 0.04 0.02 0.21 0.10 0.00 0.00 175.35 175.79 1a6e s LYS 203 N 0.70 0.41 1.25 1.78 2.47 -0.43 -4.96 119.74 120.96 1a6e s LYS 203 Ca -0.12 0.12 -0.20 0.00 -1.56 0.00 0.00 55.97 54.20 1a6e s LYS 203 Cb -0.16 -1.01 0.31 0.00 -1.46 0.00 0.00 37.83 35.50 1a6e s LYS 203 CO 0.03 -0.36 1.07 1.14 0.16 0.00 0.00 175.35 177.39 1a6e s GLN 204 N 2.02 -1.62 0.00 4.03 -2.07 -1.26 -3.61 119.66 117.14 1a6e s GLN 204 Ca 0.04 -0.04 0.00 0.00 -1.82 0.00 0.00 55.36 53.55 1a6e s GLN 204 Cb -0.13 -1.55 0.00 0.00 -1.09 0.00 0.00 33.01 30.25 1a6e s GLN 204 CO -0.05 -3.98 0.00 0.41 -1.32 0.00 0.00 175.29 170.35 1a6e n GLY 205 N -0.46 0.63 3.31 2.60 0.00 0.27 -4.78 105.19 106.75 1a6e n GLY 205 Ca 0.13 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 1a6e n GLY 205 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1a6e s GLY 206 N -2.71 -0.24 0.95 -0.02 0.00 -1.19 -4.94 107.32 99.17 1a6e s GLY 206 Ca 0.00 0.20 -0.12 0.00 0.00 0.00 0.00 44.72 44.80 1a6e s GLY 206 CO 0.00 -0.05 1.11 0.00 0.00 0.00 0.00 173.10 174.16 1a6e s ALA 207 N -2.67 1.37 0.13 3.20 0.00 -1.26 -0.62 121.76 121.92 1a6e s ALA 207 Ca -0.04 -0.38 -0.16 0.00 0.00 0.00 0.00 51.96 51.38 1a6e s ALA 207 Cb -0.00 -3.09 -0.01 0.00 0.00 0.00 0.00 23.12 20.01 1a6e s ALA 207 CO -0.04 -2.53 1.71 0.82 0.00 0.00 0.00 175.76 175.72 1a6e h ILE 208 N -1.67 1.17 -0.12 0.00 2.04 -1.93 -1.59 117.51 115.40 1a6e h ILE 208 Ca -0.52 -0.48 0.03 0.00 1.00 0.00 0.00 64.86 64.89 1a6e h ILE 208 Cb 1.32 0.79 -0.00 0.00 -0.74 0.00 0.00 36.82 38.19 1a6e h ILE 208 CO 0.59 0.18 0.32 0.44 0.00 0.00 0.00 178.15 179.68 1a6e h ASP 209 N 0.47 0.00 0.43 1.72 5.19 -1.93 0.80 116.42 123.10 1a6e h ASP 209 Ca 0.13 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.54 1a6e h ASP 209 Cb 0.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.63 1a6e h ASP 209 CO -0.02 0.00 0.00 0.47 -3.12 0.00 0.00 179.24 176.57 1a6e n ASP 210 N -3.21 0.00 -4.74 6.45 8.00 -0.60 -4.83 116.55 117.63 1a6e n ASP 210 Ca 0.01 -0.05 -0.42 0.00 0.71 0.00 0.00 54.79 55.04 1a6e n ASP 210 Cb 0.41 -0.28 -0.02 0.00 -0.02 0.00 0.00 41.12 41.21 1a6e n ASP 210 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1a6e s THR 211 N -2.56 2.10 0.13 -3.53 2.01 0.27 -4.71 115.64 109.35 1a6e s THR 211 Ca 0.22 0.08 -0.02 0.00 0.31 0.00 0.00 61.69 62.29 1a6e s THR 211 Cb 0.15 -3.05 -0.04 0.00 0.01 0.00 0.00 72.50 69.57 1a6e s THR 211 CO 0.35 0.01 0.07 0.00 -0.69 0.00 0.00 174.62 174.36 1a6e s GLN 212 N -0.10 0.92 -0.26 4.92 -2.07 -1.00 -4.96 119.66 117.11 1a6e s GLN 212 Ca 0.66 -1.40 -0.10 0.00 -1.82 0.00 0.00 55.36 52.70 1a6e s GLN 212 Cb -0.48 0.25 -0.04 0.00 -1.09 0.00 0.00 33.01 31.65 1a6e s GLN 212 CO 0.44 -0.26 0.15 -1.17 -1.32 0.00 0.00 175.29 173.13 1a6e s LEU 213 N -3.03 3.89 -0.22 2.60 2.96 -1.26 -0.24 118.68 123.38 1a6e s LEU 213 Ca 0.22 -0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.09 1a6e s LEU 213 Cb 0.07 -2.06 0.01 0.00 0.50 0.00 0.00 46.19 44.71 1a6e s LEU 213 CO 0.01 -0.00 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.32 1a6e s ILE 214 N 1.47 2.98 -0.44 6.68 -1.09 0.15 -4.98 121.20 125.97 1a6e s ILE 214 Ca 0.07 -0.72 -0.28 0.00 -2.23 0.00 0.00 60.65 57.49 1a6e s ILE 214 Cb -0.15 -2.38 -0.01 0.00 -1.58 0.00 0.00 42.46 38.34 1a6e s ILE 214 CO 0.07 0.39 1.71 0.20 -1.23 0.00 0.00 174.94 176.09 1a6e s ASN 215 N 1.40 5.83 0.00 3.58 -0.87 -1.26 -0.12 114.94 123.50 1a6e s ASN 215 Ca 0.04 0.88 0.00 0.00 -1.57 0.00 0.00 52.86 52.22 1a6e s ASN 215 Cb -0.15 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 38.55 1a6e s ASN 215 CO -0.06 -1.83 0.00 0.61 -2.57 0.00 0.00 177.10 173.25 1a6e n GLY 216 N 5.42 0.90 3.04 0.66 0.00 -1.22 -4.13 105.19 109.86 1a6e n GLY 216 Ca 0.20 -1.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.03 1a6e n GLY 216 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a6e s ILE 217 N -2.06 1.89 0.04 -0.61 -1.09 -0.91 -2.35 121.20 116.11 1a6e s ILE 217 Ca 0.00 -1.19 -0.22 0.00 -2.23 0.00 0.00 60.65 57.01 1a6e s ILE 217 Cb 0.00 -1.92 -0.06 0.00 -1.58 0.00 0.00 42.46 38.90 1a6e s ILE 217 CO 0.00 0.18 0.64 -0.63 -1.23 0.00 0.00 174.94 173.90 1a6e s ILE 218 N 1.28 4.78 -0.05 2.92 1.01 -1.26 -2.04 121.20 127.84 1a6e s ILE 218 Ca -0.02 1.36 0.06 0.00 0.00 0.00 0.00 60.65 62.05 1a6e s ILE 218 Cb -0.17 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.31 1a6e s ILE 218 CO -0.08 0.45 -0.23 -0.69 0.00 0.00 0.00 174.94 174.39 1a6e s VAL 219 N -0.46 1.88 -1.28 2.92 1.01 0.47 -4.98 120.40 119.96 1a6e s VAL 219 Ca 0.33 -0.97 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 1a6e s VAL 219 Cb -0.19 -1.59 0.14 0.00 0.00 0.00 0.00 36.38 34.73 1a6e s VAL 219 CO 0.20 0.53 1.71 -0.67 0.00 0.00 0.00 175.10 176.87 1a6e n ASP 220 N 2.97 4.98 -3.67 3.32 -0.08 -1.26 -0.92 116.55 121.89 1a6e n ASP 220 Ca -0.17 -2.99 -0.13 0.00 -1.51 0.00 0.00 54.79 49.98 1a6e n ASP 220 Cb 0.52 -1.58 -0.08 0.00 2.34 0.00 0.00 41.12 42.32 1a6e n ASP 220 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1a6e s LYS 221 N 1.83 0.68 0.38 -0.67 -0.14 -1.26 -4.98 119.74 115.58 1a6e s LYS 221 Ca 0.44 0.86 0.08 0.00 -1.36 0.00 0.00 55.97 55.99 1a6e s LYS 221 Cb 0.04 0.31 -0.03 0.00 -1.68 0.00 0.00 37.83 36.47 1a6e s LYS 221 CO 0.01 -0.09 0.31 -1.83 -0.76 0.00 0.00 175.35 172.98 1a6e s GLU 222 N 0.48 2.54 0.34 1.68 -1.05 -1.25 -2.17 118.70 119.27 1a6e s GLU 222 Ca -0.01 -1.49 -0.29 0.00 -0.15 0.00 0.00 54.97 53.02 1a6e s GLU 222 Cb -0.04 -2.35 -0.11 0.00 -0.44 0.00 0.00 34.13 31.19 1a6e s GLU 222 CO -0.02 -0.06 1.53 0.36 0.95 0.00 0.00 175.26 178.02 1a6e n LYS 223 N -1.42 2.68 0.13 -4.83 2.85 -1.26 -4.70 118.16 111.61 1a6e n LYS 223 Ca 0.01 0.94 0.10 0.00 -1.05 0.00 0.00 58.31 58.31 1a6e n LYS 223 Cb 0.61 -2.70 0.48 0.00 -0.65 0.00 0.00 35.03 32.78 1a6e n LYS 223 CO 0.00 0.00 0.00 1.55 -0.05 0.00 0.00 177.40 178.90 1a6e n VAL 224 N 1.14 1.13 -3.78 0.58 3.14 -0.15 -4.71 118.33 115.68 1a6e n VAL 224 Ca 0.04 0.59 -0.13 0.00 -2.96 0.00 0.00 64.34 61.88 1a6e n VAL 224 Cb 0.38 -1.56 -0.12 0.00 -1.06 0.00 0.00 33.84 31.47 1a6e n VAL 224 CO 0.00 0.00 0.00 -2.28 -6.46 0.00 0.00 176.83 168.09 1a6e s HIS 225 N -3.41 -0.26 0.53 1.45 5.65 -1.26 -5.04 115.29 112.95 1a6e s HIS 225 Ca -0.00 0.63 0.33 0.00 0.25 0.00 0.00 55.06 56.27 1a6e s HIS 225 Cb 0.06 0.08 1.49 0.00 -1.18 0.00 0.00 32.58 33.03 1a6e s HIS 225 CO 0.21 -0.14 1.83 -1.35 -0.65 0.00 0.00 174.74 174.64 1a6e h PRO 226 N 6.04 0.04 -0.00 2.88 0.11 -2.00 -1.30 132.00 137.76 1a6e h PRO 226 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1a6e h PRO 226 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1a6e h PRO 226 CO 0.37 0.02 -0.10 0.41 -0.21 0.00 0.00 178.00 178.50 1a6e n GLY 227 N -1.73 -0.96 3.80 -0.55 0.00 -1.26 -4.90 105.19 99.59 1a6e n GLY 227 Ca 0.23 -0.26 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 1a6e n GLY 227 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1a6e s MET 228 N -2.46 3.84 0.63 1.61 -1.94 -0.49 -4.91 119.30 115.58 1a6e s MET 228 Ca 0.30 1.38 -0.17 0.00 -1.71 0.00 0.00 55.69 55.48 1a6e s MET 228 Cb 0.20 -2.15 -0.02 0.00 2.01 0.00 0.00 34.83 34.88 1a6e s MET 228 CO 0.47 -0.40 1.20 -1.25 -0.01 0.00 0.00 175.02 175.03 1a6e s PRO 229 N -3.15 2.77 0.10 2.03 0.04 -1.26 -4.95 135.00 130.58 1a6e s PRO 229 Ca 0.66 1.76 0.27 0.00 0.04 0.00 0.00 61.00 63.73 1a6e s PRO 229 Cb -0.17 -1.91 0.86 0.00 0.04 0.00 0.00 34.50 33.32 1a6e s PRO 229 CO 0.21 -1.35 1.72 -0.25 0.04 0.00 0.00 177.00 177.37 1a6e n ASP 230 N -1.93 0.47 -3.68 6.66 9.92 -1.26 -4.85 116.55 121.87 1a6e n ASP 230 Ca 0.13 0.39 -0.14 0.00 -0.53 0.00 0.00 54.79 54.64 1a6e n ASP 230 Cb 0.50 -0.43 -0.09 0.00 -0.64 0.00 0.00 41.12 40.46 1a6e n ASP 230 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1a6e s VAL 231 N -3.06 -0.00 -0.05 2.53 0.11 -1.26 -0.85 120.40 117.82 1a6e s VAL 231 Ca 0.11 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.19 1a6e s VAL 231 Cb 0.15 -0.78 0.01 0.00 -1.53 0.00 0.00 36.38 34.24 1a6e s VAL 231 CO 0.60 0.00 -0.11 0.68 -3.33 0.00 0.00 175.10 172.95 1a6e s VAL 232 N 0.30 0.98 0.05 2.04 -7.23 0.42 -4.99 120.40 111.97 1a6e s VAL 232 Ca -0.00 -0.41 0.01 0.00 -1.81 0.00 0.00 61.98 59.76 1a6e s VAL 232 Cb -0.04 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.96 1a6e s VAL 232 CO 0.01 0.31 0.14 -0.54 -0.31 0.00 0.00 175.10 174.71 1a6e s LYS 233 N 0.55 3.19 -0.78 4.82 1.02 -1.26 -0.64 119.74 126.64 1a6e s LYS 233 Ca -0.11 -0.52 -0.02 0.00 0.02 0.00 0.00 55.97 55.34 1a6e s LYS 233 Cb -0.14 -2.91 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 1a6e s LYS 233 CO 0.02 0.61 0.63 -0.25 -0.92 0.00 0.00 175.35 175.45 1a6e n ASP 234 N 0.57 -5.80 -4.77 2.83 8.00 0.27 -4.90 116.55 112.75 1a6e n ASP 234 Ca -0.08 -0.64 -0.39 0.00 0.71 0.00 0.00 54.79 54.39 1a6e n ASP 234 Cb 0.52 -2.80 -0.06 0.00 -0.02 0.00 0.00 41.12 38.76 1a6e n ASP 234 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a6e s ALA 235 N -2.91 3.46 -0.60 2.24 0.00 0.25 -4.97 121.76 119.24 1a6e s ALA 235 Ca 0.02 0.24 -0.10 0.00 0.00 0.00 0.00 51.96 52.13 1a6e s ALA 235 Cb -0.00 -2.88 0.15 0.00 0.00 0.00 0.00 23.12 20.39 1a6e s ALA 235 CO 0.85 0.25 0.49 0.15 0.00 0.00 0.00 175.76 177.49 1a6e s LYS 236 N -0.78 2.83 -0.35 0.00 3.01 -1.26 -2.58 119.74 120.62 1a6e s LYS 236 Ca 0.35 -2.08 -0.29 0.00 -1.01 0.00 0.00 55.97 52.94 1a6e s LYS 236 Cb -0.21 -4.06 0.01 0.00 -1.01 0.00 0.00 37.83 32.56 1a6e s LYS 236 CO 0.23 -1.23 1.31 0.42 0.51 0.00 0.00 175.35 176.59 1a6e s ILE 237 N 0.82 4.10 -0.35 2.17 1.01 -0.10 0.60 121.20 129.44 1a6e s ILE 237 Ca 0.11 1.20 -0.15 0.00 0.00 0.00 0.00 60.65 61.81 1a6e s ILE 237 Cb -0.22 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.03 1a6e s ILE 237 CO -0.03 -0.60 0.33 0.00 0.00 0.00 0.00 174.94 174.64 1a6e s ALA 238 N 4.63 3.49 -0.36 9.38 0.00 0.11 0.58 121.76 139.60 1a6e s ALA 238 Ca 0.56 -1.32 -0.12 0.00 0.00 0.00 0.00 51.96 51.08 1a6e s ALA 238 Cb -0.15 -2.80 0.01 0.00 0.00 0.00 0.00 23.12 20.18 1a6e s ALA 238 CO 0.26 -1.11 0.23 -0.51 0.00 0.00 0.00 175.76 174.62 1a6e s LEU 239 N 1.92 4.65 0.14 0.00 1.02 -1.26 -1.37 118.68 123.77 1a6e s LEU 239 Ca 0.10 -0.75 0.05 0.00 0.02 0.00 0.00 54.13 53.54 1a6e s LEU 239 Cb -0.17 -2.08 -0.04 0.00 0.02 0.00 0.00 46.19 43.92 1a6e s LEU 239 CO 0.11 -0.33 0.12 -0.76 0.02 0.00 0.00 176.35 175.51 1a6e s LEU 240 N 1.63 3.79 -0.19 1.79 1.43 -0.73 -0.34 118.68 126.06 1a6e s LEU 240 Ca 0.04 -0.10 0.15 0.00 -1.03 0.00 0.00 54.13 53.19 1a6e s LEU 240 Cb -0.18 -2.42 0.44 0.00 0.03 0.00 0.00 46.19 44.06 1a6e s LEU 240 CO 0.08 0.10 1.19 -0.67 0.23 0.00 0.00 176.35 177.28 1a6e n ASP 241 N -0.11 2.31 -3.93 2.29 2.03 0.14 -2.39 116.55 116.88 1a6e n ASP 241 Ca -0.08 -3.18 -0.10 0.00 0.52 0.00 0.00 54.79 51.94 1a6e n ASP 241 Cb 0.54 -0.43 -0.10 0.00 -0.72 0.00 0.00 41.12 40.41 1a6e n ASP 241 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1a6e s ALA 242 N -2.68 -0.08 0.35 -1.67 0.00 -1.26 -4.75 121.76 111.68 1a6e s ALA 242 Ca 0.39 -0.44 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 1a6e s ALA 242 Cb 0.38 0.17 -0.08 0.00 0.00 0.00 0.00 23.12 23.59 1a6e s ALA 242 CO -0.06 -0.23 0.76 -1.25 0.00 0.00 0.00 175.76 174.97 1a6e s PRO 243 N -1.87 3.94 -0.68 0.00 0.04 -1.26 -4.44 135.00 130.72 1a6e s PRO 243 Ca -0.11 0.63 -0.21 0.00 0.04 0.00 0.00 61.00 61.34 1a6e s PRO 243 Cb -0.06 -2.41 0.09 0.00 0.04 0.00 0.00 34.50 32.16 1a6e s PRO 243 CO -0.01 0.08 0.92 -0.51 0.04 0.00 0.00 177.00 177.52 1a6e s LEU 244 N -3.27 4.75 0.20 -3.56 2.01 -0.73 -4.97 118.68 113.10 1a6e s LEU 244 Ca 0.54 -1.26 -0.19 0.00 0.01 0.00 0.00 54.13 53.23 1a6e s LEU 244 Cb -0.10 -2.39 0.03 0.00 0.01 0.00 0.00 46.19 43.75 1a6e s LEU 244 CO 0.22 -1.30 0.56 -1.61 1.01 0.00 0.00 176.35 175.22 1a6e s GLU 245 N 3.50 1.41 0.32 1.70 2.02 -1.26 -1.41 118.70 124.99 1a6e s GLU 245 Ca 0.21 -0.82 -0.29 0.00 0.02 0.00 0.00 54.97 54.09 1a6e s GLU 245 Cb -0.17 0.54 -0.10 0.00 0.10 0.00 0.00 34.13 34.50 1a6e s GLU 245 CO 0.06 -0.61 1.37 0.96 0.02 0.00 0.00 175.26 177.06 1a6e s ILE 246 N -3.86 2.57 -0.34 -1.63 -5.25 -1.26 -4.96 121.20 106.47 1a6e s ILE 246 Ca 0.08 0.56 -0.18 0.00 -0.99 0.00 0.00 60.65 60.12 1a6e s ILE 246 Cb -0.02 -3.35 -0.01 0.00 2.95 0.00 0.00 42.46 42.03 1a6e s ILE 246 CO -0.03 0.12 0.51 -0.75 -1.79 0.00 0.00 174.94 173.00 1a6e s LYS 247 N -1.54 3.66 -0.04 0.37 2.36 -1.26 -5.05 119.74 118.25 1a6e s LYS 247 Ca 0.52 -0.12 -0.23 0.00 -2.55 0.00 0.00 55.97 53.59 1a6e s LYS 247 Cb -0.42 -3.79 -0.04 0.00 -1.05 0.00 0.00 37.83 32.53 1a6e s LYS 247 CO 0.53 -0.61 0.68 0.21 1.55 0.00 0.00 175.35 177.70 1a6e s LYS 248 N 2.38 4.42 1.11 4.03 2.36 -1.26 -5.04 119.74 127.73 1a6e s LYS 248 Ca 0.19 0.85 -0.18 0.00 -2.55 0.00 0.00 55.97 54.28 1a6e s LYS 248 Cb -0.15 -3.42 0.11 0.00 -1.05 0.00 0.00 37.83 33.31 1a6e s LYS 248 CO 0.13 0.15 0.08 -2.30 1.55 0.00 0.00 175.35 174.96 1a6e n PRO 249 N 3.45 -1.51 0.09 4.03 -0.02 -1.26 -4.93 135.00 134.85 1a6e n PRO 249 Ca -0.03 -0.42 0.02 0.00 -2.02 0.00 0.00 63.50 61.06 1a6e n PRO 249 Cb 0.51 -1.73 -0.02 0.00 -0.02 0.00 0.00 33.50 32.24 1a6e n PRO 249 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1a6e h GLU 250 N -2.04 0.00 -6.86 -0.52 3.07 -2.03 -3.47 114.58 102.74 1a6e h GLU 250 Ca -0.53 0.00 -0.50 0.00 -0.50 0.00 0.00 59.36 57.83 1a6e h GLU 250 Cb 1.35 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.28 1a6e h GLU 250 CO 0.38 0.35 0.10 -0.06 -1.40 0.00 0.00 179.01 178.38 1a6e s PHE 251 N -2.99 3.50 -0.45 4.33 0.40 -1.26 -4.96 117.98 116.55 1a6e s PHE 251 Ca 0.01 0.96 -0.26 0.00 -0.60 0.00 0.00 56.93 57.03 1a6e s PHE 251 Cb 0.08 -2.39 -0.07 0.00 0.51 0.00 0.00 43.02 41.16 1a6e s PHE 251 CO 0.78 -0.15 2.39 -0.25 0.70 0.00 0.00 175.22 178.69 1a6e n ASP 252 N -1.57 2.46 -4.59 1.36 9.92 -1.26 -4.92 116.55 117.95 1a6e n ASP 252 Ca 0.02 -0.39 -0.34 0.00 -0.53 0.00 0.00 54.79 53.54 1a6e n ASP 252 Cb 0.54 -1.58 -0.11 0.00 -0.64 0.00 0.00 41.12 39.33 1a6e n ASP 252 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1a6e s THR 253 N 11.61 3.81 -0.02 -3.53 2.01 -1.26 -5.10 115.64 123.15 1a6e s THR 253 Ca 0.99 -0.44 -0.03 0.00 0.31 0.00 0.00 61.69 62.53 1a6e s THR 253 Cb -0.21 -2.57 0.01 0.00 0.01 0.00 0.00 72.50 69.74 1a6e s THR 253 CO 0.28 0.60 0.07 0.20 -0.69 0.00 0.00 174.62 175.07 1a6e s ASN 254 N -0.77 -0.06 -0.11 3.53 0.01 -1.26 -5.09 114.94 111.18 1a6e s ASN 254 Ca 0.12 0.12 -0.17 0.00 -0.71 0.00 0.00 52.86 52.22 1a6e s ASN 254 Cb -0.11 0.15 -0.05 0.00 0.41 0.00 0.00 41.25 41.65 1a6e s ASN 254 CO 0.02 -0.04 0.42 -0.76 -1.51 0.00 0.00 177.10 175.23 1a6e s LEU 255 N -0.04 4.30 -0.32 0.60 1.02 -1.26 -5.06 118.68 117.92 1a6e s LEU 255 Ca -0.01 0.76 -0.03 0.00 0.02 0.00 0.00 54.13 54.87 1a6e s LEU 255 Cb -0.01 -2.60 0.05 0.00 0.02 0.00 0.00 46.19 43.65 1a6e s LEU 255 CO 0.00 0.07 0.04 -0.60 0.02 0.00 0.00 176.35 175.88 1a6e s ARG 256 N 0.35 2.42 -0.30 1.70 3.52 -1.26 -5.07 118.95 120.31 1a6e s ARG 256 Ca 0.23 -1.30 -0.09 0.00 -0.13 0.00 0.00 55.73 54.44 1a6e s ARG 256 Cb -0.15 -3.27 -0.01 0.00 -1.56 0.00 0.00 34.95 29.96 1a6e s ARG 256 CO 0.09 -0.67 0.12 0.42 -0.81 0.00 0.00 175.30 174.45 1a6e s ILE 257 N 1.27 4.41 -0.33 4.11 1.01 -1.26 -4.90 121.20 125.50 1a6e s ILE 257 Ca -0.03 -0.46 0.11 0.00 0.00 0.00 0.00 60.65 60.27 1a6e s ILE 257 Cb -0.20 -3.23 -0.14 0.00 0.01 0.00 0.00 42.46 38.90 1a6e s ILE 257 CO -0.01 0.10 0.38 -0.62 0.00 0.00 0.00 174.94 174.80 1a6e n GLU 258 N 4.95 2.26 -4.57 2.79 1.02 -1.26 -4.93 120.64 120.90 1a6e n GLU 258 Ca -0.14 -0.04 -0.33 0.00 -0.02 0.00 0.00 57.16 56.63 1a6e n GLU 258 Cb 0.49 -1.11 -0.16 0.00 -0.02 0.00 0.00 31.44 30.64 1a6e n GLU 258 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1a6e s ASP 259 N -2.50 3.26 0.66 1.62 -1.08 -1.26 -5.01 116.67 112.36 1a6e s ASP 259 Ca 0.01 -0.58 0.32 0.00 -0.52 0.00 0.00 52.55 51.79 1a6e s ASP 259 Cb 0.08 -1.48 1.76 0.00 -1.46 0.00 0.00 42.92 41.81 1a6e s ASP 259 CO 0.46 0.07 1.99 1.55 0.52 0.00 0.00 175.17 179.76 1a6e h PRO 260 N 7.40 0.00 -0.12 4.34 0.13 -2.04 -1.27 132.00 140.44 1a6e h PRO 260 Ca -0.34 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.64 1a6e h PRO 260 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 1a6e h PRO 260 CO 0.57 0.00 -0.57 1.03 -0.23 0.00 0.00 178.00 178.80 1a6e h SER 261 N 0.00 0.42 -0.33 1.44 0.87 -2.01 -3.17 113.55 110.77 1a6e h SER 261 Ca 0.01 -0.23 0.06 0.00 -1.23 0.00 0.00 61.79 60.40 1a6e h SER 261 Cb 0.57 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.40 1a6e h SER 261 CO -0.00 0.90 0.23 0.24 -0.53 0.00 0.00 176.83 177.67 1a6e h MET 262 N 0.28 0.15 -0.76 2.24 2.86 -1.66 -2.99 114.93 115.06 1a6e h MET 262 Ca 0.00 -0.01 0.16 0.00 -2.06 0.00 0.00 59.70 57.79 1a6e h MET 262 Cb 1.09 -0.03 -0.11 0.00 0.06 0.00 0.00 31.60 32.61 1a6e h MET 262 CO 0.10 0.10 0.25 0.82 1.06 0.00 0.00 176.91 179.24 1a6e h ILE 263 N 0.16 0.57 -0.00 -1.22 2.04 -1.71 0.14 117.51 117.49 1a6e h ILE 263 Ca 0.15 -0.12 -0.20 0.00 1.00 0.00 0.00 64.86 65.69 1a6e h ILE 263 Cb 0.39 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1a6e h ILE 263 CO -0.02 0.06 -0.86 -0.61 0.00 0.00 0.00 178.15 176.72 1a6e h GLN 264 N 0.35 0.23 -0.85 2.37 4.15 -1.76 -2.60 115.11 117.01 1a6e h GLN 264 Ca 0.43 -0.24 -0.03 0.00 0.77 0.00 0.00 58.65 59.58 1a6e h GLN 264 Cb 0.71 0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.43 1a6e h GLN 264 CO -0.47 0.96 0.43 0.87 -1.93 0.00 0.00 178.83 178.69 1a6e h LYS 265 N 0.13 1.21 -0.00 1.69 1.57 -0.88 -0.55 116.57 119.74 1a6e h LYS 265 Ca -0.05 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1a6e h LYS 265 Cb 1.48 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 1a6e h LYS 265 CO 0.13 0.91 -0.00 0.74 -0.57 0.00 0.00 179.45 180.66 1a6e h PHE 266 N 1.20 0.01 -0.53 -1.35 0.04 -0.86 -1.92 116.94 113.53 1a6e h PHE 266 Ca 0.29 -0.00 0.05 0.00 2.80 0.00 0.00 57.97 61.11 1a6e h PHE 266 Cb 0.08 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.20 1a6e h PHE 266 CO 0.01 0.35 0.35 -0.07 -0.60 0.00 0.00 178.31 178.35 1a6e h LEU 267 N -0.33 0.45 -0.15 1.54 3.38 -1.17 -1.03 115.31 118.00 1a6e h LEU 267 Ca 0.00 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1a6e h LEU 267 Cb 0.34 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1a6e h LEU 267 CO 0.00 0.30 -0.16 0.00 0.09 0.00 0.00 178.44 178.67 1a6e h ALA 268 N 1.71 0.22 -0.94 1.53 0.00 -1.01 -2.82 119.26 117.94 1a6e h ALA 268 Ca 0.22 -0.34 0.10 0.00 0.00 0.00 0.00 54.91 54.90 1a6e h ALA 268 Cb 0.23 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.89 1a6e h ALA 268 CO -0.06 0.12 0.58 1.96 0.00 0.00 0.00 179.25 181.85 1a6e h GLN 269 N 0.01 0.93 -0.36 0.00 1.08 -0.43 0.12 115.11 116.44 1a6e h GLN 269 Ca 0.02 -0.06 -0.08 0.00 -1.45 0.00 0.00 58.65 57.09 1a6e h GLN 269 Cb 0.70 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.91 1a6e h GLN 269 CO 0.04 0.61 -0.11 0.93 -0.95 0.00 0.00 178.83 179.35 1a6e h GLU 270 N 0.95 0.63 -0.17 1.46 5.08 -1.19 -1.68 114.58 119.67 1a6e h GLU 270 Ca 0.45 -0.19 -0.19 0.00 -1.00 0.00 0.00 59.36 58.43 1a6e h GLU 270 Cb 0.39 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.58 1a6e h GLU 270 CO -0.24 0.73 -0.65 0.93 -1.00 0.00 0.00 179.01 178.78 1a6e h GLU 271 N 0.58 0.63 -0.70 2.33 5.08 -1.00 -3.07 114.58 118.43 1a6e h GLU 271 Ca 0.10 -0.46 -0.01 0.00 -1.00 0.00 0.00 59.36 58.00 1a6e h GLU 271 Cb 0.54 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1a6e h GLU 271 CO 0.03 1.08 0.41 -0.91 -1.00 0.00 0.00 179.01 178.62 1a6e h ASN 272 N 0.46 0.86 -0.86 1.42 4.21 -0.51 0.86 115.58 122.02 1a6e h ASN 272 Ca -0.02 -0.07 0.09 0.00 1.21 0.00 0.00 56.30 57.51 1a6e h ASN 272 Cb 1.24 -0.22 -0.07 0.00 -1.12 0.00 0.00 38.32 38.15 1a6e h ASN 272 CO 0.13 0.68 0.51 0.24 -1.29 0.00 0.00 177.43 177.69 1a6e h MET 273 N 0.96 0.84 -0.12 0.81 2.86 -1.22 0.36 114.93 119.42 1a6e h MET 273 Ca 0.25 -0.05 -0.23 0.00 -2.06 0.00 0.00 59.70 57.61 1a6e h MET 273 Cb -0.01 -0.19 0.01 0.00 0.06 0.00 0.00 31.60 31.47 1a6e h MET 273 CO -0.05 0.55 -0.81 -0.07 1.06 0.00 0.00 176.91 177.60 1a6e h LEU 274 N 0.86 0.89 -1.87 1.22 3.38 -1.42 -2.17 115.31 116.21 1a6e h LEU 274 Ca 0.41 -0.60 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 1a6e h LEU 274 Cb 0.34 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1a6e h LEU 274 CO -0.23 1.40 -0.11 -0.09 0.09 0.00 0.00 178.44 179.50 1a6e h ARG 275 N 0.49 0.00 0.00 1.13 2.43 0.22 -2.43 114.38 116.22 1a6e h ARG 275 Ca -0.06 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.86 1a6e h ARG 275 Cb 1.44 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.95 1a6e h ARG 275 CO 0.16 0.11 -1.36 0.93 -1.51 0.00 0.00 179.97 178.30 1a6e h GLU 276 N 0.00 0.00 0.09 0.20 5.08 -0.12 -2.55 114.58 117.28 1a6e h GLU 276 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1a6e h GLU 276 Cb 0.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1a6e h GLU 276 CO 0.01 0.74 -0.05 0.52 -1.00 0.00 0.00 179.01 179.24 1a6e h MET 277 N 0.00 -0.12 -0.77 2.33 2.86 -0.92 0.20 114.93 118.51 1a6e h MET 277 Ca -0.15 0.01 0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1a6e h MET 277 Cb 1.89 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 33.53 1a6e h MET 277 CO 0.10 -0.08 0.48 0.28 1.06 0.00 0.00 176.91 178.75 1a6e h VAL 278 N -0.13 1.08 -0.37 -2.22 2.07 -1.58 -1.58 116.25 113.53 1a6e h VAL 278 Ca -0.01 -0.31 0.04 0.00 0.82 0.00 0.00 66.70 67.23 1a6e h VAL 278 Cb 0.10 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 29.92 1a6e h VAL 278 CO 0.02 0.17 0.15 0.44 0.02 0.00 0.00 177.57 178.36 1a6e h ASP 279 N 0.92 0.19 0.42 0.57 5.19 -0.97 0.21 116.42 122.95 1a6e h ASP 279 Ca 0.32 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.75 1a6e h ASP 279 Cb 0.06 0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.56 1a6e h ASP 279 CO -0.13 0.14 -0.45 0.50 -3.12 0.00 0.00 179.24 176.18 1a6e h LYS 280 N 0.32 -0.85 -0.93 3.56 1.63 -0.02 1.03 116.57 121.31 1a6e h LYS 280 Ca 0.17 0.06 0.21 0.00 -0.85 0.00 0.00 60.65 60.23 1a6e h LYS 280 Cb 0.12 0.19 -0.12 0.00 -0.60 0.00 0.00 32.23 31.83 1a6e h LYS 280 CO -0.15 -0.57 0.48 0.82 -3.45 0.00 0.00 179.45 176.58 1a6e h ILE 281 N -0.88 0.57 -0.12 2.00 2.04 -1.24 -0.49 117.51 119.39 1a6e h ILE 281 Ca -0.05 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.58 1a6e h ILE 281 Cb 0.77 -0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.84 1a6e h ILE 281 CO -0.07 0.10 -0.11 0.50 0.00 0.00 0.00 178.15 178.57 1a6e h LYS 282 N 0.54 0.29 -0.54 2.37 3.64 -0.30 -2.31 116.57 120.26 1a6e h LYS 282 Ca 0.57 -0.15 0.09 0.00 -1.27 0.00 0.00 60.65 59.89 1a6e h LYS 282 Cb 1.00 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.79 1a6e h LYS 282 CO -0.46 0.68 0.37 0.66 -2.27 0.00 0.00 179.45 178.42 1a6e h SER 283 N -0.09 0.30 -0.00 4.20 4.64 0.27 0.37 113.55 123.23 1a6e h SER 283 Ca 0.02 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1a6e h SER 283 Cb 0.62 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1a6e h SER 283 CO 0.03 0.18 0.00 0.55 -0.87 0.00 0.00 176.83 176.72 1a6e n VAL 284 N -4.46 0.00 -0.62 0.95 3.14 -0.69 -4.87 118.33 111.77 1a6e n VAL 284 Ca 0.09 -0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.46 1a6e n VAL 284 Cb 0.37 -0.34 0.00 0.00 -1.06 0.00 0.00 33.84 32.81 1a6e n VAL 284 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1a6e n GLY 285 N 0.86 0.67 3.77 7.55 0.00 0.13 -4.58 105.19 113.59 1a6e n GLY 285 Ca 0.17 -0.13 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1a6e n GLY 285 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6e s ALA 286 N -2.00 3.41 -0.04 4.61 0.00 -0.87 -4.61 121.76 122.26 1a6e s ALA 286 Ca 0.00 1.38 0.05 0.00 0.00 0.00 0.00 51.96 53.39 1a6e s ALA 286 Cb 0.00 -3.54 -0.07 0.00 0.00 0.00 0.00 23.12 19.51 1a6e s ALA 286 CO 0.00 -0.90 0.05 -1.71 0.00 0.00 0.00 175.76 173.20 1a6e n ASN 287 N 0.36 3.69 -3.98 0.00 2.85 0.20 -4.66 115.26 113.71 1a6e n ASN 287 Ca 0.02 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.34 1a6e n ASN 287 Cb 0.41 0.84 -0.14 0.00 1.24 0.00 0.00 39.78 42.14 1a6e n ASN 287 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1a6e s VAL 288 N -2.22 0.43 -0.30 3.44 1.01 -0.98 -2.78 120.40 119.00 1a6e s VAL 288 Ca -0.02 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1a6e s VAL 288 Cb 0.02 -0.40 0.09 0.00 0.00 0.00 0.00 36.38 36.09 1a6e s VAL 288 CO 0.23 -0.01 0.05 -0.69 0.00 0.00 0.00 175.10 174.68 1a6e s VAL 289 N -0.42 1.43 -0.31 2.92 1.01 -0.76 0.09 120.40 124.36 1a6e s VAL 289 Ca -0.01 -1.63 -0.10 0.00 0.00 0.00 0.00 61.98 60.24 1a6e s VAL 289 Cb -0.04 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1a6e s VAL 289 CO -0.00 -0.52 0.15 -0.63 0.00 0.00 0.00 175.10 174.10 1a6e s ILE 290 N 1.36 4.66 0.09 2.22 1.01 -0.47 -1.85 121.20 128.21 1a6e s ILE 290 Ca 0.07 -0.36 0.09 0.00 0.00 0.00 0.00 60.65 60.44 1a6e s ILE 290 Cb -0.18 -3.35 -0.04 0.00 0.01 0.00 0.00 42.46 38.90 1a6e s ILE 290 CO -0.16 0.09 -0.21 0.28 0.00 0.00 0.00 174.94 174.95 1a6e s THR 291 N 1.63 2.65 0.13 2.92 -1.32 -1.00 -1.77 115.64 118.87 1a6e s THR 291 Ca 0.05 -1.43 -0.01 0.00 -1.21 0.00 0.00 61.69 59.09 1a6e s THR 291 Cb -0.17 -2.16 -0.20 0.00 -1.51 0.00 0.00 72.50 68.46 1a6e s THR 291 CO 0.07 0.20 1.28 1.56 -2.21 0.00 0.00 174.62 175.52 1a6e h GLN 292 N 4.13 0.26 0.00 7.08 4.20 -1.69 -1.16 115.11 127.93 1a6e h GLN 292 Ca -0.49 -0.33 0.00 0.00 0.06 0.00 0.00 58.65 57.89 1a6e h GLN 292 Cb 1.16 0.11 0.00 0.00 0.30 0.00 0.00 27.48 29.05 1a6e h GLN 292 CO 0.45 1.07 0.00 1.63 -0.67 0.00 0.00 178.83 181.31 1a6e n LYS 293 N -3.62 2.20 -3.02 1.46 5.02 -1.26 -2.97 118.16 115.96 1a6e n LYS 293 Ca -0.05 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.98 1a6e n LYS 293 Cb 0.89 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.89 1a6e n LYS 293 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1a6e s GLY 294 N -1.14 1.42 -0.16 0.72 0.00 -1.26 -0.25 107.32 106.65 1a6e s GLY 294 Ca 0.00 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 43.99 1a6e s GLY 294 CO 0.00 -0.63 -0.19 -0.42 0.00 0.00 0.00 173.10 171.86 1a6e s ILE 295 N -2.52 2.24 0.66 0.90 1.01 -1.26 -1.78 121.20 120.45 1a6e s ILE 295 Ca 0.44 -0.91 -0.18 0.00 0.00 0.00 0.00 60.65 60.01 1a6e s ILE 295 Cb -0.10 -1.92 -0.01 0.00 0.01 0.00 0.00 42.46 40.44 1a6e s ILE 295 CO 0.40 0.53 1.23 -0.67 0.00 0.00 0.00 174.94 176.44 1a6e n ASP 296 N 4.24 1.76 -0.28 3.58 2.03 -0.50 -4.78 116.55 122.60 1a6e n ASP 296 Ca -0.20 0.80 -0.01 0.00 0.52 0.00 0.00 54.79 55.90 1a6e n ASP 296 Cb 0.51 -1.53 0.18 0.00 -0.72 0.00 0.00 41.12 39.57 1a6e n ASP 296 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 1a6e h ASP 297 N 0.37 0.99 -0.04 1.67 5.19 -1.99 0.24 116.42 122.85 1a6e h ASP 297 Ca -0.50 -0.04 -0.21 0.00 -0.62 0.00 0.00 57.03 55.66 1a6e h ASP 297 Cb 1.34 -0.25 0.01 0.00 0.18 0.00 0.00 39.33 40.61 1a6e h ASP 297 CO 0.52 0.73 -0.77 -0.03 -3.12 0.00 0.00 179.24 176.57 1a6e h MET 298 N 1.16 0.70 -0.56 3.56 4.05 -1.97 -2.36 114.93 119.51 1a6e h MET 298 Ca 0.31 -0.57 -0.06 0.00 -0.28 0.00 0.00 59.70 59.10 1a6e h MET 298 Cb -0.11 0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 1a6e h MET 298 CO -0.06 1.18 0.10 0.00 0.23 0.00 0.00 176.91 178.35 1a6e h ALA 299 N 0.66 1.12 -0.60 0.39 0.00 -1.80 -1.75 119.26 117.27 1a6e h ALA 299 Ca -0.05 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 54.69 1a6e h ALA 299 Cb 1.38 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 18.89 1a6e h ALA 299 CO 0.15 0.58 0.29 1.96 0.00 0.00 0.00 179.25 182.24 1a6e h GLN 300 N 0.84 0.53 -0.12 0.00 4.20 -0.28 -1.79 115.11 118.49 1a6e h GLN 300 Ca 0.18 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.90 1a6e h GLN 300 Cb 0.37 -0.12 -0.05 0.00 0.30 0.00 0.00 27.48 27.98 1a6e h GLN 300 CO 0.01 0.35 -0.17 1.25 -0.67 0.00 0.00 178.83 179.60 1a6e h HIS 301 N 0.54 -0.43 0.08 2.96 2.76 -0.80 -1.73 115.15 118.53 1a6e h HIS 301 Ca 0.28 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.49 1a6e h HIS 301 Cb 0.23 0.21 -0.04 0.00 1.55 0.00 0.00 27.41 29.37 1a6e h HIS 301 CO -0.11 -0.24 -0.26 1.88 -1.30 0.00 0.00 177.93 177.90 1a6e h TYR 302 N -0.22 -0.70 -0.18 5.26 0.05 -1.07 0.34 116.97 120.46 1a6e h TYR 302 Ca 0.09 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.94 1a6e h TYR 302 Cb 0.35 0.30 -0.05 0.00 1.01 0.00 0.00 36.73 38.34 1a6e h TYR 302 CO -0.28 -0.36 -0.13 -0.07 -1.05 0.00 0.00 178.16 176.27 1a6e h LEU 303 N -0.45 -0.41 -0.12 3.88 3.38 -1.26 0.37 115.31 120.71 1a6e h LEU 303 Ca 0.04 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.14 1a6e h LEU 303 Cb 0.49 0.21 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 1a6e h LEU 303 CO -0.18 -0.17 -0.37 -1.28 0.09 0.00 0.00 178.44 176.54 1a6e h SER 304 N -0.13 -1.15 -0.80 -0.43 0.87 -0.98 0.25 113.55 111.17 1a6e h SER 304 Ca 0.11 0.16 0.06 0.00 -1.23 0.00 0.00 61.79 60.88 1a6e h SER 304 Cb 0.29 0.48 -0.05 0.00 -0.44 0.00 0.00 62.40 62.68 1a6e h SER 304 CO -0.26 -0.40 0.53 -0.09 -0.53 0.00 0.00 176.83 176.08 1a6e h ARG 305 N -0.45 0.88 0.00 2.24 9.65 0.63 0.83 114.38 128.16 1a6e h ARG 305 Ca 0.08 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 1a6e h ARG 305 Cb 0.59 -0.20 0.00 0.00 -1.39 0.00 0.00 29.97 28.97 1a6e h ARG 305 CO -0.37 0.58 0.00 0.00 2.80 0.00 0.00 179.97 182.98 1a6e n ALA 306 N -2.42 1.92 -0.81 2.80 0.00 0.12 -4.84 120.51 117.27 1a6e n ALA 306 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1a6e n ALA 306 Cb 0.19 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.34 1a6e n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a6e n GLY 307 N 0.30 0.52 3.70 0.00 0.00 0.28 -5.03 105.19 104.97 1a6e n GLY 307 Ca 0.07 -0.67 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 1a6e n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a6e s ILE 308 N -2.00 5.00 -0.35 -0.61 1.01 -0.06 -4.69 121.20 119.49 1a6e s ILE 308 Ca 0.00 1.53 -0.23 0.00 0.00 0.00 0.00 60.65 61.95 1a6e s ILE 308 Cb 0.00 -4.08 0.01 0.00 0.01 0.00 0.00 42.46 38.39 1a6e s ILE 308 CO 0.00 0.19 0.77 -0.47 0.00 0.00 0.00 174.94 175.44 1a6e s TYR 309 N 1.12 3.14 -0.06 3.97 6.14 -1.12 -4.21 117.35 126.33 1a6e s TYR 309 Ca 0.39 0.60 0.03 0.00 0.64 0.00 0.00 57.07 58.73 1a6e s TYR 309 Cb -0.18 -3.34 0.01 0.00 0.42 0.00 0.00 41.96 38.88 1a6e s TYR 309 CO 0.18 -0.68 -0.14 0.00 0.64 0.00 0.00 175.55 175.55 1a6e s ALA 310 N 3.03 1.34 0.29 3.97 0.00 -1.26 -1.83 121.76 127.30 1a6e s ALA 310 Ca 0.31 -0.50 0.09 0.00 0.00 0.00 0.00 51.96 51.87 1a6e s ALA 310 Cb -0.13 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1a6e s ALA 310 CO 0.16 0.16 0.02 0.14 0.00 0.00 0.00 175.76 176.24 1a6e s VAL 311 N 0.49 3.26 0.25 0.00 -7.23 -0.77 -0.98 120.40 115.43 1a6e s VAL 311 Ca -0.12 -1.89 0.01 0.00 -1.81 0.00 0.00 61.98 58.17 1a6e s VAL 311 Cb -0.15 -2.85 -0.03 0.00 0.56 0.00 0.00 36.38 33.91 1a6e s VAL 311 CO 0.04 -0.32 0.21 0.00 -0.31 0.00 0.00 175.10 174.71 1a6e s ARG 312 N -3.71 1.43 -1.71 4.82 1.70 -1.26 -2.38 118.95 117.84 1a6e s ARG 312 Ca 0.33 -1.75 -0.21 0.00 -0.47 0.00 0.00 55.73 53.63 1a6e s ARG 312 Cb -0.05 0.30 0.20 0.00 -0.57 0.00 0.00 34.95 34.83 1a6e s ARG 312 CO 0.20 -0.50 0.61 0.54 -1.08 0.00 0.00 175.30 175.07 1a6e n ARG 313 N -0.40 -1.60 -2.38 3.89 1.74 0.66 -4.89 116.66 113.67 1a6e n ARG 313 Ca 0.04 0.21 -0.35 0.00 -0.77 0.00 0.00 57.85 56.97 1a6e n ARG 313 Cb 0.64 -4.83 -0.02 0.00 -1.02 0.00 0.00 32.46 27.24 1a6e n ARG 313 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1a6e s VAL 314 N -3.17 3.41 0.10 1.55 1.01 -0.46 -4.91 120.40 117.92 1a6e s VAL 314 Ca 0.75 0.95 -0.31 0.00 0.00 0.00 0.00 61.98 63.37 1a6e s VAL 314 Cb -0.43 -3.42 -0.09 0.00 0.00 0.00 0.00 36.38 32.44 1a6e s VAL 314 CO 0.92 -0.12 1.66 -0.75 0.00 0.00 0.00 175.10 176.82 1a6e s LYS 315 N -3.01 4.19 0.24 2.72 2.20 -1.26 -4.47 119.74 120.35 1a6e s LYS 315 Ca 0.67 2.38 -0.04 0.00 -0.36 0.00 0.00 55.97 58.61 1a6e s LYS 315 Cb -0.23 -3.51 0.47 0.00 -1.51 0.00 0.00 37.83 33.06 1a6e s LYS 315 CO 0.27 -0.73 1.70 -0.22 -0.36 0.00 0.00 175.35 176.01 1a6e h LYS 316 N 8.05 0.33 -0.63 4.03 1.63 -1.93 0.42 116.57 128.46 1a6e h LYS 316 Ca -0.43 -0.02 0.08 0.00 -0.85 0.00 0.00 60.65 59.43 1a6e h LYS 316 Cb 1.20 -0.07 -0.06 0.00 -0.60 0.00 0.00 32.23 32.70 1a6e h LYS 316 CO 0.93 0.22 0.30 0.66 -3.45 0.00 0.00 179.45 178.10 1a6e h SER 317 N 0.34 0.37 -0.74 4.20 4.64 -2.01 -0.54 113.55 119.81 1a6e h SER 317 Ca 0.42 0.06 -0.04 0.00 -0.47 0.00 0.00 61.79 61.76 1a6e h SER 317 Cb 0.69 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.74 1a6e h SER 317 CO -0.47 0.23 0.32 0.44 -0.87 0.00 0.00 176.83 176.48 1a6e h ASP 318 N 0.53 1.01 -0.52 4.97 3.32 -0.65 -2.61 116.42 122.47 1a6e h ASP 318 Ca 0.31 -0.14 0.09 0.00 0.02 0.00 0.00 57.03 57.31 1a6e h ASP 318 Cb 0.31 -0.26 -0.08 0.00 0.22 0.00 0.00 39.33 39.52 1a6e h ASP 318 CO -0.25 0.89 0.08 -0.03 -1.72 0.00 0.00 179.24 178.20 1a6e h MET 319 N 1.09 0.20 -0.35 3.56 4.05 0.66 -0.47 114.93 123.66 1a6e h MET 319 Ca 0.26 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.65 1a6e h MET 319 Cb 0.17 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.91 1a6e h MET 319 CO -0.03 0.13 0.18 -0.44 0.23 0.00 0.00 176.91 176.99 1a6e h ASP 320 N 0.20 0.45 -0.69 1.39 3.32 -0.99 -1.51 116.42 118.58 1a6e h ASP 320 Ca 0.27 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1a6e h ASP 320 Cb 0.38 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 1a6e h ASP 320 CO -0.37 0.42 0.45 0.11 -1.72 0.00 0.00 179.24 178.13 1a6e h LYS 321 N 0.44 0.92 -0.13 3.56 1.57 -0.96 -0.58 116.57 121.39 1a6e h LYS 321 Ca 0.12 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.70 1a6e h LYS 321 Cb 0.08 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1a6e h LYS 321 CO -0.02 0.62 -0.51 -0.07 -0.57 0.00 0.00 179.45 178.90 1a6e h LEU 322 N 0.95 0.39 0.32 2.94 3.38 -0.90 -2.02 115.31 120.36 1a6e h LEU 322 Ca 0.25 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1a6e h LEU 322 Cb -0.09 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1a6e h LEU 322 CO -0.05 0.83 -0.15 0.00 0.09 0.00 0.00 178.44 179.16 1a6e h ALA 323 N 1.18 -1.01 -0.75 1.53 0.00 -0.10 -0.98 119.26 119.13 1a6e h ALA 323 Ca 0.01 -0.09 0.17 0.00 0.00 0.00 0.00 54.91 55.00 1a6e h ALA 323 Cb 1.00 0.16 -0.13 0.00 0.00 0.00 0.00 17.79 18.82 1a6e h ALA 323 CO 0.09 -0.98 -0.01 0.87 0.00 0.00 0.00 179.25 179.21 1a6e h LYS 324 N -0.46 0.09 0.80 0.00 1.57 -1.21 0.44 116.57 117.80 1a6e h LYS 324 Ca -0.04 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 1a6e h LYS 324 Cb 0.32 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 1a6e h LYS 324 CO 0.07 0.06 -0.49 0.00 -0.57 0.00 0.00 179.45 178.52 1a6e h ALA 325 N 1.71 -1.28 -0.00 3.86 0.00 -1.36 -3.15 119.26 119.03 1a6e h ALA 325 Ca 0.40 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1a6e h ALA 325 Cb 0.70 0.61 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1a6e h ALA 325 CO -0.67 -1.23 -0.09 0.25 0.00 0.00 0.00 179.25 177.51 1a6e n THR 326 N -5.58 0.00 -2.36 0.00 -2.24 -0.38 -0.59 114.28 103.13 1a6e n THR 326 Ca -0.15 -0.07 -0.12 0.00 -2.27 0.00 0.00 64.05 61.45 1a6e n THR 326 Cb 0.50 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.63 1a6e n THR 326 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a6e n GLY 327 N 1.25 -0.08 3.97 3.38 0.00 0.15 -0.41 105.19 113.45 1a6e n GLY 327 Ca 0.15 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1a6e n GLY 327 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6e s ALA 328 N -2.68 3.19 -0.03 4.61 0.00 -1.02 -4.51 121.76 121.32 1a6e s ALA 328 Ca 0.05 -1.58 0.00 0.00 0.00 0.00 0.00 51.96 50.43 1a6e s ALA 328 Cb -0.02 -2.26 0.03 0.00 0.00 0.00 0.00 23.12 20.86 1a6e s ALA 328 CO 0.06 -1.84 -0.01 -1.12 0.00 0.00 0.00 175.76 172.86 1a6e s SER 329 N -4.81 0.57 -1.06 0.00 0.01 -0.92 -4.77 113.70 102.72 1a6e s SER 329 Ca 0.69 -0.04 -0.23 0.00 1.31 0.00 0.00 55.95 57.69 1a6e s SER 329 Cb -0.04 -0.26 -0.01 0.00 0.21 0.00 0.00 66.02 65.91 1a6e s SER 329 CO 0.48 -0.10 1.78 -0.63 0.41 0.00 0.00 173.24 175.18 1a6e s ILE 330 N 1.06 3.70 0.07 1.44 1.01 -1.26 -4.33 121.20 122.89 1a6e s ILE 330 Ca -0.09 -0.83 -0.31 0.00 0.00 0.00 0.00 60.65 59.42 1a6e s ILE 330 Cb -0.14 -4.59 -0.07 0.00 0.01 0.00 0.00 42.46 37.68 1a6e s ILE 330 CO -0.02 -1.38 1.37 -0.69 0.00 0.00 0.00 174.94 174.22 1a6e s VAL 331 N 8.07 3.55 -0.56 2.92 1.01 0.54 -4.56 120.40 131.37 1a6e s VAL 331 Ca 0.61 1.06 0.06 0.00 0.00 0.00 0.00 61.98 63.71 1a6e s VAL 331 Cb -0.02 -3.68 0.15 0.00 0.00 0.00 0.00 36.38 32.83 1a6e s VAL 331 CO 0.01 0.05 1.07 -1.20 0.00 0.00 0.00 175.10 175.04 1a6e n SER 332 N 4.47 2.36 -3.44 3.32 7.64 -1.26 0.26 113.62 126.97 1a6e n SER 332 Ca 0.12 -1.88 -0.27 0.00 1.01 0.00 0.00 58.87 57.85 1a6e n SER 332 Cb 0.43 -0.11 -0.10 0.00 -1.01 0.00 0.00 64.21 63.43 1a6e n SER 332 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1a6e n THR 333 N 0.11 -0.51 -0.33 0.44 -1.04 -1.26 -4.74 114.28 106.95 1a6e n THR 333 Ca 0.06 -3.84 0.24 0.00 -2.04 0.00 0.00 64.05 58.47 1a6e n THR 333 Cb 0.32 -1.81 0.48 0.00 -1.82 0.00 0.00 70.33 67.49 1a6e n THR 333 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 1a6e h ILE 334 N 4.04 0.25 -0.14 12.58 5.03 -1.97 0.23 117.51 137.53 1a6e h ILE 334 Ca 0.21 -0.09 0.04 0.00 -0.12 0.00 0.00 64.86 64.90 1a6e h ILE 334 Cb 0.87 -0.04 -0.01 0.00 -3.03 0.00 0.00 36.82 34.62 1a6e h ILE 334 CO 0.46 0.05 0.23 0.44 -0.68 0.00 0.00 178.15 178.65 1a6e h ASP 335 N 0.27 0.00 -0.19 1.72 3.32 -1.96 0.12 116.42 119.69 1a6e h ASP 335 Ca 0.74 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.79 1a6e h ASP 335 Cb 1.71 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.26 1a6e h ASP 335 CO -0.64 0.00 -0.00 -0.62 -1.72 0.00 0.00 179.24 176.26 1a6e n GLU 336 N -3.46 2.46 -2.10 3.56 -0.58 0.82 -4.98 120.64 116.35 1a6e n GLU 336 Ca 0.01 -2.78 -0.43 0.00 -0.42 0.00 0.00 57.16 53.54 1a6e n GLU 336 Cb 0.34 -1.75 -0.03 0.00 -0.57 0.00 0.00 31.44 29.43 1a6e n GLU 336 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1a6e s ILE 337 N -2.85 3.64 0.29 -3.67 2.07 0.03 -4.96 121.20 115.76 1a6e s ILE 337 Ca 0.39 0.69 0.04 0.00 -1.41 0.00 0.00 60.65 60.36 1a6e s ILE 337 Cb 0.33 -3.76 -0.03 0.00 0.13 0.00 0.00 42.46 39.13 1a6e s ILE 337 CO 0.07 -0.41 0.45 -0.94 -1.91 0.00 0.00 174.94 172.20 1a6e s SER 338 N 4.89 6.25 0.48 4.50 1.04 -1.26 -4.88 113.70 124.71 1a6e s SER 338 Ca 0.73 0.16 0.14 0.00 0.48 0.00 0.00 55.95 57.47 1a6e s SER 338 Cb -0.22 -1.82 1.13 0.00 0.10 0.00 0.00 66.02 65.20 1a6e s SER 338 CO 0.31 -0.21 2.08 0.77 0.98 0.00 0.00 173.24 177.17 1a6e h SER 339 N 0.97 0.05 0.58 7.02 4.64 -1.93 0.47 113.55 125.35 1a6e h SER 339 Ca -0.50 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.81 1a6e h SER 339 Cb 1.23 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1a6e h SER 339 CO 0.60 0.10 0.00 0.77 -0.87 0.00 0.00 176.83 177.43 1a6e h SER 340 N 0.05 0.00 0.65 4.97 4.64 -1.94 -2.46 113.55 119.46 1a6e h SER 340 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1a6e h SER 340 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1a6e h SER 340 CO 0.01 0.00 -0.23 0.47 -0.87 0.00 0.00 176.83 176.21 1a6e n ASP 341 N -2.31 0.32 -4.72 4.97 8.00 0.17 -4.82 116.55 118.16 1a6e n ASP 341 Ca 0.01 -0.06 -0.41 0.00 0.71 0.00 0.00 54.79 55.04 1a6e n ASP 341 Cb 0.19 -0.09 -0.04 0.00 -0.02 0.00 0.00 41.12 41.16 1a6e n ASP 341 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1a6e s LEU 342 N -2.88 4.44 0.79 0.64 1.02 -0.93 -2.16 118.68 119.60 1a6e s LEU 342 Ca 0.16 1.89 -0.09 0.00 0.02 0.00 0.00 54.13 56.11 1a6e s LEU 342 Cb 0.19 -3.59 0.11 0.00 0.02 0.00 0.00 46.19 42.92 1a6e s LEU 342 CO 0.59 -0.24 1.11 -0.83 0.02 0.00 0.00 176.35 177.00 1a6e s GLY 343 N 0.43 1.72 0.01 -3.19 0.00 0.20 -4.51 107.32 101.98 1a6e s GLY 343 Ca 0.51 -1.13 0.02 0.00 0.00 0.00 0.00 44.72 44.12 1a6e s GLY 343 CO 0.31 -0.59 -0.06 -1.59 0.00 0.00 0.00 173.10 171.17 1a6e s THR 344 N -3.44 0.44 -0.14 0.90 2.01 0.45 -0.93 115.64 114.93 1a6e s THR 344 Ca 0.65 -0.45 -0.23 0.00 0.31 0.00 0.00 61.69 61.97 1a6e s THR 344 Cb -0.08 -0.41 0.06 0.00 0.01 0.00 0.00 72.50 72.08 1a6e s THR 344 CO 0.47 -0.02 0.59 0.00 -0.69 0.00 0.00 174.62 174.97 1a6e s ALA 345 N -0.46 -1.48 0.29 7.40 0.00 -1.06 -2.19 121.76 124.25 1a6e s ALA 345 Ca -0.01 1.39 -0.01 0.00 0.00 0.00 0.00 51.96 53.33 1a6e s ALA 345 Cb -0.04 -0.53 0.43 0.00 0.00 0.00 0.00 23.12 22.98 1a6e s ALA 345 CO -0.00 -0.31 1.88 1.49 0.00 0.00 0.00 175.76 178.83 1a6e h GLU 346 N 4.32 0.90 -1.70 0.00 4.22 0.14 0.74 114.58 123.21 1a6e h GLU 346 Ca -0.28 -0.13 0.03 0.00 0.08 0.00 0.00 59.36 59.06 1a6e h GLU 346 Cb 1.16 -0.16 -0.24 0.00 0.50 0.00 0.00 28.75 30.00 1a6e h GLU 346 CO 0.25 0.72 0.38 -0.98 -2.18 0.00 0.00 179.01 177.20 1a6e s ARG 347 N -5.47 0.61 -0.06 1.92 1.04 -0.24 0.98 118.95 117.73 1a6e s ARG 347 Ca -0.10 0.62 0.05 0.00 -1.04 0.00 0.00 55.73 55.26 1a6e s ARG 347 Cb 0.16 0.30 -0.01 0.00 -2.04 0.00 0.00 34.95 33.36 1a6e s ARG 347 CO 0.80 -0.10 -0.23 0.08 -0.04 0.00 0.00 175.30 175.81 1a6e s VAL 348 N 0.05 2.22 -0.09 4.99 1.01 0.19 -0.91 120.40 127.86 1a6e s VAL 348 Ca 0.01 -1.01 -0.17 0.00 0.00 0.00 0.00 61.98 60.82 1a6e s VAL 348 Cb -0.04 -1.82 0.04 0.00 0.00 0.00 0.00 36.38 34.56 1a6e s VAL 348 CO -0.03 0.57 0.41 -0.70 0.00 0.00 0.00 175.10 175.35 1a6e s GLU 349 N -0.18 0.63 -0.09 2.72 2.12 -0.77 -0.44 118.70 122.70 1a6e s GLU 349 Ca -0.03 0.23 -0.21 0.00 0.36 0.00 0.00 54.97 55.32 1a6e s GLU 349 Cb -0.14 0.30 -0.04 0.00 0.26 0.00 0.00 34.13 34.51 1a6e s GLU 349 CO 0.04 -0.14 0.60 -1.14 -0.54 0.00 0.00 175.26 174.08 1a6e s GLN 350 N -0.58 4.40 0.03 4.30 0.74 -0.03 -0.30 119.66 128.21 1a6e s GLN 350 Ca -0.07 0.69 0.04 0.00 0.05 0.00 0.00 55.36 56.08 1a6e s GLN 350 Cb -0.04 -3.44 -0.02 0.00 1.10 0.00 0.00 33.01 30.61 1a6e s GLN 350 CO 0.03 0.11 -0.12 0.14 -0.55 0.00 0.00 175.29 174.90 1a6e s VAL 351 N 0.71 0.94 -0.32 1.34 -7.23 0.77 -4.91 120.40 111.71 1a6e s VAL 351 Ca 0.33 -0.87 -0.21 0.00 -1.81 0.00 0.00 61.98 59.41 1a6e s VAL 351 Cb -0.17 -0.86 -0.00 0.00 0.56 0.00 0.00 36.38 35.91 1a6e s VAL 351 CO 0.15 -0.01 0.69 -0.75 -0.31 0.00 0.00 175.10 174.87 1a6e s LYS 352 N -0.99 3.88 -0.86 4.82 2.20 -1.26 0.27 119.74 127.80 1a6e s LYS 352 Ca 0.00 0.35 -0.13 0.00 -0.36 0.00 0.00 55.97 55.83 1a6e s LYS 352 Cb -0.07 -3.74 0.23 0.00 -1.51 0.00 0.00 37.83 32.73 1a6e s LYS 352 CO 0.01 -0.64 0.80 0.08 -0.36 0.00 0.00 175.35 175.24 1a6e s VAL 353 N 2.76 5.62 0.00 4.02 1.01 0.15 -4.91 120.40 129.04 1a6e s VAL 353 Ca 0.28 -2.60 0.00 0.00 0.00 0.00 0.00 61.98 59.65 1a6e s VAL 353 Cb -0.14 -4.46 0.00 0.00 0.00 0.00 0.00 36.38 31.77 1a6e s VAL 353 CO 0.13 -1.05 0.00 0.61 0.00 0.00 0.00 175.10 174.79 1a6e n GLY 354 N 3.80 1.61 0.07 4.51 0.00 -1.26 -3.01 105.19 110.91 1a6e n GLY 354 Ca 0.15 -0.05 -0.07 0.00 0.00 0.00 0.00 46.02 46.05 1a6e n GLY 354 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1a6e h GLU 355 N 0.00 -0.04 -7.49 1.61 4.81 -1.91 -3.48 114.58 108.08 1a6e h GLU 355 Ca 0.00 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.77 1a6e h GLU 355 Cb 0.00 0.01 0.13 0.00 0.63 0.00 0.00 28.75 29.52 1a6e h GLU 355 CO 0.00 0.38 0.30 -0.51 -0.73 0.00 0.00 179.01 178.45 1a6e s ASP 356 N -5.76 3.56 -0.18 1.04 1.11 -1.16 -5.01 116.67 110.27 1a6e s ASP 356 Ca -0.09 0.96 -0.02 0.00 0.18 0.00 0.00 52.55 53.58 1a6e s ASP 356 Cb -0.01 -1.54 -0.01 0.00 1.07 0.00 0.00 42.92 42.43 1a6e s ASP 356 CO 0.32 -2.52 -0.07 -0.31 1.18 0.00 0.00 175.17 173.77 1a6e s TYR 357 N -3.29 2.92 0.23 4.23 2.02 -1.26 0.31 117.35 122.51 1a6e s TYR 357 Ca 0.64 -0.76 0.10 0.00 -0.37 0.00 0.00 57.07 56.68 1a6e s TYR 357 Cb -0.15 -1.99 -0.04 0.00 -0.40 0.00 0.00 41.96 39.38 1a6e s TYR 357 CO 0.53 -0.36 -0.12 -1.64 -1.57 0.00 0.00 175.55 172.39 1a6e s MET 358 N 0.92 1.95 -0.28 -0.62 -1.94 0.14 -3.86 119.30 115.61 1a6e s MET 358 Ca -0.01 -1.47 -0.07 0.00 -1.71 0.00 0.00 55.69 52.43 1a6e s MET 358 Cb -0.15 -2.02 -0.00 0.00 2.01 0.00 0.00 34.83 34.67 1a6e s MET 358 CO 0.00 0.38 0.07 -0.08 -0.01 0.00 0.00 175.02 175.39 1a6e s THR 359 N -2.07 4.01 -0.35 2.05 -1.32 -0.10 -0.16 115.64 117.71 1a6e s THR 359 Ca 0.27 -0.56 -0.11 0.00 -1.21 0.00 0.00 61.69 60.08 1a6e s THR 359 Cb -0.07 -3.01 0.00 0.00 -1.51 0.00 0.00 72.50 67.91 1a6e s THR 359 CO 0.16 0.16 0.21 -0.36 -2.21 0.00 0.00 174.62 172.57 1a6e s PHE 360 N 1.53 3.22 -0.77 9.09 0.40 0.59 -0.40 117.98 131.63 1a6e s PHE 360 Ca 0.04 -0.58 -0.17 0.00 -0.60 0.00 0.00 56.93 55.62 1a6e s PHE 360 Cb -0.17 -2.44 0.15 0.00 0.51 0.00 0.00 43.02 41.08 1a6e s PHE 360 CO 0.02 -0.50 0.85 0.54 0.70 0.00 0.00 175.22 176.84 1a6e s VAL 361 N 1.64 5.06 0.04 -0.44 0.11 -0.86 -1.85 120.40 124.09 1a6e s VAL 361 Ca 0.04 -1.67 0.00 0.00 -2.93 0.00 0.00 61.98 57.42 1a6e s VAL 361 Cb -0.18 -4.57 -0.04 0.00 -1.53 0.00 0.00 36.38 30.06 1a6e s VAL 361 CO 0.08 -1.21 0.15 -0.89 -3.33 0.00 0.00 175.10 169.90 1a6e s THR 362 N 1.83 5.09 -0.18 5.04 2.01 -0.08 -2.14 115.64 127.20 1a6e s THR 362 Ca 0.20 -0.43 -0.00 0.00 0.31 0.00 0.00 61.69 61.77 1a6e s THR 362 Cb -0.14 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 68.94 1a6e s THR 362 CO -0.04 0.21 0.15 0.61 -0.69 0.00 0.00 174.62 174.87 1a6e n GLY 363 N 0.62 0.37 3.75 4.40 0.00 -1.26 -1.07 105.19 112.00 1a6e n GLY 363 Ca -0.08 -0.41 -0.36 0.00 0.00 0.00 0.00 46.02 45.17 1a6e n GLY 363 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6e h LYS 365 N 0.84 0.69 -4.38 0.00 3.64 -1.45 -3.34 116.57 112.57 1a6e h LYS 365 Ca -0.50 -0.04 -0.73 0.00 -1.27 0.00 0.00 60.65 58.11 1a6e h LYS 365 Cb 1.29 -0.16 -0.23 0.00 -0.41 0.00 0.00 32.23 32.72 1a6e h LYS 365 CO 0.55 0.46 -0.39 1.21 -2.27 0.00 0.00 179.45 179.01 1a6e s ASN 366 N -5.49 6.01 0.00 4.20 3.04 0.25 -4.96 114.94 117.99 1a6e s ASN 366 Ca -0.12 -1.27 0.18 0.00 0.04 0.00 0.00 52.86 51.69 1a6e s ASN 366 Cb 0.22 -2.13 0.89 0.00 -1.54 0.00 0.00 41.25 38.69 1a6e s ASN 366 CO 0.79 -0.58 1.55 -0.81 -3.04 0.00 0.00 177.10 175.01 1a6e n PRO 367 N 5.12 0.22 -0.50 0.43 -0.04 -1.25 -3.31 135.00 135.66 1a6e n PRO 367 Ca -0.12 0.13 -0.10 0.00 -0.04 0.00 0.00 63.50 63.38 1a6e n PRO 367 Cb 0.44 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.47 1a6e n PRO 367 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1a6e n LYS 368 N -1.32 1.49 -4.46 0.54 5.02 -1.26 -4.75 118.16 113.42 1a6e n LYS 368 Ca 0.08 -1.16 -0.23 0.00 -2.02 0.00 0.00 58.31 54.97 1a6e n LYS 368 Cb 0.15 -1.46 -0.16 0.00 -0.02 0.00 0.00 35.03 33.54 1a6e n LYS 368 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1a6e s ALA 369 N -1.28 1.08 0.15 7.82 0.00 -1.21 -4.41 121.76 123.91 1a6e s ALA 369 Ca 0.22 -0.31 -0.07 0.00 0.00 0.00 0.00 51.96 51.81 1a6e s ALA 369 Cb 0.19 -0.51 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 1a6e s ALA 369 CO 0.04 0.08 0.22 0.54 0.00 0.00 0.00 175.76 176.64 1a6e s VAL 370 N 0.71 0.08 0.05 0.00 0.11 0.58 -3.45 120.40 118.48 1a6e s VAL 370 Ca -0.13 -1.53 0.05 0.00 -2.93 0.00 0.00 61.98 57.43 1a6e s VAL 370 Cb -0.15 -1.89 -0.03 0.00 -1.53 0.00 0.00 36.38 32.79 1a6e s VAL 370 CO 0.03 -0.36 -0.14 -0.44 -3.33 0.00 0.00 175.10 170.86 1a6e s SER 371 N -2.99 1.66 -0.16 3.54 0.01 0.83 -0.55 113.70 116.04 1a6e s SER 371 Ca 0.19 -0.53 0.01 0.00 1.31 0.00 0.00 55.95 56.92 1a6e s SER 371 Cb 0.05 -0.08 0.01 0.00 0.21 0.00 0.00 66.02 66.20 1a6e s SER 371 CO 0.00 -0.02 -0.17 -0.63 0.41 0.00 0.00 173.24 172.83 1a6e s ILE 372 N -1.05 2.41 -0.61 1.44 1.01 0.11 0.29 121.20 124.80 1a6e s ILE 372 Ca -0.00 -0.85 -0.10 0.00 0.00 0.00 0.00 60.65 59.70 1a6e s ILE 372 Cb -0.09 -2.01 0.16 0.00 0.01 0.00 0.00 42.46 40.53 1a6e s ILE 372 CO 0.02 0.52 0.51 -0.22 0.00 0.00 0.00 174.94 175.77 1a6e s LEU 373 N 0.97 5.98 0.03 2.97 2.96 0.66 -0.58 118.68 131.67 1a6e s LEU 373 Ca -0.03 -2.31 -0.30 0.00 -0.22 0.00 0.00 54.13 51.27 1a6e s LEU 373 Cb -0.15 -2.06 -0.07 0.00 0.50 0.00 0.00 46.19 44.41 1a6e s LEU 373 CO -0.04 -0.62 1.48 -0.69 -1.32 0.00 0.00 176.35 175.16 1a6e s VAL 374 N 0.76 3.46 -0.07 1.68 1.01 0.16 -2.37 120.40 125.03 1a6e s VAL 374 Ca 0.11 0.89 0.03 0.00 0.00 0.00 0.00 61.98 63.01 1a6e s VAL 374 Cb -0.21 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 1a6e s VAL 374 CO -0.03 0.00 -0.15 -0.13 0.00 0.00 0.00 175.10 174.80 1a6e s ARG 375 N 2.35 2.71 -0.12 2.72 1.81 -1.26 -1.32 118.95 125.84 1a6e s ARG 375 Ca 0.67 -0.70 -0.14 0.00 -1.72 0.00 0.00 55.73 53.84 1a6e s ARG 375 Cb -0.34 -2.43 0.04 0.00 -0.45 0.00 0.00 34.95 31.77 1a6e s ARG 375 CO 0.29 0.52 0.37 0.20 -0.68 0.00 0.00 175.30 176.00 1a6e s GLY 376 N -0.46 -0.27 0.46 -3.53 0.00 -0.67 -3.54 107.32 99.31 1a6e s GLY 376 Ca 0.06 0.94 0.18 0.00 0.00 0.00 0.00 44.72 45.90 1a6e s GLY 376 CO 0.02 0.78 2.00 0.83 0.00 0.00 0.00 173.10 176.72 1a6e h GLU 377 N 5.18 0.00 -5.73 2.90 4.39 -1.17 0.81 114.58 120.96 1a6e h GLU 377 Ca -0.27 0.00 -0.48 0.00 0.34 0.00 0.00 59.36 58.95 1a6e h GLU 377 Cb 1.18 0.00 -0.17 0.00 -0.10 0.00 0.00 28.75 29.66 1a6e h GLU 377 CO 0.29 0.19 -0.77 0.99 -1.16 0.00 0.00 179.01 178.55 1a6e s THR 378 N -4.45 1.67 0.04 1.13 2.01 -1.26 -3.40 115.64 111.38 1a6e s THR 378 Ca -0.03 -1.92 -0.17 0.00 0.31 0.00 0.00 61.69 59.87 1a6e s THR 378 Cb 0.15 -1.80 -0.08 0.00 0.01 0.00 0.00 72.50 70.78 1a6e s THR 378 CO 0.67 -0.40 1.27 -0.08 -0.69 0.00 0.00 174.62 175.39 1a6e h GLU 379 N 3.19 -0.44 -0.01 4.92 4.81 -1.99 0.21 114.58 125.27 1a6e h GLU 379 Ca -0.41 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.85 1a6e h GLU 379 Cb 1.21 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.68 1a6e h GLU 379 CO 0.53 -0.29 0.09 0.45 -0.73 0.00 0.00 179.01 179.05 1a6e h HIS 380 N -0.45 0.00 0.02 0.92 3.86 -1.98 -0.18 115.15 117.34 1a6e h HIS 380 Ca -0.02 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1a6e h HIS 380 Cb 0.41 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.88 1a6e h HIS 380 CO -0.21 0.00 -0.01 0.28 0.86 0.00 0.00 177.93 178.85 1a6e h VAL 381 N 0.00 1.08 0.00 2.45 2.07 -1.70 -3.26 116.25 116.89 1a6e h VAL 381 Ca 0.00 -1.72 -0.01 0.00 0.82 0.00 0.00 66.70 65.79 1a6e h VAL 381 Cb 0.18 2.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1a6e h VAL 381 CO -0.00 0.35 -0.06 1.62 0.02 0.00 0.00 177.57 179.50 1a6e h VAL 382 N -0.97 0.89 -0.66 2.57 3.04 0.19 -1.84 116.25 119.46 1a6e h VAL 382 Ca -0.00 -0.21 -0.03 0.00 -1.01 0.00 0.00 66.70 65.45 1a6e h VAL 382 Cb 0.60 1.12 -0.03 0.00 -2.01 0.00 0.00 31.29 30.97 1a6e h VAL 382 CO 0.01 0.06 0.31 0.44 -1.01 0.00 0.00 177.57 177.37 1a6e h ASP 383 N 0.00 0.87 0.07 3.17 5.19 -1.15 0.81 116.42 125.39 1a6e h ASP 383 Ca -0.00 -0.14 -0.21 0.00 -0.62 0.00 0.00 57.03 56.06 1a6e h ASP 383 Cb 0.11 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 39.40 1a6e h ASP 383 CO 0.01 0.76 -0.80 -0.08 -3.12 0.00 0.00 179.24 176.01 1a6e h GLU 384 N 0.92 0.60 -0.79 3.56 4.57 -1.47 -1.96 114.58 120.00 1a6e h GLU 384 Ca 0.23 -0.52 0.05 0.00 -1.18 0.00 0.00 59.36 57.94 1a6e h GLU 384 Cb 0.13 0.12 -0.05 0.00 -0.16 0.00 0.00 28.75 28.78 1a6e h GLU 384 CO -0.03 1.14 0.49 0.52 -1.18 0.00 0.00 179.01 179.95 1a6e h MET 385 N 0.39 0.90 -0.53 1.92 2.86 -0.86 0.45 114.93 120.07 1a6e h MET 385 Ca -0.05 -0.05 -0.10 0.00 -2.06 0.00 0.00 59.70 57.43 1a6e h MET 385 Cb 1.41 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.85 1a6e h MET 385 CO 0.15 0.60 -0.08 1.49 1.06 0.00 0.00 176.91 180.13 1a6e h GLU 386 N 0.93 0.98 -0.08 1.72 4.81 -0.77 -1.60 114.58 120.57 1a6e h GLU 386 Ca 0.33 -0.34 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1a6e h GLU 386 Cb 0.09 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.39 1a6e h GLU 386 CO -0.14 1.01 -0.01 0.00 -0.73 0.00 0.00 179.01 179.14 1a6e h ARG 387 N 0.88 0.15 -0.70 1.92 3.08 -0.47 -2.84 114.38 116.41 1a6e h ARG 387 Ca 0.15 -0.05 0.11 0.00 0.07 0.00 0.00 59.98 60.26 1a6e h ARG 387 Cb 0.62 -0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.58 1a6e h ARG 387 CO 0.04 0.44 0.29 0.77 -1.07 0.00 0.00 179.97 180.44 1a6e h SER 388 N -0.15 0.31 -0.40 7.04 0.02 0.09 -2.16 113.55 118.30 1a6e h SER 388 Ca 0.02 0.09 -0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1a6e h SER 388 Cb 0.38 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 1a6e h SER 388 CO 0.01 0.15 0.08 0.40 -1.14 0.00 0.00 176.83 176.33 1a6e h ILE 389 N 0.47 1.23 -0.83 3.27 2.04 -1.31 -2.72 117.51 119.67 1a6e h ILE 389 Ca 0.36 -0.82 0.14 0.00 1.00 0.00 0.00 64.86 65.54 1a6e h ILE 389 Cb 0.48 1.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.50 1a6e h ILE 389 CO -0.34 0.28 0.54 0.74 0.00 0.00 0.00 178.15 179.38 1a6e h THR 390 N 0.51 0.82 -0.69 -0.27 2.02 -1.15 0.91 112.91 115.06 1a6e h THR 390 Ca 0.12 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 1a6e h THR 390 Cb 0.34 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 66.91 1a6e h THR 390 CO 0.00 0.11 0.37 -0.78 0.37 0.00 0.00 175.52 175.59 1a6e h ASP 391 N 0.58 0.86 0.12 4.18 1.82 -1.13 -1.23 116.42 121.62 1a6e h ASP 391 Ca 0.41 -0.10 -0.01 0.00 -0.39 0.00 0.00 57.03 56.95 1a6e h ASP 391 Cb 0.76 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 40.55 1a6e h ASP 391 CO -0.17 0.71 -0.06 0.28 -1.61 0.00 0.00 179.24 178.40 1a6e h SER 392 N 0.95 -0.13 -0.38 2.28 0.02 -0.74 -1.50 113.55 114.04 1a6e h SER 392 Ca 0.24 -0.20 0.08 0.00 -0.84 0.00 0.00 61.79 61.08 1a6e h SER 392 Cb 0.05 0.03 -0.09 0.00 0.14 0.00 0.00 62.40 62.53 1a6e h SER 392 CO -0.04 0.12 -0.24 -0.07 -1.14 0.00 0.00 176.83 175.46 1a6e h LEU 393 N -0.39 -0.81 -1.87 5.07 3.38 -1.11 0.44 115.31 120.02 1a6e h LEU 393 Ca -0.02 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 1a6e h LEU 393 Cb 0.32 0.41 -0.00 0.00 0.09 0.00 0.00 40.66 41.48 1a6e h LEU 393 CO 0.03 -0.27 0.02 0.45 0.09 0.00 0.00 178.44 178.76 1a6e h HIS 394 N -0.18 0.09 0.05 1.13 3.86 -1.14 0.25 115.15 119.21 1a6e h HIS 394 Ca 0.18 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1a6e h HIS 394 Cb 0.47 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.91 1a6e h HIS 394 CO -0.46 0.08 -0.02 0.28 0.86 0.00 0.00 177.93 178.67 1a6e h VAL 395 N 0.09 0.00 -1.07 2.45 2.07 0.22 0.48 116.25 120.50 1a6e h VAL 395 Ca 0.02 -0.09 0.29 0.00 0.82 0.00 0.00 66.70 67.74 1a6e h VAL 395 Cb 0.04 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.73 1a6e h VAL 395 CO -0.00 0.00 0.72 -0.37 0.02 0.00 0.00 177.57 177.93 1a6e h VAL 396 N -0.15 0.49 0.67 2.57 -1.51 -0.15 0.32 116.25 118.49 1a6e h VAL 396 Ca -0.01 -0.09 -0.03 0.00 -1.23 0.00 0.00 66.70 65.35 1a6e h VAL 396 Cb 0.05 0.22 0.01 0.00 -2.13 0.00 0.00 31.29 29.44 1a6e h VAL 396 CO 0.01 0.05 -0.32 0.00 -1.23 0.00 0.00 177.57 176.07 1a6e h ALA 397 N 1.56 -0.92 -0.98 5.19 0.00 -1.00 0.22 119.26 123.32 1a6e h ALA 397 Ca 0.57 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 55.46 1a6e h ALA 397 Cb 1.73 0.35 -0.09 0.00 0.00 0.00 0.00 17.79 19.78 1a6e h ALA 397 CO -0.19 -0.85 0.61 1.03 0.00 0.00 0.00 179.25 179.85 1a6e h SER 398 N -1.22 0.75 0.86 0.00 0.87 0.18 0.11 113.55 115.11 1a6e h SER 398 Ca -0.09 0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.50 1a6e h SER 398 Cb 0.69 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.59 1a6e h SER 398 CO 0.15 0.31 -0.41 0.00 -0.53 0.00 0.00 176.83 176.35 1a6e h ALA 399 N 1.61 -1.17 -0.79 6.23 0.00 -0.62 -0.94 119.26 123.58 1a6e h ALA 399 Ca 0.54 -0.25 0.13 0.00 0.00 0.00 0.00 54.91 55.32 1a6e h ALA 399 Cb 0.83 0.45 -0.14 0.00 0.00 0.00 0.00 17.79 18.94 1a6e h ALA 399 CO -0.31 -1.09 -0.36 1.25 0.00 0.00 0.00 179.25 178.74 1a6e h LEU 400 N -1.30 -1.28 0.90 0.00 5.85 0.27 0.15 115.31 119.90 1a6e h LEU 400 Ca -0.12 0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1a6e h LEU 400 Cb 0.89 0.66 0.00 0.00 0.37 0.00 0.00 40.66 42.59 1a6e h LEU 400 CO 0.19 -0.30 -0.47 -0.33 -0.34 0.00 0.00 178.44 177.20 1a6e h GLU 401 N -0.08 -1.20 -0.47 1.25 5.08 -0.98 -3.16 114.58 115.02 1a6e h GLU 401 Ca 0.29 0.08 0.10 0.00 -1.00 0.00 0.00 59.36 58.83 1a6e h GLU 401 Cb 0.58 0.27 -0.10 0.00 0.50 0.00 0.00 28.75 30.00 1a6e h GLU 401 CO -0.84 -0.80 -0.20 -0.44 -1.00 0.00 0.00 179.01 175.73 1a6e h ASP 402 N -1.25 -0.71 0.00 1.42 3.32 -0.02 -3.44 116.42 115.75 1a6e h ASP 402 Ca -0.12 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1a6e h ASP 402 Cb 0.97 0.39 0.00 0.00 0.22 0.00 0.00 39.33 40.92 1a6e h ASP 402 CO 0.18 -0.23 0.00 0.61 -1.72 0.00 0.00 179.24 178.07 1a6e n GLY 403 N -1.40 0.83 3.38 2.75 0.00 0.43 -5.05 105.19 106.14 1a6e n GLY 403 Ca 0.04 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 1a6e n GLY 403 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6e s ALA 404 N -2.22 2.04 0.09 4.61 0.00 -1.26 0.88 121.76 125.91 1a6e s ALA 404 Ca 0.00 -1.95 -0.12 0.00 0.00 0.00 0.00 51.96 49.89 1a6e s ALA 404 Cb 0.00 0.87 0.01 0.00 0.00 0.00 0.00 23.12 24.00 1a6e s ALA 404 CO 0.00 -0.39 0.27 1.52 0.00 0.00 0.00 175.76 177.17 1a6e s TYR 405 N -3.53 -0.00 0.21 0.00 -0.85 0.40 -3.14 117.35 110.43 1a6e s TYR 405 Ca 0.37 -0.34 0.11 0.00 -0.52 0.00 0.00 57.07 56.69 1a6e s TYR 405 Cb 0.08 0.07 -0.05 0.00 0.38 0.00 0.00 41.96 42.44 1a6e s TYR 405 CO 0.15 -0.59 -0.22 0.00 -1.52 0.00 0.00 175.55 173.37 1a6e s ALA 406 N -3.62 2.47 0.17 9.51 0.00 0.07 -1.26 121.76 129.10 1a6e s ALA 406 Ca 0.03 -1.67 -0.30 0.00 0.00 0.00 0.00 51.96 50.01 1a6e s ALA 406 Cb 0.03 -0.28 -0.08 0.00 0.00 0.00 0.00 23.12 22.79 1a6e s ALA 406 CO -0.10 0.35 1.28 0.00 0.00 0.00 0.00 175.76 177.29 1a6e s ALA 407 N -1.98 3.50 0.48 0.00 0.00 -1.26 -1.49 121.76 121.01 1a6e s ALA 407 Ca 0.22 1.05 0.00 0.00 0.00 0.00 0.00 51.96 53.23 1a6e s ALA 407 Cb -0.07 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.58 1a6e s ALA 407 CO 0.10 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.77 1a6e n GLY 408 N 2.59 1.35 2.41 0.00 0.00 0.20 -3.09 105.19 108.66 1a6e n GLY 408 Ca 0.07 -1.72 -0.20 0.00 0.00 0.00 0.00 46.02 44.17 1a6e n GLY 408 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a6e n GLY 409 N 5.00 -0.14 2.46 -0.02 0.00 -1.26 -1.65 105.19 109.58 1a6e n GLY 409 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1a6e n GLY 409 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1a6e n GLY 410 N -0.95 1.54 0.33 -0.02 0.00 -1.26 -0.09 105.19 104.73 1a6e n GLY 410 Ca -0.23 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 1a6e n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1a6e h ALA 411 N 0.00 -0.78 -0.49 4.61 0.00 -1.45 0.50 119.26 121.65 1a6e h ALA 411 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1a6e h ALA 411 Cb 0.00 0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1a6e h ALA 411 CO 0.00 -0.90 0.27 0.00 0.00 0.00 0.00 179.25 178.62 1a6e h THR 412 N -0.87 1.15 0.08 0.00 1.03 -1.74 0.24 112.91 112.81 1a6e h THR 412 Ca -0.08 -0.38 -0.00 0.00 -0.01 0.00 0.00 66.41 65.94 1a6e h THR 412 Cb 0.63 0.49 0.00 0.00 -1.07 0.00 0.00 68.15 68.20 1a6e h THR 412 CO 0.13 0.17 -0.04 0.00 -0.01 0.00 0.00 175.52 175.77 1a6e h ALA 413 N 1.62 -0.11 -0.61 0.00 0.00 -1.83 0.19 119.26 118.52 1a6e h ALA 413 Ca 0.18 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.02 1a6e h ALA 413 Cb 0.02 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1a6e h ALA 413 CO -0.03 -0.45 0.41 0.00 0.00 0.00 0.00 179.25 179.17 1a6e h ALA 414 N 0.58 1.78 0.43 0.00 0.00 -0.43 0.32 119.26 121.94 1a6e h ALA 414 Ca -0.01 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1a6e h ALA 414 Cb 0.27 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1a6e h ALA 414 CO 0.02 0.13 -0.21 1.49 0.00 0.00 0.00 179.25 180.68 1a6e h GLU 415 N 0.62 -0.55 -0.69 0.00 4.57 0.27 -0.40 114.58 118.40 1a6e h GLU 415 Ca 0.26 0.04 0.09 0.00 -1.18 0.00 0.00 59.36 58.57 1a6e h GLU 415 Cb 0.24 0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.91 1a6e h GLU 415 CO -0.08 -0.25 0.45 0.82 -1.18 0.00 0.00 179.01 178.77 1a6e h ILE 416 N -0.85 0.94 -0.51 2.32 2.04 -0.04 0.33 117.51 121.73 1a6e h ILE 416 Ca -0.06 -0.20 -0.03 0.00 1.00 0.00 0.00 64.86 65.57 1a6e h ILE 416 Cb 0.56 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.92 1a6e h ILE 416 CO 0.10 0.11 0.21 0.00 0.00 0.00 0.00 178.15 178.56 1a6e h ALA 417 N 1.65 0.67 0.70 1.87 0.00 -0.13 -1.15 119.26 122.86 1a6e h ALA 417 Ca 0.31 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 1a6e h ALA 417 Cb 0.45 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1a6e h ALA 417 CO -0.10 0.27 -0.37 0.35 0.00 0.00 0.00 179.25 179.40 1a6e h PHE 418 N 0.69 -0.97 0.00 0.00 3.57 0.76 -2.80 116.94 118.19 1a6e h PHE 418 Ca 0.17 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 1a6e h PHE 418 Cb 0.19 0.33 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 1a6e h PHE 418 CO 0.00 -0.58 -0.07 0.00 -2.23 0.00 0.00 178.31 175.43 1a6e h ARG 419 N -0.99 0.00 -0.04 1.11 3.08 -1.13 -2.24 114.38 114.17 1a6e h ARG 419 Ca -0.09 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.80 1a6e h ARG 419 Cb 0.77 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1a6e h ARG 419 CO 0.13 0.07 -0.69 -0.07 -1.07 0.00 0.00 179.97 178.35 1a6e h LEU 420 N 0.00 0.22 -1.46 3.04 3.38 -1.00 -2.48 115.31 117.01 1a6e h LEU 420 Ca -0.00 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1a6e h LEU 420 Cb 0.15 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1a6e h LEU 420 CO 0.01 0.84 -0.15 0.03 0.09 0.00 0.00 178.44 179.26 1a6e h ARG 421 N 0.13 0.17 0.28 1.13 2.47 -1.15 0.33 114.38 117.73 1a6e h ARG 421 Ca -0.02 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.65 1a6e h ARG 421 Cb 1.22 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.52 1a6e h ARG 421 CO 0.10 0.32 -0.13 0.77 0.56 0.00 0.00 179.97 181.59 1a6e h SER 422 N 0.16 -0.32 -1.24 7.04 0.02 -1.51 -3.08 113.55 114.61 1a6e h SER 422 Ca 0.03 0.01 0.38 0.00 -0.84 0.00 0.00 61.79 61.37 1a6e h SER 422 Cb 0.36 0.08 -0.11 0.00 0.14 0.00 0.00 62.40 62.88 1a6e h SER 422 CO 0.02 0.01 0.81 0.22 -1.14 0.00 0.00 176.83 176.75 1a6e h TYR 423 N -0.84 0.52 -0.21 3.45 3.20 -1.35 1.04 116.97 122.77 1a6e h TYR 423 Ca -0.04 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.86 1a6e h TYR 423 Cb 0.29 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.40 1a6e h TYR 423 CO 0.02 -0.10 0.11 0.00 -1.64 0.00 0.00 178.16 176.55 1a6e h ALA 424 N 1.58 0.26 0.00 1.82 0.00 -0.95 0.16 119.26 122.12 1a6e h ALA 424 Ca 0.74 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.63 1a6e h ALA 424 Cb 2.25 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.99 1a6e h ALA 424 CO -0.35 -0.29 -0.08 0.37 0.00 0.00 0.00 179.25 178.90 1a6e h GLN 425 N 0.24 0.00 0.22 0.00 -0.00 0.12 -3.05 115.11 112.64 1a6e h GLN 425 Ca 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.72 1a6e h GLN 425 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 27.48 27.49 1a6e h GLN 425 CO -0.05 0.08 -0.10 0.87 0.00 0.00 0.00 178.83 179.63 1a6e h LYS 426 N 0.00 -0.28 -4.26 1.69 1.57 -0.49 -3.32 116.57 111.48 1a6e h LYS 426 Ca -0.00 0.02 -0.70 0.00 -1.87 0.00 0.00 60.65 58.09 1a6e h LYS 426 Cb 0.15 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.47 1a6e h LYS 426 CO 0.01 -0.19 3.00 -0.89 -0.57 0.00 0.00 179.45 180.82 1a6e n ILE 427 N -4.22 3.50 -1.55 1.86 2.08 0.41 -4.93 119.36 116.51 1a6e n ILE 427 Ca -0.04 -3.14 -0.29 0.00 0.56 0.00 0.00 62.75 59.84 1a6e n ILE 427 Cb 0.11 -2.57 0.13 0.00 -0.75 0.00 0.00 39.64 36.56 1a6e n ILE 427 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 1a6e s GLY 428 N 3.36 1.58 0.00 7.39 0.00 -1.16 -3.53 107.32 114.96 1a6e s GLY 428 Ca 0.48 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.68 1a6e s GLY 428 CO -0.06 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.67 1a6e n GLY 429 N -2.26 0.21 0.08 0.20 0.00 -1.26 -4.48 105.19 97.69 1a6e n GLY 429 Ca 0.07 -1.87 -0.12 0.00 0.00 0.00 0.00 46.02 44.09 1a6e n GLY 429 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1a6e h ARG 430 N 0.00 0.14 -0.74 1.61 3.08 -2.00 -3.15 114.38 113.32 1a6e h ARG 430 Ca 0.00 -0.24 0.15 0.00 0.07 0.00 0.00 59.98 59.96 1a6e h ARG 430 Cb 0.00 0.09 -0.10 0.00 0.08 0.00 0.00 29.97 30.04 1a6e h ARG 430 CO 0.00 1.09 0.23 1.96 -1.07 0.00 0.00 179.97 182.18 1a6e h GLN 431 N 0.04 0.33 -0.93 0.04 1.08 -1.86 0.40 115.11 114.21 1a6e h GLN 431 Ca -0.09 -0.02 0.11 0.00 -1.45 0.00 0.00 58.65 57.20 1a6e h GLN 431 Cb 1.89 -0.07 -0.08 0.00 -0.05 0.00 0.00 27.48 29.16 1a6e h GLN 431 CO 0.16 0.22 0.56 0.37 -0.95 0.00 0.00 178.83 179.19 1a6e h GLN 432 N 0.34 0.87 -0.76 1.46 4.15 -1.59 -0.07 115.11 119.51 1a6e h GLN 432 Ca 0.41 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.79 1a6e h GLN 432 Cb 0.68 -0.20 -0.04 0.00 0.21 0.00 0.00 27.48 28.13 1a6e h GLN 432 CO -0.46 0.57 0.50 -0.07 -1.93 0.00 0.00 178.83 177.44 1a6e h LEU 433 N 0.89 0.86 -0.42 -2.39 4.07 -0.29 -0.96 115.31 117.07 1a6e h LEU 433 Ca 0.46 -0.02 -0.07 0.00 0.08 0.00 0.00 57.88 58.33 1a6e h LEU 433 Cb 0.46 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 41.98 1a6e h LEU 433 CO -0.27 0.62 -0.01 0.00 -1.08 0.00 0.00 178.44 177.70 1a6e h ALA 434 N 1.28 0.57 -0.72 1.53 0.00 -0.93 -2.02 119.26 118.98 1a6e h ALA 434 Ca 0.28 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1a6e h ALA 434 Cb -0.10 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 1a6e h ALA 434 CO -0.07 0.37 0.40 0.82 0.00 0.00 0.00 179.25 180.77 1a6e h ILE 435 N 0.58 1.21 -0.19 0.00 2.04 -0.57 -1.03 117.51 119.55 1a6e h ILE 435 Ca 0.12 -0.51 -0.18 0.00 1.00 0.00 0.00 64.86 65.29 1a6e h ILE 435 Cb 0.50 0.23 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1a6e h ILE 435 CO 0.02 0.23 -0.56 -0.33 0.00 0.00 0.00 178.15 177.51 1a6e h GLU 436 N 1.00 0.73 -0.85 2.37 5.08 -1.10 -2.51 114.58 119.29 1a6e h GLU 436 Ca 0.26 -0.52 0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1a6e h GLU 436 Cb 0.01 0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 1a6e h GLU 436 CO -0.04 1.14 0.56 0.87 -1.00 0.00 0.00 179.01 180.54 1a6e h LYS 437 N 0.44 1.12 -0.95 2.33 1.79 -1.04 -0.17 116.57 120.09 1a6e h LYS 437 Ca -0.02 -0.07 0.09 0.00 -2.18 0.00 0.00 60.65 58.47 1a6e h LYS 437 Cb 1.18 -0.25 -0.07 0.00 -1.58 0.00 0.00 32.23 31.51 1a6e h LYS 437 CO 0.12 0.75 0.60 0.35 -1.08 0.00 0.00 179.45 180.19 1a6e h PHE 438 N 1.15 1.10 0.14 -1.35 3.04 -1.14 0.15 116.94 120.03 1a6e h PHE 438 Ca 0.31 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 62.28 1a6e h PHE 438 Cb -0.13 -0.35 0.00 0.00 2.56 0.00 0.00 35.95 38.03 1a6e h PHE 438 CO -0.01 0.50 -0.07 0.00 -2.02 0.00 0.00 178.31 176.72 1a6e h ALA 439 N 1.48 -0.18 -0.81 2.41 0.00 -0.63 -1.40 119.26 120.13 1a6e h ALA 439 Ca 0.44 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.35 1a6e h ALA 439 Cb 0.31 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.12 1a6e h ALA 439 CO -0.22 -0.56 0.53 -0.44 0.00 0.00 0.00 179.25 178.56 1a6e h ASP 440 N -0.27 0.74 -0.24 0.00 5.19 -0.06 -1.73 116.42 120.05 1a6e h ASP 440 Ca -0.02 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.35 1a6e h ASP 440 Cb 0.22 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.57 1a6e h ASP 440 CO 0.03 0.46 -0.04 0.00 -3.12 0.00 0.00 179.24 176.57 1a6e h ALA 441 N 1.58 0.32 -0.74 3.45 0.00 -0.44 -2.66 119.26 120.77 1a6e h ALA 441 Ca 0.36 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 55.12 1a6e h ALA 441 Cb 0.31 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1a6e h ALA 441 CO -0.13 0.11 0.49 0.82 0.00 0.00 0.00 179.25 180.53 1a6e h ILE 442 N 0.19 0.90 0.00 0.00 1.08 -0.39 0.31 117.51 119.61 1a6e h ILE 442 Ca 0.06 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 1a6e h ILE 442 Cb 0.50 0.26 0.00 0.00 -3.07 0.00 0.00 36.82 34.50 1a6e h ILE 442 CO 0.02 0.11 0.01 -0.62 -0.69 0.00 0.00 178.15 176.97 1a6e n GLU 443 N -4.50 0.00 -0.32 2.37 1.02 -0.85 -2.22 120.64 116.15 1a6e n GLU 443 Ca 0.13 0.22 -0.04 0.00 -0.02 0.00 0.00 57.16 57.45 1a6e n GLU 443 Cb 0.38 -1.51 0.08 0.00 -0.02 0.00 0.00 31.44 30.38 1a6e n GLU 443 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1a6e h GLU 444 N 0.00 1.16 0.23 3.49 4.39 -0.42 -2.84 114.58 120.58 1a6e h GLU 444 Ca 0.00 -0.10 0.01 0.00 0.34 0.00 0.00 59.36 59.61 1a6e h GLU 444 Cb 0.01 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 28.38 1a6e h GLU 444 CO 0.00 0.81 -0.40 0.82 -1.16 0.00 0.00 179.01 179.08 1a6e h ILE 445 N 1.17 0.19 -0.96 3.13 1.08 -1.66 0.17 117.51 120.63 1a6e h ILE 445 Ca 0.31 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.87 1a6e h ILE 445 Cb -0.05 0.19 -0.07 0.00 -3.07 0.00 0.00 36.82 33.82 1a6e h ILE 445 CO -0.06 0.00 0.61 -0.65 -0.69 0.00 0.00 178.15 177.37 1a6e h PRO 446 N -0.71 0.97 0.08 2.37 0.11 -1.78 0.11 132.00 133.16 1a6e h PRO 446 Ca 0.00 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 1a6e h PRO 446 Cb 0.69 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.58 1a6e h PRO 446 CO -0.17 0.64 -0.04 0.00 -0.21 0.00 0.00 178.00 178.23 1a6e h ARG 447 N 1.00 -0.10 0.13 1.05 3.08 -1.10 0.06 114.38 118.50 1a6e h ARG 447 Ca 0.44 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.50 1a6e h ARG 447 Cb 0.36 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1a6e h ARG 447 CO -0.20 0.01 -0.14 0.00 -1.07 0.00 0.00 179.97 178.57 1a6e h ALA 448 N 0.73 -0.26 -0.45 0.04 0.00 0.02 0.32 119.26 119.65 1a6e h ALA 448 Ca -0.01 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1a6e h ALA 448 Cb 0.16 0.20 -0.07 0.00 0.00 0.00 0.00 17.79 18.08 1a6e h ALA 448 CO 0.02 -0.67 0.02 -0.07 0.00 0.00 0.00 179.25 178.55 1a6e h LEU 449 N -0.30 -0.15 0.76 0.00 3.38 -0.72 0.22 115.31 118.51 1a6e h LEU 449 Ca 0.01 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1a6e h LEU 449 Cb 0.29 0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.22 1a6e h LEU 449 CO -0.04 -0.04 -0.37 0.00 0.09 0.00 0.00 178.44 178.08 1a6e h ALA 450 N 1.39 -1.03 -0.67 1.53 0.00 -0.62 -2.97 119.26 116.89 1a6e h ALA 450 Ca 0.22 -0.23 0.09 0.00 0.00 0.00 0.00 54.91 54.99 1a6e h ALA 450 Cb 0.32 0.40 -0.11 0.00 0.00 0.00 0.00 17.79 18.40 1a6e h ALA 450 CO -0.36 -0.99 -0.47 0.93 0.00 0.00 0.00 179.25 178.36 1a6e h GLU 451 N -1.20 -0.18 -0.96 0.00 5.08 0.08 0.41 114.58 117.81 1a6e h GLU 451 Ca -0.10 0.01 0.20 0.00 -1.00 0.00 0.00 59.36 58.47 1a6e h GLU 451 Cb 0.80 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.01 1a6e h GLU 451 CO 0.17 -0.12 0.61 -0.91 -1.00 0.00 0.00 179.01 177.76 1a6e h ASN 452 N -0.19 0.57 0.02 1.42 2.35 -0.61 -1.90 115.58 117.25 1a6e h ASN 452 Ca 0.18 0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.99 1a6e h ASN 452 Cb 0.55 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.88 1a6e h ASN 452 CO -0.75 0.21 -0.01 0.00 -1.65 0.00 0.00 177.43 175.23 1a6e h ALA 453 N 1.62 -0.03 0.00 -0.83 0.00 -0.80 -3.45 119.26 115.76 1a6e h ALA 453 Ca 0.52 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1a6e h ALA 453 Cb 1.08 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1a6e h ALA 453 CO -0.26 -0.14 0.00 0.41 0.00 0.00 0.00 179.25 179.26 1a6e n GLY 454 N 0.96 0.33 3.70 0.00 0.00 -0.47 -5.06 105.19 104.65 1a6e n GLY 454 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.58 1a6e n GLY 454 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1a6e n LEU 455 N 0.00 5.17 -4.60 0.99 4.77 -1.02 -4.91 117.00 117.41 1a6e n LEU 455 Ca 0.00 0.72 -0.43 0.00 -0.03 0.00 0.00 56.01 56.27 1a6e n LEU 455 Cb 0.00 -1.52 -0.02 0.00 -2.33 0.00 0.00 43.42 39.55 1a6e n LEU 455 CO 0.00 -1.37 1.04 -0.62 -1.33 0.00 0.00 177.39 175.11 1a6e s ASP 456 N -1.67 6.60 0.14 -1.43 2.15 -1.26 -4.00 116.67 117.19 1a6e s ASP 456 Ca 0.78 0.41 -0.29 0.00 0.43 0.00 0.00 52.55 53.89 1a6e s ASP 456 Cb -0.34 -2.55 -0.04 0.00 -0.30 0.00 0.00 42.92 39.69 1a6e s ASP 456 CO 0.45 -1.29 1.58 -0.65 -0.17 0.00 0.00 175.17 175.08 1a6e h PRO 457 N 9.29 -0.41 -0.01 4.34 0.11 -1.90 -0.84 132.00 142.58 1a6e h PRO 457 Ca -0.23 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.90 1a6e h PRO 457 Cb 1.06 0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1a6e h PRO 457 CO 1.14 -0.27 -0.02 0.97 -0.21 0.00 0.00 178.00 179.61 1a6e h ILE 458 N -0.42 1.02 0.03 4.15 6.09 -1.97 0.37 117.51 126.78 1a6e h ILE 458 Ca 0.10 -0.09 -0.04 0.00 -1.37 0.00 0.00 64.86 63.46 1a6e h ILE 458 Cb 0.61 1.03 0.00 0.00 0.47 0.00 0.00 36.82 38.94 1a6e h ILE 458 CO -0.48 0.03 -0.18 -0.78 -3.07 0.00 0.00 178.15 173.66 1a6e h ASP 459 N 0.01 0.11 -0.38 2.19 3.58 -1.83 -2.75 116.42 117.36 1a6e h ASP 459 Ca 0.00 -0.95 -0.00 0.00 0.42 0.00 0.00 57.03 56.49 1a6e h ASP 459 Cb 0.04 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 1a6e h ASP 459 CO 0.00 1.06 0.22 0.40 -2.88 0.00 0.00 179.24 178.04 1a6e h ILE 460 N -0.81 1.14 -0.84 2.25 1.08 -0.94 -1.02 117.51 118.35 1a6e h ILE 460 Ca -0.03 -0.34 0.04 0.00 -0.39 0.00 0.00 64.86 64.14 1a6e h ILE 460 Cb 1.11 0.67 -0.05 0.00 -3.07 0.00 0.00 36.82 35.48 1a6e h ILE 460 CO 0.03 0.14 0.55 0.25 -0.69 0.00 0.00 178.15 178.44 1a6e h LEU 461 N 0.50 0.90 -0.13 1.44 7.12 -0.37 0.48 115.31 125.24 1a6e h LEU 461 Ca 0.14 -0.01 -0.05 0.00 0.13 0.00 0.00 57.88 58.09 1a6e h LEU 461 Cb 0.03 -0.21 -0.00 0.00 -0.53 0.00 0.00 40.66 39.95 1a6e h LEU 461 CO -0.02 0.62 -0.11 -0.07 -0.13 0.00 0.00 178.44 178.73 1a6e h LEU 462 N 1.04 0.33 -0.97 2.25 4.07 -1.14 -0.95 115.31 119.94 1a6e h LEU 462 Ca 0.34 -0.46 -0.06 0.00 0.08 0.00 0.00 57.88 57.78 1a6e h LEU 462 Cb 0.04 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.66 1a6e h LEU 462 CO -0.10 0.71 0.11 0.11 -1.08 0.00 0.00 178.44 178.19 1a6e h LYS 463 N -0.06 0.86 -0.25 1.13 1.57 -0.69 -1.65 116.57 117.48 1a6e h LYS 463 Ca 0.02 -0.19 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1a6e h LYS 463 Cb 0.61 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1a6e h LYS 463 CO 0.03 0.79 0.17 1.25 -0.57 0.00 0.00 179.45 181.11 1a6e h LEU 464 N 0.82 0.29 -0.47 2.94 5.85 0.10 -2.11 115.31 122.73 1a6e h LEU 464 Ca 0.18 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.89 1a6e h LEU 464 Cb 0.33 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1a6e h LEU 464 CO 0.00 0.22 0.31 0.03 -0.34 0.00 0.00 178.44 178.66 1a6e h ARG 465 N 0.34 0.61 0.02 1.25 3.08 -0.79 -2.17 114.38 116.72 1a6e h ARG 465 Ca 0.09 -0.04 0.01 0.00 0.07 0.00 0.00 59.98 60.11 1a6e h ARG 465 Cb -0.04 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 1a6e h ARG 465 CO -0.02 0.41 -0.25 0.00 -1.07 0.00 0.00 179.97 179.04 1a6e h ALA 466 N 1.18 -0.72 -0.73 0.04 0.00 -0.66 0.22 119.26 118.59 1a6e h ALA 466 Ca 0.18 -0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.18 1a6e h ALA 466 Cb -0.06 0.70 -0.10 0.00 0.00 0.00 0.00 17.79 18.33 1a6e h ALA 466 CO -0.04 -0.79 0.25 0.93 0.00 0.00 0.00 179.25 179.59 1a6e h GLU 467 N -0.32 0.37 0.00 0.00 4.39 -1.39 0.14 114.58 117.76 1a6e h GLU 467 Ca 0.00 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.60 1a6e h GLU 467 Cb 0.34 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 1a6e h GLU 467 CO -0.16 0.24 -0.37 0.45 -1.16 0.00 0.00 179.01 178.02 1a6e h HIS 468 N 0.38 0.00 -0.08 4.33 3.86 -0.92 0.75 115.15 123.46 1a6e h HIS 468 Ca 0.40 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.60 1a6e h HIS 468 Cb 0.62 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.09 1a6e h HIS 468 CO -0.20 0.37 0.02 0.00 0.86 0.00 0.00 177.93 178.98 1a6e h ALA 469 N 1.63 0.11 0.00 2.45 0.00 0.21 -1.74 119.26 121.92 1a6e h ALA 469 Ca -0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1a6e h ALA 469 Cb 0.68 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.44 1a6e h ALA 469 CO 0.05 -0.27 0.00 1.63 0.00 0.00 0.00 179.25 180.66 1a6e n LYS 470 N -4.90 0.61 -2.35 0.00 5.02 -0.39 -4.75 118.16 111.40 1a6e n LYS 470 Ca -0.06 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.07 1a6e n LYS 470 Cb 0.15 -1.25 -0.00 0.00 -0.02 0.00 0.00 35.03 33.90 1a6e n LYS 470 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1a6e n GLY 471 N 0.44 -0.28 2.57 0.72 0.00 -0.65 -4.92 105.19 103.07 1a6e n GLY 471 Ca 0.00 -0.21 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 1a6e n GLY 471 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1a6e n ASN 472 N -1.07 7.61 0.00 1.61 5.03 0.21 -4.85 115.26 123.79 1a6e n ASN 472 Ca -0.18 -3.35 0.00 0.00 0.87 0.00 0.00 54.58 51.92 1a6e n ASN 472 Cb 0.64 -1.29 0.00 0.00 -1.02 0.00 0.00 39.78 38.10 1a6e n ASN 472 CO 0.00 0.00 0.00 2.29 -1.83 0.00 0.00 177.26 177.72 1a6e n LYS 473 N 1.16 0.00 -0.05 3.52 2.85 -1.26 -0.82 118.16 123.56 1a6e n LYS 473 Ca 0.54 0.07 0.02 0.00 -1.05 0.00 0.00 58.31 57.89 1a6e n LYS 473 Cb 0.26 -1.62 0.03 0.00 -0.65 0.00 0.00 35.03 33.05 1a6e n LYS 473 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1a6e n THR 474 N -0.88 0.92 -2.58 0.58 -2.24 -1.26 -4.49 114.28 104.33 1a6e n THR 474 Ca 0.00 -0.99 -0.43 0.00 -2.27 0.00 0.00 64.05 60.36 1a6e n THR 474 Cb 0.12 0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.78 1a6e n THR 474 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1a6e s TYR 475 N -1.11 2.88 0.00 4.78 1.51 0.00 -0.58 117.35 124.84 1a6e s TYR 475 Ca 0.06 0.88 0.00 0.00 -1.01 0.00 0.00 57.07 57.00 1a6e s TYR 475 Cb 0.05 -4.16 0.00 0.00 -0.11 0.00 0.00 41.96 37.74 1a6e s TYR 475 CO 0.01 -1.19 0.00 0.41 -1.11 0.00 0.00 175.55 173.67 1a6e n GLY 476 N 4.52 5.05 3.46 0.71 0.00 -0.49 -4.01 105.19 114.45 1a6e n GLY 476 Ca 0.12 -2.11 -0.43 0.00 0.00 0.00 0.00 46.02 43.60 1a6e n GLY 476 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1a6e s ILE 477 N -0.61 5.17 -1.01 -0.61 1.09 0.87 -2.65 121.20 123.45 1a6e s ILE 477 Ca 0.00 -0.55 -0.23 0.00 -1.10 0.00 0.00 60.65 58.77 1a6e s ILE 477 Cb 0.00 -4.00 0.04 0.00 -1.06 0.00 0.00 42.46 37.43 1a6e s ILE 477 CO 0.00 -0.39 1.52 0.21 -0.10 0.00 0.00 174.94 176.17 1a6e s ASN 478 N 1.83 6.32 0.00 3.58 3.84 -0.55 -4.83 114.94 125.14 1a6e s ASN 478 Ca 0.08 -1.35 0.00 0.00 0.21 0.00 0.00 52.86 51.80 1a6e s ASN 478 Cb -0.18 -2.57 0.00 0.00 -0.55 0.00 0.00 41.25 37.95 1a6e s ASN 478 CO 0.11 -1.67 0.77 1.33 -2.79 0.00 0.00 177.10 174.85 1a6e n VAL 479 N 7.02 1.17 -0.08 -5.21 0.24 -1.26 -0.09 118.33 120.12 1a6e n VAL 479 Ca 0.34 0.41 -0.23 0.00 -2.04 0.00 0.00 64.34 62.83 1a6e n VAL 479 Cb 0.50 -1.41 -0.12 0.00 -1.47 0.00 0.00 33.84 31.34 1a6e n VAL 479 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 1a6e n PHE 480 N -1.27 0.80 0.06 6.34 3.72 -1.26 -4.45 117.46 121.41 1a6e n PHE 480 Ca 0.00 0.25 0.08 0.00 -0.05 0.00 0.00 57.45 57.74 1a6e n PHE 480 Cb 0.12 -1.09 -0.05 0.00 -0.94 0.00 0.00 39.48 37.51 1a6e n PHE 480 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1a6e n THR 481 N -3.92 0.66 -0.90 4.37 -2.24 -0.91 -4.95 114.28 106.38 1a6e n THR 481 Ca -0.38 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 60.82 1a6e n THR 481 Cb 0.88 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 1a6e n THR 481 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1a6e n GLY 482 N 1.25 0.73 3.92 3.38 0.00 0.87 -5.02 105.19 110.33 1a6e n GLY 482 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.72 1a6e n GLY 482 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a6e s GLU 483 N -0.10 3.54 -0.92 1.61 2.02 -1.24 -4.88 118.70 118.73 1a6e s GLU 483 Ca 0.00 -0.26 -0.15 0.00 0.02 0.00 0.00 54.97 54.57 1a6e s GLU 483 Cb 0.00 -2.76 0.19 0.00 0.10 0.00 0.00 34.13 31.66 1a6e s GLU 483 CO 0.00 0.31 0.99 0.42 0.02 0.00 0.00 175.26 177.00 1a6e s ILE 484 N -2.00 5.27 0.20 -1.63 1.09 -1.26 -1.48 121.20 121.39 1a6e s ILE 484 Ca 0.40 -2.23 0.03 0.00 -1.10 0.00 0.00 60.65 57.74 1a6e s ILE 484 Cb -0.11 -4.64 0.03 0.00 -1.06 0.00 0.00 42.46 36.68 1a6e s ILE 484 CO 0.30 -1.28 0.22 -0.62 -0.10 0.00 0.00 174.94 173.46 1a6e n GLU 485 N 4.97 1.03 -2.56 2.79 1.02 -1.09 -4.77 120.64 122.04 1a6e n GLU 485 Ca 0.21 -1.18 -0.43 0.00 -0.02 0.00 0.00 57.16 55.74 1a6e n GLU 485 Cb 0.47 0.03 -0.02 0.00 -0.02 0.00 0.00 31.44 31.89 1a6e n GLU 485 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1a6e s ASP 486 N -2.23 6.53 0.30 1.62 -1.08 -1.26 -1.39 116.67 119.16 1a6e s ASP 486 Ca 0.16 0.41 0.00 0.00 -0.52 0.00 0.00 52.55 52.61 1a6e s ASP 486 Cb -0.01 -2.55 0.47 0.00 -1.46 0.00 0.00 42.92 39.37 1a6e s ASP 486 CO 0.10 -1.35 1.87 0.24 0.52 0.00 0.00 175.17 176.55 1a6e h MET 487 N 9.57 0.79 -0.01 4.34 2.86 -1.16 -1.29 114.93 130.03 1a6e h MET 487 Ca -0.24 -0.14 -0.17 0.00 -2.06 0.00 0.00 59.70 57.09 1a6e h MET 487 Cb 1.07 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 1a6e h MET 487 CO 1.14 0.69 -0.77 -0.39 1.06 0.00 0.00 176.91 178.64 1a6e h VAL 488 N 0.78 1.50 0.67 -2.22 -1.51 -1.77 0.13 116.25 113.82 1a6e h VAL 488 Ca 0.18 -2.48 -0.03 0.00 -1.23 0.00 0.00 66.70 63.14 1a6e h VAL 488 Cb 0.22 2.35 0.01 0.00 -2.13 0.00 0.00 31.29 31.73 1a6e h VAL 488 CO -0.01 0.72 -0.32 0.50 -1.23 0.00 0.00 177.57 177.23 1a6e h LYS 489 N 0.06 -0.87 0.00 5.19 3.11 -1.84 -2.42 116.57 119.81 1a6e h LYS 489 Ca -0.02 0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.88 1a6e h LYS 489 Cb 1.34 0.20 0.00 0.00 -1.00 0.00 0.00 32.23 32.77 1a6e h LYS 489 CO 0.11 -0.58 0.00 0.09 -2.81 0.00 0.00 179.45 176.26 1a6e n ASN 490 N -5.03 0.00 0.00 4.20 5.03 -0.52 -4.85 115.26 114.09 1a6e n ASN 490 Ca -0.11 0.05 0.00 0.00 0.87 0.00 0.00 54.58 55.38 1a6e n ASN 490 Cb 0.35 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 38.98 1a6e n ASN 490 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1a6e n GLY 491 N -0.85 0.82 3.54 7.41 0.00 -0.86 -5.01 105.19 110.25 1a6e n GLY 491 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1a6e n GLY 491 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1a6e s VAL 492 N -3.19 4.22 0.04 1.61 -7.23 0.39 -4.64 120.40 111.60 1a6e s VAL 492 Ca 0.00 0.50 -0.03 0.00 -1.81 0.00 0.00 61.98 60.64 1a6e s VAL 492 Cb 0.00 -4.63 -0.02 0.00 0.56 0.00 0.00 36.38 32.29 1a6e s VAL 492 CO 0.00 -1.24 0.04 0.27 -0.31 0.00 0.00 175.10 173.86 1a6e s ILE 493 N 4.39 0.15 0.03 -0.62 -4.36 -1.26 -0.63 121.20 118.91 1a6e s ILE 493 Ca 0.35 -1.27 -0.07 0.00 -0.26 0.00 0.00 60.65 59.40 1a6e s ILE 493 Cb -0.11 -0.98 -0.00 0.00 1.25 0.00 0.00 42.46 42.62 1a6e s ILE 493 CO 0.21 -0.70 0.12 -1.83 0.24 0.00 0.00 174.94 172.98 1a6e s GLU 494 N -2.83 0.57 0.43 0.37 -1.05 -0.55 -4.50 118.70 111.13 1a6e s GLU 494 Ca -0.03 -0.62 -0.25 0.00 -0.15 0.00 0.00 54.97 53.92 1a6e s GLU 494 Cb 0.00 0.23 -0.10 0.00 -0.44 0.00 0.00 34.13 33.82 1a6e s GLU 494 CO -0.06 -0.15 1.12 -2.30 0.95 0.00 0.00 175.26 174.83 1a6e n PRO 495 N 0.96 1.58 -0.16 -4.83 -0.02 -1.26 -0.75 135.00 130.52 1a6e n PRO 495 Ca -0.20 0.56 -0.01 0.00 -2.02 0.00 0.00 63.50 61.83 1a6e n PRO 495 Cb 0.58 -2.20 0.23 0.00 -0.02 0.00 0.00 33.50 32.09 1a6e n PRO 495 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1a6e h ILE 496 N 1.73 1.20 -0.98 4.25 2.10 -1.85 -3.04 117.51 120.92 1a6e h ILE 496 Ca -0.46 -0.57 0.20 0.00 1.08 0.00 0.00 64.86 65.12 1a6e h ILE 496 Cb 1.32 0.40 -0.09 0.00 -1.09 0.00 0.00 36.82 37.36 1a6e h ILE 496 CO 0.58 0.24 0.62 -0.09 -1.08 0.00 0.00 178.15 178.41 1a6e h ARG 497 N 0.88 0.59 0.25 2.19 2.43 -1.89 -1.91 114.38 116.91 1a6e h ARG 497 Ca 0.22 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 1a6e h ARG 497 Cb 0.09 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.49 1a6e h ARG 497 CO -0.03 0.39 -0.26 0.28 -1.51 0.00 0.00 179.97 178.84 1a6e h VAL 498 N 0.60 0.45 -0.77 0.20 2.07 -1.83 -3.04 116.25 113.94 1a6e h VAL 498 Ca 0.55 0.00 0.04 0.00 0.82 0.00 0.00 66.70 68.10 1a6e h VAL 498 Cb 1.07 0.45 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1a6e h VAL 498 CO -0.30 0.00 0.48 1.23 0.02 0.00 0.00 177.57 179.00 1a6e h GLY 499 N -0.54 1.12 0.97 2.17 0.00 -1.50 -2.74 103.07 102.55 1a6e h GLY 499 Ca -0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 1a6e h GLY 499 CO -0.06 0.30 0.10 0.50 0.00 0.00 0.00 176.54 177.38 1a6e h LYS 500 N 0.93 0.78 -0.10 4.80 1.57 -1.53 -2.75 116.57 120.27 1a6e h LYS 500 Ca 0.31 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 1a6e h LYS 500 Cb 0.04 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 1a6e h LYS 500 CO -0.12 0.77 -0.03 1.96 -0.57 0.00 0.00 179.45 181.46 1a6e h GLN 501 N 0.65 0.20 -0.38 3.15 7.50 -1.47 0.32 115.11 125.08 1a6e h GLN 501 Ca 0.15 -0.08 0.08 0.00 0.50 0.00 0.00 58.65 59.30 1a6e h GLN 501 Cb 0.35 -0.01 -0.09 0.00 0.05 0.00 0.00 27.48 27.79 1a6e h GLN 501 CO 0.00 0.52 -0.29 0.00 -1.50 0.00 0.00 178.83 177.56 1a6e h ALA 502 N 0.67 -0.11 -0.50 3.87 0.00 -1.52 1.13 119.26 122.80 1a6e h ALA 502 Ca 0.02 0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1a6e h ALA 502 Cb 0.45 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 1a6e h ALA 502 CO 0.01 -0.68 0.20 -0.84 0.00 0.00 0.00 179.25 177.93 1a6e h ILE 503 N -0.23 1.19 0.54 0.00 -0.00 -1.41 0.30 117.51 117.90 1a6e h ILE 503 Ca 0.18 -0.58 -0.03 0.00 -0.00 0.00 0.00 64.86 64.43 1a6e h ILE 503 Cb 0.51 0.60 0.01 0.00 -0.00 0.00 0.00 36.82 37.93 1a6e h ILE 503 CO -0.51 0.23 -0.26 -0.08 -0.00 0.00 0.00 178.15 177.53 1a6e h GLU 504 N 0.71 -0.70 -0.84 0.16 4.81 0.16 -0.64 114.58 118.24 1a6e h GLU 504 Ca 0.17 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 1a6e h GLU 504 Cb 0.15 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.65 1a6e h GLU 504 CO -0.02 -0.40 0.50 0.77 -0.73 0.00 0.00 179.01 179.13 1a6e h SER 505 N -0.99 1.02 -0.09 1.04 0.02 0.13 -1.87 113.55 112.81 1a6e h SER 505 Ca -0.07 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1a6e h SER 505 Cb 0.63 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.91 1a6e h SER 505 CO 0.12 0.80 0.04 0.00 -1.14 0.00 0.00 176.83 176.65 1a6e h ALA 506 N 1.27 0.11 0.00 3.77 0.00 -0.37 -2.33 119.26 121.71 1a6e h ALA 506 Ca 0.30 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.07 1a6e h ALA 506 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1a6e h ALA 506 CO -0.05 -0.34 -0.39 1.79 0.00 0.00 0.00 179.25 180.25 1a6e h THR 507 N 0.03 1.10 0.00 0.00 1.35 -0.89 -2.33 112.91 112.17 1a6e h THR 507 Ca 0.03 -1.41 -0.08 0.00 -0.55 0.00 0.00 66.41 64.40 1a6e h THR 507 Cb 0.09 1.80 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 1a6e h THR 507 CO -0.00 0.38 -0.37 -0.33 -0.25 0.00 0.00 175.52 174.94 1a6e h GLU 508 N 0.00 0.00 0.28 4.72 4.39 -1.13 -1.33 114.58 121.50 1a6e h GLU 508 Ca -0.00 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1a6e h GLU 508 Cb 0.77 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 1a6e h GLU 508 CO 0.05 0.37 -0.13 0.00 -1.16 0.00 0.00 179.01 178.14 1a6e h ALA 509 N 1.63 -0.37 -0.86 3.43 0.00 -1.00 -2.89 119.26 119.19 1a6e h ALA 509 Ca -0.00 -0.14 0.22 0.00 0.00 0.00 0.00 54.91 54.99 1a6e h ALA 509 Cb 0.84 0.14 -0.14 0.00 0.00 0.00 0.00 17.79 18.63 1a6e h ALA 509 CO 0.05 -0.37 0.16 0.00 0.00 0.00 0.00 179.25 179.08 1a6e h ALA 510 N -0.86 1.15 -0.64 0.00 0.00 -1.37 0.31 119.26 117.85 1a6e h ALA 510 Ca -0.04 0.24 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1a6e h ALA 510 Cb 0.41 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1a6e h ALA 510 CO 0.06 -0.47 0.13 0.82 0.00 0.00 0.00 179.25 179.79 1a6e h ILE 511 N 0.16 1.26 0.46 0.00 2.04 -1.32 -0.33 117.51 119.78 1a6e h ILE 511 Ca 0.53 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 65.39 1a6e h ILE 511 Cb 1.04 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 1a6e h ILE 511 CO -0.69 0.36 -0.22 -0.03 0.00 0.00 0.00 178.15 177.57 1a6e h MET 512 N 0.96 -0.60 -0.53 2.37 4.05 -0.76 -2.03 114.93 118.38 1a6e h MET 512 Ca 0.20 0.04 0.05 0.00 -0.28 0.00 0.00 59.70 59.71 1a6e h MET 512 Cb 0.39 0.14 -0.03 0.00 -0.80 0.00 0.00 31.60 31.30 1a6e h MET 512 CO 0.01 -0.31 0.35 0.82 0.23 0.00 0.00 176.91 178.01 1a6e h ILE 513 N -0.83 1.02 0.00 1.77 5.03 -1.29 -1.97 117.51 121.23 1a6e h ILE 513 Ca -0.06 -0.18 0.00 0.00 -0.12 0.00 0.00 64.86 64.49 1a6e h ILE 513 Cb 0.57 0.43 0.00 0.00 -3.03 0.00 0.00 36.82 34.79 1a6e h ILE 513 CO 0.10 0.10 0.00 0.25 -0.68 0.00 0.00 178.15 177.92 1a6e h LEU 514 N 0.54 0.00 0.00 1.44 5.85 -0.72 -3.11 115.31 119.30 1a6e h LEU 514 Ca 0.22 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 1a6e h LEU 514 Cb 0.20 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1a6e h LEU 514 CO -0.06 0.00 -1.72 0.54 -0.34 0.00 0.00 178.44 176.86 1a6e n ARG 515 N -2.67 0.64 -2.20 1.25 1.74 -0.75 -4.81 116.66 109.86 1a6e n ARG 515 Ca 0.02 -0.06 -0.41 0.00 -0.77 0.00 0.00 57.85 56.63 1a6e n ARG 515 Cb 0.30 -1.63 -0.03 0.00 -1.02 0.00 0.00 32.46 30.09 1a6e n ARG 515 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1a6e s ILE 516 N -3.34 3.58 -2.25 0.55 1.01 -1.15 -4.85 121.20 114.75 1a6e s ILE 516 Ca -0.06 0.46 0.22 0.00 0.00 0.00 0.00 60.65 61.28 1a6e s ILE 516 Cb 0.12 -4.14 0.51 0.00 0.01 0.00 0.00 42.46 38.96 1a6e s ILE 516 CO 0.86 -0.97 1.46 -0.90 0.00 0.00 0.00 174.94 175.40 1a6e n ASP 517 N 10.81 3.43 -3.64 3.58 5.75 -1.26 -4.57 116.55 130.65 1a6e n ASP 517 Ca 0.17 -1.98 -0.08 0.00 -0.01 0.00 0.00 54.79 52.88 1a6e n ASP 517 Cb 0.50 -0.34 -0.07 0.00 -1.03 0.00 0.00 41.12 40.18 1a6e n ASP 517 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1a6e s ASP 518 N -1.27 -0.54 -0.23 -1.12 -1.08 -1.26 -4.51 116.67 106.67 1a6e s ASP 518 Ca 0.42 0.99 -0.01 0.00 -0.52 0.00 0.00 52.55 53.43 1a6e s ASP 518 Cb 0.23 1.06 0.06 0.00 -1.46 0.00 0.00 42.92 42.81 1a6e s ASP 518 CO 0.31 -0.17 -0.01 0.54 0.52 0.00 0.00 175.17 176.37 1a6e s VAL 519 N 0.55 1.11 0.38 1.11 0.11 -1.26 -5.10 120.40 117.30 1a6e s VAL 519 Ca -0.00 -0.99 0.05 0.00 -2.93 0.00 0.00 61.98 58.10 1a6e s VAL 519 Cb -0.05 -1.50 -0.06 0.00 -1.53 0.00 0.00 36.38 33.23 1a6e s VAL 519 CO -0.08 -0.19 0.04 0.27 -3.33 0.00 0.00 175.10 171.81 1a6e s ILE 520 N 1.58 1.48 -2.74 7.04 -4.36 -1.26 -5.12 121.20 117.81 1a6e s ILE 520 Ca -0.03 -2.00 0.26 0.00 -0.26 0.00 0.00 60.65 58.62 1a6e s ILE 520 Cb -0.18 -2.81 0.37 0.00 1.25 0.00 0.00 42.46 41.10 1a6e s ILE 520 CO -0.08 0.00 1.51 0.00 0.24 0.00 0.00 174.94 176.61