#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b6r h HIS 7 N 0.00 0.63 -0.39 0.66 6.17 -2.04 -2.94 115.15 117.25 3b6r h HIS 7 Ca 0.00 -0.24 -0.05 0.00 0.71 0.00 0.00 60.37 60.80 3b6r h HIS 7 Cb 0.00 -0.11 -0.02 0.00 2.52 0.00 0.00 27.41 29.80 3b6r h HIS 7 CO 0.00 0.96 0.05 -0.97 0.71 0.00 0.00 177.93 178.68 3b6r h ASN 8 N 0.12 0.56 -0.65 3.26 -1.24 -1.98 -1.51 115.58 114.12 3b6r h ASN 8 Ca 0.00 -0.10 -0.02 0.00 0.71 0.00 0.00 56.30 56.89 3b6r h ASN 8 Cb 0.94 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.82 3b6r h ASN 8 CO 0.07 0.60 0.34 0.00 -1.29 0.00 0.00 177.43 177.15 3b6r h ALA 9 N 1.48 0.84 -0.06 1.57 0.00 -1.97 0.43 119.26 121.54 3b6r h ALA 9 Ca 0.13 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3b6r h ALA 9 Cb 0.30 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3b6r h ALA 9 CO 0.00 0.37 0.04 1.25 0.00 0.00 0.00 179.25 180.91 3b6r h LEU 10 N 0.89 0.07 -1.76 0.00 6.46 -1.17 -2.32 115.31 117.48 3b6r h LEU 10 Ca 0.23 -0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.95 3b6r h LEU 10 Cb 0.08 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 3b6r h LEU 10 CO -0.03 0.06 -0.06 0.11 -0.62 0.00 0.00 178.44 177.90 3b6r h LYS 11 N 0.07 0.08 0.00 1.25 1.57 -0.91 0.13 116.57 118.74 3b6r h LYS 11 Ca 0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3b6r h LYS 11 Cb 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.30 3b6r h LYS 11 CO -0.00 0.14 0.00 1.28 -0.57 0.00 0.00 179.45 180.30 3b6r n LEU 12 N -4.42 0.15 0.20 2.94 7.99 0.11 -1.81 117.00 122.16 3b6r n LEU 12 Ca -0.02 0.54 0.09 0.00 -0.01 0.00 0.00 56.01 56.61 3b6r n LEU 12 Cb 0.17 -0.52 0.28 0.00 -0.11 0.00 0.00 43.42 43.23 3b6r n LEU 12 CO 0.35 -0.32 0.72 0.03 -1.51 0.00 0.00 177.39 176.66 3b6r h ARG 13 N 0.00 0.00 -6.22 3.23 3.08 -0.81 -3.44 114.38 110.23 3b6r h ARG 13 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 3b6r h ARG 13 Cb 0.27 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.28 3b6r h ARG 13 CO 0.00 0.23 -0.12 -0.06 -1.07 0.00 0.00 179.97 178.95 3b6r s PHE 14 N -3.33 3.66 0.72 3.04 0.08 -0.75 -5.05 117.98 116.36 3b6r s PHE 14 Ca 0.03 1.04 -0.16 0.00 0.12 0.00 0.00 56.93 57.96 3b6r s PHE 14 Cb 0.08 -2.34 0.02 0.00 -0.57 0.00 0.00 43.02 40.21 3b6r s PHE 14 CO 0.67 0.51 1.16 -2.30 -0.10 0.00 0.00 175.22 175.15 3b6r n PRO 15 N 1.15 0.62 -0.19 0.24 -0.02 -1.26 -4.85 135.00 130.69 3b6r n PRO 15 Ca -0.08 0.27 0.12 0.00 -2.02 0.00 0.00 63.50 61.79 3b6r n PRO 15 Cb 0.52 -2.40 0.43 0.00 -0.02 0.00 0.00 33.50 32.03 3b6r n PRO 15 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3b6r h ALA 16 N -0.18 1.91 0.00 3.55 0.00 -1.92 -1.37 119.26 121.24 3b6r h ALA 16 Ca -0.48 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 3b6r h ALA 16 Cb 1.33 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 3b6r h ALA 16 CO 0.49 -0.10 -0.25 1.05 0.00 0.00 0.00 179.25 180.44 3b6r h GLU 17 N 0.59 0.00 0.00 0.00 4.11 -1.93 -0.22 114.58 117.13 3b6r h GLU 17 Ca 0.37 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.77 3b6r h GLU 17 Cb 0.63 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 3b6r h GLU 17 CO -0.14 0.25 -0.16 -0.44 0.07 0.00 0.00 179.01 178.59 3b6r h ASP 18 N 0.00 0.00 0.21 3.06 3.32 -1.59 -3.21 116.42 118.21 3b6r h ASP 18 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3b6r h ASP 18 Cb 0.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.00 3b6r h ASP 18 CO 0.03 0.16 -1.67 -0.62 -1.72 0.00 0.00 179.24 175.42 3b6r n GLU 19 N -3.16 0.57 -1.68 3.56 -0.58 -0.96 -4.95 120.64 113.44 3b6r n GLU 19 Ca 0.03 -0.11 -0.47 0.00 -0.42 0.00 0.00 57.16 56.19 3b6r n GLU 19 Cb 0.55 -1.58 -0.04 0.00 -0.57 0.00 0.00 31.44 29.80 3b6r n GLU 19 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3b6r n PHE 20 N -2.25 2.35 -2.14 -0.32 7.35 -0.13 -4.93 117.46 117.38 3b6r n PHE 20 Ca -0.02 0.08 -0.36 0.00 -0.76 0.00 0.00 57.45 56.39 3b6r n PHE 20 Cb 0.54 -2.63 0.01 0.00 0.35 0.00 0.00 39.48 37.76 3b6r n PHE 20 CO 0.00 0.00 0.00 -1.25 -0.76 0.00 0.00 176.76 174.75 3b6r s PRO 21 N 2.62 3.25 -0.53 -7.13 0.04 -1.26 -4.98 135.00 127.02 3b6r s PRO 21 Ca 0.86 1.75 -0.21 0.00 0.04 0.00 0.00 61.00 63.43 3b6r s PRO 21 Cb -0.66 -2.04 0.05 0.00 0.04 0.00 0.00 34.50 31.89 3b6r s PRO 21 CO 0.44 -0.96 0.76 0.34 0.04 0.00 0.00 177.00 177.62 3b6r s ASP 22 N -1.60 6.27 -0.27 6.66 -1.08 -1.26 -4.90 116.67 120.49 3b6r s ASP 22 Ca 0.73 -0.69 0.11 0.00 -0.52 0.00 0.00 52.55 52.18 3b6r s ASP 22 Cb -0.28 -2.35 0.53 0.00 -1.46 0.00 0.00 42.92 39.36 3b6r s ASP 22 CO 0.31 -1.04 1.50 0.18 0.52 0.00 0.00 175.17 176.64 3b6r n LEU 23 N 6.72 4.31 0.26 -1.34 4.77 -1.26 -4.73 117.00 125.72 3b6r n LEU 23 Ca -0.03 -3.51 0.09 0.00 -0.03 0.00 0.00 56.01 52.53 3b6r n LEU 23 Cb 0.46 -0.63 0.66 0.00 -2.33 0.00 0.00 43.42 41.58 3b6r n LEU 23 CO 0.58 1.04 1.05 0.77 -1.33 0.00 0.00 177.39 179.51 3b6r h SER 24 N 1.29 0.00 -0.30 -1.43 4.64 -1.99 -2.41 113.55 113.35 3b6r h SER 24 Ca 0.19 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.48 3b6r h SER 24 Cb 1.71 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.78 3b6r h SER 24 CO 0.40 0.02 0.01 0.00 -0.87 0.00 0.00 176.83 176.39 3b6r n ALA 25 N -2.50 3.22 -2.88 5.18 0.00 -1.26 -5.01 120.51 117.25 3b6r n ALA 25 Ca -0.03 -2.38 -0.35 0.00 0.00 0.00 0.00 53.44 50.68 3b6r n ALA 25 Cb 0.11 -0.75 -0.06 0.00 0.00 0.00 0.00 19.45 18.75 3b6r n ALA 25 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 3b6r s HIS 26 N -2.88 3.54 -0.51 0.00 4.02 -0.91 -4.84 115.29 113.72 3b6r s HIS 26 Ca 0.43 0.42 0.05 0.00 1.02 0.00 0.00 55.06 56.98 3b6r s HIS 26 Cb 0.36 -1.87 0.18 0.00 -1.02 0.00 0.00 32.58 30.23 3b6r s HIS 26 CO 0.08 0.68 0.42 -1.71 1.02 0.00 0.00 174.74 175.23 3b6r n ASN 27 N 1.44 0.80 -3.94 1.40 4.05 0.26 -4.94 115.26 114.33 3b6r n ASN 27 Ca -0.15 -2.70 -0.09 0.00 0.45 0.00 0.00 54.58 52.09 3b6r n ASN 27 Cb 0.54 -0.62 -0.08 0.00 1.23 0.00 0.00 39.78 40.84 3b6r n ASN 27 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 3b6r s ASN 28 N -0.63 0.14 0.26 1.20 2.20 -1.26 -4.57 114.94 112.29 3b6r s ASN 28 Ca 0.31 -0.82 -0.03 0.00 -0.94 0.00 0.00 52.86 51.39 3b6r s ASN 28 Cb 0.04 0.36 0.40 0.00 -2.00 0.00 0.00 41.25 40.04 3b6r s ASN 28 CO -0.17 -0.77 1.86 0.45 -2.94 0.00 0.00 177.10 175.52 3b6r h HIS 29 N 2.72 1.10 -0.51 1.54 3.86 -1.16 -2.16 115.15 120.55 3b6r h HIS 29 Ca -0.33 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 58.93 3b6r h HIS 29 Cb 1.20 -0.36 -0.03 0.00 1.06 0.00 0.00 27.41 29.28 3b6r h HIS 29 CO 0.43 0.54 0.30 1.98 0.86 0.00 0.00 177.93 182.04 3b6r h MET 30 N 1.06 0.57 -0.23 2.45 1.85 -1.00 -2.10 114.93 117.53 3b6r h MET 30 Ca 0.42 -0.03 0.01 0.00 -0.61 0.00 0.00 59.70 59.49 3b6r h MET 30 Cb 0.22 -0.13 -0.01 0.00 0.43 0.00 0.00 31.60 32.11 3b6r h MET 30 CO -0.19 0.38 0.15 0.00 -0.40 0.00 0.00 176.91 176.85 3b6r h ALA 31 N 1.23 1.88 0.00 0.39 0.00 -1.67 0.17 119.26 121.26 3b6r h ALA 31 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.10 3b6r h ALA 31 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3b6r h ALA 31 CO -0.10 0.10 0.00 0.87 0.00 0.00 0.00 179.25 180.12 3b6r h LYS 32 N 0.28 0.00 0.00 0.00 1.57 -1.13 -3.35 116.57 113.93 3b6r h LYS 32 Ca 0.09 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.69 3b6r h LYS 32 Cb 0.02 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 3b6r h LYS 32 CO -0.02 0.00 -1.66 0.28 -0.57 0.00 0.00 179.45 177.48 3b6r n VAL 33 N -2.88 0.66 -1.94 0.50 0.31 -0.55 -4.98 118.33 109.45 3b6r n VAL 33 Ca 0.02 -0.31 -0.42 0.00 -0.01 0.00 0.00 64.34 63.62 3b6r n VAL 33 Cb 0.35 -0.86 -0.03 0.00 -0.91 0.00 0.00 33.84 32.40 3b6r n VAL 33 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 3b6r s LEU 34 N -5.30 3.45 0.30 7.52 2.96 -0.06 -4.98 118.68 122.57 3b6r s LEU 34 Ca -0.12 1.15 0.07 0.00 -0.22 0.00 0.00 54.13 55.01 3b6r s LEU 34 Cb 0.04 -3.24 -0.03 0.00 0.50 0.00 0.00 46.19 43.46 3b6r s LEU 34 CO 0.32 -1.95 0.29 0.42 -1.32 0.00 0.00 176.35 174.10 3b6r s THR 35 N 7.86 4.07 0.30 3.68 -4.23 -1.26 -4.96 115.64 121.10 3b6r s THR 35 Ca 0.81 -1.30 -0.00 0.00 -1.18 0.00 0.00 61.69 60.01 3b6r s THR 35 Cb -0.21 -3.35 0.27 0.00 1.34 0.00 0.00 72.50 70.55 3b6r s THR 35 CO 0.31 -0.25 1.93 -0.65 -0.54 0.00 0.00 174.62 175.42 3b6r h PRO 36 N 1.28 1.02 -0.15 3.99 0.11 -1.99 -1.21 132.00 135.06 3b6r h PRO 36 Ca -0.47 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.56 3b6r h PRO 36 Cb 1.25 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 3b6r h PRO 36 CO 0.59 0.68 0.03 0.93 -0.21 0.00 0.00 178.00 180.01 3b6r h GLU 37 N 1.05 0.24 -0.20 1.05 3.07 -1.99 -1.21 114.58 116.60 3b6r h GLU 37 Ca 0.36 -0.06 -0.05 0.00 -0.50 0.00 0.00 59.36 59.10 3b6r h GLU 37 Cb 0.08 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 3b6r h GLU 37 CO -0.11 0.42 -0.08 1.25 -1.40 0.00 0.00 179.01 179.08 3b6r h LEU 38 N 0.03 0.29 -0.24 1.33 5.85 -1.87 -1.99 115.31 118.71 3b6r h LEU 38 Ca 0.04 -0.06 -0.09 0.00 0.84 0.00 0.00 57.88 58.61 3b6r h LEU 38 Cb 0.29 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 3b6r h LEU 38 CO 0.00 0.42 -0.22 0.22 -0.34 0.00 0.00 178.44 178.52 3b6r h TYR 39 N 0.30 0.69 -0.28 1.25 3.20 -1.02 -2.12 116.97 118.98 3b6r h TYR 39 Ca 0.06 -0.20 -0.06 0.00 3.14 0.00 0.00 58.73 61.67 3b6r h TYR 39 Cb 0.34 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 3b6r h TYR 39 CO 0.01 0.89 -0.08 0.00 -1.64 0.00 0.00 178.16 177.34 3b6r h ALA 40 N 0.68 1.35 -0.09 1.82 0.00 -0.95 0.57 119.26 122.63 3b6r h ALA 40 Ca 0.04 -0.23 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 3b6r h ALA 40 Cb 0.77 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3b6r h ALA 40 CO 0.06 0.44 -0.75 1.49 0.00 0.00 0.00 179.25 180.49 3b6r h GLU 41 N 0.42 0.49 0.00 0.00 4.81 -1.28 -3.36 114.58 115.66 3b6r h GLU 41 Ca 0.08 -0.40 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 3b6r h GLU 41 Cb 0.41 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.87 3b6r h GLU 41 CO 0.02 1.04 -0.94 1.28 -0.73 0.00 0.00 179.01 179.68 3b6r n LEU 42 N -3.86 0.81 0.19 1.64 4.32 -0.81 -4.60 117.00 114.70 3b6r n LEU 42 Ca -0.05 -0.47 0.14 0.00 -0.02 0.00 0.00 56.01 55.61 3b6r n LEU 42 Cb 0.72 0.00 0.63 0.00 -1.62 0.00 0.00 43.42 43.15 3b6r n LEU 42 CO 0.49 0.20 0.91 0.08 -1.22 0.00 0.00 177.39 177.86 3b6r h ARG 43 N 0.00 0.00 0.00 3.23 0.11 -1.03 -2.50 114.38 114.19 3b6r h ARG 43 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3b6r h ARG 43 Cb 0.46 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.54 3b6r h ARG 43 CO 0.00 0.00 -0.88 0.00 0.10 0.00 0.00 179.97 179.19 3b6r n ALA 44 N -1.87 3.41 -1.44 0.08 0.00 -1.26 -4.76 120.51 114.66 3b6r n ALA 44 Ca 0.00 -0.38 -0.30 0.00 0.00 0.00 0.00 53.44 52.76 3b6r n ALA 44 Cb 0.18 -1.02 0.09 0.00 0.00 0.00 0.00 19.45 18.70 3b6r n ALA 44 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3b6r s LYS 45 N -3.15 2.17 -0.07 0.00 1.02 -0.94 -5.08 119.74 113.69 3b6r s LYS 45 Ca 0.05 0.84 -0.30 0.00 0.02 0.00 0.00 55.97 56.59 3b6r s LYS 45 Cb 0.15 -1.91 0.10 0.00 -0.52 0.00 0.00 37.83 35.64 3b6r s LYS 45 CO 0.78 -1.61 0.82 -1.54 -0.92 0.00 0.00 175.35 172.88 3b6r s SER 46 N -3.70 -0.50 0.75 2.83 1.04 -1.26 -4.42 113.70 108.43 3b6r s SER 46 Ca 0.61 0.44 -0.06 0.00 0.48 0.00 0.00 55.95 57.41 3b6r s SER 46 Cb -0.15 0.43 0.10 0.00 0.10 0.00 0.00 66.02 66.50 3b6r s SER 46 CO 0.55 -0.54 1.06 0.42 0.98 0.00 0.00 173.24 175.71 3b6r s THR 47 N -1.65 2.21 0.55 2.02 -4.23 -0.75 -4.89 115.64 108.89 3b6r s THR 47 Ca -0.04 -0.33 0.24 0.00 -1.18 0.00 0.00 61.69 60.38 3b6r s THR 47 Cb -0.00 -2.88 0.35 0.00 1.34 0.00 0.00 72.50 71.30 3b6r s THR 47 CO 0.02 0.00 2.09 -0.65 -0.54 0.00 0.00 174.62 175.54 3b6r h PRO 48 N -0.75 0.00 0.00 3.99 0.11 -1.97 -0.23 132.00 133.15 3b6r h PRO 48 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3b6r h PRO 48 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 3b6r h PRO 48 CO 0.50 0.00 -0.03 1.03 -0.21 0.00 0.00 178.00 179.28 3b6r h SER 49 N 0.00 0.00 0.00 -2.05 0.87 -1.99 -3.47 113.55 106.91 3b6r h SER 49 Ca 0.11 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 3b6r h SER 49 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 3b6r h SER 49 CO -0.00 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.91 3b6r n GLY 50 N 1.24 0.65 3.72 5.77 0.00 -0.10 -5.06 105.19 111.41 3b6r n GLY 50 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3b6r n GLY 50 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3b6r s PHE 51 N -2.00 3.24 0.48 1.61 5.36 -1.26 -4.71 117.98 120.70 3b6r s PHE 51 Ca 0.00 0.99 0.05 0.00 -0.96 0.00 0.00 56.93 57.01 3b6r s PHE 51 Cb 0.00 -3.68 -0.01 0.00 -0.34 0.00 0.00 43.02 38.99 3b6r s PHE 51 CO 0.00 -2.33 0.19 0.95 -1.46 0.00 0.00 175.22 172.57 3b6r s THR 52 N 0.91 1.75 0.19 0.12 -4.23 -1.26 -1.82 115.64 111.30 3b6r s THR 52 Ca 0.63 -1.74 -0.11 0.00 -1.18 0.00 0.00 61.69 59.29 3b6r s THR 52 Cb -0.37 -2.49 0.11 0.00 1.34 0.00 0.00 72.50 71.09 3b6r s THR 52 CO 0.32 0.00 1.79 0.25 -0.54 0.00 0.00 174.62 176.44 3b6r h LEU 53 N 1.21 0.85 -1.10 4.79 5.85 -1.81 -1.41 115.31 123.70 3b6r h LEU 53 Ca -0.41 -0.11 0.08 0.00 0.84 0.00 0.00 57.88 58.28 3b6r h LEU 53 Cb 1.29 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 42.03 3b6r h LEU 53 CO 0.68 0.72 0.61 0.44 -0.34 0.00 0.00 178.44 180.55 3b6r h ASP 54 N 0.92 0.92 -0.50 1.25 3.32 -1.93 -0.51 116.42 119.87 3b6r h ASP 54 Ca 0.23 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.21 3b6r h ASP 54 Cb 0.08 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 3b6r h ASP 54 CO -0.03 0.56 -0.03 0.44 -1.72 0.00 0.00 179.24 178.45 3b6r h ASP 55 N 1.02 0.90 -0.58 6.45 3.32 -1.75 -1.92 116.42 123.86 3b6r h ASP 55 Ca 0.43 -0.32 0.01 0.00 0.02 0.00 0.00 57.03 57.16 3b6r h ASP 55 Cb 0.30 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 3b6r h ASP 55 CO -0.18 1.01 0.38 0.58 -1.72 0.00 0.00 179.24 179.31 3b6r h VAL 56 N 0.77 1.13 -0.01 -1.35 2.07 -0.11 -3.23 116.25 115.53 3b6r h VAL 56 Ca 0.14 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.39 3b6r h VAL 56 Cb 0.57 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3b6r h VAL 56 CO 0.03 0.14 -0.47 2.30 0.02 0.00 0.00 177.57 179.59 3b6r n ILE 57 N -4.70 0.00 -0.20 4.57 -5.35 -0.42 -1.01 119.36 112.26 3b6r n ILE 57 Ca 0.04 -0.11 -0.01 0.00 -0.27 0.00 0.00 62.75 62.40 3b6r n ILE 57 Cb 0.03 0.64 0.06 0.00 -1.74 0.00 0.00 39.64 38.63 3b6r n ILE 57 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 3b6r h GLN 58 N 1.04 0.01 -0.47 6.28 5.75 -1.37 0.24 115.11 126.59 3b6r h GLN 58 Ca 0.00 -0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.53 3b6r h GLN 58 Cb 0.56 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.08 3b6r h GLN 58 CO 0.00 0.00 0.31 0.00 -2.65 0.00 0.00 178.83 176.50 3b6r h THR 59 N 0.01 1.04 0.00 2.39 1.03 -1.81 0.95 112.91 116.51 3b6r h THR 59 Ca 0.29 -0.18 -0.06 0.00 -0.01 0.00 0.00 66.41 66.45 3b6r h THR 59 Cb 0.44 0.48 -0.01 0.00 -1.07 0.00 0.00 68.15 68.00 3b6r h THR 59 CO -0.61 0.09 -0.29 1.23 -0.01 0.00 0.00 175.52 175.94 3b6r h GLY 60 N 0.51 0.00 0.62 2.99 0.00 -0.47 0.14 103.07 106.87 3b6r h GLY 60 Ca 0.19 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.36 3b6r h GLY 60 CO -0.05 0.00 -0.71 -2.08 0.00 0.00 0.00 176.54 173.71 3b6r h VAL 61 N 0.00 1.54 0.00 4.60 2.07 -0.13 -3.34 116.25 120.99 3b6r h VAL 61 Ca -0.00 -2.47 -0.07 0.00 0.82 0.00 0.00 66.70 64.97 3b6r h VAL 61 Cb 1.00 3.17 -0.01 0.00 -1.52 0.00 0.00 31.29 33.93 3b6r h VAL 61 CO 0.04 0.70 -0.35 0.44 0.02 0.00 0.00 177.57 178.41 3b6r h ASP 62 N -0.42 0.00 -3.83 0.57 5.19 -0.81 -3.39 116.42 113.73 3b6r h ASP 62 Ca -0.12 0.00 -0.66 0.00 -0.62 0.00 0.00 57.03 55.63 3b6r h ASP 62 Cb 1.54 0.00 -0.40 0.00 0.18 0.00 0.00 39.33 40.65 3b6r h ASP 62 CO 0.13 0.35 -0.68 0.20 -3.12 0.00 0.00 179.24 176.13 3b6r s ASN 63 N -6.74 4.72 0.43 6.45 0.01 0.03 -4.96 114.94 114.88 3b6r s ASN 63 Ca -0.02 -2.35 0.11 0.00 -0.71 0.00 0.00 52.86 49.89 3b6r s ASN 63 Cb 0.14 -1.65 0.94 0.00 0.41 0.00 0.00 41.25 41.08 3b6r s ASN 63 CO 0.70 -0.36 2.01 -0.65 -1.51 0.00 0.00 177.10 177.29 3b6r h PRO 64 N 7.40 0.22 0.00 -0.60 0.11 -1.78 -3.43 132.00 133.92 3b6r h PRO 64 Ca -0.05 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.02 3b6r h PRO 64 Cb 0.99 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.06 3b6r h PRO 64 CO 0.57 0.26 0.00 0.41 -0.21 0.00 0.00 178.00 179.04 3b6r n GLY 65 N -1.18 2.64 3.26 -0.55 0.00 -1.26 0.91 105.19 109.01 3b6r n GLY 65 Ca -0.01 -0.96 -0.13 0.00 0.00 0.00 0.00 46.02 44.93 3b6r n GLY 65 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3b6r s HIS 66 N -5.87 -0.34 0.23 1.61 2.46 -1.26 -5.00 115.29 107.11 3b6r s HIS 66 Ca 0.00 0.77 0.36 0.00 0.47 0.00 0.00 55.06 56.66 3b6r s HIS 66 Cb 0.00 0.13 1.66 0.00 -0.13 0.00 0.00 32.58 34.24 3b6r s HIS 66 CO 0.00 -0.26 2.08 -1.00 -2.47 0.00 0.00 174.74 173.09 3b6r h PRO 67 N 5.01 0.00 0.00 2.88 0.13 -1.99 -3.37 132.00 134.67 3b6r h PRO 67 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3b6r h PRO 67 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3b6r h PRO 67 CO 0.32 0.00 -0.77 0.66 -0.23 0.00 0.00 178.00 177.97 3b6r n TYR 68 N -3.02 0.00 -4.17 1.56 4.02 -1.26 -5.11 117.16 109.18 3b6r n TYR 68 Ca -0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.78 3b6r n TYR 68 Cb 0.23 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.45 3b6r n TYR 68 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 176.86 176.81 3b6r s ILE 69 N -1.64 0.11 -0.12 -0.72 -4.36 -1.26 -5.01 121.20 108.21 3b6r s ILE 69 Ca 0.00 -1.94 -0.26 0.00 -0.26 0.00 0.00 60.65 58.19 3b6r s ILE 69 Cb 0.00 -2.18 -0.02 0.00 1.25 0.00 0.00 42.46 41.51 3b6r s ILE 69 CO 0.00 -0.33 0.85 -0.32 0.24 0.00 0.00 174.94 175.37 3b6r s MET 70 N -4.07 4.38 0.20 0.37 -2.45 -1.26 -4.28 119.30 112.18 3b6r s MET 70 Ca 0.28 1.09 0.04 0.00 -1.25 0.00 0.00 55.69 55.85 3b6r s MET 70 Cb 0.07 -3.53 -0.03 0.00 1.25 0.00 0.00 34.83 32.59 3b6r s MET 70 CO 0.05 -0.21 0.30 0.95 1.05 0.00 0.00 175.02 177.16 3b6r s THR 71 N 1.69 5.17 0.08 10.11 -4.23 -1.26 -5.01 115.64 122.19 3b6r s THR 71 Ca 0.41 -0.89 -0.15 0.00 -1.18 0.00 0.00 61.69 59.87 3b6r s THR 71 Cb -0.18 -3.73 -0.15 0.00 1.34 0.00 0.00 72.50 69.78 3b6r s THR 71 CO 0.16 -0.21 1.29 0.58 -0.54 0.00 0.00 174.62 175.90 3b6r h VAL 72 N 1.46 1.32 0.00 2.29 2.07 -1.95 -1.50 116.25 119.94 3b6r h VAL 72 Ca -0.50 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 65.20 3b6r h VAL 72 Cb 1.21 2.01 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 3b6r h VAL 72 CO 0.64 0.57 0.00 0.61 0.02 0.00 0.00 177.57 179.41 3b6r n GLY 73 N 0.62 0.41 3.53 2.17 0.00 -1.26 -0.42 105.19 110.24 3b6r n GLY 73 Ca -0.07 -0.99 -0.08 0.00 0.00 0.00 0.00 46.02 44.88 3b6r n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b6r s VAL 75 N -3.23 0.20 -0.02 0.00 -7.23 -0.18 -4.59 120.40 105.34 3b6r s VAL 75 Ca 0.06 -1.63 -0.05 0.00 -1.81 0.00 0.00 61.98 58.54 3b6r s VAL 75 Cb -0.01 -1.48 -0.04 0.00 0.56 0.00 0.00 36.38 35.41 3b6r s VAL 75 CO -0.08 -0.89 0.20 0.00 -0.31 0.00 0.00 175.10 174.02 3b6r s ALA 76 N -3.90 3.91 -0.85 1.32 0.00 -0.36 -4.43 121.76 117.45 3b6r s ALA 76 Ca 0.07 -0.68 0.20 0.00 0.00 0.00 0.00 51.96 51.55 3b6r s ALA 76 Cb 0.07 -1.96 -0.23 0.00 0.00 0.00 0.00 23.12 21.00 3b6r s ALA 76 CO -0.10 0.69 0.81 0.41 0.00 0.00 0.00 175.76 177.57 3b6r n GLY 77 N 1.19 -0.90 3.77 0.00 0.00 -1.26 -4.66 105.19 103.33 3b6r n GLY 77 Ca -0.13 -0.56 -0.02 0.00 0.00 0.00 0.00 46.02 45.31 3b6r n GLY 77 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3b6r s ASP 78 N -3.05 -0.11 0.24 1.61 3.84 -1.26 -0.37 116.67 117.57 3b6r s ASP 78 Ca 0.06 -0.43 -0.05 0.00 -0.00 0.00 0.00 52.55 52.13 3b6r s ASP 78 Cb 0.15 0.43 0.32 0.00 -1.38 0.00 0.00 42.92 42.45 3b6r s ASP 78 CO 0.83 -0.82 1.87 -0.08 -0.00 0.00 0.00 175.17 176.97 3b6r h GLU 79 N 2.00 1.04 0.00 2.11 4.81 -1.96 -2.47 114.58 120.11 3b6r h GLU 79 Ca -0.26 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 58.91 3b6r h GLU 79 Cb 1.22 -0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.37 3b6r h GLU 79 CO 0.29 0.69 -0.01 0.93 -0.73 0.00 0.00 179.01 180.18 3b6r h GLU 80 N 1.07 0.00 -0.97 1.92 3.07 -1.98 -3.13 114.58 114.56 3b6r h GLU 80 Ca 0.38 0.00 0.08 0.00 -0.50 0.00 0.00 59.36 59.32 3b6r h GLU 80 Cb 0.10 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 27.94 3b6r h GLU 80 CO -0.15 0.01 0.61 0.77 -1.40 0.00 0.00 179.01 178.85 3b6r h SER 81 N 0.00 0.95 0.44 1.42 0.02 -1.84 -0.57 113.55 113.97 3b6r h SER 81 Ca -0.00 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 3b6r h SER 81 Cb 0.13 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 3b6r h SER 81 CO 0.00 0.58 -0.09 1.88 -1.14 0.00 0.00 176.83 178.05 3b6r h TYR 82 N 1.07 0.00 0.00 3.45 0.05 -1.74 -1.53 116.97 118.27 3b6r h TYR 82 Ca 0.44 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 59.04 3b6r h TYR 82 Cb 0.27 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.98 3b6r h TYR 82 CO -0.01 0.09 -1.15 -1.91 -1.05 0.00 0.00 178.16 174.13 3b6r n GLU 83 N -3.48 0.53 -0.20 4.88 4.07 -0.60 -2.87 120.64 122.96 3b6r n GLU 83 Ca -0.02 0.52 0.06 0.00 -0.06 0.00 0.00 57.16 57.67 3b6r n GLU 83 Cb 0.24 -1.70 0.34 0.00 -0.06 0.00 0.00 31.44 30.25 3b6r n GLU 83 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 3b6r h VAL 84 N -1.00 1.02 -0.50 6.31 2.07 -1.17 -2.33 116.25 120.65 3b6r h VAL 84 Ca -0.27 -0.27 -0.29 0.00 0.82 0.00 0.00 66.70 66.69 3b6r h VAL 84 Cb 1.09 0.16 -0.17 0.00 -1.52 0.00 0.00 31.29 30.85 3b6r h VAL 84 CO -0.16 0.15 -0.02 0.49 0.02 0.00 0.00 177.57 178.05 3b6r n PHE 85 N -4.48 1.61 0.02 1.57 3.72 -0.58 -4.73 117.46 114.60 3b6r n PHE 85 Ca 0.11 -1.81 0.13 0.00 -0.05 0.00 0.00 57.45 55.83 3b6r n PHE 85 Cb 0.23 -0.60 0.58 0.00 -0.94 0.00 0.00 39.48 38.75 3b6r n PHE 85 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 3b6r h LYS 86 N 1.19 0.21 0.00 -1.08 2.10 -1.27 -0.23 116.57 117.49 3b6r h LYS 86 Ca 0.31 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.95 3b6r h LYS 86 Cb 1.71 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 32.99 3b6r h LYS 86 CO 0.59 0.14 0.00 -0.44 -2.00 0.00 0.00 179.45 177.74 3b6r h ASP 87 N 0.21 0.00 0.00 7.07 3.45 -1.85 0.12 116.42 125.43 3b6r h ASP 87 Ca 0.20 0.00 -0.26 0.00 0.43 0.00 0.00 57.03 57.39 3b6r h ASP 87 Cb 0.50 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 39.23 3b6r h ASP 87 CO -0.03 0.00 -1.75 -0.11 -1.57 0.00 0.00 179.24 175.77 3b6r n LEU 88 N -2.47 1.93 -0.19 1.55 7.94 -0.17 -4.57 117.00 121.01 3b6r n LEU 88 Ca 0.00 0.38 -0.07 0.00 -1.11 0.00 0.00 56.01 55.21 3b6r n LEU 88 Cb 0.16 -0.83 0.02 0.00 0.53 0.00 0.00 43.42 43.31 3b6r n LEU 88 CO 0.18 0.21 1.04 -0.26 -1.11 0.00 0.00 177.39 177.45 3b6r h PHE 89 N -1.00 0.74 -0.44 1.96 0.04 -1.24 -3.15 116.94 113.85 3b6r h PHE 89 Ca -0.40 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.45 3b6r h PHE 89 Cb 1.30 -0.24 -0.08 0.00 2.20 0.00 0.00 35.95 39.14 3b6r h PHE 89 CO -0.17 0.54 -0.07 -0.44 -0.60 0.00 0.00 178.31 177.57 3b6r h ASP 90 N 0.73 -0.33 -0.66 2.17 3.32 -1.01 0.39 116.42 121.04 3b6r h ASP 90 Ca 0.19 0.12 -0.06 0.00 0.02 0.00 0.00 57.03 57.30 3b6r h ASP 90 Cb 0.03 0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 3b6r h ASP 90 CO -0.03 -0.11 0.19 -0.65 -1.72 0.00 0.00 179.24 176.91 3b6r h PRO 91 N 0.04 1.06 -0.08 3.56 0.11 -1.78 -1.65 132.00 133.26 3b6r h PRO 91 Ca 0.22 -0.23 -0.01 0.00 0.11 0.00 0.00 66.00 66.08 3b6r h PRO 91 Cb 0.33 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.28 3b6r h PRO 91 CO -0.42 0.92 0.01 0.82 -0.21 0.00 0.00 178.00 179.12 3b6r h ILE 92 N 1.01 1.22 -0.75 4.15 2.04 -1.28 -1.82 117.51 122.09 3b6r h ILE 92 Ca 0.22 -0.69 0.07 0.00 1.00 0.00 0.00 64.86 65.46 3b6r h ILE 92 Cb 0.32 1.53 -0.06 0.00 -0.74 0.00 0.00 36.82 37.87 3b6r h ILE 92 CO -0.00 0.19 0.42 0.40 0.00 0.00 0.00 178.15 179.16 3b6r h ILE 93 N -0.11 0.94 -0.60 -0.67 2.04 -0.10 0.21 117.51 119.23 3b6r h ILE 93 Ca 0.02 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.58 3b6r h ILE 93 Cb 0.30 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 36.49 3b6r h ILE 93 CO 0.00 0.14 0.20 -0.08 0.00 0.00 0.00 178.15 178.41 3b6r h GLU 94 N 0.74 0.92 -0.17 2.37 4.81 -1.18 -0.24 114.58 121.85 3b6r h GLU 94 Ca 0.35 -0.19 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 3b6r h GLU 94 Cb 0.26 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.50 3b6r h GLU 94 CO -0.21 0.82 -0.18 0.22 -0.73 0.00 0.00 179.01 178.92 3b6r h ASP 95 N 0.85 0.45 0.06 1.04 1.82 -0.54 0.77 116.42 120.87 3b6r h ASP 95 Ca 0.19 -0.49 -0.10 0.00 -0.39 0.00 0.00 57.03 56.24 3b6r h ASP 95 Cb 0.27 -0.13 -0.01 0.00 0.68 0.00 0.00 39.33 40.14 3b6r h ASP 95 CO -0.01 0.85 -0.32 -0.09 -1.61 0.00 0.00 179.24 178.06 3b6r h ARG 96 N 0.06 0.38 -2.45 0.28 9.65 -0.54 -3.32 114.38 118.44 3b6r h ARG 96 Ca 0.02 -0.16 -0.69 0.00 -1.10 0.00 0.00 59.98 58.05 3b6r h ARG 96 Cb 0.73 -0.01 -0.36 0.00 -1.39 0.00 0.00 29.97 28.94 3b6r h ARG 96 CO 0.04 0.67 0.05 0.72 2.80 0.00 0.00 179.97 184.25 3b6r n HIS 97 N -4.08 3.13 -2.92 2.20 8.25 -0.11 -4.91 115.22 116.78 3b6r n HIS 97 Ca -0.01 -3.42 -0.01 0.00 -0.26 0.00 0.00 57.72 54.02 3b6r n HIS 97 Cb 0.44 -0.86 0.00 0.00 1.12 0.00 0.00 29.99 30.69 3b6r n HIS 97 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3b6r n GLY 98 N 0.74 -0.04 2.12 -1.41 0.00 -1.24 -1.11 105.19 104.24 3b6r n GLY 98 Ca 0.31 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.34 3b6r n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b6r n GLY 99 N -0.68 0.73 3.59 -0.02 0.00 0.26 -4.99 105.19 104.09 3b6r n GLY 99 Ca -0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.57 3b6r n GLY 99 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3b6r n TYR 100 N -2.47 1.96 -2.49 1.61 9.36 -0.27 -4.94 117.16 119.92 3b6r n TYR 100 Ca 0.00 -0.10 -0.28 0.00 3.32 0.00 0.00 57.90 60.84 3b6r n TYR 100 Cb 0.00 -2.71 0.00 0.00 -0.63 0.00 0.00 39.34 36.00 3b6r n TYR 100 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 3b6r s LYS 101 N 6.23 3.54 0.53 2.98 1.02 -1.26 -3.60 119.74 129.17 3b6r s LYS 101 Ca 1.01 0.29 0.24 0.00 0.02 0.00 0.00 55.97 57.53 3b6r s LYS 101 Cb -0.40 -2.32 1.38 0.00 -0.52 0.00 0.00 37.83 35.98 3b6r s LYS 101 CO 0.37 -0.28 2.02 -1.35 -0.92 0.00 0.00 175.35 175.19 3b6r h PRO 102 N 0.12 0.00 -0.01 -1.68 0.11 -1.92 -0.66 132.00 127.96 3b6r h PRO 102 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3b6r h PRO 102 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3b6r h PRO 102 CO 0.62 0.00 -0.29 -1.13 -0.21 0.00 0.00 178.00 176.99 3b6r n SER 103 N -4.39 0.80 -4.75 -2.05 3.41 -1.26 -4.94 113.62 100.44 3b6r n SER 103 Ca 0.08 -0.66 -0.29 0.00 -0.26 0.00 0.00 58.87 57.73 3b6r n SER 103 Cb 0.53 0.12 0.14 0.00 -0.26 0.00 0.00 64.21 64.74 3b6r n SER 103 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 3b6r s ASP 104 N -2.62 3.41 0.04 4.04 1.01 -0.26 -5.08 116.67 117.21 3b6r s ASP 104 Ca 0.22 1.17 0.06 0.00 0.71 0.00 0.00 52.55 54.71 3b6r s ASP 104 Cb 0.19 -1.81 -0.02 0.00 1.01 0.00 0.00 42.92 42.28 3b6r s ASP 104 CO 0.55 -2.64 -0.18 -1.61 0.21 0.00 0.00 175.17 171.51 3b6r s GLU 105 N -5.11 1.19 0.01 8.23 2.02 -1.26 -4.66 118.70 119.12 3b6r s GLU 105 Ca 0.64 -0.86 -0.13 0.00 0.02 0.00 0.00 54.97 54.64 3b6r s GLU 105 Cb -0.16 -1.26 -0.06 0.00 0.10 0.00 0.00 34.13 32.75 3b6r s GLU 105 CO 0.55 0.32 0.38 -1.58 0.02 0.00 0.00 175.26 174.95 3b6r s HIS 106 N -0.82 3.68 -0.08 1.61 5.65 -0.39 -4.72 115.29 120.22 3b6r s HIS 106 Ca 0.05 0.89 0.05 0.00 0.25 0.00 0.00 55.06 56.30 3b6r s HIS 106 Cb -0.08 -2.22 -0.00 0.00 -1.18 0.00 0.00 32.58 29.09 3b6r s HIS 106 CO 0.02 0.62 -0.24 0.21 -0.65 0.00 0.00 174.74 174.69 3b6r s LYS 107 N -1.32 2.71 0.06 2.88 2.47 -1.26 -4.90 119.74 120.38 3b6r s LYS 107 Ca 0.26 -0.86 0.02 0.00 -1.56 0.00 0.00 55.97 53.82 3b6r s LYS 107 Cb -0.15 -2.17 -0.04 0.00 -1.46 0.00 0.00 37.83 34.01 3b6r s LYS 107 CO 0.14 0.27 0.08 0.99 0.16 0.00 0.00 175.35 176.99 3b6r s THR 108 N 0.10 4.59 -0.41 3.43 2.01 -1.26 -3.70 115.64 120.39 3b6r s THR 108 Ca -0.11 -0.67 0.07 0.00 0.31 0.00 0.00 61.69 61.30 3b6r s THR 108 Cb -0.16 -3.18 0.18 0.00 0.01 0.00 0.00 72.50 69.35 3b6r s THR 108 CO 0.06 0.19 0.60 -0.62 -0.69 0.00 0.00 174.62 174.15 3b6r s ASP 109 N -2.21 -1.08 -0.65 3.53 -1.08 -1.26 -4.90 116.67 109.02 3b6r s ASP 109 Ca 0.28 -1.00 -0.02 0.00 -0.52 0.00 0.00 52.55 51.28 3b6r s ASP 109 Cb -0.12 1.72 0.42 0.00 -1.46 0.00 0.00 42.92 43.48 3b6r s ASP 109 CO 0.20 -0.17 2.04 0.18 0.52 0.00 0.00 175.17 177.94 3b6r n LEU 110 N 4.26 7.58 -4.23 -1.34 4.77 -1.26 -2.97 117.00 123.81 3b6r n LEU 110 Ca 0.12 -4.23 -0.42 0.00 -0.03 0.00 0.00 56.01 51.46 3b6r n LEU 110 Cb 0.55 -0.99 -0.08 0.00 -2.33 0.00 0.00 43.42 40.57 3b6r n LEU 110 CO 0.02 1.47 -0.00 0.21 -1.33 0.00 0.00 177.39 177.75 3b6r s ASN 111 N -1.58 5.78 0.32 -1.43 3.84 -1.26 -4.88 114.94 115.72 3b6r s ASN 111 Ca 0.61 -1.87 0.09 0.00 0.21 0.00 0.00 52.86 51.90 3b6r s ASN 111 Cb 0.48 -2.04 0.86 0.00 -0.55 0.00 0.00 41.25 40.00 3b6r s ASN 111 CO -0.03 -0.71 1.73 -0.65 -2.79 0.00 0.00 177.10 174.65 3b6r h PRO 112 N 8.52 0.58 -0.29 0.43 0.11 -1.90 -0.28 132.00 139.17 3b6r h PRO 112 Ca -0.23 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 65.93 3b6r h PRO 112 Cb 1.08 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 3b6r h PRO 112 CO 0.88 0.39 0.23 -0.44 -0.21 0.00 0.00 178.00 178.85 3b6r h ASP 113 N 0.60 0.00 0.44 -2.05 3.45 -1.99 0.01 116.42 116.88 3b6r h ASP 113 Ca 0.63 0.00 0.00 0.00 0.43 0.00 0.00 57.03 58.09 3b6r h ASP 113 Cb 1.17 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.94 3b6r h ASP 113 CO -0.47 0.00 0.00 0.59 -1.57 0.00 0.00 179.24 177.79 3b6r n ASN 114 N -4.24 0.00 -4.64 6.45 3.02 -0.11 -4.63 115.26 111.10 3b6r n ASN 114 Ca 0.04 0.08 -0.40 0.00 -0.03 0.00 0.00 54.58 54.27 3b6r n ASN 114 Cb 0.39 -0.32 -0.07 0.00 -0.61 0.00 0.00 39.78 39.18 3b6r n ASN 114 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3b6r s LEU 115 N -2.64 4.10 -0.25 3.41 1.98 -0.01 -4.99 118.68 120.27 3b6r s LEU 115 Ca 0.18 0.69 -0.12 0.00 -2.89 0.00 0.00 54.13 51.99 3b6r s LEU 115 Cb 0.14 -2.79 -0.05 0.00 0.66 0.00 0.00 46.19 44.15 3b6r s LEU 115 CO 0.32 -0.28 0.24 0.00 -1.89 0.00 0.00 176.35 174.74 3b6r s GLN 116 N 2.11 4.03 4.05 1.98 -2.07 -1.26 -4.95 119.66 123.55 3b6r s GLN 116 Ca 0.25 -0.18 0.00 0.00 -1.82 0.00 0.00 55.36 53.62 3b6r s GLN 116 Cb -0.16 -3.60 0.00 0.00 -1.09 0.00 0.00 33.01 28.16 3b6r s GLN 116 CO 0.09 -0.09 0.00 0.41 -1.32 0.00 0.00 175.29 174.38 3b6r n GLY 117 N 4.58 0.70 2.51 2.60 0.00 -1.26 -4.92 105.19 109.40 3b6r n GLY 117 Ca -0.13 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 44.87 3b6r n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b6r n GLY 118 N 0.00 1.47 0.70 -0.02 0.00 -1.26 -4.61 105.19 101.48 3b6r n GLY 118 Ca 0.00 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 46.00 3b6r n GLY 118 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3b6r n ASP 119 N -1.09 2.45 -2.90 1.61 5.75 -1.26 -0.62 116.55 120.49 3b6r n ASP 119 Ca -0.19 -1.72 -0.12 0.00 -0.01 0.00 0.00 54.79 52.74 3b6r n ASP 119 Cb 0.62 0.17 0.05 0.00 -1.03 0.00 0.00 41.12 40.92 3b6r n ASP 119 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3b6r n ASP 120 N 0.75 -1.08 -4.76 -1.12 -0.08 -1.22 -4.33 116.55 104.71 3b6r n ASP 120 Ca 0.11 -3.39 -0.41 0.00 -1.51 0.00 0.00 54.79 49.59 3b6r n ASP 120 Cb 0.49 0.91 -0.02 0.00 2.34 0.00 0.00 41.12 44.83 3b6r n ASP 120 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3b6r s LEU 121 N -2.38 4.43 -0.44 -2.67 1.43 0.15 -4.81 118.68 114.38 3b6r s LEU 121 Ca 0.29 2.62 -0.41 0.00 -1.03 0.00 0.00 54.13 55.60 3b6r s LEU 121 Cb 0.32 -3.64 -0.16 0.00 0.03 0.00 0.00 46.19 42.74 3b6r s LEU 121 CO -0.06 -0.54 2.14 -0.67 0.23 0.00 0.00 176.35 177.45 3b6r n ASP 122 N 1.35 1.25 0.32 2.29 4.64 -1.26 -4.08 116.55 121.06 3b6r n ASP 122 Ca 0.02 0.60 0.22 0.00 -1.38 0.00 0.00 54.79 54.25 3b6r n ASP 122 Cb 0.42 -1.03 1.12 0.00 -1.04 0.00 0.00 41.12 40.59 3b6r n ASP 122 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 3b6r h PRO 123 N 10.05 0.00 0.00 -0.67 0.11 -1.88 0.11 132.00 139.72 3b6r h PRO 123 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3b6r h PRO 123 Cb 1.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.49 3b6r h PRO 123 CO 1.06 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.94 3b6r n ASN 124 N -3.04 0.00 0.00 -2.05 4.13 -1.26 -4.20 115.26 108.84 3b6r n ASN 124 Ca -0.02 -0.12 0.00 0.00 1.68 0.00 0.00 54.58 56.12 3b6r n ASN 124 Cb 0.10 -0.29 0.00 0.00 -1.54 0.00 0.00 39.78 38.05 3b6r n ASN 124 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 3b6r n TYR 125 N -1.29 -0.01 -2.77 3.10 4.01 -0.38 -4.87 117.16 114.94 3b6r n TYR 125 Ca 0.14 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.45 3b6r n TYR 125 Cb 0.24 0.09 -0.03 0.00 -0.31 0.00 0.00 39.34 39.34 3b6r n TYR 125 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3b6r s VAL 126 N -2.00 4.51 0.08 -0.72 1.01 0.25 -0.91 120.40 122.62 3b6r s VAL 126 Ca 0.00 1.16 -0.02 0.00 0.00 0.00 0.00 61.98 63.12 3b6r s VAL 126 Cb 0.00 -4.39 -0.27 0.00 0.00 0.00 0.00 36.38 31.72 3b6r s VAL 126 CO 0.00 -0.65 1.14 -0.07 0.00 0.00 0.00 175.10 175.52 3b6r h LEU 127 N 10.31 0.35 -7.00 3.92 4.07 -0.01 -3.38 115.31 123.57 3b6r h LEU 127 Ca -0.23 -0.38 -0.02 0.00 0.08 0.00 0.00 57.88 57.33 3b6r h LEU 127 Cb 1.07 -0.11 -0.15 0.00 1.08 0.00 0.00 40.66 42.55 3b6r h LEU 127 CO 1.01 1.30 0.25 -0.94 -1.08 0.00 0.00 178.44 178.98 3b6r s SER 128 N -7.05 -0.57 0.01 -0.43 1.04 -1.19 -0.19 113.70 105.31 3b6r s SER 128 Ca -0.04 0.27 0.08 0.00 0.48 0.00 0.00 55.95 56.75 3b6r s SER 128 Cb 0.08 0.54 -0.02 0.00 0.10 0.00 0.00 66.02 66.72 3b6r s SER 128 CO 0.87 -0.78 -0.25 -0.44 0.98 0.00 0.00 173.24 173.62 3b6r s SER 129 N -2.10 2.98 -0.06 7.02 0.01 -0.39 -1.49 113.70 119.67 3b6r s SER 129 Ca -0.03 -0.50 -0.09 0.00 1.31 0.00 0.00 55.95 56.64 3b6r s SER 129 Cb -0.01 -0.31 0.02 0.00 0.21 0.00 0.00 66.02 65.94 3b6r s SER 129 CO -0.04 0.28 0.22 -0.60 0.41 0.00 0.00 173.24 173.51 3b6r s ARG 130 N -0.84 0.35 -0.06 12.44 3.52 -0.32 -1.81 118.95 132.23 3b6r s ARG 130 Ca 0.10 0.13 -0.00 0.00 -0.13 0.00 0.00 55.73 55.83 3b6r s ARG 130 Cb -0.10 0.16 0.03 0.00 -1.56 0.00 0.00 34.95 33.48 3b6r s ARG 130 CO 0.00 -0.06 -0.02 0.08 -0.81 0.00 0.00 175.30 174.49 3b6r s VAL 131 N -0.32 0.44 0.14 7.11 1.01 0.38 -0.88 120.40 128.28 3b6r s VAL 131 Ca -0.04 0.02 0.02 0.00 0.00 0.00 0.00 61.98 61.98 3b6r s VAL 131 Cb -0.03 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 3b6r s VAL 131 CO 0.01 0.24 -0.02 0.00 0.00 0.00 0.00 175.10 175.33 3b6r s ARG 132 N 1.54 0.98 0.34 2.72 1.04 -0.69 -1.08 118.95 123.80 3b6r s ARG 132 Ca -0.01 -1.45 -0.14 0.00 -1.04 0.00 0.00 55.73 53.10 3b6r s ARG 132 Cb -0.13 -0.21 0.03 0.00 -2.04 0.00 0.00 34.95 32.59 3b6r s ARG 132 CO -0.03 -0.09 0.67 -0.08 -0.04 0.00 0.00 175.30 175.72 3b6r s THR 133 N -3.66 0.00 0.10 4.99 -1.32 -0.41 -0.80 115.64 114.54 3b6r s THR 133 Ca 0.19 -1.18 0.03 0.00 -1.21 0.00 0.00 61.69 59.51 3b6r s THR 133 Cb 0.06 -2.56 -0.04 0.00 -1.51 0.00 0.00 72.50 68.44 3b6r s THR 133 CO 0.00 0.00 -0.08 -0.83 -2.21 0.00 0.00 174.62 171.50 3b6r s GLY 134 N -3.07 0.81 0.02 6.08 0.00 -1.25 -0.22 107.32 109.69 3b6r s GLY 134 Ca 0.19 -1.25 0.01 0.00 0.00 0.00 0.00 44.72 43.66 3b6r s GLY 134 CO 0.12 -1.34 -0.03 0.50 0.00 0.00 0.00 173.10 172.35 3b6r s ARG 135 N -3.20 0.29 -0.06 2.90 1.81 -0.24 -4.91 118.95 115.54 3b6r s ARG 135 Ca 0.08 -0.46 0.04 0.00 -1.72 0.00 0.00 55.73 53.67 3b6r s ARG 135 Cb 0.00 -0.04 -0.02 0.00 -0.45 0.00 0.00 34.95 34.44 3b6r s ARG 135 CO -0.02 -0.00 -0.18 -1.12 -0.68 0.00 0.00 175.30 173.30 3b6r s SER 136 N -1.02 3.70 -0.29 0.23 0.01 -1.26 -2.04 113.70 113.04 3b6r s SER 136 Ca -0.09 -0.32 -0.23 0.00 1.31 0.00 0.00 55.95 56.62 3b6r s SER 136 Cb -0.07 -0.89 -0.00 0.00 0.21 0.00 0.00 66.02 65.26 3b6r s SER 136 CO -0.00 0.29 0.78 -0.63 0.41 0.00 0.00 173.24 174.09 3b6r s ILE 137 N -0.43 4.82 0.38 1.44 -1.09 -1.26 -0.48 121.20 124.58 3b6r s ILE 137 Ca 0.05 1.24 -0.27 0.00 -2.23 0.00 0.00 60.65 59.44 3b6r s ILE 137 Cb -0.12 -4.12 -0.11 0.00 -1.58 0.00 0.00 42.46 36.54 3b6r s ILE 137 CO 0.02 -0.19 1.42 -1.14 -1.23 0.00 0.00 174.94 173.82 3b6r n ARG 138 N 6.11 2.43 0.00 2.79 0.63 -0.08 -2.78 116.66 125.76 3b6r n ARG 138 Ca 0.03 0.85 0.00 0.00 -0.92 0.00 0.00 57.85 57.82 3b6r n ARG 138 Cb 0.48 -2.56 0.00 0.00 0.45 0.00 0.00 32.46 30.83 3b6r n ARG 138 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3b6r n GLY 139 N 0.57 1.53 3.53 5.14 0.00 -1.26 -4.79 105.19 109.91 3b6r n GLY 139 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3b6r n GLY 139 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3b6r s PHE 140 N -2.40 2.60 0.68 1.61 0.08 -1.12 -5.12 117.98 114.30 3b6r s PHE 140 Ca 0.00 -0.23 -0.12 0.00 0.12 0.00 0.00 56.93 56.70 3b6r s PHE 140 Cb 0.00 -1.35 0.00 0.00 -0.57 0.00 0.00 43.02 41.11 3b6r s PHE 140 CO 0.00 0.43 1.06 0.00 -0.10 0.00 0.00 175.22 176.61 3b6r s LEU 142 N -5.31 2.93 0.46 0.00 1.02 0.50 -4.42 118.68 113.86 3b6r s LEU 142 Ca 0.60 1.32 0.29 0.00 0.02 0.00 0.00 54.13 56.36 3b6r s LEU 142 Cb -0.15 -4.14 1.37 0.00 0.02 0.00 0.00 46.19 43.30 3b6r s LEU 142 CO 0.50 -1.42 1.70 -0.65 0.02 0.00 0.00 176.35 176.51 3b6r h PRO 143 N -0.71 0.16 0.00 1.29 0.11 -1.86 0.42 132.00 131.40 3b6r h PRO 143 Ca -0.45 -0.01 -0.04 0.00 0.11 0.00 0.00 66.00 65.61 3b6r h PRO 143 Cb 1.24 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3b6r h PRO 143 CO 0.61 0.10 -0.17 -1.35 -0.21 0.00 0.00 178.00 176.98 3b6r h PRO 144 N 0.16 0.00 0.00 1.05 0.11 -1.83 -3.34 132.00 128.15 3b6r h PRO 144 Ca 0.71 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.82 3b6r h PRO 144 Cb 2.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.38 3b6r h PRO 144 CO -0.26 0.17 -0.83 1.58 -0.21 0.00 0.00 178.00 178.45 3b6r n HIS 145 N -3.85 0.00 -1.72 0.65 -0.00 0.30 -4.51 115.22 106.10 3b6r n HIS 145 Ca -0.02 0.00 -0.41 0.00 0.46 0.00 0.00 57.72 57.75 3b6r n HIS 145 Cb 0.27 0.00 0.01 0.00 -0.12 0.00 0.00 29.99 30.15 3b6r n HIS 145 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 3b6r s SER 147 N -0.43 5.02 0.33 0.00 1.04 -1.26 -4.83 113.70 113.57 3b6r s SER 147 Ca 0.59 0.96 0.02 0.00 0.48 0.00 0.00 55.95 58.01 3b6r s SER 147 Cb -0.51 -1.62 0.60 0.00 0.10 0.00 0.00 66.02 64.59 3b6r s SER 147 CO 0.59 -1.59 1.95 0.03 0.98 0.00 0.00 173.24 175.20 3b6r h ARG 148 N -0.83 0.90 -0.09 4.02 3.08 -1.98 -0.64 114.38 118.84 3b6r h ARG 148 Ca -0.45 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.54 3b6r h ARG 148 Cb 1.29 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 3b6r h ARG 148 CO 0.65 0.59 0.04 0.78 -1.07 0.00 0.00 179.97 180.96 3b6r h GLY 149 N 0.93 0.14 0.98 0.04 0.00 -1.99 -0.81 103.07 102.36 3b6r h GLY 149 Ca 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3b6r h GLY 149 CO -0.10 0.07 0.11 0.83 0.00 0.00 0.00 176.54 177.45 3b6r h GLU 150 N 0.01 0.24 -0.80 4.80 5.08 -1.78 -0.76 114.58 121.38 3b6r h GLU 150 Ca 0.03 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 3b6r h GLU 150 Cb 0.14 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.29 3b6r h GLU 150 CO -0.00 0.18 0.51 -0.09 -1.00 0.00 0.00 179.01 178.61 3b6r h ARG 151 N 0.23 0.98 -0.44 2.33 2.43 -1.08 0.11 114.38 118.94 3b6r h ARG 151 Ca 0.07 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 3b6r h ARG 151 Cb -0.00 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 3b6r h ARG 151 CO -0.01 0.65 -0.02 0.00 -1.51 0.00 0.00 179.97 179.07 3b6r h ARG 152 N 1.01 0.73 -0.58 0.20 3.08 -0.80 -1.65 114.38 116.37 3b6r h ARG 152 Ca 0.31 -0.20 -0.09 0.00 0.07 0.00 0.00 59.98 60.08 3b6r h ARG 152 Cb -0.01 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 3b6r h ARG 152 CO -0.10 0.76 -0.00 0.00 -1.07 0.00 0.00 179.97 179.55 3b6r h ALA 153 N 1.29 0.91 -0.28 0.04 0.00 -0.06 -1.43 119.26 119.74 3b6r h ALA 153 Ca 0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3b6r h ALA 153 Cb 0.45 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3b6r h ALA 153 CO 0.02 0.65 0.08 0.82 0.00 0.00 0.00 179.25 180.82 3b6r h ILE 154 N 0.92 1.21 -0.53 0.00 2.04 -0.68 -1.41 117.51 119.04 3b6r h ILE 154 Ca 0.17 -0.67 0.01 0.00 1.00 0.00 0.00 64.86 65.37 3b6r h ILE 154 Cb 0.53 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 3b6r h ILE 154 CO 0.03 0.22 0.35 -0.08 0.00 0.00 0.00 178.15 178.66 3b6r h GLU 155 N 0.28 0.68 -0.13 2.37 4.81 -1.14 0.84 114.58 122.29 3b6r h GLU 155 Ca 0.09 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 3b6r h GLU 155 Cb 0.26 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 3b6r h GLU 155 CO -0.00 0.45 -0.09 -0.22 -0.73 0.00 0.00 179.01 178.42 3b6r h LYS 156 N 0.70 -0.09 -0.70 1.92 3.64 -1.08 -0.06 116.57 120.90 3b6r h LYS 156 Ca 0.20 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.53 3b6r h LYS 156 Cb -0.07 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 3b6r h LYS 156 CO -0.05 -0.06 0.22 -0.07 -2.27 0.00 0.00 179.45 177.22 3b6r h LEU 157 N -0.09 1.00 -0.35 5.20 3.38 -0.87 -2.48 115.31 121.09 3b6r h LEU 157 Ca 0.08 -0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.81 3b6r h LEU 157 Cb 0.22 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3b6r h LEU 157 CO -0.19 0.93 -0.00 0.00 0.09 0.00 0.00 178.44 179.27 3b6r h ALA 158 N 1.20 0.48 -0.39 1.53 0.00 -0.46 -2.29 119.26 119.33 3b6r h ALA 158 Ca 0.23 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 3b6r h ALA 158 Cb 0.29 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 3b6r h ALA 158 CO -0.01 0.24 0.15 0.28 0.00 0.00 0.00 179.25 179.92 3b6r h VAL 159 N 0.44 1.20 -0.53 0.00 2.07 -0.92 -0.53 116.25 117.97 3b6r h VAL 159 Ca 0.10 -0.62 -0.09 0.00 0.82 0.00 0.00 66.70 66.91 3b6r h VAL 159 Cb 0.46 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.08 3b6r h VAL 159 CO 0.02 0.22 -0.04 1.05 0.02 0.00 0.00 177.57 178.85 3b6r h GLU 160 N 0.49 0.94 0.45 1.57 4.11 -1.45 -1.86 114.58 118.83 3b6r h GLU 160 Ca 0.13 -0.29 -0.02 0.00 0.07 0.00 0.00 59.36 59.24 3b6r h GLU 160 Cb 0.20 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3b6r h GLU 160 CO -0.01 0.95 -0.22 0.00 0.07 0.00 0.00 179.01 179.80 3b6r h ALA 161 N 1.10 -0.61 -0.12 1.06 0.00 -1.28 -3.13 119.26 116.28 3b6r h ALA 161 Ca 0.15 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.91 3b6r h ALA 161 Cb 0.55 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3b6r h ALA 161 CO 0.03 -0.69 0.14 -0.07 0.00 0.00 0.00 179.25 178.66 3b6r h LEU 162 N -0.91 0.00 0.00 0.00 4.07 -1.09 -0.72 115.31 116.67 3b6r h LEU 162 Ca -0.06 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.90 3b6r h LEU 162 Cb 0.57 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.31 3b6r h LEU 162 CO 0.10 0.00 0.00 -1.54 -1.08 0.00 0.00 178.44 175.92 3b6r n SER 163 N -3.76 0.00 0.05 -0.43 3.41 -0.70 -2.35 113.62 109.85 3b6r n SER 163 Ca 0.00 0.16 0.12 0.00 -0.26 0.00 0.00 58.87 58.89 3b6r n SER 163 Cb 0.25 -0.34 0.06 0.00 -0.26 0.00 0.00 64.21 63.91 3b6r n SER 163 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3b6r n SER 164 N -1.34 0.66 -4.75 4.04 7.64 -0.27 -4.92 113.62 114.67 3b6r n SER 164 Ca 0.07 0.01 -0.37 0.00 1.01 0.00 0.00 58.87 59.59 3b6r n SER 164 Cb 0.15 0.57 0.03 0.00 -1.01 0.00 0.00 64.21 63.96 3b6r n SER 164 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3b6r s LEU 165 N -4.33 3.81 0.00 -3.43 1.43 -0.99 -5.01 118.68 110.15 3b6r s LEU 165 Ca 0.03 2.58 0.02 0.00 -1.03 0.00 0.00 54.13 55.72 3b6r s LEU 165 Cb 0.13 -4.38 -0.01 0.00 0.03 0.00 0.00 46.19 41.97 3b6r s LEU 165 CO 0.78 -1.50 0.26 -0.90 0.23 0.00 0.00 176.35 175.22 3b6r n ASP 166 N -1.15 -0.71 0.00 2.29 3.85 -1.26 -4.19 116.55 115.39 3b6r n ASP 166 Ca 0.11 -2.34 0.00 0.00 -0.71 0.00 0.00 54.79 51.85 3b6r n ASP 166 Cb 0.47 1.42 0.00 0.00 -1.35 0.00 0.00 41.12 41.66 3b6r n ASP 166 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3b6r n GLY 167 N -0.40 1.41 0.00 6.12 0.00 -1.26 -1.93 105.19 109.13 3b6r n GLY 167 Ca 0.03 -0.65 0.08 0.00 0.00 0.00 0.00 46.02 45.47 3b6r n GLY 167 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3b6r n ASP 168 N 3.81 0.00 -0.95 1.61 -0.08 -1.26 -1.94 116.55 117.74 3b6r n ASP 168 Ca 0.00 0.40 0.12 0.00 -1.51 0.00 0.00 54.79 53.80 3b6r n ASP 168 Cb 0.00 -0.45 0.10 0.00 2.34 0.00 0.00 41.12 43.11 3b6r n ASP 168 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 3b6r n LEU 169 N -1.45 2.97 -4.73 -2.67 4.32 -0.81 -4.75 117.00 109.87 3b6r n LEU 169 Ca 0.05 -1.02 -0.42 0.00 -0.02 0.00 0.00 56.01 54.59 3b6r n LEU 169 Cb 0.17 -0.01 -0.01 0.00 -1.62 0.00 0.00 43.42 41.94 3b6r n LEU 169 CO 0.14 0.50 1.15 0.00 -1.22 0.00 0.00 177.39 177.96 3b6r n ALA 170 N 1.32 2.14 -3.00 -1.18 0.00 -0.82 -4.30 120.51 114.68 3b6r n ALA 170 Ca 0.14 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.95 3b6r n ALA 170 Cb 0.59 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.64 3b6r n ALA 170 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b6r n GLY 171 N 1.66 3.38 3.16 0.00 0.00 -1.26 -3.56 105.19 108.57 3b6r n GLY 171 Ca 0.07 -1.25 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 3b6r n GLY 171 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3b6r s ARG 172 N -0.96 0.54 -0.15 1.61 3.52 -1.00 -4.97 118.95 117.54 3b6r s ARG 172 Ca 0.00 -0.28 -0.09 0.00 -0.13 0.00 0.00 55.73 55.23 3b6r s ARG 172 Cb 0.00 0.23 -0.05 0.00 -1.56 0.00 0.00 34.95 33.58 3b6r s ARG 172 CO 0.00 -0.14 0.16 -0.47 -0.81 0.00 0.00 175.30 174.05 3b6r s TYR 173 N -1.27 3.52 -0.30 5.12 5.04 -1.26 -2.21 117.35 125.99 3b6r s TYR 173 Ca -0.13 0.48 0.03 0.00 -2.44 0.00 0.00 57.07 55.01 3b6r s TYR 173 Cb -0.06 -2.08 0.08 0.00 0.35 0.00 0.00 41.96 40.25 3b6r s TYR 173 CO 0.02 0.52 -0.03 0.71 -1.34 0.00 0.00 175.55 175.43 3b6r s TYR 174 N -0.36 3.43 0.25 4.97 2.02 0.12 -4.97 117.35 122.81 3b6r s TYR 174 Ca 0.13 -2.61 -0.30 0.00 -0.37 0.00 0.00 57.07 53.93 3b6r s TYR 174 Cb -0.12 -2.37 -0.09 0.00 -0.40 0.00 0.00 41.96 38.98 3b6r s TYR 174 CO 0.02 -0.91 1.26 0.00 -1.57 0.00 0.00 175.55 174.35 3b6r s ALA 175 N 1.03 3.49 0.20 3.71 0.00 -1.26 -0.83 121.76 128.09 3b6r s ALA 175 Ca 0.01 1.10 -0.12 0.00 0.00 0.00 0.00 51.96 52.95 3b6r s ALA 175 Cb -0.19 -3.45 0.23 0.00 0.00 0.00 0.00 23.12 19.71 3b6r s ALA 175 CO -0.07 -0.48 1.69 1.25 0.00 0.00 0.00 175.76 178.15 3b6r h LEU 176 N 4.44 -0.15 -0.34 0.00 5.85 -1.02 -0.13 115.31 123.97 3b6r h LEU 176 Ca -0.46 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.38 3b6r h LEU 176 Cb 1.22 0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.44 3b6r h LEU 176 CO 0.71 -0.05 0.00 1.17 -0.34 0.00 0.00 178.44 179.93 3b6r n LYS 177 N -5.20 0.05 -0.04 1.25 4.81 -1.26 -2.17 118.16 115.59 3b6r n LYS 177 Ca 0.07 0.43 0.12 0.00 -0.87 0.00 0.00 58.31 58.06 3b6r n LYS 177 Cb 0.29 -1.63 0.14 0.00 0.02 0.00 0.00 35.03 33.85 3b6r n LYS 177 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3b6r n SER 178 N -1.74 3.07 -4.92 3.14 3.41 -0.06 -4.94 113.62 111.57 3b6r n SER 178 Ca 0.01 -1.99 -0.30 0.00 -0.26 0.00 0.00 58.87 56.33 3b6r n SER 178 Cb 0.10 -0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 63.95 3b6r n SER 178 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3b6r s MET 179 N -1.88 3.45 0.83 4.33 -1.94 -0.92 -4.97 119.30 118.19 3b6r s MET 179 Ca 0.31 -0.44 -0.12 0.00 -1.71 0.00 0.00 55.69 53.72 3b6r s MET 179 Cb 0.21 -3.01 0.09 0.00 2.01 0.00 0.00 34.83 34.12 3b6r s MET 179 CO 0.31 0.58 1.16 0.95 -0.01 0.00 0.00 175.02 178.01 3b6r s THR 180 N -1.56 2.08 0.23 2.05 -4.23 -1.26 -4.85 115.64 108.11 3b6r s THR 180 Ca 0.35 0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 60.82 3b6r s THR 180 Cb -0.13 -2.96 0.21 0.00 1.34 0.00 0.00 72.50 70.96 3b6r s THR 180 CO 0.28 -0.03 1.86 -0.08 -0.54 0.00 0.00 174.62 176.10 3b6r h GLU 181 N -1.15 1.26 -0.48 3.99 4.57 -1.98 -1.99 114.58 118.79 3b6r h GLU 181 Ca -0.47 -0.15 -0.13 0.00 -1.18 0.00 0.00 59.36 57.43 3b6r h GLU 181 Cb 1.33 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 3b6r h GLU 181 CO 0.65 0.92 -0.20 0.00 -1.18 0.00 0.00 179.01 179.20 3b6r h ALA 182 N 1.27 0.67 -0.55 2.92 0.00 -1.99 -2.50 119.26 119.08 3b6r h ALA 182 Ca 0.32 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3b6r h ALA 182 Cb 0.03 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3b6r h ALA 182 CO -0.05 0.65 0.26 0.93 0.00 0.00 0.00 179.25 181.04 3b6r h GLU 183 N 0.84 0.80 -0.13 0.00 5.08 -1.85 -1.06 114.58 118.25 3b6r h GLU 183 Ca 0.11 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 3b6r h GLU 183 Cb 0.78 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.88 3b6r h GLU 183 CO 0.06 0.66 0.01 0.37 -1.00 0.00 0.00 179.01 179.12 3b6r h GLN 184 N 0.75 0.22 -0.27 2.33 4.15 -1.32 -2.68 115.11 118.29 3b6r h GLN 184 Ca 0.19 -0.07 -0.07 0.00 0.77 0.00 0.00 58.65 59.48 3b6r h GLN 184 Cb 0.13 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 3b6r h GLN 184 CO -0.02 0.44 -0.12 1.96 -1.93 0.00 0.00 178.83 179.16 3b6r h GLN 185 N -0.02 0.45 -0.30 1.69 1.08 -1.41 -1.69 115.11 114.91 3b6r h GLN 185 Ca 0.04 -0.12 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 3b6r h GLN 185 Cb 0.33 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 3b6r h GLN 185 CO 0.00 0.57 0.18 0.37 -0.95 0.00 0.00 178.83 179.00 3b6r h GLN 186 N 0.42 0.41 -0.35 1.46 5.75 -1.11 0.23 115.11 121.93 3b6r h GLN 186 Ca 0.08 -0.04 -0.09 0.00 -0.15 0.00 0.00 58.65 58.45 3b6r h GLN 186 Cb 0.46 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.91 3b6r h GLN 186 CO 0.03 0.33 -0.15 -0.07 -2.65 0.00 0.00 178.83 176.32 3b6r h LEU 187 N 0.38 0.61 0.25 -2.39 3.38 -1.21 -1.26 115.31 115.07 3b6r h LEU 187 Ca 0.11 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 3b6r h LEU 187 Cb 0.03 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3b6r h LEU 187 CO -0.02 0.78 -0.12 0.40 0.09 0.00 0.00 178.44 179.57 3b6r h ILE 188 N 0.56 0.80 -0.07 1.22 2.04 -0.87 0.37 117.51 121.56 3b6r h ILE 188 Ca 0.10 -0.66 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 3b6r h ILE 188 Cb 0.58 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.80 3b6r h ILE 188 CO 0.04 0.14 -0.00 0.44 0.00 0.00 0.00 178.15 178.76 3b6r h ASP 189 N -0.69 0.08 -0.02 1.72 5.19 -0.50 0.74 116.42 122.94 3b6r h ASP 189 Ca -0.03 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 3b6r h ASP 189 Cb 0.48 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.97 3b6r h ASP 189 CO 0.06 0.11 0.00 0.47 -3.12 0.00 0.00 179.24 176.75 3b6r n ASP 190 N -4.48 0.15 -0.45 6.45 8.00 -0.48 -4.89 116.55 120.86 3b6r n ASP 190 Ca -0.02 -1.49 -0.06 0.00 0.71 0.00 0.00 54.79 53.93 3b6r n ASP 190 Cb 0.12 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.19 3b6r n ASP 190 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3b6r n HIS 191 N -0.66 0.00 -0.11 1.24 8.25 0.25 -4.94 115.22 119.25 3b6r n HIS 191 Ca 0.13 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.38 3b6r n HIS 191 Cb 0.08 -1.35 -0.12 0.00 1.12 0.00 0.00 29.99 29.73 3b6r n HIS 191 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3b6r n PHE 192 N -2.81 0.30 -3.91 4.41 3.72 0.05 -5.00 117.46 114.22 3b6r n PHE 192 Ca -0.06 0.08 -0.31 0.00 -0.05 0.00 0.00 57.45 57.11 3b6r n PHE 192 Cb 0.20 -1.04 -0.04 0.00 -0.94 0.00 0.00 39.48 37.67 3b6r n PHE 192 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 3b6r s LEU 193 N -6.92 4.35 0.52 4.37 2.96 -0.77 -4.97 118.68 118.22 3b6r s LEU 193 Ca -0.33 0.27 -0.22 0.00 -0.22 0.00 0.00 54.13 53.64 3b6r s LEU 193 Cb 0.10 -2.97 -0.06 0.00 0.50 0.00 0.00 46.19 43.76 3b6r s LEU 193 CO 0.61 0.16 1.25 0.72 -1.32 0.00 0.00 176.35 177.76 3b6r s PHE 194 N -1.54 2.54 1.22 5.38 -0.12 -1.26 -4.38 117.98 119.83 3b6r s PHE 194 Ca 0.35 1.47 -0.17 0.00 -0.05 0.00 0.00 56.93 58.53 3b6r s PHE 194 Cb -0.13 -3.57 0.30 0.00 -0.63 0.00 0.00 43.02 38.99 3b6r s PHE 194 CO 0.28 -2.20 1.02 0.34 -0.05 0.00 0.00 175.22 174.61 3b6r s ASP 195 N -1.25 0.61 0.65 1.98 -1.08 -1.26 -4.87 116.67 111.44 3b6r s ASP 195 Ca 0.70 1.08 -0.15 0.00 -0.52 0.00 0.00 52.55 53.65 3b6r s ASP 195 Cb -0.34 -1.63 -0.01 0.00 -1.46 0.00 0.00 42.92 39.49 3b6r s ASP 195 CO 0.39 -4.37 1.11 -0.54 0.52 0.00 0.00 175.17 172.29 3b6r s LYS 196 N -4.90 2.88 -0.11 4.34 1.02 -1.26 -4.81 119.74 116.89 3b6r s LYS 196 Ca 0.68 1.40 -0.30 0.00 0.02 0.00 0.00 55.97 57.78 3b6r s LYS 196 Cb -0.18 -1.96 -0.36 0.00 -0.52 0.00 0.00 37.83 34.82 3b6r s LYS 196 CO 0.60 -1.19 1.62 -0.35 -0.92 0.00 0.00 175.35 175.11 3b6r n PRO 197 N -2.30 0.01 -0.00 -1.68 -0.04 -1.26 -4.36 135.00 125.37 3b6r n PRO 197 Ca 0.10 -1.05 0.06 0.00 -0.04 0.00 0.00 63.50 62.57 3b6r n PRO 197 Cb 0.52 -2.62 -0.08 0.00 -0.04 0.00 0.00 33.50 31.28 3b6r n PRO 197 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 3b6r n VAL 198 N 7.15 0.00 -1.62 0.52 0.24 -1.26 -4.86 118.33 118.49 3b6r n VAL 198 Ca 0.45 -0.25 -0.46 0.00 -2.04 0.00 0.00 64.34 62.04 3b6r n VAL 198 Cb 0.42 0.36 -0.03 0.00 -1.47 0.00 0.00 33.84 33.13 3b6r n VAL 198 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 3b6r n SER 199 N -1.79 1.92 0.08 -1.34 2.88 -1.26 -4.88 113.62 109.23 3b6r n SER 199 Ca -0.01 1.15 -0.00 0.00 -1.33 0.00 0.00 58.87 58.67 3b6r n SER 199 Cb 0.27 -1.32 0.30 0.00 -0.75 0.00 0.00 64.21 62.71 3b6r n SER 199 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 3b6r h PRO 200 N 3.45 0.32 -0.05 -1.46 0.13 -2.00 -1.61 132.00 130.79 3b6r h PRO 200 Ca -0.43 -0.10 -0.07 0.00 -0.87 0.00 0.00 66.00 64.53 3b6r h PRO 200 Cb 1.32 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.42 3b6r h PRO 200 CO 0.70 0.52 -0.22 1.25 -0.23 0.00 0.00 178.00 180.03 3b6r h LEU 201 N 0.30 0.28 -0.25 1.56 5.85 -1.93 -2.68 115.31 118.43 3b6r h LEU 201 Ca 0.05 -0.65 0.06 0.00 0.84 0.00 0.00 57.88 58.18 3b6r h LEU 201 Cb 0.54 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.43 3b6r h LEU 201 CO 0.04 0.88 -0.11 0.25 -0.34 0.00 0.00 178.44 179.16 3b6r h LEU 202 N -0.30 -0.38 0.12 2.25 5.85 -1.88 -1.58 115.31 119.39 3b6r h LEU 202 Ca -0.01 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 3b6r h LEU 202 Cb 0.87 0.22 0.00 0.00 0.37 0.00 0.00 40.66 42.12 3b6r h LEU 202 CO 0.05 -0.14 -0.06 -0.07 -0.34 0.00 0.00 178.44 177.88 3b6r h LEU 203 N -0.07 -0.13 -1.83 2.25 -0.00 -1.37 -2.39 115.31 111.77 3b6r h LEU 203 Ca 0.13 -0.23 -0.02 0.00 -0.00 0.00 0.00 57.88 57.77 3b6r h LEU 203 Cb 0.28 0.03 -0.00 0.00 -0.00 0.00 0.00 40.66 40.97 3b6r h LEU 203 CO -0.30 0.16 -0.08 0.00 -0.00 0.00 0.00 178.44 178.22 3b6r h ALA 204 N 0.41 1.10 -0.01 1.53 0.00 -1.42 -2.86 119.26 118.02 3b6r h ALA 204 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3b6r h ALA 204 Cb 0.35 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3b6r h ALA 204 CO 0.03 0.10 -0.31 -1.13 0.00 0.00 0.00 179.25 177.94 3b6r n SER 205 N -3.33 0.89 0.00 0.00 3.41 -0.60 -4.19 113.62 109.80 3b6r n SER 205 Ca -0.01 -0.74 0.00 0.00 -0.26 0.00 0.00 58.87 57.86 3b6r n SER 205 Cb 0.26 0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 3b6r n SER 205 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3b6r n GLY 206 N 1.37 0.75 0.00 5.00 0.00 -1.08 -4.62 105.19 106.62 3b6r n GLY 206 Ca 0.11 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.28 3b6r n GLY 206 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3b6r n MET 207 N -2.38 0.45 0.00 1.61 2.81 -0.90 -3.32 117.12 115.39 3b6r n MET 207 Ca 0.00 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.02 3b6r n MET 207 Cb 0.00 -1.50 0.25 0.00 -0.71 0.00 0.00 33.22 31.26 3b6r n MET 207 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3b6r n ALA 208 N -1.27 2.99 -1.64 3.04 0.00 -1.22 -4.95 120.51 117.46 3b6r n ALA 208 Ca 0.15 -0.53 -0.45 0.00 0.00 0.00 0.00 53.44 52.61 3b6r n ALA 208 Cb 0.23 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.68 3b6r n ALA 208 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3b6r n ARG 209 N 0.08 1.69 -0.81 0.00 1.74 -1.21 -2.33 116.66 115.82 3b6r n ARG 209 Ca 0.13 0.59 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 3b6r n ARG 209 Cb 0.43 -2.10 0.00 0.00 -1.02 0.00 0.00 32.46 29.77 3b6r n ARG 209 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3b6r n ASP 210 N 1.38 -3.26 -4.55 0.55 8.00 -1.26 -4.85 116.55 112.56 3b6r n ASP 210 Ca 0.09 0.00 -0.46 0.00 0.71 0.00 0.00 54.79 55.13 3b6r n ASP 210 Cb 0.32 -2.80 -0.02 0.00 -0.02 0.00 0.00 41.12 38.60 3b6r n ASP 210 CO 0.00 0.00 0.00 1.87 -0.39 0.00 0.00 177.20 178.68 3b6r n TRP 211 N -2.06 0.90 -0.85 1.24 -0.00 -0.99 -0.88 117.44 114.80 3b6r n TRP 211 Ca 0.00 0.76 -0.11 0.00 -0.00 0.00 0.00 57.50 58.15 3b6r n TRP 211 Cb 0.26 -2.19 0.23 0.00 -0.00 0.00 0.00 31.31 29.61 3b6r n TRP 211 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 3b6r n PRO 212 N 1.01 2.97 -1.67 5.87 -0.04 -1.26 -5.12 135.00 136.77 3b6r n PRO 212 Ca 0.13 -2.70 -0.47 0.00 -0.04 0.00 0.00 63.50 60.42 3b6r n PRO 212 Cb 0.29 -2.09 -0.04 0.00 -0.04 0.00 0.00 33.50 31.61 3b6r n PRO 212 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3b6r n ASP 213 N -0.39 3.13 -1.81 3.54 -0.08 -0.06 -2.24 116.55 118.63 3b6r n ASP 213 Ca 0.42 1.05 -0.20 0.00 -1.51 0.00 0.00 54.79 54.56 3b6r n ASP 213 Cb 1.37 -1.40 -0.05 0.00 2.34 0.00 0.00 41.12 43.38 3b6r n ASP 213 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3b6r n ALA 214 N 4.25 -0.41 -2.60 -1.67 0.00 -1.26 -4.97 120.51 113.85 3b6r n ALA 214 Ca 0.19 0.25 -0.30 0.00 0.00 0.00 0.00 53.44 53.58 3b6r n ALA 214 Cb 0.28 -2.02 -0.10 0.00 0.00 0.00 0.00 19.45 17.61 3b6r n ALA 214 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3b6r s ARG 215 N -4.20 2.32 -0.07 0.00 3.00 -0.95 -4.58 118.95 114.46 3b6r s ARG 215 Ca 0.00 -0.91 -0.30 0.00 0.00 0.00 0.00 55.73 54.51 3b6r s ARG 215 Cb 0.00 -2.40 0.10 0.00 0.00 0.00 0.00 34.95 32.65 3b6r s ARG 215 CO 0.00 0.54 1.35 0.20 0.00 0.00 0.00 175.30 177.38 3b6r s GLY 216 N -2.05 -0.19 -0.02 -3.53 0.00 -1.09 -0.42 107.32 100.02 3b6r s GLY 216 Ca 0.21 0.12 0.01 0.00 0.00 0.00 0.00 44.72 45.07 3b6r s GLY 216 CO 0.13 6.58 -0.04 -1.50 0.00 0.00 0.00 173.10 178.26 3b6r s ILE 217 N -2.01 0.43 -0.05 0.90 2.07 -0.01 -0.68 121.20 121.85 3b6r s ILE 217 Ca 0.32 -0.16 0.03 0.00 -1.41 0.00 0.00 60.65 59.43 3b6r s ILE 217 Cb -0.00 -0.41 -0.03 0.00 0.13 0.00 0.00 42.46 42.15 3b6r s ILE 217 CO -0.02 0.16 -0.14 0.86 -1.91 0.00 0.00 174.94 173.88 3b6r s TRP 218 N 0.33 2.71 0.04 3.50 -0.00 -0.15 0.11 118.94 125.48 3b6r s TRP 218 Ca -0.04 -0.17 -0.27 0.00 -0.00 0.00 0.00 56.10 55.63 3b6r s TRP 218 Cb -0.08 -1.64 0.07 0.00 -0.00 0.00 0.00 33.47 31.83 3b6r s TRP 218 CO -0.00 0.18 0.63 -3.38 -0.00 0.00 0.00 176.95 174.38 3b6r s HIS 219 N -0.70 -0.59 0.94 5.86 -3.43 -0.94 0.55 115.29 116.99 3b6r s HIS 219 Ca 0.11 0.75 -0.13 0.00 -0.80 0.00 0.00 55.06 54.99 3b6r s HIS 219 Cb -0.11 0.46 0.15 0.00 -1.43 0.00 0.00 32.58 31.65 3b6r s HIS 219 CO 0.01 -0.70 1.14 0.54 -2.00 0.00 0.00 174.74 173.72 3b6r s ASN 220 N -1.87 3.26 0.28 7.38 4.22 -0.75 -2.38 114.94 125.09 3b6r s ASN 220 Ca -0.06 0.94 0.02 0.00 -2.14 0.00 0.00 52.86 51.62 3b6r s ASN 220 Cb -0.00 -1.48 0.61 0.00 1.28 0.00 0.00 41.25 41.65 3b6r s ASN 220 CO -0.00 -2.71 1.80 0.44 -2.04 0.00 0.00 177.10 174.59 3b6r h ASP 221 N -1.60 0.78 0.27 3.54 3.45 -1.85 -1.41 116.42 119.60 3b6r h ASP 221 Ca -0.50 0.08 0.00 0.00 0.43 0.00 0.00 57.03 57.03 3b6r h ASP 221 Cb 1.33 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 40.03 3b6r h ASP 221 CO 0.59 0.35 -0.10 0.59 -1.57 0.00 0.00 179.24 179.11 3b6r n ASN 222 N -4.73 0.58 -3.54 6.45 3.02 -1.26 -4.93 115.26 110.84 3b6r n ASN 222 Ca 0.20 -0.74 -0.19 0.00 -0.03 0.00 0.00 54.58 53.82 3b6r n ASN 222 Cb 0.45 -0.04 0.07 0.00 -0.61 0.00 0.00 39.78 39.64 3b6r n ASN 222 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3b6r n LYS 223 N -0.81 -5.97 -0.00 3.52 5.02 -0.53 -4.89 118.16 114.50 3b6r n LYS 223 Ca 0.16 0.76 0.03 0.00 -2.02 0.00 0.00 58.31 57.23 3b6r n LYS 223 Cb 0.27 -5.59 -0.04 0.00 -0.02 0.00 0.00 35.03 29.65 3b6r n LYS 223 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3b6r n THR 224 N -4.21 0.00 -3.72 -0.18 -2.24 -1.26 -4.80 114.28 97.88 3b6r n THR 224 Ca -0.29 -0.26 -0.22 0.00 -2.27 0.00 0.00 64.05 61.01 3b6r n THR 224 Cb 0.67 0.72 -0.18 0.00 -2.10 0.00 0.00 70.33 69.44 3b6r n THR 224 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3b6r s PHE 225 N -1.93 0.40 0.05 4.78 5.36 -1.26 -1.04 117.98 124.34 3b6r s PHE 225 Ca 0.00 -0.03 0.01 0.00 -0.96 0.00 0.00 56.93 55.95 3b6r s PHE 225 Cb 0.04 -0.67 -0.03 0.00 -0.34 0.00 0.00 43.02 42.02 3b6r s PHE 225 CO 0.24 -0.29 -0.05 -0.51 -1.46 0.00 0.00 175.22 173.15 3b6r s LEU 226 N 2.06 2.38 -0.08 6.12 1.02 0.86 -1.81 118.68 129.23 3b6r s LEU 226 Ca 0.05 -0.77 -0.01 0.00 0.02 0.00 0.00 54.13 53.42 3b6r s LEU 226 Cb -0.13 0.02 0.03 0.00 0.02 0.00 0.00 46.19 46.13 3b6r s LEU 226 CO -0.05 -0.40 -0.03 -0.69 0.02 0.00 0.00 176.35 175.21 3b6r s VAL 227 N -2.62 0.57 -0.08 -1.59 1.01 0.19 -0.08 120.40 117.80 3b6r s VAL 227 Ca -0.02 -0.03 -0.21 0.00 0.00 0.00 0.00 61.98 61.72 3b6r s VAL 227 Cb -0.02 -0.66 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 3b6r s VAL 227 CO -0.04 0.28 0.60 0.26 0.00 0.00 0.00 175.10 176.20 3b6r s TRP 228 N 1.68 3.57 -0.24 5.22 0.51 -0.37 -0.98 118.94 128.33 3b6r s TRP 228 Ca 0.01 1.11 -0.06 0.00 -2.12 0.00 0.00 56.10 55.04 3b6r s TRP 228 Cb -0.13 -2.69 -0.02 0.00 -0.81 0.00 0.00 33.47 29.82 3b6r s TRP 228 CO -0.05 0.15 0.03 0.08 -0.51 0.00 0.00 176.95 176.65 3b6r s VAL 229 N 0.61 3.98 -1.22 4.03 1.01 0.14 -2.07 120.40 126.89 3b6r s VAL 229 Ca 0.32 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 3b6r s VAL 229 Cb -0.17 -2.84 0.00 0.00 0.00 0.00 0.00 36.38 33.37 3b6r s VAL 229 CO 0.15 0.37 0.04 0.59 0.00 0.00 0.00 175.10 176.26 3b6r n ASN 230 N 4.82 -4.43 0.00 3.32 3.02 0.20 -2.67 115.26 119.52 3b6r n ASN 230 Ca -0.17 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 3b6r n ASN 230 Cb 0.51 -3.55 0.00 0.00 -0.61 0.00 0.00 39.78 36.13 3b6r n ASN 230 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3b6r n GLU 231 N -2.45 0.00 0.21 3.52 2.13 -1.26 -4.81 120.64 117.98 3b6r n GLU 231 Ca -0.16 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.77 3b6r n GLU 231 Cb 0.63 0.00 0.15 0.00 0.27 0.00 0.00 31.44 32.49 3b6r n GLU 231 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 3b6r h GLU 232 N 0.00 0.00 -4.49 5.31 4.81 -1.95 -3.46 114.58 114.80 3b6r h GLU 232 Ca 0.00 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.04 3b6r h GLU 232 Cb 0.00 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 29.23 3b6r h GLU 232 CO 0.00 0.07 -0.67 -0.51 -0.73 0.00 0.00 179.01 177.17 3b6r s ASP 233 N -6.24 0.68 0.21 1.04 1.01 -1.26 -4.59 116.67 107.51 3b6r s ASP 233 Ca 0.07 -1.11 -0.10 0.00 0.71 0.00 0.00 52.55 52.12 3b6r s ASP 233 Cb 0.05 0.20 0.29 0.00 1.01 0.00 0.00 42.92 44.47 3b6r s ASP 233 CO 0.68 -0.62 1.72 0.45 0.21 0.00 0.00 175.17 177.61 3b6r h HIS 234 N 2.93 0.28 -3.87 4.23 3.86 -1.89 -3.13 115.15 117.56 3b6r h HIS 234 Ca -0.35 0.03 -0.29 0.00 -1.16 0.00 0.00 60.37 58.60 3b6r h HIS 234 Cb 1.18 -0.03 -0.28 0.00 1.06 0.00 0.00 27.41 29.34 3b6r h HIS 234 CO 0.51 0.02 -0.74 -0.51 0.86 0.00 0.00 177.93 178.06 3b6r s LEU 235 N -10.47 2.03 -0.22 2.43 1.02 -0.86 -0.63 118.68 111.98 3b6r s LEU 235 Ca -0.13 -0.11 -0.01 0.00 0.02 0.00 0.00 54.13 53.90 3b6r s LEU 235 Cb 0.17 -0.18 0.06 0.00 0.02 0.00 0.00 46.19 46.26 3b6r s LEU 235 CO 0.74 0.02 -0.00 -0.13 0.02 0.00 0.00 176.35 177.00 3b6r s ARG 236 N -0.22 1.10 -0.23 1.70 1.81 -0.88 -1.08 118.95 121.15 3b6r s ARG 236 Ca 0.00 -0.72 -0.16 0.00 -1.72 0.00 0.00 55.73 53.13 3b6r s ARG 236 Cb -0.02 -2.34 -0.03 0.00 -0.45 0.00 0.00 34.95 32.11 3b6r s ARG 236 CO -0.00 -0.64 0.43 0.08 -0.68 0.00 0.00 175.30 174.49 3b6r s VAL 237 N 1.63 5.15 -0.02 3.52 1.01 0.70 -1.24 120.40 131.15 3b6r s VAL 237 Ca -0.03 0.74 0.05 0.00 0.00 0.00 0.00 61.98 62.74 3b6r s VAL 237 Cb -0.18 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 3b6r s VAL 237 CO -0.08 0.18 -0.17 -0.63 0.00 0.00 0.00 175.10 174.40 3b6r s ILE 238 N 1.77 1.36 -0.08 2.22 1.01 0.88 -1.28 121.20 127.08 3b6r s ILE 238 Ca 0.19 -0.72 0.02 0.00 0.00 0.00 0.00 60.65 60.14 3b6r s ILE 238 Cb -0.15 -1.14 0.01 0.00 0.01 0.00 0.00 42.46 41.19 3b6r s ILE 238 CO 0.09 0.39 -0.14 -0.55 0.00 0.00 0.00 174.94 174.73 3b6r s SER 239 N -0.29 2.03 0.14 3.58 0.15 -0.24 -0.10 113.70 118.97 3b6r s SER 239 Ca 0.04 -0.34 -0.24 0.00 0.70 0.00 0.00 55.95 56.11 3b6r s SER 239 Cb -0.08 -0.92 0.07 0.00 -1.71 0.00 0.00 66.02 63.38 3b6r s SER 239 CO -0.00 0.03 0.61 0.00 1.20 0.00 0.00 173.24 175.08 3b6r s MET 240 N 0.75 1.26 -0.08 5.44 0.23 -0.21 -0.47 119.30 126.22 3b6r s MET 240 Ca -0.13 -0.42 -0.31 0.00 -1.03 0.00 0.00 55.69 53.80 3b6r s MET 240 Cb -0.16 0.58 0.12 0.00 -1.53 0.00 0.00 34.83 33.84 3b6r s MET 240 CO 0.03 -0.54 1.03 1.14 -2.03 0.00 0.00 175.02 174.65 3b6r s GLN 241 N -3.57 0.61 0.73 3.16 -2.07 -0.75 -4.25 119.66 113.52 3b6r s GLN 241 Ca 0.00 -0.23 -0.13 0.00 -1.82 0.00 0.00 55.36 53.18 3b6r s GLN 241 Cb -0.01 0.27 0.04 0.00 -1.09 0.00 0.00 33.01 32.22 3b6r s GLN 241 CO -0.11 -0.27 1.12 0.15 -1.32 0.00 0.00 175.29 174.86 3b6r s LYS 242 N -2.82 2.39 0.21 9.60 -0.14 -1.26 -1.26 119.74 126.47 3b6r s LYS 242 Ca 0.07 1.38 0.00 0.00 -1.36 0.00 0.00 55.97 56.06 3b6r s LYS 242 Cb -0.01 -1.90 0.00 0.00 -1.68 0.00 0.00 37.83 34.24 3b6r s LYS 242 CO -0.07 -1.56 0.00 0.41 -0.76 0.00 0.00 175.35 173.37 3b6r n GLY 243 N -0.58 -2.48 1.77 -3.33 0.00 0.74 -4.69 105.19 96.62 3b6r n GLY 243 Ca 0.10 -1.88 -0.17 0.00 0.00 0.00 0.00 46.02 44.07 3b6r n GLY 243 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b6r n GLY 244 N -0.11 5.89 3.06 -0.02 0.00 -1.26 -2.46 105.19 110.29 3b6r n GLY 244 Ca 0.00 -2.31 -0.43 0.00 0.00 0.00 0.00 46.02 43.28 3b6r n GLY 244 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3b6r n ASN 245 N -0.77 5.95 -0.06 1.61 4.05 -1.26 0.34 115.26 125.12 3b6r n ASN 245 Ca 0.37 -3.27 0.11 0.00 0.45 0.00 0.00 54.58 52.24 3b6r n ASN 245 Cb 0.91 -1.35 0.50 0.00 1.23 0.00 0.00 39.78 41.07 3b6r n ASN 245 CO 0.00 0.00 0.00 -0.03 -3.05 0.00 0.00 177.26 174.18 3b6r h MET 246 N 5.79 0.40 -0.39 1.20 1.85 -1.53 -2.58 114.93 119.67 3b6r h MET 246 Ca 0.24 -0.02 -0.04 0.00 -0.61 0.00 0.00 59.70 59.27 3b6r h MET 246 Cb 0.67 -0.09 -0.02 0.00 0.43 0.00 0.00 31.60 32.60 3b6r h MET 246 CO 1.34 0.26 0.09 -0.22 -0.40 0.00 0.00 176.91 177.98 3b6r h LYS 247 N 0.41 0.62 -0.60 0.39 3.64 -1.12 0.56 116.57 120.47 3b6r h LYS 247 Ca 0.25 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 3b6r h LYS 247 Cb 0.44 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 3b6r h LYS 247 CO -0.06 0.66 0.04 1.49 -2.27 0.00 0.00 179.45 179.31 3b6r h GLU 248 N 0.48 1.03 -0.62 1.90 4.81 -1.76 0.60 114.58 121.02 3b6r h GLU 248 Ca 0.12 -0.31 0.01 0.00 -0.13 0.00 0.00 59.36 59.05 3b6r h GLU 248 Cb 0.32 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.56 3b6r h GLU 248 CO 0.00 1.00 0.41 0.28 -0.73 0.00 0.00 179.01 179.97 3b6r h VAL 249 N 0.93 1.15 -0.33 0.32 2.07 -1.20 -1.47 116.25 117.71 3b6r h VAL 249 Ca 0.18 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.28 3b6r h VAL 249 Cb 0.50 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 3b6r h VAL 249 CO 0.02 0.15 -0.33 0.15 0.02 0.00 0.00 177.57 177.59 3b6r h PHE 250 N 0.83 0.86 -0.29 1.57 3.57 -0.61 -1.27 116.94 121.59 3b6r h PHE 250 Ca 0.23 -0.23 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 3b6r h PHE 250 Cb -0.08 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 3b6r h PHE 250 CO -0.03 0.96 0.13 1.15 -2.23 0.00 0.00 178.31 178.29 3b6r h THR 251 N 0.62 1.16 -0.51 4.41 2.02 -0.53 0.57 112.91 120.65 3b6r h THR 251 Ca 0.07 -0.46 -0.05 0.00 0.77 0.00 0.00 66.41 66.74 3b6r h THR 251 Cb 0.85 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.17 3b6r h THR 251 CO 0.07 0.16 0.12 -0.09 0.37 0.00 0.00 175.52 176.16 3b6r h ARG 252 N 0.33 0.78 0.12 6.66 2.43 -1.20 -1.09 114.38 122.41 3b6r h ARG 252 Ca 0.10 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3b6r h ARG 252 Cb 0.14 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3b6r h ARG 252 CO -0.01 0.71 -0.06 0.35 -1.51 0.00 0.00 179.97 179.45 3b6r h PHE 253 N 0.75 -0.14 -0.74 2.20 3.57 -0.70 -0.50 116.94 121.38 3b6r h PHE 253 Ca 0.17 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.64 3b6r h PHE 253 Cb 0.28 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3b6r h PHE 253 CO 0.02 0.01 0.36 0.00 -2.23 0.00 0.00 178.31 176.46 3b6r h THR 255 N 1.03 0.38 -0.57 0.00 2.02 -1.10 -2.04 112.91 112.64 3b6r h THR 255 Ca 0.25 -0.21 0.03 0.00 0.77 0.00 0.00 66.41 67.25 3b6r h THR 255 Cb 0.11 0.46 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 3b6r h THR 255 CO -0.03 0.03 0.34 1.23 0.37 0.00 0.00 175.52 177.46 3b6r h GLY 256 N -0.92 0.81 0.71 2.16 0.00 -1.07 -2.03 103.07 102.74 3b6r h GLY 256 Ca -0.08 -0.25 0.05 0.00 0.00 0.00 0.00 47.33 47.04 3b6r h GLY 256 CO 0.13 0.21 0.24 -2.00 0.00 0.00 0.00 176.54 175.12 3b6r h LEU 257 N 0.67 0.34 -0.79 3.11 5.85 -1.14 0.14 115.31 123.50 3b6r h LEU 257 Ca 0.23 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.88 3b6r h LEU 257 Cb 0.04 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3b6r h LEU 257 CO -0.11 0.24 -0.17 0.71 -0.34 0.00 0.00 178.44 178.77 3b6r h THR 258 N 0.48 1.26 -0.56 1.05 1.35 -1.13 -1.67 112.91 113.69 3b6r h THR 258 Ca 0.22 -1.24 -0.11 0.00 -0.55 0.00 0.00 66.41 64.73 3b6r h THR 258 Cb 0.14 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 67.69 3b6r h THR 258 CO -0.16 0.42 -0.09 1.56 -0.25 0.00 0.00 175.52 177.00 3b6r h GLN 259 N 0.65 1.04 -0.27 4.72 4.20 -0.87 -1.64 115.11 122.94 3b6r h GLN 259 Ca 0.10 -0.37 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 3b6r h GLN 259 Cb 0.65 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 3b6r h GLN 259 CO 0.05 1.07 0.17 0.82 -0.67 0.00 0.00 178.83 180.26 3b6r h ILE 260 N 0.93 1.10 -0.92 2.54 2.04 -0.66 -0.58 117.51 121.95 3b6r h ILE 260 Ca 0.15 -0.24 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 3b6r h ILE 260 Cb 0.66 0.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 3b6r h ILE 260 CO 0.05 0.10 0.53 -0.08 0.00 0.00 0.00 178.15 178.74 3b6r h GLU 261 N 0.35 1.27 -0.38 2.37 4.81 -1.17 -1.73 114.58 120.10 3b6r h GLU 261 Ca 0.10 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3b6r h GLU 261 Cb 0.01 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 3b6r h GLU 261 CO -0.02 0.91 0.24 1.15 -0.73 0.00 0.00 179.01 180.57 3b6r h THR 262 N 1.29 1.11 -0.81 0.32 2.02 -0.85 -1.06 112.91 114.92 3b6r h THR 262 Ca 0.33 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 3b6r h THR 262 Cb -0.01 0.58 -0.04 0.00 -1.74 0.00 0.00 68.15 66.94 3b6r h THR 262 CO -0.06 0.11 0.49 -0.07 0.37 0.00 0.00 175.52 176.36 3b6r h LEU 263 N 0.50 0.97 -0.61 2.58 3.38 -0.64 -1.65 115.31 119.84 3b6r h LEU 263 Ca 0.14 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 3b6r h LEU 263 Cb -0.04 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3b6r h LEU 263 CO -0.03 0.75 -0.16 -0.26 0.09 0.00 0.00 178.44 178.83 3b6r h PHE 264 N 1.11 1.05 -0.79 1.13 -1.00 -1.01 -2.97 116.94 114.46 3b6r h PHE 264 Ca 0.29 -0.23 -0.02 0.00 2.81 0.00 0.00 57.97 60.82 3b6r h PHE 264 Cb -0.05 -0.25 -0.04 0.00 3.61 0.00 0.00 35.95 39.22 3b6r h PHE 264 CO -0.01 1.01 0.39 0.87 -1.61 0.00 0.00 178.31 178.97 3b6r h LYS 265 N 0.82 1.12 0.00 1.51 1.57 -0.81 -0.95 116.57 119.83 3b6r h LYS 265 Ca 0.12 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3b6r h LYS 265 Cb 0.71 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.81 3b6r h LYS 265 CO 0.05 0.85 0.00 0.66 -0.57 0.00 0.00 179.45 180.44 3b6r h SER 266 N 1.12 0.00 -0.56 0.86 4.64 -1.15 0.15 113.55 118.60 3b6r h SER 266 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3b6r h SER 266 Cb 0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 3b6r h SER 266 CO -0.04 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.21 3b6r n LYS 267 N -3.06 3.76 -2.12 4.77 5.02 -0.45 -4.94 118.16 121.14 3b6r n LYS 267 Ca -0.03 -2.87 -0.14 0.00 -2.02 0.00 0.00 58.31 53.26 3b6r n LYS 267 Cb 0.08 -1.90 -0.02 0.00 -0.02 0.00 0.00 35.03 33.18 3b6r n LYS 267 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3b6r n ASP 268 N 0.79 -4.38 -4.44 4.39 -0.08 0.52 -5.02 116.55 108.33 3b6r n ASP 268 Ca 0.24 0.05 -0.31 0.00 -1.51 0.00 0.00 54.79 53.26 3b6r n ASP 268 Cb 0.91 -3.48 -0.13 0.00 2.34 0.00 0.00 41.12 40.76 3b6r n ASP 268 CO 0.00 0.00 0.00 -0.31 0.12 0.00 0.00 177.20 177.01 3b6r s TYR 269 N -2.67 2.54 0.11 -0.67 2.02 -0.65 -5.01 117.35 113.02 3b6r s TYR 269 Ca 0.00 -0.27 0.06 0.00 -0.37 0.00 0.00 57.07 56.48 3b6r s TYR 269 Cb 0.00 -1.48 -0.04 0.00 -0.40 0.00 0.00 41.96 40.04 3b6r s TYR 269 CO 0.00 0.21 -0.14 -1.83 -1.57 0.00 0.00 175.55 172.22 3b6r s GLU 270 N -1.27 0.99 0.38 -0.62 -1.05 -1.26 -3.15 118.70 112.73 3b6r s GLU 270 Ca 0.14 -1.20 -0.20 0.00 -0.15 0.00 0.00 54.97 53.56 3b6r s GLU 270 Cb -0.10 -0.89 -0.10 0.00 -0.44 0.00 0.00 34.13 32.59 3b6r s GLU 270 CO 0.04 0.17 0.88 -0.06 0.95 0.00 0.00 175.26 177.24 3b6r s PHE 271 N -2.02 3.38 0.09 4.83 0.08 -1.26 -0.90 117.98 122.18 3b6r s PHE 271 Ca 0.07 1.50 -0.31 0.00 0.12 0.00 0.00 56.93 58.31 3b6r s PHE 271 Cb -0.06 -2.75 -0.08 0.00 -0.57 0.00 0.00 43.02 39.56 3b6r s PHE 271 CO 0.03 0.00 1.53 -1.64 -0.10 0.00 0.00 175.22 175.04 3b6r s MET 272 N -2.96 4.24 -0.04 0.44 -1.94 0.36 -4.70 119.30 114.70 3b6r s MET 272 Ca 0.58 2.22 -0.29 0.00 -1.71 0.00 0.00 55.69 56.48 3b6r s MET 272 Cb -0.11 -3.40 0.10 0.00 2.01 0.00 0.00 34.83 33.43 3b6r s MET 272 CO 0.16 -0.61 0.84 -0.46 -0.01 0.00 0.00 175.02 174.94 3b6r s TRP 273 N 1.87 -0.45 -0.09 -0.03 -0.00 -1.26 -2.01 118.94 116.97 3b6r s TRP 273 Ca 0.69 0.57 -0.30 0.00 -0.00 0.00 0.00 56.10 57.06 3b6r s TRP 273 Cb -0.39 0.48 0.08 0.00 -0.00 0.00 0.00 33.47 33.65 3b6r s TRP 273 CO 0.31 -0.53 0.75 0.54 -0.00 0.00 0.00 176.95 178.01 3b6r s ASN 274 N -1.78 -0.61 0.48 5.86 2.20 -0.86 -4.97 114.94 115.25 3b6r s ASN 274 Ca -0.01 0.72 0.33 0.00 -0.94 0.00 0.00 52.86 52.95 3b6r s ASN 274 Cb -0.01 0.57 1.44 0.00 -2.00 0.00 0.00 41.25 41.26 3b6r s ASN 274 CO -0.02 -0.52 1.72 -0.65 -2.94 0.00 0.00 177.10 174.68 3b6r h PRO 275 N 3.10 0.12 0.00 3.55 0.11 -1.93 0.91 132.00 137.84 3b6r h PRO 275 Ca -0.26 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.73 3b6r h PRO 275 Cb 1.15 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.21 3b6r h PRO 275 CO 0.34 0.08 -0.70 1.25 -0.21 0.00 0.00 178.00 178.76 3b6r h HIS 276 N 0.12 0.00 -0.01 0.65 -0.00 -1.91 -1.02 115.15 112.98 3b6r h HIS 276 Ca 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 61.06 3b6r h HIS 276 Cb 2.38 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.79 3b6r h HIS 276 CO -0.00 0.99 -0.19 1.28 -0.00 0.00 0.00 177.93 180.00 3b6r n LEU 277 N -4.54 1.17 0.00 0.26 4.32 -1.17 -3.79 117.00 113.24 3b6r n LEU 277 Ca -0.19 -0.33 0.00 0.00 -0.02 0.00 0.00 56.01 55.46 3b6r n LEU 277 Cb 0.50 -0.09 0.00 0.00 -1.62 0.00 0.00 43.42 42.21 3b6r n LEU 277 CO 0.20 0.21 0.00 0.61 -1.22 0.00 0.00 177.39 177.19 3b6r n GLY 278 N 1.30 1.86 3.72 -0.72 0.00 0.30 0.27 105.19 111.93 3b6r n GLY 278 Ca 0.14 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 45.14 3b6r n GLY 278 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3b6r s TYR 279 N 0.00 3.68 -0.18 1.61 2.02 -0.08 -2.04 117.35 122.37 3b6r s TYR 279 Ca 0.00 1.68 -0.25 0.00 -0.37 0.00 0.00 57.07 58.14 3b6r s TYR 279 Cb 0.00 -3.15 -0.02 0.00 -0.40 0.00 0.00 41.96 38.40 3b6r s TYR 279 CO 0.00 -0.14 0.80 0.42 -1.57 0.00 0.00 175.55 175.06 3b6r s ILE 280 N 0.50 4.90 0.31 2.71 -1.09 -0.85 -3.15 121.20 124.53 3b6r s ILE 280 Ca 0.51 1.56 0.03 0.00 -2.23 0.00 0.00 60.65 60.51 3b6r s ILE 280 Cb -0.24 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.48 3b6r s ILE 280 CO 0.30 0.04 0.09 -0.76 -1.23 0.00 0.00 174.94 173.37 3b6r s LEU 281 N 2.14 1.92 0.11 2.97 1.43 -1.26 -4.03 118.68 121.96 3b6r s LEU 281 Ca 0.37 -1.42 -0.25 0.00 -1.03 0.00 0.00 54.13 51.80 3b6r s LEU 281 Cb -0.16 -0.17 -0.08 0.00 0.03 0.00 0.00 46.19 45.81 3b6r s LEU 281 CO 0.12 -0.70 1.66 0.74 0.23 0.00 0.00 176.35 178.40 3b6r h THR 282 N 2.20 0.55 -3.45 5.49 2.02 -1.86 -3.42 112.91 114.44 3b6r h THR 282 Ca -0.39 0.00 -0.61 0.00 0.77 0.00 0.00 66.41 66.19 3b6r h THR 282 Cb 1.25 0.55 -0.12 0.00 -1.74 0.00 0.00 68.15 68.08 3b6r h THR 282 CO 0.64 0.00 -0.37 0.00 0.37 0.00 0.00 175.52 176.16 3b6r h PRO 284 N 7.19 0.00 0.00 0.00 0.11 -1.81 0.30 132.00 137.79 3b6r h PRO 284 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3b6r h PRO 284 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3b6r h PRO 284 CO 0.71 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.16 3b6r h SER 285 N 0.00 0.00 -0.53 -2.05 4.64 -1.95 -2.88 113.55 110.78 3b6r h SER 285 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 3b6r h SER 285 Cb 1.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.94 3b6r h SER 285 CO -0.00 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 176.55 3b6r n ASN 286 N -2.99 4.96 -4.24 4.97 5.03 0.10 -4.64 115.26 118.45 3b6r n ASN 286 Ca -0.00 -2.75 -0.30 0.00 0.87 0.00 0.00 54.58 52.40 3b6r n ASN 286 Cb 0.24 -0.60 0.19 0.00 -1.02 0.00 0.00 39.78 38.59 3b6r n ASN 286 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3b6r s LEU 287 N -2.40 1.80 0.00 3.41 1.43 -1.09 -3.12 118.68 118.71 3b6r s LEU 287 Ca 0.50 0.62 0.00 0.00 -1.03 0.00 0.00 54.13 54.21 3b6r s LEU 287 Cb 0.36 -2.64 0.00 0.00 0.03 0.00 0.00 46.19 43.94 3b6r s LEU 287 CO 0.17 -3.15 0.00 0.61 0.23 0.00 0.00 176.35 174.22 3b6r n GLY 288 N -2.31 1.57 0.09 -3.19 0.00 0.14 -2.38 105.19 99.10 3b6r n GLY 288 Ca 0.12 0.05 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 3b6r n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3b6r h THR 289 N 0.00 0.98 -0.60 2.61 1.35 -1.23 -0.18 112.91 115.84 3b6r h THR 289 Ca 0.00 -2.66 -0.26 0.00 -0.55 0.00 0.00 66.41 62.94 3b6r h THR 289 Cb 0.00 2.43 -0.10 0.00 -1.73 0.00 0.00 68.15 68.75 3b6r h THR 289 CO 0.00 0.56 -0.24 0.61 -0.25 0.00 0.00 175.52 176.20 3b6r n GLY 290 N 1.43 1.23 3.72 5.82 0.00 -1.00 -4.65 105.19 111.73 3b6r n GLY 290 Ca -0.09 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.52 3b6r n GLY 290 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3b6r s LEU 291 N -2.89 4.28 -0.27 0.99 0.20 -1.26 -3.78 118.68 115.94 3b6r s LEU 291 Ca 0.00 0.83 0.00 0.00 0.69 0.00 0.00 54.13 55.65 3b6r s LEU 291 Cb 0.00 -2.71 0.08 0.00 -0.43 0.00 0.00 46.19 43.13 3b6r s LEU 291 CO 0.00 -0.01 0.02 -0.60 -0.29 0.00 0.00 176.35 175.48 3b6r s ARG 292 N 0.64 1.20 -0.13 1.98 3.52 0.02 -4.77 118.95 121.41 3b6r s ARG 292 Ca 0.26 -1.12 -0.04 0.00 -0.13 0.00 0.00 55.73 54.70 3b6r s ARG 292 Cb -0.15 -2.46 -0.03 0.00 -1.56 0.00 0.00 34.95 30.75 3b6r s ARG 292 CO 0.11 -0.79 0.01 0.00 -0.81 0.00 0.00 175.30 173.81 3b6r s ALA 293 N 1.43 3.25 0.26 6.12 0.00 -1.26 -1.71 121.76 129.85 3b6r s ALA 293 Ca 0.03 -0.79 -0.20 0.00 0.00 0.00 0.00 51.96 51.00 3b6r s ALA 293 Cb -0.18 -1.63 0.07 0.00 0.00 0.00 0.00 23.12 21.38 3b6r s ALA 293 CO -0.13 0.37 0.95 0.20 0.00 0.00 0.00 175.76 177.15 3b6r s GLY 294 N -0.18 0.23 0.12 0.00 0.00 -0.06 -2.36 107.32 105.07 3b6r s GLY 294 Ca 0.05 -0.51 0.02 0.00 0.00 0.00 0.00 44.72 44.28 3b6r s GLY 294 CO 0.02 1.50 -0.06 -1.34 0.00 0.00 0.00 173.10 173.22 3b6r s VAL 295 N -2.16 0.77 -0.34 1.40 -7.23 -0.38 -1.17 120.40 111.29 3b6r s VAL 295 Ca 0.20 -1.96 -0.14 0.00 -1.81 0.00 0.00 61.98 58.27 3b6r s VAL 295 Cb -0.04 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.12 3b6r s VAL 295 CO 0.08 -0.80 0.30 -1.00 -0.31 0.00 0.00 175.10 173.36 3b6r s HIS 296 N -3.58 3.22 -0.03 2.82 3.76 -0.56 -1.79 115.29 119.14 3b6r s HIS 296 Ca 0.14 -0.12 0.03 0.00 -0.15 0.00 0.00 55.06 54.96 3b6r s HIS 296 Cb 0.05 -2.57 0.00 0.00 1.11 0.00 0.00 32.58 31.17 3b6r s HIS 296 CO -0.03 -0.39 -0.11 -1.50 -0.85 0.00 0.00 174.74 171.86 3b6r s ILE 297 N 1.86 0.90 -0.51 0.60 2.07 0.34 0.67 121.20 127.13 3b6r s ILE 297 Ca 0.09 -0.44 -0.29 0.00 -1.41 0.00 0.00 60.65 58.60 3b6r s ILE 297 Cb -0.17 -0.79 0.03 0.00 0.13 0.00 0.00 42.46 41.66 3b6r s ILE 297 CO 0.11 0.27 1.14 -0.54 -1.91 0.00 0.00 174.94 174.02 3b6r s LYS 298 N 0.09 3.65 -0.41 3.50 1.02 -0.08 -0.75 119.74 126.75 3b6r s LYS 298 Ca -0.02 0.45 0.08 0.00 0.02 0.00 0.00 55.97 56.51 3b6r s LYS 298 Cb -0.08 -3.94 0.27 0.00 -0.52 0.00 0.00 37.83 33.55 3b6r s LYS 298 CO 0.01 -1.46 0.57 1.28 -0.92 0.00 0.00 175.35 174.82 3b6r n LEU 299 N 7.99 0.58 -0.21 3.17 4.77 -0.46 -4.89 117.00 127.93 3b6r n LEU 299 Ca 0.11 -4.80 -0.00 0.00 -0.03 0.00 0.00 56.01 51.28 3b6r n LEU 299 Cb 0.49 0.55 0.23 0.00 -2.33 0.00 0.00 43.42 42.35 3b6r n LEU 299 CO 0.71 2.11 1.20 1.55 -1.33 0.00 0.00 177.39 181.63 3b6r h PRO 300 N 3.84 0.99 0.17 3.23 0.13 -1.92 0.05 132.00 138.49 3b6r h PRO 300 Ca 0.08 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 65.13 3b6r h PRO 300 Cb 0.87 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3b6r h PRO 300 CO 0.50 0.69 -0.08 -0.91 -0.23 0.00 0.00 178.00 177.96 3b6r h ASN 301 N 1.01 -0.19 -0.99 1.44 2.35 -1.92 -3.25 115.58 114.02 3b6r h ASN 301 Ca 0.26 0.01 0.22 0.00 -0.55 0.00 0.00 56.30 56.24 3b6r h ASN 301 Cb -0.05 0.05 -0.10 0.00 0.05 0.00 0.00 38.32 38.27 3b6r h ASN 301 CO -0.05 0.02 0.62 -0.07 -1.65 0.00 0.00 177.43 176.30 3b6r h LEU 302 N -0.54 0.63 -0.98 1.61 -0.00 -1.91 -0.76 115.31 113.37 3b6r h LEU 302 Ca -0.02 0.09 0.18 0.00 -0.00 0.00 0.00 57.88 58.13 3b6r h LEU 302 Cb 0.17 -0.02 -0.11 0.00 -0.00 0.00 0.00 40.66 40.71 3b6r h LEU 302 CO 0.04 0.20 0.58 1.23 -0.00 0.00 0.00 178.44 180.48 3b6r h GLY 303 N 0.60 1.73 -5.25 0.83 0.00 -1.06 -2.07 103.07 97.84 3b6r h GLY 303 Ca 0.57 -0.34 -0.69 0.00 0.00 0.00 0.00 47.33 46.87 3b6r h GLY 303 CO -0.34 -0.07 0.23 1.17 0.00 0.00 0.00 176.54 177.54 3b6r n LYS 304 N -4.79 3.70 -4.29 4.80 4.81 -0.29 -5.00 118.16 117.10 3b6r n LYS 304 Ca 0.22 -4.36 -0.21 0.00 -0.87 0.00 0.00 58.31 53.09 3b6r n LYS 304 Cb 0.55 -2.31 -0.13 0.00 0.02 0.00 0.00 35.03 33.17 3b6r n LYS 304 CO 0.00 0.00 0.00 -1.58 1.17 0.00 0.00 177.40 176.99 3b6r s HIS 305 N -3.87 1.50 0.00 5.64 2.46 -0.78 -5.01 115.29 115.23 3b6r s HIS 305 Ca 0.47 -0.42 0.00 0.00 0.47 0.00 0.00 55.06 55.58 3b6r s HIS 305 Cb 0.33 -0.84 0.00 0.00 -0.13 0.00 0.00 32.58 31.94 3b6r s HIS 305 CO -0.23 0.11 0.93 0.39 -2.47 0.00 0.00 174.74 173.47 3b6r n GLU 306 N 1.35 0.00 -0.02 2.88 1.02 -1.26 -3.11 120.64 121.51 3b6r n GLU 306 Ca -0.20 0.64 -0.00 0.00 -0.02 0.00 0.00 57.16 57.58 3b6r n GLU 306 Cb 0.54 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 3b6r n GLU 306 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 3b6r n LYS 307 N -2.17 1.02 -0.03 3.49 2.85 -1.26 -4.20 118.16 117.86 3b6r n LYS 307 Ca 0.00 -0.04 -0.14 0.00 -1.05 0.00 0.00 58.31 57.08 3b6r n LYS 307 Cb 0.00 -1.09 -0.09 0.00 -0.65 0.00 0.00 35.03 33.19 3b6r n LYS 307 CO 0.00 0.00 0.00 0.35 -0.05 0.00 0.00 177.40 177.70 3b6r h PHE 308 N 0.02 0.21 0.00 5.58 3.57 -1.82 -1.99 116.94 122.51 3b6r h PHE 308 Ca 0.01 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.43 3b6r h PHE 308 Cb 0.95 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.65 3b6r h PHE 308 CO 0.02 0.70 0.00 0.66 -2.23 0.00 0.00 178.31 177.46 3b6r h SER 309 N -0.34 0.00 0.17 0.41 4.64 -1.83 -2.26 113.55 114.34 3b6r h SER 309 Ca 0.00 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.04 3b6r h SER 309 Cb 0.69 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.81 3b6r h SER 309 CO 0.02 0.00 -1.19 -0.33 -0.87 0.00 0.00 176.83 174.46 3b6r h GLU 310 N 0.00 0.50 -0.64 4.77 4.39 -1.79 -2.25 114.58 119.57 3b6r h GLU 310 Ca 0.00 -0.77 -0.08 0.00 0.34 0.00 0.00 59.36 58.85 3b6r h GLU 310 Cb 0.26 0.27 -0.03 0.00 -0.10 0.00 0.00 28.75 29.16 3b6r h GLU 310 CO 0.00 1.36 0.10 0.28 -1.16 0.00 0.00 179.01 179.58 3b6r h VAL 311 N 0.04 1.26 -0.25 3.13 2.07 -0.82 0.13 116.25 121.81 3b6r h VAL 311 Ca -0.20 -1.01 -0.04 0.00 0.82 0.00 0.00 66.70 66.27 3b6r h VAL 311 Cb 1.91 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 3b6r h VAL 311 CO 0.23 0.38 0.01 -0.07 0.02 0.00 0.00 177.57 178.14 3b6r h LEU 312 N 0.98 0.41 -1.50 2.57 3.38 -1.49 0.66 115.31 120.32 3b6r h LEU 312 Ca 0.20 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 3b6r h LEU 312 Cb 0.43 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3b6r h LEU 312 CO 0.01 0.61 -0.26 0.50 0.09 0.00 0.00 178.44 179.39 3b6r h LYS 313 N 0.21 0.00 -0.23 1.13 3.64 -1.26 0.40 116.57 120.45 3b6r h LYS 313 Ca 0.07 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.30 3b6r h LYS 313 Cb 0.38 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 3b6r h LYS 313 CO 0.01 0.26 -0.44 -0.09 -2.27 0.00 0.00 179.45 176.91 3b6r h ARG 314 N 0.00 0.71 -0.26 1.90 9.65 -0.54 -3.04 114.38 122.80 3b6r h ARG 314 Ca -0.00 -0.45 0.00 0.00 -1.10 0.00 0.00 59.98 58.42 3b6r h ARG 314 Cb 0.50 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.13 3b6r h ARG 314 CO 0.03 1.08 0.00 1.28 2.80 0.00 0.00 179.97 185.16 3b6r n LEU 315 N -4.17 1.45 -2.79 3.80 4.32 0.19 -1.27 117.00 118.52 3b6r n LEU 315 Ca -0.05 -0.72 -0.22 0.00 -0.02 0.00 0.00 56.01 55.00 3b6r n LEU 315 Cb 0.56 -0.18 0.02 0.00 -1.62 0.00 0.00 43.42 42.21 3b6r n LEU 315 CO 0.47 0.36 -0.10 0.54 -1.22 0.00 0.00 177.39 177.44 3b6r n ARG 316 N 0.28 -3.69 -4.20 3.23 1.74 -0.53 -4.90 116.66 108.59 3b6r n ARG 316 Ca 0.10 0.94 -0.30 0.00 -0.77 0.00 0.00 57.85 57.82 3b6r n ARG 316 Cb 0.23 -5.73 -0.09 0.00 -1.02 0.00 0.00 32.46 25.85 3b6r n ARG 316 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3b6r s LEU 317 N -6.44 3.18 0.08 0.55 1.43 0.13 0.41 118.68 118.02 3b6r s LEU 317 Ca 0.19 -0.31 0.09 0.00 -1.03 0.00 0.00 54.13 53.07 3b6r s LEU 317 Cb -0.09 -1.95 -0.03 0.00 0.03 0.00 0.00 46.19 44.15 3b6r s LEU 317 CO 0.24 0.18 -0.21 -1.58 0.23 0.00 0.00 176.35 175.21 3b6r s GLN 318 N -2.22 1.84 -0.02 1.70 0.74 0.15 -4.06 119.66 117.79 3b6r s GLN 318 Ca 0.23 -1.12 0.03 0.00 0.05 0.00 0.00 55.36 54.55 3b6r s GLN 318 Cb -0.11 -2.08 -0.03 0.00 1.10 0.00 0.00 33.01 31.88 3b6r s GLN 318 CO 0.15 0.50 -0.09 -1.59 -0.55 0.00 0.00 175.29 173.71 3b6r s LYS 319 N -1.68 2.53 0.27 1.67 -2.85 -1.26 -1.87 119.74 116.55 3b6r s LYS 319 Ca 0.15 -0.71 0.02 0.00 -1.00 0.00 0.00 55.97 54.43 3b6r s LYS 319 Cb -0.10 -2.46 -0.04 0.00 -2.06 0.00 0.00 37.83 33.16 3b6r s LYS 319 CO 0.06 0.61 0.15 1.03 0.10 0.00 0.00 175.35 177.30 3b6r s ARG 320 N -1.18 1.47 0.81 1.78 0.52 0.45 -4.94 118.95 117.86 3b6r s ARG 320 Ca 0.15 -1.82 -0.12 0.00 -0.52 0.00 0.00 55.73 53.42 3b6r s ARG 320 Cb -0.11 -0.02 0.08 0.00 0.52 0.00 0.00 34.95 35.42 3b6r s ARG 320 CO 0.05 -0.41 1.13 0.20 0.02 0.00 0.00 175.30 176.28 3b6r s GLY 321 N -3.31 1.60 0.49 -3.53 0.00 -0.88 -1.89 107.32 99.80 3b6r s GLY 321 Ca 0.37 -0.43 0.14 0.00 0.00 0.00 0.00 44.72 44.80 3b6r s GLY 321 CO 0.16 0.04 2.11 -0.84 0.00 0.00 0.00 173.10 174.56 3b6r h THR 322 N -1.10 1.04 -0.61 0.90 2.02 -1.64 -1.44 112.91 112.08 3b6r h THR 322 Ca -0.47 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 66.57 3b6r h THR 322 Cb 1.30 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 3b6r h THR 322 CO 0.63 0.05 0.00 0.61 0.37 0.00 0.00 175.52 177.18 3b6r n GLY 323 N -1.44 2.28 0.00 2.16 0.00 -1.26 -5.00 105.19 101.93 3b6r n GLY 323 Ca -0.02 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.26 3b6r n GLY 323 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b6r n GLY 324 N 1.25 -0.37 0.29 -0.02 0.00 -0.54 -4.69 105.19 101.11 3b6r n GLY 324 Ca 0.23 -2.27 0.10 0.00 0.00 0.00 0.00 46.02 44.08 3b6r n GLY 324 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3b6r h VAL 325 N 0.00 0.95 -0.41 1.61 3.04 -1.94 -1.64 116.25 117.86 3b6r h VAL 325 Ca 0.00 -0.02 0.00 0.00 -1.01 0.00 0.00 66.70 65.67 3b6r h VAL 325 Cb 0.00 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 30.17 3b6r h VAL 325 CO 0.00 0.01 0.00 0.47 -1.01 0.00 0.00 177.57 177.04 3b6r n ASP 326 N -4.50 2.34 -4.43 3.17 10.43 -1.26 -4.72 116.55 117.58 3b6r n ASP 326 Ca 0.00 -2.04 -0.21 0.00 2.57 0.00 0.00 54.79 55.11 3b6r n ASP 326 Cb 0.20 -0.30 -0.10 0.00 1.84 0.00 0.00 41.12 42.75 3b6r n ASP 326 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3b6r s THR 327 N -1.49 1.46 0.40 -3.53 -4.23 -0.67 -5.07 115.64 102.51 3b6r s THR 327 Ca 0.28 -2.07 0.05 0.00 -1.18 0.00 0.00 61.69 58.76 3b6r s THR 327 Cb 0.15 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.44 3b6r s THR 327 CO 0.18 -0.21 0.57 0.00 -0.54 0.00 0.00 174.62 174.62 3b6r s ALA 328 N -3.13 4.12 -0.00 3.99 0.00 -1.26 -2.51 121.76 122.96 3b6r s ALA 328 Ca 0.31 -1.37 -0.29 0.00 0.00 0.00 0.00 51.96 50.61 3b6r s ALA 328 Cb 0.06 -1.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 3b6r s ALA 328 CO 0.13 -0.24 0.95 0.00 0.00 0.00 0.00 175.76 176.59 3b6r s ALA 329 N -2.37 3.19 0.01 0.00 0.00 -1.26 -2.80 121.76 118.52 3b6r s ALA 329 Ca 0.49 0.49 0.09 0.00 0.00 0.00 0.00 51.96 53.03 3b6r s ALA 329 Cb -0.10 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.71 3b6r s ALA 329 CO 0.34 -0.20 -0.26 0.14 0.00 0.00 0.00 175.76 175.78 3b6r s VAL 330 N 0.93 2.07 -1.47 0.00 -7.23 -1.26 -4.65 120.40 108.80 3b6r s VAL 330 Ca 0.50 -1.23 0.00 0.00 -1.81 0.00 0.00 61.98 59.44 3b6r s VAL 330 Cb -0.21 -1.74 0.00 0.00 0.56 0.00 0.00 36.38 34.99 3b6r s VAL 330 CO 0.27 0.48 0.00 0.61 -0.31 0.00 0.00 175.10 176.15 3b6r n GLY 331 N 2.14 1.31 2.69 2.32 0.00 -1.26 -2.35 105.19 110.04 3b6r n GLY 331 Ca -0.16 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3b6r n GLY 331 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b6r n GLY 332 N -1.23 0.52 3.55 -0.02 0.00 -1.26 -4.92 105.19 101.82 3b6r n GLY 332 Ca -0.14 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 3b6r n GLY 332 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3b6r s VAL 333 N -2.34 4.67 0.00 1.61 1.01 -0.99 -1.36 120.40 123.01 3b6r s VAL 333 Ca 0.00 0.46 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 3b6r s VAL 333 Cb 0.00 -4.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 3b6r s VAL 333 CO 0.00 -0.67 0.13 -0.36 0.00 0.00 0.00 175.10 174.20 3b6r s PHE 334 N 3.23 3.41 -0.46 5.22 0.08 0.07 -3.93 117.98 125.60 3b6r s PHE 334 Ca 0.29 0.27 -0.17 0.00 0.12 0.00 0.00 56.93 57.44 3b6r s PHE 334 Cb -0.12 -1.77 0.05 0.00 -0.57 0.00 0.00 43.02 40.60 3b6r s PHE 334 CO 0.22 0.59 0.45 0.34 -0.10 0.00 0.00 175.22 176.72 3b6r s ASP 335 N -1.91 6.17 -0.19 1.36 -1.08 -0.79 -0.50 116.67 119.73 3b6r s ASP 335 Ca 0.26 -0.98 -0.02 0.00 -0.52 0.00 0.00 52.55 51.29 3b6r s ASP 335 Cb -0.12 -2.22 -0.01 0.00 -1.46 0.00 0.00 42.92 39.11 3b6r s ASP 335 CO 0.17 -0.66 -0.09 -0.69 0.52 0.00 0.00 175.17 174.43 3b6r s VAL 336 N 2.03 3.11 0.21 1.11 1.01 -0.74 -0.41 120.40 126.71 3b6r s VAL 336 Ca 0.09 -0.60 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 3b6r s VAL 336 Cb -0.20 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 3b6r s VAL 336 CO 0.10 0.47 0.21 -0.94 0.00 0.00 0.00 175.10 174.94 3b6r s SER 337 N 1.16 0.10 0.23 3.32 1.04 -0.78 -1.24 113.70 117.52 3b6r s SER 337 Ca 0.02 -1.27 -0.30 0.00 0.48 0.00 0.00 55.95 54.88 3b6r s SER 337 Cb -0.14 0.42 -0.09 0.00 0.10 0.00 0.00 66.02 66.31 3b6r s SER 337 CO -0.03 -0.90 1.37 0.54 0.98 0.00 0.00 173.24 175.20 3b6r s ASN 338 N -3.12 6.78 -0.04 7.02 2.20 -0.99 0.34 114.94 127.13 3b6r s ASN 338 Ca 0.34 2.53 -0.22 0.00 -0.94 0.00 0.00 52.86 54.57 3b6r s ASN 338 Cb 0.05 -2.62 -0.26 0.00 -2.00 0.00 0.00 41.25 36.43 3b6r s ASN 338 CO 0.11 -0.60 1.00 0.00 -2.94 0.00 0.00 177.10 174.66 3b6r h ALA 339 N 5.12 0.01 -2.36 3.54 0.00 -0.32 -3.42 119.26 121.84 3b6r h ALA 339 Ca -0.45 -0.57 -0.50 0.00 0.00 0.00 0.00 54.91 53.38 3b6r h ALA 339 Cb 1.22 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.05 3b6r h ALA 339 CO 0.77 0.26 -0.08 0.16 0.00 0.00 0.00 179.25 180.36 3b6r s ASP 340 N -6.65 6.39 0.00 0.00 1.47 -1.26 -4.97 116.67 111.65 3b6r s ASP 340 Ca -0.14 0.74 0.00 0.00 1.18 0.00 0.00 52.55 54.33 3b6r s ASP 340 Cb 0.02 -2.16 0.00 0.00 -0.34 0.00 0.00 42.92 40.44 3b6r s ASP 340 CO 0.79 -0.30 0.01 0.54 0.68 0.00 0.00 175.17 176.89 3b6r n ARG 341 N -1.37 1.23 -5.21 2.11 1.74 -1.26 -4.95 116.66 108.95 3b6r n ARG 341 Ca -0.01 -0.01 -0.32 0.00 -0.77 0.00 0.00 57.85 56.74 3b6r n ARG 341 Cb 0.55 -0.15 -0.17 0.00 -1.02 0.00 0.00 32.46 31.67 3b6r n ARG 341 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3b6r s LEU 342 N -0.36 2.12 0.00 0.55 2.96 -1.25 -0.78 118.68 121.92 3b6r s LEU 342 Ca 0.00 -0.53 0.00 0.00 -0.22 0.00 0.00 54.13 53.38 3b6r s LEU 342 Cb 0.00 -1.41 0.00 0.00 0.50 0.00 0.00 46.19 45.28 3b6r s LEU 342 CO 0.00 0.18 0.00 0.61 -1.32 0.00 0.00 176.35 175.82 3b6r n GLY 343 N 3.35 0.38 3.08 7.98 0.00 -1.26 -4.93 105.19 113.80 3b6r n GLY 343 Ca -0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.68 3b6r n GLY 343 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3b6r s PHE 344 N -2.00 0.85 0.71 1.61 0.40 -1.26 -4.88 117.98 113.40 3b6r s PHE 344 Ca 0.00 -0.40 -0.11 0.00 -0.60 0.00 0.00 56.93 55.82 3b6r s PHE 344 Cb 0.00 -0.50 0.02 0.00 0.51 0.00 0.00 43.02 43.04 3b6r s PHE 344 CO 0.00 -0.02 1.10 -1.54 0.70 0.00 0.00 175.22 175.46 3b6r s SER 345 N -1.29 5.43 0.22 1.36 1.04 -1.24 -4.72 113.70 114.50 3b6r s SER 345 Ca -0.04 1.12 -0.08 0.00 0.48 0.00 0.00 55.95 57.43 3b6r s SER 345 Cb -0.08 -1.91 0.26 0.00 0.10 0.00 0.00 66.02 64.38 3b6r s SER 345 CO 0.01 -1.35 1.85 -0.33 0.98 0.00 0.00 173.24 174.39 3b6r h GLU 346 N -0.66 0.87 -0.27 4.02 3.07 -1.78 -1.01 114.58 118.83 3b6r h GLU 346 Ca -0.45 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.35 3b6r h GLU 346 Cb 1.25 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.96 3b6r h GLU 346 CO 0.64 0.58 0.12 0.28 -1.40 0.00 0.00 179.01 179.22 3b6r h VAL 347 N 0.90 1.16 -0.82 3.13 2.07 -1.90 -1.55 116.25 119.24 3b6r h VAL 347 Ca 0.33 -0.48 0.04 0.00 0.82 0.00 0.00 66.70 67.41 3b6r h VAL 347 Cb 0.10 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 30.81 3b6r h VAL 347 CO -0.15 0.17 0.54 -0.33 0.02 0.00 0.00 177.57 177.82 3b6r h GLU 348 N 0.29 0.96 0.07 1.57 5.08 -1.79 0.04 114.58 120.79 3b6r h GLU 348 Ca 0.09 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3b6r h GLU 348 Cb 0.15 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3b6r h GLU 348 CO -0.01 0.63 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.53 3b6r h LEU 349 N 0.99 -0.07 -1.03 1.33 4.07 -0.85 -1.69 115.31 118.05 3b6r h LEU 349 Ca 0.33 -0.25 -0.04 0.00 0.08 0.00 0.00 57.88 58.00 3b6r h LEU 349 Cb 0.08 0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.81 3b6r h LEU 349 CO -0.10 0.21 0.23 0.58 -1.08 0.00 0.00 178.44 178.28 3b6r h VAL 350 N -0.37 1.23 -0.83 1.22 2.07 -1.01 -2.25 116.25 116.32 3b6r h VAL 350 Ca -0.01 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.78 3b6r h VAL 350 Cb 0.32 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 3b6r h VAL 350 CO 0.01 0.29 0.52 -0.61 0.02 0.00 0.00 177.57 177.81 3b6r h GLN 351 N 0.91 1.11 -0.20 1.57 5.75 -0.85 0.12 115.11 123.52 3b6r h GLN 351 Ca 0.21 -0.08 -0.10 0.00 -0.15 0.00 0.00 58.65 58.53 3b6r h GLN 351 Cb 0.21 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.50 3b6r h GLN 351 CO -0.02 0.76 -0.29 0.52 -2.65 0.00 0.00 178.83 177.15 3b6r h MET 352 N 1.13 0.38 -0.14 1.69 2.86 -0.73 -0.71 114.93 119.41 3b6r h MET 352 Ca 0.30 -0.15 -0.09 0.00 -2.06 0.00 0.00 59.70 57.70 3b6r h MET 352 Cb -0.08 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.56 3b6r h MET 352 CO -0.06 0.64 -0.27 0.28 1.06 0.00 0.00 176.91 178.57 3b6r h VAL 353 N 0.34 1.36 0.15 -2.22 2.07 -0.92 0.76 116.25 117.80 3b6r h VAL 353 Ca 0.05 -1.52 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 3b6r h VAL 353 Cb 0.69 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.46 3b6r h VAL 353 CO 0.05 0.45 -0.08 0.58 0.02 0.00 0.00 177.57 178.60 3b6r h VAL 354 N 0.05 0.84 -0.63 2.57 2.07 -0.83 -0.34 116.25 119.98 3b6r h VAL 354 Ca 0.01 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 3b6r h VAL 354 Cb 0.85 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 3b6r h VAL 354 CO 0.06 0.00 0.17 0.44 0.02 0.00 0.00 177.57 178.26 3b6r h ASP 355 N -0.21 0.94 -0.25 0.57 3.45 -1.18 -3.09 116.42 116.65 3b6r h ASP 355 Ca -0.02 -0.23 -0.01 0.00 0.43 0.00 0.00 57.03 57.21 3b6r h ASP 355 Cb 0.17 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 38.68 3b6r h ASP 355 CO 0.03 0.92 0.13 1.23 -1.57 0.00 0.00 179.24 179.98 3b6r h GLY 356 N 0.92 0.37 0.35 2.75 0.00 -0.64 -3.07 103.07 103.74 3b6r h GLY 356 Ca 0.20 -0.17 0.09 0.00 0.00 0.00 0.00 47.33 47.44 3b6r h GLY 356 CO -0.00 0.16 0.11 -2.08 0.00 0.00 0.00 176.54 174.73 3b6r h VAL 357 N 0.28 0.72 -0.22 4.60 2.07 -1.01 -1.21 116.25 121.48 3b6r h VAL 357 Ca 0.09 -0.09 0.04 0.00 0.82 0.00 0.00 66.70 67.56 3b6r h VAL 357 Cb 0.08 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 3b6r h VAL 357 CO -0.01 0.05 0.15 0.11 0.02 0.00 0.00 177.57 177.88 3b6r h LYS 358 N 0.25 0.14 0.00 1.57 1.57 -1.46 0.77 116.57 119.41 3b6r h LYS 358 Ca 0.26 -0.01 -0.22 0.00 -1.87 0.00 0.00 60.65 58.81 3b6r h LYS 358 Cb 0.34 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 3b6r h LYS 358 CO -0.33 0.09 -0.92 1.25 -0.57 0.00 0.00 179.45 178.97 3b6r h LEU 359 N 0.14 0.44 -0.48 2.94 6.46 -1.19 -2.53 115.31 121.09 3b6r h LEU 359 Ca 0.10 -0.35 -0.08 0.00 -0.12 0.00 0.00 57.88 57.42 3b6r h LEU 359 Cb 0.21 -0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 39.98 3b6r h LEU 359 CO -0.01 1.16 -0.00 -0.07 -0.62 0.00 0.00 178.44 178.89 3b6r h LEU 360 N 0.19 0.84 -1.07 2.25 3.38 -0.21 -1.53 115.31 119.16 3b6r h LEU 360 Ca -0.07 -0.31 -0.08 0.00 0.09 0.00 0.00 57.88 57.51 3b6r h LEU 360 Cb 1.56 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.07 3b6r h LEU 360 CO 0.15 0.95 -0.19 0.16 0.09 0.00 0.00 178.44 179.60 3b6r h ILE 361 N 0.71 1.24 0.08 1.22 3.07 -0.94 -1.34 117.51 121.56 3b6r h ILE 361 Ca 0.14 -1.12 -0.00 0.00 1.55 0.00 0.00 64.86 65.43 3b6r h ILE 361 Cb 0.52 1.27 0.00 0.00 -0.27 0.00 0.00 36.82 38.34 3b6r h ILE 361 CO 0.03 0.36 -0.04 -0.08 -1.05 0.00 0.00 178.15 177.36 3b6r h GLU 362 N 0.40 -0.11 -0.87 0.16 4.57 -1.12 0.93 114.58 118.54 3b6r h GLU 362 Ca 0.07 0.01 0.05 0.00 -1.18 0.00 0.00 59.36 58.30 3b6r h GLU 362 Cb 0.56 0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.13 3b6r h GLU 362 CO 0.04 0.13 0.57 0.52 -1.18 0.00 0.00 179.01 179.08 3b6r h MET 363 N -0.33 1.00 -0.03 1.92 2.86 -1.10 -2.25 114.93 117.02 3b6r h MET 363 Ca -0.01 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 3b6r h MET 363 Cb 0.28 -0.23 -0.00 0.00 0.06 0.00 0.00 31.60 31.72 3b6r h MET 363 CO 0.02 0.66 -0.00 1.49 1.06 0.00 0.00 176.91 180.14 3b6r h GLU 364 N 1.03 0.05 -0.36 1.72 4.57 -0.99 -0.95 114.58 119.65 3b6r h GLU 364 Ca 0.36 -0.02 0.10 0.00 -1.18 0.00 0.00 59.36 58.62 3b6r h GLU 364 Cb 0.10 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 3b6r h GLU 364 CO -0.12 0.37 0.26 1.96 -1.18 0.00 0.00 179.01 180.30 3b6r h GLN 365 N -0.28 0.00 0.17 1.92 4.20 -0.41 -0.93 115.11 119.78 3b6r h GLN 365 Ca 0.01 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.38 3b6r h GLN 365 Cb 0.35 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.13 3b6r h GLN 365 CO 0.00 0.00 -1.69 0.00 -0.67 0.00 0.00 178.83 176.47 3b6r h ARG 366 N 0.00 0.36 -0.08 1.46 3.08 -1.29 -3.27 114.38 114.64 3b6r h ARG 366 Ca 0.17 -0.61 -0.03 0.00 0.07 0.00 0.00 59.98 59.58 3b6r h ARG 366 Cb 0.69 0.23 -0.01 0.00 0.08 0.00 0.00 29.97 30.96 3b6r h ARG 366 CO -0.00 1.26 -0.08 -0.07 -1.07 0.00 0.00 179.97 180.01 3b6r h LEU 367 N 0.10 0.10 0.00 3.04 3.38 -0.41 0.67 115.31 122.19 3b6r h LEU 367 Ca -0.32 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3b6r h LEU 367 Cb 2.08 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.80 3b6r h LEU 367 CO 0.18 0.20 0.00 -1.84 0.09 0.00 0.00 178.44 177.07 3b6r n GLU 368 N -4.38 0.44 -0.23 1.13 0.28 -0.43 -2.67 120.64 114.79 3b6r n GLU 368 Ca -0.02 0.01 0.08 0.00 -0.16 0.00 0.00 57.16 57.08 3b6r n GLU 368 Cb 0.19 -1.50 0.17 0.00 1.43 0.00 0.00 31.44 31.74 3b6r n GLU 368 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3b6r n GLN 369 N -1.27 2.34 -0.06 3.44 6.02 0.12 -4.95 117.38 123.02 3b6r n GLN 369 Ca 0.14 -2.49 0.00 0.00 -0.01 0.00 0.00 57.00 54.64 3b6r n GLN 369 Cb 0.22 -1.55 0.00 0.00 1.02 0.00 0.00 30.24 29.93 3b6r n GLN 369 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3b6r n GLY 370 N -0.72 1.24 2.25 1.08 0.00 -0.99 -4.85 105.19 103.21 3b6r n GLY 370 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3b6r n GLY 370 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3b6r n GLN 371 N -2.00 3.39 -1.53 1.61 6.02 -0.59 -4.90 117.38 119.38 3b6r n GLN 371 Ca 0.00 -1.98 -0.31 0.00 -0.01 0.00 0.00 57.00 54.70 3b6r n GLN 371 Cb 0.00 -2.64 -0.10 0.00 1.02 0.00 0.00 30.24 28.51 3b6r n GLN 371 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3b6r n ALA 372 N 3.35 0.61 -2.49 -1.58 0.00 -1.26 -4.43 120.51 114.70 3b6r n ALA 372 Ca 0.72 -0.82 -0.36 0.00 0.00 0.00 0.00 53.44 52.98 3b6r n ALA 372 Cb 0.36 -2.83 -0.06 0.00 0.00 0.00 0.00 19.45 16.93 3b6r n ALA 372 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 3b6r s ILE 373 N 9.95 5.01 0.00 0.00 1.10 -1.26 -4.97 121.20 131.03 3b6r s ILE 373 Ca 1.13 0.66 0.00 0.00 -0.51 0.00 0.00 60.65 61.94 3b6r s ILE 373 Cb -0.59 -3.69 0.00 0.00 0.15 0.00 0.00 42.46 38.33 3b6r s ILE 373 CO 0.34 0.36 0.29 -0.90 -2.11 0.00 0.00 174.94 172.92 3b6r n ASP 374 N 1.13 0.58 0.07 4.50 5.68 -1.26 -4.68 116.55 122.56 3b6r n ASP 374 Ca -0.09 -0.90 -0.06 0.00 -0.50 0.00 0.00 54.79 53.23 3b6r n ASP 374 Cb 0.52 0.10 -0.11 0.00 -1.14 0.00 0.00 41.12 40.49 3b6r n ASP 374 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 3b6r h ASP 375 N 0.00 0.00 0.20 -1.12 2.03 -2.00 -3.13 116.42 112.40 3b6r h ASP 375 Ca 0.00 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3b6r h ASP 375 Cb 0.14 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.64 3b6r h ASP 375 CO 0.00 0.96 -0.01 -0.07 -1.03 0.00 0.00 179.24 179.09 3b6r h LEU 376 N 0.00 0.00 -8.75 0.15 3.38 -2.01 -3.43 115.31 104.65 3b6r h LEU 376 Ca -0.01 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 57.24 3b6r h LEU 376 Cb 1.74 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.48 3b6r h LEU 376 CO 0.12 0.01 1.16 0.80 0.09 0.00 0.00 178.44 180.62 3b6r n MET 377 N -3.25 0.94 -2.30 1.13 1.56 -1.19 -4.93 117.12 109.09 3b6r n MET 377 Ca -0.02 0.31 -0.25 0.00 -0.27 0.00 0.00 57.70 57.46 3b6r n MET 377 Cb 0.13 -2.14 0.09 0.00 2.15 0.00 0.00 33.22 33.45 3b6r n MET 377 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 3b6r s PRO 378 N 4.91 1.91 -0.01 2.12 0.04 -1.26 -5.07 135.00 137.63 3b6r s PRO 378 Ca 1.06 -0.52 -0.18 0.00 0.04 0.00 0.00 61.00 61.40 3b6r s PRO 378 Cb -1.06 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 31.23 3b6r s PRO 378 CO 0.60 -1.38 0.51 0.00 0.04 0.00 0.00 177.00 176.77 3b6r s ALA 379 N -3.26 3.56 -0.19 8.56 0.00 -1.26 -4.99 121.76 124.18 3b6r s ALA 379 Ca 0.63 -0.08 -0.34 0.00 0.00 0.00 0.00 51.96 52.16 3b6r s ALA 379 Cb -0.09 -2.61 -0.11 0.00 0.00 0.00 0.00 23.12 20.32 3b6r s ALA 379 CO 0.45 0.26 1.99 0.94 0.00 0.00 0.00 175.76 179.40 3b6r n GLN 380 N 2.50 1.76 0.00 0.00 7.27 -1.26 -4.84 117.38 122.81 3b6r n GLN 380 Ca -0.09 0.60 0.10 0.00 0.07 0.00 0.00 57.00 57.68 3b6r n GLN 380 Cb 0.51 -2.62 0.62 0.00 2.41 0.00 0.00 30.24 31.17 3b6r n GLN 380 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76