#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kbi n PRO 2 N 0.00 -0.45 -2.62 3.49 -0.02 -1.26 -4.90 135.00 129.24 1kbi n PRO 2 Ca 0.00 -0.07 -0.43 0.00 -2.02 0.00 0.00 63.50 60.98 1kbi n PRO 2 Cb 0.00 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1kbi n PRO 2 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1kbi n LYS 3 N -3.67 3.72 -3.31 -0.52 5.02 -1.26 -4.99 118.16 113.16 1kbi n LYS 3 Ca 0.11 -3.82 -0.31 0.00 -2.02 0.00 0.00 58.31 52.27 1kbi n LYS 3 Cb 0.52 -2.85 -0.05 0.00 -0.02 0.00 0.00 35.03 32.63 1kbi n LYS 3 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1kbi s LEU 4 N -0.34 4.10 -0.58 -0.35 2.01 -1.26 -5.03 118.68 117.23 1kbi s LEU 4 Ca 0.38 0.95 -0.24 0.00 0.01 0.00 0.00 54.13 55.24 1kbi s LEU 4 Cb 0.05 -3.74 0.05 0.00 0.01 0.00 0.00 46.19 42.56 1kbi s LEU 4 CO 0.02 -0.14 0.94 -0.62 1.01 0.00 0.00 176.35 177.55 1kbi s ASP 5 N -2.57 6.29 0.00 2.29 2.15 -1.26 -4.89 116.67 118.68 1kbi s ASP 5 Ca 0.48 -0.54 0.00 0.00 0.43 0.00 0.00 52.55 52.92 1kbi s ASP 5 Cb -0.11 -2.43 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1kbi s ASP 5 CO 0.23 -1.27 0.63 0.23 -0.17 0.00 0.00 175.17 174.82 1kbi n MET 6 N 7.49 0.82 -3.21 4.34 2.81 -1.26 -4.01 117.12 124.10 1kbi n MET 6 Ca -0.00 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.60 1kbi n MET 6 Cb 0.47 -1.19 -0.06 0.00 -0.71 0.00 0.00 33.22 31.73 1kbi n MET 6 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1kbi n ASN 7 N -0.23 4.29 -3.91 7.83 5.03 -1.26 -4.95 115.26 122.07 1kbi n ASN 7 Ca 0.00 -3.53 -0.10 0.00 0.87 0.00 0.00 54.58 51.82 1kbi n ASN 7 Cb 0.10 -0.69 -0.10 0.00 -1.02 0.00 0.00 39.78 38.07 1kbi n ASN 7 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1kbi s LYS 8 N -2.89 0.52 -0.37 3.52 1.02 -1.26 -5.09 119.74 115.19 1kbi s LYS 8 Ca 0.42 -0.60 -0.39 0.00 0.02 0.00 0.00 55.97 55.43 1kbi s LYS 8 Cb 0.19 0.21 -0.14 0.00 -0.52 0.00 0.00 37.83 37.56 1kbi s LYS 8 CO -0.05 -0.13 2.07 1.04 -0.92 0.00 0.00 175.35 177.36 1kbi n GLN 9 N 1.12 0.81 -0.81 1.68 6.02 -1.26 -4.52 117.38 120.42 1kbi n GLN 9 Ca -0.21 0.24 -0.33 0.00 -0.01 0.00 0.00 57.00 56.69 1kbi n GLN 9 Cb 0.57 -2.13 0.11 0.00 1.02 0.00 0.00 30.24 29.82 1kbi n GLN 9 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1kbi n LYS 10 N 7.33 -0.29 -4.37 -1.09 4.76 -1.26 -4.54 118.16 118.69 1kbi n LYS 10 Ca 0.41 -0.05 -0.19 0.00 -2.87 0.00 0.00 58.31 55.61 1kbi n LYS 10 Cb 0.13 -1.78 -0.10 0.00 -1.84 0.00 0.00 35.03 31.45 1kbi n LYS 10 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1kbi s ILE 11 N -2.36 1.82 0.03 -0.18 1.01 0.13 -4.94 121.20 116.71 1kbi s ILE 11 Ca 0.55 -2.23 0.05 0.00 0.00 0.00 0.00 60.65 59.02 1kbi s ILE 11 Cb -0.21 -2.12 -0.03 0.00 0.01 0.00 0.00 42.46 40.11 1kbi s ILE 11 CO 0.69 -0.54 -0.11 -0.94 0.00 0.00 0.00 174.94 174.04 1kbi s SER 12 N -3.35 4.34 0.00 3.58 1.04 -1.26 0.48 113.70 118.52 1kbi s SER 12 Ca 0.24 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.41 1kbi s SER 12 Cb -0.01 -0.90 0.00 0.00 0.10 0.00 0.00 66.02 65.21 1kbi s SER 12 CO 0.08 0.26 0.29 -2.65 0.98 0.00 0.00 173.24 172.20 1kbi n PRO 13 N 1.45 0.00 -0.05 4.02 -0.02 -1.26 -1.01 135.00 138.12 1kbi n PRO 13 Ca -0.15 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.25 1kbi n PRO 13 Cb 0.52 -1.45 -0.04 0.00 -0.02 0.00 0.00 33.50 32.51 1kbi n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1kbi n ALA 14 N -0.77 1.91 0.64 3.55 0.00 -1.26 -3.99 120.51 120.59 1kbi n ALA 14 Ca 0.00 -0.43 0.08 0.00 0.00 0.00 0.00 53.44 53.09 1kbi n ALA 14 Cb 0.00 0.29 0.37 0.00 0.00 0.00 0.00 19.45 20.11 1kbi n ALA 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1kbi n GLU 15 N -2.97 0.08 -0.09 0.00 -0.58 -0.18 -2.81 120.64 114.09 1kbi n GLU 15 Ca -0.19 0.19 -0.10 0.00 -0.42 0.00 0.00 57.16 56.64 1kbi n GLU 15 Cb 0.68 -1.50 -0.04 0.00 -0.57 0.00 0.00 31.44 30.02 1kbi n GLU 15 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1kbi n VAL 16 N -1.42 1.47 0.24 2.62 0.31 -0.97 -4.20 118.33 116.39 1kbi n VAL 16 Ca 0.05 0.12 0.06 0.00 -0.01 0.00 0.00 64.34 64.56 1kbi n VAL 16 Cb 0.17 -2.31 0.35 0.00 -0.91 0.00 0.00 33.84 31.13 1kbi n VAL 16 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1kbi h ALA 17 N -0.97 1.45 0.54 3.52 0.00 -1.55 -0.08 119.26 122.18 1kbi h ALA 17 Ca -0.08 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 1kbi h ALA 17 Cb 0.89 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.68 1kbi h ALA 17 CO -0.05 -0.45 -0.26 0.87 0.00 0.00 0.00 179.25 179.36 1kbi h LYS 18 N 0.00 -0.70 -5.51 0.00 1.57 -1.69 -3.39 116.57 106.85 1kbi h LYS 18 Ca 0.00 0.05 -0.37 0.00 -1.87 0.00 0.00 60.65 58.46 1kbi h LYS 18 Cb 1.07 0.16 -0.04 0.00 0.08 0.00 0.00 32.23 33.49 1kbi h LYS 18 CO 0.00 -0.43 1.20 -1.01 -0.57 0.00 0.00 179.45 178.63 1kbi s HIS 19 N -4.20 2.04 -0.19 -1.35 3.76 -0.04 -4.59 115.29 110.72 1kbi s HIS 19 Ca -0.12 0.23 0.14 0.00 -0.15 0.00 0.00 55.06 55.17 1kbi s HIS 19 Cb 0.01 -4.08 0.44 0.00 1.11 0.00 0.00 32.58 30.06 1kbi s HIS 19 CO 0.38 -1.27 1.19 0.27 -0.85 0.00 0.00 174.74 174.46 1kbi n ASN 20 N 13.73 2.35 -4.32 1.40 2.04 -1.13 -1.76 115.26 127.56 1kbi n ASN 20 Ca 0.45 -3.27 -0.29 0.00 -0.44 0.00 0.00 54.58 51.04 1kbi n ASN 20 Cb 0.46 -0.43 -0.15 0.00 -2.53 0.00 0.00 39.78 37.14 1kbi n ASN 20 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1kbi s LYS 21 N -2.74 1.71 0.59 -3.83 1.02 -0.83 -4.77 119.74 110.89 1kbi s LYS 21 Ca 0.39 -1.05 0.32 0.00 0.02 0.00 0.00 55.97 55.65 1kbi s LYS 21 Cb 0.38 -1.86 1.19 0.00 -0.52 0.00 0.00 37.83 37.02 1kbi s LYS 21 CO -0.06 0.48 1.46 -1.35 -0.92 0.00 0.00 175.35 174.96 1kbi h PRO 22 N 4.87 0.00 -0.02 -1.68 0.11 -1.97 0.53 132.00 133.84 1kbi h PRO 22 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1kbi h PRO 22 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1kbi h PRO 22 CO 0.44 0.00 -0.03 -0.40 -0.21 0.00 0.00 178.00 177.80 1kbi n ASP 23 N -3.48 2.12 -3.08 -2.05 5.75 -1.26 -4.65 116.55 109.90 1kbi n ASP 23 Ca 0.26 -1.56 -0.16 0.00 -0.01 0.00 0.00 54.79 53.32 1kbi n ASP 23 Cb 1.51 0.05 -0.04 0.00 -1.03 0.00 0.00 41.12 41.60 1kbi n ASP 23 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1kbi n ASP 24 N 0.71 -1.83 -4.38 -1.12 4.64 0.18 -4.98 116.55 109.76 1kbi n ASP 24 Ca 0.08 -2.67 -0.36 0.00 -1.38 0.00 0.00 54.79 50.46 1kbi n ASP 24 Cb 0.35 0.54 -0.13 0.00 -1.04 0.00 0.00 41.12 40.84 1kbi n ASP 24 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1kbi s TRP 26 N 1.55 1.73 0.06 0.00 0.52 -0.72 -1.32 118.94 120.74 1kbi s TRP 26 Ca 0.06 -0.37 -0.05 0.00 0.02 0.00 0.00 56.10 55.75 1kbi s TRP 26 Cb -0.15 -1.02 -0.02 0.00 -1.15 0.00 0.00 33.47 31.13 1kbi s TRP 26 CO 0.01 0.09 0.10 0.54 0.02 0.00 0.00 176.95 177.70 1kbi s VAL 27 N -0.82 0.16 -0.09 4.03 0.11 -0.49 0.13 120.40 123.44 1kbi s VAL 27 Ca 0.07 -1.32 0.04 0.00 -2.93 0.00 0.00 61.98 57.83 1kbi s VAL 27 Cb -0.09 -1.23 -0.01 0.00 -1.53 0.00 0.00 36.38 33.52 1kbi s VAL 27 CO 0.02 -0.73 -0.21 0.68 -3.33 0.00 0.00 175.10 171.53 1kbi s VAL 28 N -3.43 2.42 -0.16 2.04 -7.23 -0.91 -1.03 120.40 112.11 1kbi s VAL 28 Ca 0.02 -0.91 -0.01 0.00 -1.81 0.00 0.00 61.98 59.27 1kbi s VAL 28 Cb 0.04 -1.94 0.04 0.00 0.56 0.00 0.00 36.38 35.08 1kbi s VAL 28 CO -0.08 0.56 -0.03 -0.63 -0.31 0.00 0.00 175.10 174.61 1kbi s ILE 29 N 0.04 0.91 -0.99 -0.62 1.01 -0.66 -1.36 121.20 119.53 1kbi s ILE 29 Ca -0.08 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 59.91 1kbi s ILE 29 Cb -0.15 -1.15 -0.00 0.00 0.01 0.00 0.00 42.46 41.17 1kbi s ILE 29 CO 0.05 0.08 0.72 0.59 0.00 0.00 0.00 174.94 176.38 1kbi n ASN 30 N 4.94 -5.61 -1.64 3.58 5.03 -1.26 -2.47 115.26 117.83 1kbi n ASN 30 Ca -0.11 -0.85 -0.19 0.00 0.87 0.00 0.00 54.58 54.31 1kbi n ASN 30 Cb 0.48 -3.21 -0.07 0.00 -1.02 0.00 0.00 39.78 35.96 1kbi n ASN 30 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1kbi n GLY 31 N -1.72 1.53 3.22 7.41 0.00 -1.26 -4.97 105.19 109.40 1kbi n GLY 31 Ca -0.13 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.71 1kbi n GLY 31 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1kbi s TYR 32 N -2.63 1.33 -0.09 1.61 5.04 -1.03 -1.66 117.35 119.92 1kbi s TYR 32 Ca 0.00 -0.55 -0.00 0.00 -2.44 0.00 0.00 57.07 54.08 1kbi s TYR 32 Cb 0.00 -0.71 -0.03 0.00 0.35 0.00 0.00 41.96 41.57 1kbi s TYR 32 CO 0.00 0.11 -0.07 0.08 -1.34 0.00 0.00 175.55 174.33 1kbi s VAL 33 N -1.99 3.71 0.02 3.14 1.01 -0.31 -1.65 120.40 124.32 1kbi s VAL 33 Ca 0.06 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.61 1kbi s VAL 33 Cb -0.06 -2.54 -0.01 0.00 0.00 0.00 0.00 36.38 33.77 1kbi s VAL 33 CO 0.02 0.57 -0.10 -0.31 0.00 0.00 0.00 175.10 175.29 1kbi s TYR 34 N -0.47 0.85 -0.56 5.22 2.02 -0.19 -1.41 117.35 122.81 1kbi s TYR 34 Ca 0.07 -0.27 -0.19 0.00 -0.37 0.00 0.00 57.07 56.32 1kbi s TYR 34 Cb -0.12 -0.53 0.09 0.00 -0.40 0.00 0.00 41.96 41.00 1kbi s TYR 34 CO 0.02 -0.01 0.67 0.34 -1.57 0.00 0.00 175.55 174.99 1kbi s ASP 35 N -0.72 6.19 0.00 2.29 3.68 0.08 -1.40 116.67 126.80 1kbi s ASP 35 Ca 0.00 -1.29 0.22 0.00 2.13 0.00 0.00 52.55 53.62 1kbi s ASP 35 Cb -0.06 -2.29 0.62 0.00 -1.45 0.00 0.00 42.92 39.74 1kbi s ASP 35 CO 0.00 -1.03 1.52 0.18 0.13 0.00 0.00 175.17 175.97 1kbi n LEU 36 N 6.22 3.78 0.02 -1.34 4.32 -0.44 -4.61 117.00 124.96 1kbi n LEU 36 Ca -0.09 -1.88 -0.10 0.00 -0.02 0.00 0.00 56.01 53.92 1kbi n LEU 36 Cb 0.43 -0.46 -0.04 0.00 -1.62 0.00 0.00 43.42 41.73 1kbi n LEU 36 CO 0.57 0.94 0.77 0.74 -1.22 0.00 0.00 177.39 179.19 1kbi h THR 37 N 4.17 0.65 0.00 -5.08 2.02 -1.85 -1.26 112.91 111.56 1kbi h THR 37 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1kbi h THR 37 Cb 0.95 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.00 1kbi h THR 37 CO 0.00 0.00 -0.28 -0.09 0.37 0.00 0.00 175.52 175.52 1kbi h ARG 38 N -0.19 0.00 0.11 6.66 9.65 -1.91 -3.31 114.38 125.38 1kbi h ARG 38 Ca 0.07 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.95 1kbi h ARG 38 Cb 0.29 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1kbi h ARG 38 CO -0.18 0.28 -0.05 0.35 2.80 0.00 0.00 179.97 183.16 1kbi h PHE 39 N 0.00 -0.13 -1.00 2.20 3.57 -1.67 -3.38 116.94 116.53 1kbi h PHE 39 Ca -0.00 -0.00 0.39 0.00 3.53 0.00 0.00 57.97 61.89 1kbi h PHE 39 Cb 0.64 0.04 -0.17 0.00 2.79 0.00 0.00 35.95 39.25 1kbi h PHE 39 CO 0.00 0.38 0.52 1.37 -2.23 0.00 0.00 178.31 178.35 1kbi h LEU 40 N -0.81 0.33 -0.48 0.59 -0.00 -1.35 0.40 115.31 113.98 1kbi h LEU 40 Ca -0.01 0.24 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 1kbi h LEU 40 Cb 0.57 0.25 0.00 0.00 -0.00 0.00 0.00 40.66 41.48 1kbi h LEU 40 CO 0.02 -0.37 0.00 -0.81 -0.00 0.00 0.00 178.44 177.29 1kbi n PRO 41 N -5.22 0.06 0.00 0.17 -0.04 -1.26 -1.52 135.00 127.19 1kbi n PRO 41 Ca 0.36 0.50 0.04 0.00 -0.04 0.00 0.00 63.50 64.36 1kbi n PRO 41 Cb 1.20 -1.67 0.02 0.00 -0.04 0.00 0.00 33.50 33.01 1kbi n PRO 41 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1kbi n ASN 42 N -1.79 1.36 -4.68 3.54 3.02 0.14 -4.75 115.26 112.10 1kbi n ASN 42 Ca 0.00 -1.18 -0.50 0.00 -0.03 0.00 0.00 54.58 52.87 1kbi n ASN 42 Cb 0.05 0.24 -0.05 0.00 -0.61 0.00 0.00 39.78 39.41 1kbi n ASN 42 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1kbi n HIS 43 N 0.07 2.22 0.25 3.10 -0.00 -0.57 -4.64 115.22 115.65 1kbi n HIS 43 Ca 0.04 0.18 0.15 0.00 -0.00 0.00 0.00 57.72 58.09 1kbi n HIS 43 Cb 0.18 -2.59 0.85 0.00 -0.00 0.00 0.00 29.99 28.43 1kbi n HIS 43 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1kbi h PRO 44 N 8.09 0.00 -0.18 1.57 0.11 -1.94 -0.76 132.00 138.90 1kbi h PRO 44 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1kbi h PRO 44 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1kbi h PRO 44 CO 0.93 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.13 1kbi n GLY 45 N -1.39 0.15 0.00 -0.55 0.00 -1.26 -5.01 105.19 97.14 1kbi n GLY 45 Ca -0.01 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1kbi n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kbi n GLY 46 N 1.04 2.11 0.10 -0.02 0.00 -0.29 -4.74 105.19 103.39 1kbi n GLY 46 Ca 0.14 -1.65 -0.06 0.00 0.00 0.00 0.00 46.02 44.46 1kbi n GLY 46 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1kbi h GLN 47 N 0.00 0.04 -0.71 1.61 3.07 -1.78 -3.34 115.11 114.00 1kbi h GLN 47 Ca 0.00 -0.05 0.15 0.00 0.09 0.00 0.00 58.65 58.84 1kbi h GLN 47 Cb 0.00 0.01 -0.10 0.00 0.08 0.00 0.00 27.48 27.47 1kbi h GLN 47 CO 0.00 0.87 0.20 -0.44 0.09 0.00 0.00 178.83 179.54 1kbi h ASP 48 N 0.02 0.07 0.24 0.06 3.32 -1.90 0.31 116.42 118.54 1kbi h ASP 48 Ca -0.02 0.13 -0.06 0.00 0.02 0.00 0.00 57.03 57.11 1kbi h ASP 48 Cb 1.49 0.16 -0.01 0.00 0.22 0.00 0.00 39.33 41.20 1kbi h ASP 48 CO 0.12 0.00 -0.26 1.62 -1.72 0.00 0.00 179.24 178.99 1kbi h VAL 49 N 0.30 1.20 0.11 -1.35 3.04 -1.85 -1.41 116.25 116.29 1kbi h VAL 49 Ca 0.40 -0.95 -0.17 0.00 -1.01 0.00 0.00 66.70 64.97 1kbi h VAL 49 Cb 0.65 1.48 0.01 0.00 -2.01 0.00 0.00 31.29 31.42 1kbi h VAL 49 CO -0.47 0.27 -0.78 0.40 -1.01 0.00 0.00 177.57 175.99 1kbi h ILE 50 N 0.04 1.46 -0.16 3.17 2.04 -1.46 -3.33 117.51 119.27 1kbi h ILE 50 Ca 0.00 -2.47 0.04 0.00 1.00 0.00 0.00 64.86 63.44 1kbi h ILE 50 Cb 0.49 3.12 -0.07 0.00 -0.74 0.00 0.00 36.82 39.62 1kbi h ILE 50 CO 0.04 0.68 -0.48 0.11 0.00 0.00 0.00 178.15 178.50 1kbi h LYS 51 N -0.50 -0.50 -0.75 2.37 1.57 -0.21 -2.35 116.57 116.21 1kbi h LYS 51 Ca -0.15 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1kbi h LYS 51 Cb 1.53 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.95 1kbi h LYS 51 CO 0.09 -0.33 0.00 1.19 -0.57 0.00 0.00 179.45 179.83 1kbi n PHE 52 N -5.44 0.00 -2.05 -1.35 0.99 -0.55 -2.42 117.46 106.65 1kbi n PHE 52 Ca -0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 57.45 57.40 1kbi n PHE 52 Cb 0.37 -0.07 -0.00 0.00 -1.00 0.00 0.00 39.48 38.77 1kbi n PHE 52 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.76 176.85 1kbi n ASN 53 N 0.10 0.03 -4.78 4.37 5.03 -0.92 -5.05 115.26 114.04 1kbi n ASN 53 Ca 0.00 -1.65 -0.33 0.00 0.87 0.00 0.00 54.58 53.46 1kbi n ASN 53 Cb 0.19 -0.11 0.02 0.00 -1.02 0.00 0.00 39.78 38.86 1kbi n ASN 53 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1kbi s ALA 54 N 0.00 2.65 0.00 5.41 0.00 -0.99 -3.25 121.76 125.58 1kbi s ALA 54 Ca 0.03 0.57 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1kbi s ALA 54 Cb 0.04 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1kbi s ALA 54 CO -0.02 -0.91 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1kbi n GLY 55 N -0.48 2.01 4.03 0.00 0.00 0.36 -4.59 105.19 106.52 1kbi n GLY 55 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 1kbi n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kbi s LYS 56 N 0.00 2.39 -0.26 1.61 1.02 -1.20 -3.34 119.74 119.96 1kbi s LYS 56 Ca 0.00 -1.54 -0.18 0.00 0.02 0.00 0.00 55.97 54.27 1kbi s LYS 56 Cb 0.00 -2.66 -0.03 0.00 -0.52 0.00 0.00 37.83 34.63 1kbi s LYS 56 CO 0.00 -0.76 0.52 0.34 -0.92 0.00 0.00 175.35 174.53 1kbi s ASP 57 N -4.61 6.44 0.00 2.83 -1.08 0.64 -2.13 116.67 118.76 1kbi s ASP 57 Ca 0.61 0.52 0.06 0.00 -0.52 0.00 0.00 52.55 53.22 1kbi s ASP 57 Cb -0.07 -2.28 0.14 0.00 -1.46 0.00 0.00 42.92 39.26 1kbi s ASP 57 CO 0.38 -0.30 1.03 0.55 0.52 0.00 0.00 175.17 177.35 1kbi n VAL 58 N 5.17 0.74 -0.32 1.11 3.14 -0.46 0.46 118.33 128.16 1kbi n VAL 58 Ca -0.04 -0.87 0.22 0.00 -2.96 0.00 0.00 64.34 60.69 1kbi n VAL 58 Cb 0.50 0.67 0.42 0.00 -1.06 0.00 0.00 33.84 34.36 1kbi n VAL 58 CO 0.00 0.00 0.00 0.74 -6.46 0.00 0.00 176.83 171.11 1kbi h THR 59 N 1.20 0.13 0.00 1.55 2.02 -1.89 0.33 112.91 116.25 1kbi h THR 59 Ca 0.00 -0.04 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1kbi h THR 59 Cb 0.54 0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 66.96 1kbi h THR 59 CO 0.00 0.02 -0.14 0.00 0.37 0.00 0.00 175.52 175.77 1kbi h ALA 60 N 1.92 1.21 0.00 6.16 0.00 -1.86 0.26 119.26 126.96 1kbi h ALA 60 Ca 0.70 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 55.33 1kbi h ALA 60 Cb 1.62 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.37 1kbi h ALA 60 CO -0.76 0.17 -0.83 0.82 0.00 0.00 0.00 179.25 178.65 1kbi h ILE 61 N 0.00 1.12 0.71 0.00 2.04 -0.58 -3.38 117.51 117.42 1kbi h ILE 61 Ca -0.00 -2.16 -0.03 0.00 1.00 0.00 0.00 64.86 63.67 1kbi h ILE 61 Cb 0.42 2.44 0.01 0.00 -0.74 0.00 0.00 36.82 38.94 1kbi h ILE 61 CO 0.02 0.38 -0.34 0.15 0.00 0.00 0.00 178.15 178.36 1kbi h PHE 62 N -1.00 -0.88 -0.85 1.37 3.57 -1.04 -3.37 116.94 114.74 1kbi h PHE 62 Ca -0.22 -0.02 0.15 0.00 3.53 0.00 0.00 57.97 61.40 1kbi h PHE 62 Cb 1.16 0.29 -0.15 0.00 2.79 0.00 0.00 35.95 40.04 1kbi h PHE 62 CO 0.14 -0.55 -0.31 1.49 -2.23 0.00 0.00 178.31 176.85 1kbi h GLU 63 N -1.05 -0.04 0.00 1.11 4.57 -1.19 -1.34 114.58 116.64 1kbi h GLU 63 Ca -0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1kbi h GLU 63 Cb 0.73 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.33 1kbi h GLU 63 CO 0.16 -0.03 0.00 -0.35 -1.18 0.00 0.00 179.01 177.61 1kbi n PRO 64 N -5.50 0.53 -0.01 0.92 -0.04 -1.26 -3.77 135.00 125.88 1kbi n PRO 64 Ca 0.10 0.04 0.01 0.00 -0.04 0.00 0.00 63.50 63.61 1kbi n PRO 64 Cb 0.41 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.38 1kbi n PRO 64 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1kbi n LEU 65 N -1.14 1.35 -4.37 1.53 4.77 -0.52 -4.78 117.00 113.85 1kbi n LEU 65 Ca 0.14 -1.16 -0.23 0.00 -0.03 0.00 0.00 56.01 54.74 1kbi n LEU 65 Cb 0.13 -0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 41.10 1kbi n LEU 65 CO 0.15 0.32 -0.49 -1.00 -1.33 0.00 0.00 177.39 175.04 1kbi s HIS 66 N -0.32 1.96 0.48 -1.77 3.76 -1.16 -4.75 115.29 113.49 1kbi s HIS 66 Ca 0.03 -0.44 -0.22 0.00 -0.15 0.00 0.00 55.06 54.28 1kbi s HIS 66 Cb 0.02 -0.95 -0.07 0.00 1.11 0.00 0.00 32.58 32.69 1kbi s HIS 66 CO 0.03 0.42 1.18 0.00 -0.85 0.00 0.00 174.74 175.52 1kbi s ALA 67 N -2.14 2.91 0.57 -1.40 0.00 -0.76 -4.70 121.76 116.23 1kbi s ALA 67 Ca 0.19 0.96 0.43 0.00 0.00 0.00 0.00 51.96 53.54 1kbi s ALA 67 Cb -0.05 -3.40 2.27 0.00 0.00 0.00 0.00 23.12 21.94 1kbi s ALA 67 CO 0.08 -0.76 2.30 -1.35 0.00 0.00 0.00 175.76 176.04 1kbi h PRO 68 N 1.84 0.00 -0.46 0.00 0.11 -1.89 -3.09 132.00 128.51 1kbi h PRO 68 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1kbi h PRO 68 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1kbi h PRO 68 CO 0.59 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.65 1kbi n ASN 69 N -3.04 3.58 0.01 -2.05 2.04 -1.26 -4.65 115.26 109.89 1kbi n ASN 69 Ca -0.03 -2.00 -0.07 0.00 -0.44 0.00 0.00 54.58 52.05 1kbi n ASN 69 Cb 0.09 -0.30 0.10 0.00 -2.53 0.00 0.00 39.78 37.15 1kbi n ASN 69 CO 0.00 0.00 0.00 -0.37 -0.44 0.00 0.00 177.26 176.45 1kbi h VAL 70 N 4.47 1.31 -0.28 3.53 -1.51 -1.93 -1.20 116.25 120.64 1kbi h VAL 70 Ca 0.00 -1.64 -0.15 0.00 -1.23 0.00 0.00 66.70 63.68 1kbi h VAL 70 Cb 0.99 1.64 -0.01 0.00 -2.13 0.00 0.00 31.29 31.79 1kbi h VAL 70 CO 0.00 0.51 -0.44 0.40 -1.23 0.00 0.00 177.57 176.81 1kbi h ILE 71 N 0.42 1.29 0.24 7.19 2.04 -1.86 0.12 117.51 126.95 1kbi h ILE 71 Ca 0.03 -1.63 -0.01 0.00 1.00 0.00 0.00 64.86 64.24 1kbi h ILE 71 Cb 0.95 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.58 1kbi h ILE 71 CO 0.08 0.53 -0.13 0.44 0.00 0.00 0.00 178.15 179.07 1kbi h ASP 72 N 0.58 -0.32 0.14 1.72 3.45 -1.85 -2.64 116.42 117.51 1kbi h ASP 72 Ca 0.04 0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.49 1kbi h ASP 72 Cb 1.00 0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 39.85 1kbi h ASP 72 CO 0.09 -0.21 -0.09 0.11 -1.57 0.00 0.00 179.24 177.57 1kbi h LYS 73 N -0.34 0.00 0.00 3.56 6.56 -1.26 -3.36 116.57 121.73 1kbi h LYS 73 Ca -0.03 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1kbi h LYS 73 Cb 0.27 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.93 1kbi h LYS 73 CO 0.04 0.09 0.00 0.66 -2.06 0.00 0.00 179.45 178.18 1kbi n TYR 74 N -4.09 0.00 -4.26 -1.35 4.02 0.03 -5.01 117.16 106.51 1kbi n TYR 74 Ca -0.03 0.00 -0.35 0.00 -0.01 0.00 0.00 57.90 57.52 1kbi n TYR 74 Cb 0.17 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.40 1kbi n TYR 74 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1kbi s ILE 75 N -0.45 4.49 0.24 -0.72 -1.09 -1.00 -5.03 121.20 117.65 1kbi s ILE 75 Ca 0.00 -0.17 -0.30 0.00 -2.23 0.00 0.00 60.65 57.95 1kbi s ILE 75 Cb 0.00 -2.93 -0.10 0.00 -1.58 0.00 0.00 42.46 37.85 1kbi s ILE 75 CO 0.00 0.57 1.38 0.00 -1.23 0.00 0.00 174.94 175.66 1kbi s ALA 76 N -0.56 3.57 0.22 9.38 0.00 -1.26 -4.85 121.76 128.26 1kbi s ALA 76 Ca 0.10 1.24 -0.10 0.00 0.00 0.00 0.00 51.96 53.20 1kbi s ALA 76 Cb -0.12 -3.52 0.32 0.00 0.00 0.00 0.00 23.12 19.80 1kbi s ALA 76 CO 0.02 -0.65 1.68 -1.00 0.00 0.00 0.00 175.76 175.81 1kbi h PRO 77 N 4.96 0.18 -0.81 0.00 0.13 -1.94 0.26 132.00 134.78 1kbi h PRO 77 Ca -0.46 -0.01 0.21 0.00 -0.87 0.00 0.00 66.00 64.87 1kbi h PRO 77 Cb 1.22 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 1kbi h PRO 77 CO 0.76 0.12 0.56 1.05 -0.23 0.00 0.00 178.00 180.26 1kbi h GLU 78 N 0.19 0.18 0.00 0.86 4.11 -2.00 0.13 114.58 118.05 1kbi h GLU 78 Ca 0.33 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.75 1kbi h GLU 78 Cb 0.53 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1kbi h GLU 78 CO -0.48 0.12 0.00 1.63 0.07 0.00 0.00 179.01 180.35 1kbi n LYS 79 N -4.40 0.13 -2.86 1.06 4.01 0.90 -4.32 118.16 112.67 1kbi n LYS 79 Ca 0.17 0.16 -0.43 0.00 -0.51 0.00 0.00 58.31 57.69 1kbi n LYS 79 Cb 0.76 -1.66 -0.03 0.00 -0.51 0.00 0.00 35.03 33.59 1kbi n LYS 79 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 1kbi s LYS 80 N -3.08 3.45 0.00 1.97 1.02 0.46 -0.74 119.74 122.82 1kbi s LYS 80 Ca 0.11 -1.40 0.00 0.00 0.02 0.00 0.00 55.97 54.70 1kbi s LYS 80 Cb 0.14 -4.75 0.00 0.00 -0.52 0.00 0.00 37.83 32.70 1kbi s LYS 80 CO 0.51 -1.84 0.93 1.28 -0.92 0.00 0.00 175.35 175.32 1kbi n LEU 81 N 7.17 0.00 0.00 3.17 4.77 -0.50 -4.97 117.00 126.64 1kbi n LEU 81 Ca 0.16 0.93 0.00 0.00 -0.03 0.00 0.00 56.01 57.07 1kbi n LEU 81 Cb 0.48 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1kbi n LEU 81 CO 0.56 -0.43 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 1kbi n GLY 82 N -0.94 -1.66 3.77 -0.72 0.00 -1.23 -4.81 105.19 99.59 1kbi n GLY 82 Ca 0.00 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 1kbi n GLY 82 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1kbi s PRO 83 N -1.71 3.75 0.27 1.61 0.02 -1.26 -1.16 135.00 136.52 1kbi s PRO 83 Ca 0.00 2.40 -0.11 0.00 0.02 0.00 0.00 61.00 63.31 1kbi s PRO 83 Cb 0.00 -2.69 -0.07 0.00 0.02 0.00 0.00 34.50 31.75 1kbi s PRO 83 CO 0.00 -0.76 0.61 -1.17 -0.33 0.00 0.00 177.00 175.35 1kbi s LEU 84 N -2.64 4.11 -0.40 -5.54 2.96 -0.66 0.19 118.68 116.69 1kbi s LEU 84 Ca 0.60 1.00 -0.13 0.00 -0.22 0.00 0.00 54.13 55.38 1kbi s LEU 84 Cb -0.43 -3.78 0.04 0.00 0.50 0.00 0.00 46.19 42.51 1kbi s LEU 84 CO 0.56 -0.13 0.27 -1.58 -1.32 0.00 0.00 176.35 174.14 1kbi s GLN 85 N -2.98 2.86 2.37 1.98 2.00 0.18 -4.75 119.66 121.31 1kbi s GLN 85 Ca 0.49 -1.15 0.00 0.00 -2.00 0.00 0.00 55.36 52.70 1kbi s GLN 85 Cb -0.11 -3.86 0.00 0.00 0.80 0.00 0.00 33.01 29.84 1kbi s GLN 85 CO 0.22 -0.79 0.00 0.41 -0.50 0.00 0.00 175.29 174.63 1kbi n GLY 86 N 5.06 0.12 0.00 2.59 0.00 -1.26 -4.29 105.19 107.41 1kbi n GLY 86 Ca -0.11 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.65 1kbi n GLY 86 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1kbi n SER 87 N 1.66 0.00 -3.57 1.61 7.64 -1.26 -4.99 113.62 114.70 1kbi n SER 87 Ca 0.00 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.72 1kbi n SER 87 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 1kbi n SER 87 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1kbi s MET 88 N 4.39 0.94 0.17 1.43 -1.94 -1.26 -4.60 119.30 118.42 1kbi s MET 88 Ca 0.00 0.58 -0.32 0.00 -1.71 0.00 0.00 55.69 54.23 1kbi s MET 88 Cb 0.00 0.45 -0.16 0.00 2.01 0.00 0.00 34.83 37.12 1kbi s MET 88 CO 0.00 -0.22 1.00 -2.30 -0.01 0.00 0.00 175.02 173.49 1kbi n PRO 89 N 1.69 0.77 0.29 2.03 -0.02 -1.26 -4.75 135.00 133.74 1kbi n PRO 89 Ca -0.16 0.27 0.16 0.00 -2.02 0.00 0.00 63.50 61.75 1kbi n PRO 89 Cb 0.56 -1.65 0.82 0.00 -0.02 0.00 0.00 33.50 33.21 1kbi n PRO 89 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1kbi h PRO 90 N 2.66 0.00 -0.66 0.52 0.13 -2.00 0.81 132.00 133.46 1kbi h PRO 90 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1kbi h PRO 90 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1kbi h PRO 90 CO 0.65 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.57 1kbi n GLU 91 N -3.07 3.93 -0.17 0.86 -0.00 -1.26 -3.98 120.64 116.95 1kbi n GLU 91 Ca -0.00 -2.95 0.04 0.00 -0.00 0.00 0.00 57.16 54.24 1kbi n GLU 91 Cb 0.41 -1.96 0.05 0.00 -0.00 0.00 0.00 31.44 29.94 1kbi n GLU 91 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 1kbi n LEU 92 N 1.12 1.27 -4.03 -1.84 7.94 0.28 -4.97 117.00 116.78 1kbi n LEU 92 Ca 0.27 -1.83 -0.31 0.00 -1.11 0.00 0.00 56.01 53.02 1kbi n LEU 92 Cb 0.94 -0.16 -0.16 0.00 0.53 0.00 0.00 43.42 44.57 1kbi n LEU 92 CO 0.26 0.43 -0.47 0.68 -1.11 0.00 0.00 177.39 177.18 1kbi s VAL 93 N -1.28 1.77 0.63 1.96 -7.23 -1.15 -0.26 120.40 114.84 1kbi s VAL 93 Ca 0.12 -1.03 -0.18 0.00 -1.81 0.00 0.00 61.98 59.08 1kbi s VAL 93 Cb 0.11 -1.78 -0.02 0.00 0.56 0.00 0.00 36.38 35.24 1kbi s VAL 93 CO 0.01 0.24 1.21 0.00 -0.31 0.00 0.00 175.10 176.25 1kbi s PRO 95 N -3.49 2.08 0.91 0.00 0.04 -1.26 -4.37 135.00 128.91 1kbi s PRO 95 Ca 0.77 -0.94 -0.14 0.00 0.04 0.00 0.00 61.00 60.72 1kbi s PRO 95 Cb -0.30 -2.39 -0.02 0.00 0.04 0.00 0.00 34.50 31.82 1kbi s PRO 95 CO 0.36 -1.12 0.14 -2.30 0.04 0.00 0.00 177.00 174.12 1kbi n PRO 96 N -2.62 -0.12 -2.88 0.56 -0.02 -1.26 -4.20 135.00 124.46 1kbi n PRO 96 Ca 0.12 -0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.17 1kbi n PRO 96 Cb 0.60 -1.63 -0.04 0.00 -0.02 0.00 0.00 33.50 32.40 1kbi n PRO 96 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1kbi s TYR 97 N -2.22 2.82 -0.42 6.00 6.04 -1.26 -4.86 117.35 123.45 1kbi s TYR 97 Ca 0.54 -0.10 0.09 0.00 0.04 0.00 0.00 57.07 57.64 1kbi s TYR 97 Cb -0.23 -4.01 0.34 0.00 -1.04 0.00 0.00 41.96 37.02 1kbi s TYR 97 CO 0.69 -1.32 0.97 0.00 -1.54 0.00 0.00 175.55 174.36 1kbi n ALA 98 N 7.29 0.47 -1.68 3.97 0.00 -1.26 -5.02 120.51 124.28 1kbi n ALA 98 Ca 0.00 -2.25 -0.63 0.00 0.00 0.00 0.00 53.44 50.56 1kbi n ALA 98 Cb 0.47 -1.06 -0.09 0.00 0.00 0.00 0.00 19.45 18.77 1kbi n ALA 98 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1kbi n PRO 99 N 0.29 0.44 -0.92 0.00 -0.02 -1.26 0.01 135.00 133.53 1kbi n PRO 99 Ca 0.13 0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1kbi n PRO 99 Cb 0.69 -1.75 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 1kbi n PRO 99 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kbi n GLY 100 N 4.52 0.70 3.61 -1.23 0.00 -1.26 -4.41 105.19 107.12 1kbi n GLY 100 Ca 0.32 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 1kbi n GLY 100 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1kbi s GLU 101 N -0.26 3.87 0.56 1.61 2.56 0.10 -4.99 118.70 122.16 1kbi s GLU 101 Ca 0.00 0.69 -0.08 0.00 0.00 0.00 0.00 54.97 55.59 1kbi s GLU 101 Cb 0.00 -3.81 -0.03 0.00 2.00 0.00 0.00 34.13 32.29 1kbi s GLU 101 CO 0.00 -1.01 0.91 0.95 -0.56 0.00 0.00 175.26 175.55 1kbi s THR 102 N 3.68 4.63 0.46 -1.70 -4.23 -1.26 -4.92 115.64 112.30 1kbi s THR 102 Ca 0.42 0.46 0.14 0.00 -1.18 0.00 0.00 61.69 61.52 1kbi s THR 102 Cb -0.11 -3.81 0.30 0.00 1.34 0.00 0.00 72.50 70.22 1kbi s THR 102 CO 0.20 -0.92 2.05 0.50 -0.54 0.00 0.00 174.62 175.91 1kbi h LYS 103 N -0.08 0.29 0.00 3.99 3.64 -2.00 -0.79 116.57 121.63 1kbi h LYS 103 Ca -0.46 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 58.78 1kbi h LYS 103 Cb 1.21 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.94 1kbi h LYS 103 CO 0.62 0.19 -0.59 1.05 -2.27 0.00 0.00 179.45 178.45 1kbi h GLU 104 N 0.30 0.00 -0.12 1.90 4.11 -1.99 -2.48 114.58 116.30 1kbi h GLU 104 Ca 0.16 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.54 1kbi h GLU 104 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 1kbi h GLU 104 CO -0.03 0.59 -0.15 -0.44 0.07 0.00 0.00 179.01 179.05 1kbi h ASP 105 N 0.00 0.34 -0.85 3.06 3.32 -1.54 0.06 116.42 120.81 1kbi h ASP 105 Ca -0.01 -0.50 0.08 0.00 0.02 0.00 0.00 57.03 56.62 1kbi h ASP 105 Cb 1.36 -0.10 -0.07 0.00 0.22 0.00 0.00 39.33 40.75 1kbi h ASP 105 CO 0.08 0.77 0.50 0.40 -1.72 0.00 0.00 179.24 179.27 1kbi h ILE 106 N -0.09 0.96 0.44 0.35 1.08 -1.36 0.22 117.51 119.11 1kbi h ILE 106 Ca 0.02 -0.30 -0.02 0.00 -0.39 0.00 0.00 64.86 64.17 1kbi h ILE 106 Cb 0.69 0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.46 1kbi h ILE 106 CO 0.04 0.16 -0.21 0.00 -0.69 0.00 0.00 178.15 177.44 1kbi h ALA 107 N 1.44 -1.10 -0.82 1.87 0.00 -1.27 -1.33 119.26 118.04 1kbi h ALA 107 Ca 0.39 -0.13 0.19 0.00 0.00 0.00 0.00 54.91 55.36 1kbi h ALA 107 Cb 0.30 0.23 -0.12 0.00 0.00 0.00 0.00 17.79 18.20 1kbi h ALA 107 CO -0.22 -1.06 0.29 -0.09 0.00 0.00 0.00 179.25 178.17 1kbi h ARG 108 N -0.62 0.34 -0.38 0.00 2.43 -0.76 -2.09 114.38 113.29 1kbi h ARG 108 Ca -0.06 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.93 1kbi h ARG 108 Cb 0.46 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 1kbi h ARG 108 CO 0.10 0.22 -0.39 0.87 -1.51 0.00 0.00 179.97 179.26 1kbi h LYS 109 N 0.35 0.93 0.00 0.20 1.57 -0.53 -1.20 116.57 117.89 1kbi h LYS 109 Ca 0.49 -0.49 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1kbi h LYS 109 Cb 0.88 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1kbi h LYS 109 CO -0.52 1.14 -0.27 0.93 -0.57 0.00 0.00 179.45 180.17 1kbi h GLU 110 N 0.76 0.00 -0.10 3.15 4.39 -0.80 0.56 114.58 122.54 1kbi h GLU 110 Ca 0.06 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 1kbi h GLU 110 Cb 0.98 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.63 1kbi h GLU 110 CO 0.10 0.27 -0.11 0.37 -1.16 0.00 0.00 179.01 178.47 1kbi h GLN 111 N 0.00 0.25 -0.61 2.33 4.15 -1.11 -2.89 115.11 117.22 1kbi h GLN 111 Ca -0.00 -0.14 0.01 0.00 0.77 0.00 0.00 58.65 59.29 1kbi h GLN 111 Cb 0.48 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 1kbi h GLN 111 CO 0.03 0.68 0.41 -0.07 -1.93 0.00 0.00 178.83 177.95 1kbi h LEU 112 N -0.17 0.70 -1.70 -2.39 3.38 -0.76 -0.48 115.31 113.90 1kbi h LEU 112 Ca 0.01 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1kbi h LEU 112 Cb 0.64 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1kbi h LEU 112 CO 0.03 0.50 0.03 0.11 0.09 0.00 0.00 178.44 179.20 1kbi h LYS 113 N 0.82 0.22 0.00 1.13 1.57 -0.81 0.25 116.57 119.76 1kbi h LYS 113 Ca 0.23 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1kbi h LYS 113 Cb -0.08 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 1kbi h LYS 113 CO -0.05 0.22 -0.03 0.66 -0.57 0.00 0.00 179.45 179.68 1kbi h SER 114 N 0.22 0.00 -0.58 0.86 4.64 -0.88 -3.10 113.55 114.71 1kbi h SER 114 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1kbi h SER 114 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1kbi h SER 114 CO -0.00 0.03 0.00 0.18 -0.87 0.00 0.00 176.83 176.17 1kbi n LEU 115 N -3.11 3.90 -4.77 5.97 4.77 0.04 -4.97 117.00 118.83 1kbi n LEU 115 Ca 0.03 -1.96 -0.41 0.00 -0.03 0.00 0.00 56.01 53.63 1kbi n LEU 115 Cb 0.46 -0.50 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 1kbi n LEU 115 CO 0.32 0.74 1.16 -0.76 -1.33 0.00 0.00 177.39 177.53 1kbi s LEU 116 N -1.45 4.34 0.81 2.23 1.43 -0.96 -4.95 118.68 120.12 1kbi s LEU 116 Ca 0.43 2.98 -0.11 0.00 -1.03 0.00 0.00 54.13 56.41 1kbi s LEU 116 Cb 0.26 -3.65 0.08 0.00 0.03 0.00 0.00 46.19 42.90 1kbi s LEU 116 CO 0.23 -0.86 1.10 -2.16 0.23 0.00 0.00 176.35 174.89 1kbi s PRO 117 N -1.48 1.98 0.35 1.29 0.04 -1.26 -4.93 135.00 130.98 1kbi s PRO 117 Ca 0.56 1.18 -0.29 0.00 0.04 0.00 0.00 61.00 62.49 1kbi s PRO 117 Cb -0.46 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.10 1kbi s PRO 117 CO 0.57 -1.84 1.51 -2.30 0.04 0.00 0.00 177.00 174.98 1kbi n PRO 118 N -3.66 2.65 0.04 0.56 -0.02 -1.26 -4.87 135.00 128.44 1kbi n PRO 118 Ca 0.09 0.93 0.20 0.00 -2.02 0.00 0.00 63.50 62.70 1kbi n PRO 118 Cb 0.53 -2.67 0.71 0.00 -0.02 0.00 0.00 33.50 32.05 1kbi n PRO 118 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1kbi h LEU 119 N 3.56 0.00 -2.16 2.45 5.85 -1.99 0.23 115.31 123.24 1kbi h LEU 119 Ca -0.49 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 1kbi h LEU 119 Cb 1.24 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.27 1kbi h LEU 119 CO 0.69 0.00 -0.03 0.44 -0.34 0.00 0.00 178.44 179.20 1kbi h ASP 120 N 0.00 0.00 -0.04 1.25 3.32 -2.02 -2.56 116.42 116.37 1kbi h ASP 120 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1kbi h ASP 120 Cb 0.95 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.50 1kbi h ASP 120 CO -0.00 0.03 0.00 0.59 -1.72 0.00 0.00 179.24 178.14 1kbi n ASN 121 N -3.24 1.40 -4.67 6.45 4.13 0.80 -4.86 115.26 115.27 1kbi n ASN 121 Ca -0.01 -1.50 -0.42 0.00 1.68 0.00 0.00 54.58 54.32 1kbi n ASN 121 Cb 0.20 -0.02 -0.03 0.00 -1.54 0.00 0.00 39.78 38.39 1kbi n ASN 121 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1kbi s ILE 122 N -1.96 4.79 -0.19 2.41 -1.09 -0.97 -4.95 121.20 119.25 1kbi s ILE 122 Ca 0.37 1.91 -0.10 0.00 -2.23 0.00 0.00 60.65 60.61 1kbi s ILE 122 Cb 0.20 -4.26 -0.21 0.00 -1.58 0.00 0.00 42.46 36.62 1kbi s ILE 122 CO 0.32 -0.04 0.12 -0.38 -1.23 0.00 0.00 174.94 173.73 1kbi n ILE 123 N 4.83 1.63 -4.22 2.92 5.41 -1.26 -5.05 119.36 123.62 1kbi n ILE 123 Ca 0.08 -0.45 -0.16 0.00 1.00 0.00 0.00 62.75 63.22 1kbi n ILE 123 Cb 0.48 -1.77 -0.08 0.00 -0.71 0.00 0.00 39.64 37.56 1kbi n ILE 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 1kbi s ASN 124 N -6.96 1.08 0.50 4.38 2.20 -1.26 -4.98 114.94 109.91 1kbi s ASN 124 Ca -0.28 -1.59 0.27 0.00 -0.94 0.00 0.00 52.86 50.32 1kbi s ASN 124 Cb 0.08 0.53 1.31 0.00 -2.00 0.00 0.00 41.25 41.17 1kbi s ASN 124 CO 0.66 -1.05 2.00 -0.07 -2.94 0.00 0.00 177.10 175.70 1kbi h LEU 125 N 2.26 0.00 -1.28 3.54 3.38 -1.96 -2.35 115.31 118.90 1kbi h LEU 125 Ca -0.28 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.62 1kbi h LEU 125 Cb 1.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.98 1kbi h LEU 125 CO 0.41 0.15 -0.31 1.88 0.09 0.00 0.00 178.44 180.66 1kbi h TYR 126 N 0.00 0.00 -0.82 1.13 -1.99 -1.97 -2.88 116.97 110.44 1kbi h TYR 126 Ca -0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1kbi h TYR 126 Cb 0.46 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.15 1kbi h TYR 126 CO 0.00 0.31 0.49 -0.44 -0.00 0.00 0.00 178.16 178.52 1kbi h ASP 127 N 0.00 1.00 -0.66 3.88 3.45 -1.84 0.30 116.42 122.55 1kbi h ASP 127 Ca -0.00 -0.07 -0.06 0.00 0.43 0.00 0.00 57.03 57.32 1kbi h ASP 127 Cb 0.68 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 39.17 1kbi h ASP 127 CO 0.04 0.78 0.18 -0.26 -1.57 0.00 0.00 179.24 178.40 1kbi h PHE 128 N 1.13 1.10 -0.19 4.55 0.04 -1.64 -1.50 116.94 120.43 1kbi h PHE 128 Ca 0.29 -0.12 0.01 0.00 2.80 0.00 0.00 57.97 60.95 1kbi h PHE 128 Cb -0.03 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.79 1kbi h PHE 128 CO -0.00 0.90 0.08 1.49 -0.60 0.00 0.00 178.31 180.18 1kbi h GLU 129 N 0.98 0.18 0.39 1.51 4.81 -1.20 0.89 114.58 122.14 1kbi h GLU 129 Ca 0.21 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1kbi h GLU 129 Cb 0.34 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1kbi h GLU 129 CO -0.00 0.12 -0.30 -0.92 -0.73 0.00 0.00 179.01 177.18 1kbi h TYR 130 N 0.19 -0.79 -0.63 0.92 5.03 -0.61 -0.24 116.97 120.84 1kbi h TYR 130 Ca 0.08 -0.00 0.10 0.00 2.58 0.00 0.00 58.73 61.49 1kbi h TYR 130 Cb 0.03 0.29 -0.08 0.00 1.55 0.00 0.00 36.73 38.52 1kbi h TYR 130 CO -0.10 -0.44 0.23 -0.07 -1.32 0.00 0.00 178.16 176.46 1kbi h LEU 131 N -0.68 0.21 -1.03 2.82 4.07 -1.16 -1.14 115.31 118.40 1kbi h LEU 131 Ca -0.03 0.09 -0.06 0.00 0.08 0.00 0.00 57.88 57.96 1kbi h LEU 131 Cb 0.59 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 42.38 1kbi h LEU 131 CO -0.00 0.12 0.09 0.00 -1.08 0.00 0.00 178.44 177.57 1kbi h ALA 132 N 1.44 1.21 0.00 1.53 0.00 -0.53 -2.28 119.26 120.63 1kbi h ALA 132 Ca 0.33 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1kbi h ALA 132 Cb 0.42 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1kbi h ALA 132 CO -0.33 0.54 -0.10 0.66 0.00 0.00 0.00 179.25 180.02 1kbi h SER 133 N 0.76 0.00 0.52 0.00 4.64 0.24 -1.22 113.55 118.49 1kbi h SER 133 Ca 0.16 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.43 1kbi h SER 133 Cb 0.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1kbi h SER 133 CO 0.00 0.10 -1.52 0.00 -0.87 0.00 0.00 176.83 174.54 1kbi n GLN 134 N -3.88 0.63 -0.01 4.77 1.13 -1.04 -4.59 117.38 114.39 1kbi n GLN 134 Ca -0.02 0.01 0.06 0.00 -1.94 0.00 0.00 57.00 55.11 1kbi n GLN 134 Cb 0.19 -1.69 -0.12 0.00 0.11 0.00 0.00 30.24 28.73 1kbi n GLN 134 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1kbi n THR 135 N -2.57 0.11 -1.63 5.09 -2.24 -0.88 -4.81 114.28 107.36 1kbi n THR 135 Ca -0.05 -0.37 -0.31 0.00 -2.27 0.00 0.00 64.05 61.05 1kbi n THR 135 Cb 0.65 0.06 0.05 0.00 -2.10 0.00 0.00 70.33 68.99 1kbi n THR 135 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1kbi s LEU 136 N -4.16 3.08 0.79 3.22 1.43 -0.50 -4.92 118.68 117.62 1kbi s LEU 136 Ca -0.06 1.53 -0.11 0.00 -1.03 0.00 0.00 54.13 54.47 1kbi s LEU 136 Cb 0.09 -4.40 0.07 0.00 0.03 0.00 0.00 46.19 41.97 1kbi s LEU 136 CO 0.62 -1.40 1.10 0.42 0.23 0.00 0.00 176.35 177.31 1kbi s THR 137 N -3.09 3.14 0.28 5.49 -4.23 -1.26 -4.74 115.64 111.22 1kbi s THR 137 Ca 0.58 0.38 -0.00 0.00 -1.18 0.00 0.00 61.69 61.47 1kbi s THR 137 Cb -0.13 -2.80 0.28 0.00 1.34 0.00 0.00 72.50 71.18 1kbi s THR 137 CO 0.55 -0.47 1.87 0.11 -0.54 0.00 0.00 174.62 176.14 1kbi h LYS 138 N -1.16 1.04 -0.28 3.99 1.57 -1.94 -0.42 116.57 119.37 1kbi h LYS 138 Ca -0.44 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.25 1kbi h LYS 138 Cb 1.24 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1kbi h LYS 138 CO 0.50 0.69 0.07 0.37 -0.57 0.00 0.00 179.45 180.51 1kbi h GLN 139 N 1.07 0.44 -0.41 3.15 -0.00 -1.90 -0.31 115.11 117.15 1kbi h GLN 139 Ca 0.45 -0.11 -0.06 0.00 -0.00 0.00 0.00 58.65 58.94 1kbi h GLN 139 Cb 0.30 -0.06 -0.02 0.00 0.00 0.00 0.00 27.48 27.71 1kbi h GLN 139 CO -0.20 0.53 0.04 0.00 0.00 0.00 0.00 178.83 179.20 1kbi h ALA 140 N 0.89 0.55 -0.72 3.38 0.00 -1.77 0.05 119.26 121.65 1kbi h ALA 140 Ca 0.09 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1kbi h ALA 140 Cb 0.29 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1kbi h ALA 140 CO 0.00 0.30 0.22 2.35 0.00 0.00 0.00 179.25 182.12 1kbi h TRP 141 N 0.55 1.17 -0.00 0.00 2.91 -1.03 -0.81 115.95 118.73 1kbi h TRP 141 Ca 0.12 -0.12 -0.00 0.00 1.13 0.00 0.00 58.89 60.02 1kbi h TRP 141 Cb 0.42 -0.34 -0.00 0.00 -0.51 0.00 0.00 29.16 28.73 1kbi h TRP 141 CO 0.03 0.93 0.00 0.00 -1.03 0.00 0.00 178.44 178.37 1kbi h ALA 142 N 1.11 0.00 -0.84 2.65 0.00 -0.85 -1.12 119.26 120.21 1kbi h ALA 142 Ca 0.23 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.05 1kbi h ALA 142 Cb 0.31 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1kbi h ALA 142 CO -0.01 -0.36 0.55 -0.92 0.00 0.00 0.00 179.25 178.52 1kbi h TYR 143 N -0.27 0.98 0.05 0.00 5.03 -0.77 -1.19 116.97 120.80 1kbi h TYR 143 Ca 0.00 0.02 -0.13 0.00 2.58 0.00 0.00 58.73 61.20 1kbi h TYR 143 Cb 0.28 -0.33 0.01 0.00 1.55 0.00 0.00 36.73 38.25 1kbi h TYR 143 CO 0.02 0.54 -0.54 1.88 -1.32 0.00 0.00 178.16 178.74 1kbi h TYR 144 N 0.99 0.44 0.00 -3.82 0.99 -1.06 -3.37 116.97 111.15 1kbi h TYR 144 Ca 0.35 -0.28 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1kbi h TYR 144 Cb 0.12 -0.04 0.00 0.00 1.00 0.00 0.00 36.73 37.82 1kbi h TYR 144 CO -0.00 1.15 -0.31 -1.13 -0.00 0.00 0.00 178.16 177.87 1kbi n SER 145 N -4.29 0.39 -4.80 3.88 3.41 -0.43 -4.94 113.62 106.85 1kbi n SER 145 Ca -0.12 0.14 -0.33 0.00 -0.26 0.00 0.00 58.87 58.31 1kbi n SER 145 Cb 0.67 -0.12 0.02 0.00 -0.26 0.00 0.00 64.21 64.52 1kbi n SER 145 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1kbi s SER 146 N -3.35 5.71 0.44 4.04 1.04 -0.46 -5.06 113.70 116.06 1kbi s SER 146 Ca 0.11 1.82 0.03 0.00 0.48 0.00 0.00 55.95 58.39 1kbi s SER 146 Cb 0.17 -2.53 -0.02 0.00 0.10 0.00 0.00 66.02 63.74 1kbi s SER 146 CO 0.64 -1.22 0.09 -0.83 0.98 0.00 0.00 173.24 172.90 1kbi s GLY 147 N -2.84 2.75 0.28 7.32 0.00 -1.26 -4.77 107.32 108.81 1kbi s GLY 147 Ca 0.63 -0.97 -0.27 0.00 0.00 0.00 0.00 44.72 44.11 1kbi s GLY 147 CO 0.38 -1.95 0.93 0.00 0.00 0.00 0.00 173.10 172.47 1kbi s ALA 148 N -3.10 3.27 0.00 3.20 0.00 0.51 -4.33 121.76 121.32 1kbi s ALA 148 Ca 0.18 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.69 1kbi s ALA 148 Cb 0.02 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.96 1kbi s ALA 148 CO 0.11 0.19 0.00 0.09 0.00 0.00 0.00 175.76 176.15 1kbi n ASN 149 N 0.95 0.00 -0.20 0.00 3.02 -0.24 -0.34 115.26 118.45 1kbi n ASN 149 Ca 0.00 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.63 1kbi n ASN 149 Cb 0.49 0.00 0.39 0.00 -0.61 0.00 0.00 39.78 40.05 1kbi n ASN 149 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1kbi n ASP 150 N 3.85 0.58 -2.66 6.41 10.43 -1.26 -4.73 116.55 129.18 1kbi n ASP 150 Ca 0.00 -1.62 -0.19 0.00 2.57 0.00 0.00 54.79 55.55 1kbi n ASP 150 Cb 0.00 -0.05 0.00 0.00 1.84 0.00 0.00 41.12 42.92 1kbi n ASP 150 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1kbi n GLU 151 N -0.35 -2.74 -0.02 -1.24 1.02 0.54 -4.90 120.64 112.95 1kbi n GLU 151 Ca 0.12 0.79 -0.13 0.00 -0.02 0.00 0.00 57.16 57.93 1kbi n GLU 151 Cb 0.14 -5.49 -0.10 0.00 -0.02 0.00 0.00 31.44 25.97 1kbi n GLU 151 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1kbi h VAL 152 N -0.40 1.44 -0.82 2.62 2.07 -1.91 -3.02 116.25 116.23 1kbi h VAL 152 Ca -0.43 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 65.73 1kbi h VAL 152 Cb 1.31 2.36 -0.04 0.00 -1.52 0.00 0.00 31.29 33.40 1kbi h VAL 152 CO 0.50 0.35 0.53 0.74 0.02 0.00 0.00 177.57 179.71 1kbi h THR 153 N -0.60 1.22 -0.54 2.57 2.02 -1.88 0.27 112.91 115.97 1kbi h THR 153 Ca -0.00 -0.42 0.10 0.00 0.77 0.00 0.00 66.41 66.85 1kbi h THR 153 Cb 0.59 0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 66.94 1kbi h THR 153 CO 0.00 0.22 0.11 -0.74 0.37 0.00 0.00 175.52 175.48 1kbi h HIS 154 N 1.12 0.17 -0.11 3.16 6.17 -1.75 0.21 115.15 124.12 1kbi h HIS 154 Ca 0.30 0.03 -0.19 0.00 0.71 0.00 0.00 60.37 61.22 1kbi h HIS 154 Cb -0.10 0.01 0.01 0.00 2.52 0.00 0.00 27.41 29.84 1kbi h HIS 154 CO -0.01 -0.02 -0.69 0.00 0.71 0.00 0.00 177.93 177.92 1kbi h ARG 155 N 0.24 0.66 -0.12 5.26 3.08 -1.27 -3.13 114.38 119.11 1kbi h ARG 155 Ca 0.27 -0.57 0.03 0.00 0.07 0.00 0.00 59.98 59.79 1kbi h ARG 155 Cb 0.38 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1kbi h ARG 155 CO -0.36 1.18 0.09 1.49 -1.07 0.00 0.00 179.97 181.30 1kbi h GLU 156 N 0.33 0.00 -0.68 0.04 4.57 0.20 -0.30 114.58 118.75 1kbi h GLU 156 Ca -0.05 0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.18 1kbi h GLU 156 Cb 1.33 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 29.87 1kbi h GLU 156 CO 0.14 0.00 0.39 -0.91 -1.18 0.00 0.00 179.01 177.45 1kbi h ASN 157 N 0.00 0.60 0.01 1.04 2.35 -0.55 -0.72 115.58 118.31 1kbi h ASN 157 Ca 0.06 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.78 1kbi h ASN 157 Cb 0.23 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1kbi h ASN 157 CO -0.00 0.39 -0.21 -0.74 -1.65 0.00 0.00 177.43 175.22 1kbi h HIS 158 N 0.73 0.18 -0.90 1.19 2.76 -1.44 -3.37 115.15 114.31 1kbi h HIS 158 Ca 0.30 -0.11 0.05 0.00 -2.20 0.00 0.00 60.37 58.41 1kbi h HIS 158 Cb 0.15 -0.02 -0.06 0.00 1.55 0.00 0.00 27.41 29.03 1kbi h HIS 158 CO -0.07 0.96 0.57 -0.91 -1.30 0.00 0.00 177.93 177.19 1kbi h ASN 159 N -0.64 0.93 -0.26 3.26 -0.26 -0.83 -1.98 115.58 115.79 1kbi h ASN 159 Ca -0.03 0.00 0.08 0.00 -0.56 0.00 0.00 56.30 55.79 1kbi h ASN 159 Cb 1.03 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 38.08 1kbi h ASN 159 CO 0.04 0.62 0.24 0.00 -1.06 0.00 0.00 177.43 177.27 1kbi h ALA 160 N 1.39 2.01 0.00 -0.83 0.00 -1.30 0.14 119.26 120.68 1kbi h ALA 160 Ca 0.37 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 1kbi h ALA 160 Cb 0.08 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1kbi h ALA 160 CO -0.14 -0.38 -0.13 1.88 0.00 0.00 0.00 179.25 180.48 1kbi h TYR 161 N 0.00 0.00 0.00 0.00 0.05 -1.54 -1.38 116.97 114.10 1kbi h TYR 161 Ca 0.13 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.91 1kbi h TYR 161 Cb 0.61 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.35 1kbi h TYR 161 CO 0.00 0.13 0.00 0.72 -1.05 0.00 0.00 178.16 177.96 1kbi n HIS 162 N -4.27 0.00 1.16 4.88 8.25 0.49 -2.22 115.22 123.51 1kbi n HIS 162 Ca -0.03 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 1kbi n HIS 162 Cb 0.20 0.00 0.36 0.00 1.12 0.00 0.00 29.99 31.67 1kbi n HIS 162 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1kbi n ARG 163 N -0.92 1.91 -5.04 -0.41 1.74 -0.52 -4.83 116.66 108.59 1kbi n ARG 163 Ca 0.20 -1.35 -0.32 0.00 -0.77 0.00 0.00 57.85 55.61 1kbi n ARG 163 Cb 0.09 -1.45 -0.16 0.00 -1.02 0.00 0.00 32.46 29.93 1kbi n ARG 163 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1kbi s ILE 164 N -1.85 2.51 0.45 0.55 1.01 -0.94 -3.42 121.20 119.51 1kbi s ILE 164 Ca 0.34 -0.87 0.06 0.00 0.00 0.00 0.00 60.65 60.18 1kbi s ILE 164 Cb 0.20 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 1kbi s ILE 164 CO 0.30 0.55 0.16 -0.36 0.00 0.00 0.00 174.94 175.59 1kbi s PHE 165 N 0.17 2.33 0.16 3.97 0.40 -1.09 -4.99 117.98 118.93 1kbi s PHE 165 Ca -0.11 -0.70 0.05 0.00 -0.60 0.00 0.00 56.93 55.57 1kbi s PHE 165 Cb -0.16 -1.87 -0.04 0.00 0.51 0.00 0.00 43.02 41.46 1kbi s PHE 165 CO 0.06 0.13 0.15 -0.06 0.70 0.00 0.00 175.22 176.20 1kbi s PHE 166 N -2.69 3.18 -0.60 0.36 0.08 -1.26 -0.75 117.98 116.30 1kbi s PHE 166 Ca 0.33 -0.00 0.06 0.00 0.12 0.00 0.00 56.93 57.44 1kbi s PHE 166 Cb 0.03 -1.53 0.21 0.00 -0.57 0.00 0.00 43.02 41.17 1kbi s PHE 166 CO 0.19 0.52 0.58 1.63 -0.10 0.00 0.00 175.22 178.03 1kbi n LYS 167 N -0.36 1.72 -2.32 0.44 5.02 0.91 -4.69 118.16 118.88 1kbi n LYS 167 Ca -0.08 -4.20 -0.36 0.00 -2.02 0.00 0.00 58.31 51.65 1kbi n LYS 167 Cb 0.55 -2.03 -0.01 0.00 -0.02 0.00 0.00 35.03 33.51 1kbi n LYS 167 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1kbi s PRO 168 N -1.61 3.60 -0.08 1.97 0.04 -1.26 -4.62 135.00 133.03 1kbi s PRO 168 Ca 0.33 1.62 -0.14 0.00 0.04 0.00 0.00 61.00 62.86 1kbi s PRO 168 Cb 0.07 -2.18 -0.05 0.00 0.04 0.00 0.00 34.50 32.39 1kbi s PRO 168 CO -0.10 -0.65 0.34 0.15 0.04 0.00 0.00 177.00 176.78 1kbi s LYS 169 N -3.04 3.99 0.46 4.56 1.02 -0.46 -4.98 119.74 121.28 1kbi s LYS 169 Ca 0.68 0.24 0.06 0.00 0.02 0.00 0.00 55.97 56.97 1kbi s LYS 169 Cb -0.24 -3.30 -0.02 0.00 -0.52 0.00 0.00 37.83 33.75 1kbi s LYS 169 CO 0.28 0.51 0.26 0.96 -0.92 0.00 0.00 175.35 176.45 1kbi s ILE 170 N -0.43 2.09 -1.45 2.17 -5.25 -1.26 -3.76 121.20 113.32 1kbi s ILE 170 Ca 0.20 -1.60 -0.10 0.00 -0.99 0.00 0.00 60.65 58.16 1kbi s ILE 170 Cb -0.15 -2.69 0.04 0.00 2.95 0.00 0.00 42.46 42.61 1kbi s ILE 170 CO 0.09 0.00 1.01 0.18 -1.79 0.00 0.00 174.94 174.43 1kbi n LEU 171 N -1.44 -2.92 -4.41 0.37 4.77 -1.26 -4.99 117.00 107.12 1kbi n LEU 171 Ca -0.02 -0.59 -0.32 0.00 -0.03 0.00 0.00 56.01 55.05 1kbi n LEU 171 Cb 0.64 -2.81 -0.14 0.00 -2.33 0.00 0.00 43.42 38.78 1kbi n LEU 171 CO 0.43 0.52 -0.48 -0.69 -1.33 0.00 0.00 177.39 175.83 1kbi s VAL 172 N -3.28 2.78 -0.34 4.08 1.01 -1.26 -5.07 120.40 118.32 1kbi s VAL 172 Ca 0.58 -0.82 -0.28 0.00 0.00 0.00 0.00 61.98 61.46 1kbi s VAL 172 Cb -0.27 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.01 1kbi s VAL 172 CO 0.71 0.58 1.83 -0.62 0.00 0.00 0.00 175.10 177.60 1kbi s ASP 173 N -0.49 5.83 -0.24 3.32 -1.08 -1.26 -4.83 116.67 117.91 1kbi s ASP 173 Ca 0.06 1.27 0.11 0.00 -0.52 0.00 0.00 52.55 53.47 1kbi s ASP 173 Cb -0.12 -2.53 0.44 0.00 -1.46 0.00 0.00 42.92 39.26 1kbi s ASP 173 CO 0.01 -1.77 1.20 1.33 0.52 0.00 0.00 175.17 176.46 1kbi n VAL 174 N 7.42 2.20 -0.16 1.11 0.24 -1.26 -4.72 118.33 123.16 1kbi n VAL 174 Ca 0.23 -3.58 -0.09 0.00 -2.04 0.00 0.00 64.34 58.86 1kbi n VAL 174 Cb 0.47 -0.52 0.00 0.00 -1.47 0.00 0.00 33.84 32.33 1kbi n VAL 174 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 1kbi h ARG 175 N 1.65 0.72 -5.31 7.34 2.43 -1.98 -3.42 114.38 115.81 1kbi h ARG 175 Ca 0.16 -0.16 -0.64 0.00 -0.81 0.00 0.00 59.98 58.53 1kbi h ARG 175 Cb 1.32 -0.10 -0.22 0.00 -0.42 0.00 0.00 29.97 30.54 1kbi h ARG 175 CO 0.38 0.69 -0.68 0.15 -1.51 0.00 0.00 179.97 179.00 1kbi s LYS 176 N -5.41 3.63 0.05 0.20 3.01 -1.26 -5.11 119.74 114.85 1kbi s LYS 176 Ca -0.13 -0.54 0.01 0.00 -1.01 0.00 0.00 55.97 54.30 1kbi s LYS 176 Cb 0.11 -2.88 -0.03 0.00 -1.01 0.00 0.00 37.83 34.03 1kbi s LYS 176 CO 0.78 0.25 -0.06 0.14 0.51 0.00 0.00 175.35 176.97 1kbi s VAL 177 N 0.34 0.43 -0.05 3.17 -7.23 -1.26 -4.76 120.40 111.04 1kbi s VAL 177 Ca -0.05 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 58.84 1kbi s VAL 177 Cb -0.14 -0.83 0.02 0.00 0.56 0.00 0.00 36.38 35.99 1kbi s VAL 177 CO 0.03 -0.58 -0.02 -0.62 -0.31 0.00 0.00 175.10 173.61 1kbi s ASP 178 N -1.98 0.99 -0.10 4.85 -1.08 0.13 -5.00 116.67 114.48 1kbi s ASP 178 Ca -0.05 -0.09 0.14 0.00 -0.52 0.00 0.00 52.55 52.03 1kbi s ASP 178 Cb -0.05 -0.39 0.45 0.00 -1.46 0.00 0.00 42.92 41.47 1kbi s ASP 178 CO -0.02 -0.10 1.37 2.30 0.52 0.00 0.00 175.17 179.24 1kbi n ILE 179 N 4.37 1.72 -2.13 4.11 -5.35 -1.26 -2.95 119.36 117.87 1kbi n ILE 179 Ca -0.20 -1.46 -0.29 0.00 -0.27 0.00 0.00 62.75 60.53 1kbi n ILE 179 Cb 0.50 0.09 0.03 0.00 -1.74 0.00 0.00 39.64 38.52 1kbi n ILE 179 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1kbi s SER 180 N -1.45 5.78 0.00 7.28 1.04 -1.19 -3.34 113.70 121.82 1kbi s SER 180 Ca 0.35 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.83 1kbi s SER 180 Cb 0.25 -2.04 0.00 0.00 0.10 0.00 0.00 66.02 64.33 1kbi s SER 180 CO 0.13 -1.05 0.00 1.07 0.98 0.00 0.00 173.24 174.37 1kbi n THR 181 N -2.73 0.00 -4.28 2.02 5.66 -0.52 -4.50 114.28 109.94 1kbi n THR 181 Ca 0.05 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.86 1kbi n THR 181 Cb 0.56 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.21 1kbi n THR 181 CO 0.00 0.00 0.00 1.51 -3.05 0.00 0.00 175.07 173.53 1kbi s ASP 182 N 1.07 1.60 -0.04 1.09 1.47 -1.26 -0.48 116.67 120.11 1kbi s ASP 182 Ca 0.00 -0.50 -0.02 0.00 1.18 0.00 0.00 52.55 53.21 1kbi s ASP 182 Cb 0.00 -0.08 0.03 0.00 -0.34 0.00 0.00 42.92 42.53 1kbi s ASP 182 CO 0.00 -0.01 0.07 -0.04 0.68 0.00 0.00 175.17 175.87 1kbi s MET 183 N -1.31 -0.05 -1.48 2.11 -1.94 0.05 -4.89 119.30 111.80 1kbi s MET 183 Ca -0.00 0.35 -0.10 0.00 -1.71 0.00 0.00 55.69 54.24 1kbi s MET 183 Cb -0.08 -0.39 0.06 0.00 2.01 0.00 0.00 34.83 36.43 1kbi s MET 183 CO 0.01 -0.28 0.86 1.28 -0.01 0.00 0.00 175.02 176.89 1kbi n LEU 184 N 4.95 -2.61 0.00 -0.03 4.32 -1.26 -1.79 117.00 120.58 1kbi n LEU 184 Ca -0.11 -0.82 0.00 0.00 -0.02 0.00 0.00 56.01 55.06 1kbi n LEU 184 Cb 0.50 -2.53 0.00 0.00 -1.62 0.00 0.00 43.42 39.77 1kbi n LEU 184 CO 0.11 0.44 0.00 0.61 -1.22 0.00 0.00 177.39 177.33 1kbi n GLY 185 N -1.67 1.06 3.35 -0.72 0.00 -1.26 -4.97 105.19 100.98 1kbi n GLY 185 Ca -0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1kbi n GLY 185 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1kbi s SER 186 N -3.05 3.12 0.15 1.61 0.01 -0.74 -5.11 113.70 109.69 1kbi s SER 186 Ca 0.00 -0.65 -0.30 0.00 1.31 0.00 0.00 55.95 56.31 1kbi s SER 186 Cb 0.00 -0.25 -0.07 0.00 0.21 0.00 0.00 66.02 65.92 1kbi s SER 186 CO 0.00 0.21 1.03 -2.28 0.41 0.00 0.00 173.24 172.61 1kbi s HIS 187 N -0.92 3.71 0.04 2.43 2.46 -1.26 -0.77 115.29 120.98 1kbi s HIS 187 Ca 0.12 1.70 0.06 0.00 0.47 0.00 0.00 55.06 57.41 1kbi s HIS 187 Cb -0.10 -3.16 -0.02 0.00 -0.13 0.00 0.00 32.58 29.17 1kbi s HIS 187 CO 0.04 -0.19 -0.17 0.08 -2.47 0.00 0.00 174.74 172.02 1kbi s VAL 188 N -0.17 1.40 0.10 0.89 1.01 0.37 -4.93 120.40 119.07 1kbi s VAL 188 Ca 0.48 -1.07 0.27 0.00 0.00 0.00 0.00 61.98 61.66 1kbi s VAL 188 Cb -0.27 -1.23 0.28 0.00 0.00 0.00 0.00 36.38 35.17 1kbi s VAL 188 CO 0.32 0.14 1.86 0.44 0.00 0.00 0.00 175.10 177.86 1kbi h ASP 189 N 4.98 0.00 -5.57 3.32 3.32 -1.84 -1.37 116.42 119.26 1kbi h ASP 189 Ca -0.40 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.41 1kbi h ASP 189 Cb 1.17 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.57 1kbi h ASP 189 CO 0.44 0.15 -0.62 0.68 -1.72 0.00 0.00 179.24 178.17 1kbi s VAL 190 N -3.64 0.01 -0.39 -1.35 -7.23 -1.25 -3.18 120.40 103.37 1kbi s VAL 190 Ca 0.01 -2.00 0.14 0.00 -1.81 0.00 0.00 61.98 58.32 1kbi s VAL 190 Cb 0.10 -2.49 0.78 0.00 0.56 0.00 0.00 36.38 35.33 1kbi s VAL 190 CO 0.61 -0.02 1.69 -0.81 -0.31 0.00 0.00 175.10 176.27 1kbi n PRO 191 N -0.27 4.64 -4.41 4.82 -0.04 -1.21 -4.49 135.00 134.04 1kbi n PRO 191 Ca 0.02 -3.01 -0.20 0.00 -0.04 0.00 0.00 63.50 60.26 1kbi n PRO 191 Cb 0.66 -2.20 -0.10 0.00 -0.04 0.00 0.00 33.50 31.81 1kbi n PRO 191 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1kbi s PHE 192 N -2.59 1.86 0.14 0.54 -0.12 -1.26 -1.14 117.98 115.41 1kbi s PHE 192 Ca 0.52 -0.90 -0.12 0.00 -0.05 0.00 0.00 56.93 56.38 1kbi s PHE 192 Cb 0.39 -1.15 0.01 0.00 -0.63 0.00 0.00 43.02 41.64 1kbi s PHE 192 CO 0.16 0.04 0.34 1.52 -0.05 0.00 0.00 175.22 177.24 1kbi s TYR 193 N -3.28 0.08 -0.20 3.49 1.13 -0.66 -4.36 117.35 113.54 1kbi s TYR 193 Ca 0.33 -0.45 -0.20 0.00 -1.41 0.00 0.00 57.07 55.35 1kbi s TYR 193 Cb 0.07 0.12 -0.03 0.00 -1.10 0.00 0.00 41.96 41.02 1kbi s TYR 193 CO 0.13 -0.72 0.58 0.08 -2.51 0.00 0.00 175.55 173.11 1kbi s VAL 194 N -3.88 5.05 0.45 -3.49 1.01 -0.41 -1.74 120.40 117.40 1kbi s VAL 194 Ca 0.09 1.08 -0.08 0.00 0.00 0.00 0.00 61.98 63.06 1kbi s VAL 194 Cb 0.02 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 1kbi s VAL 194 CO -0.06 0.13 0.80 -0.55 0.00 0.00 0.00 175.10 175.42 1kbi s SER 195 N 1.21 6.39 0.32 3.32 0.15 0.35 -0.92 113.70 124.53 1kbi s SER 195 Ca 0.26 1.07 -0.29 0.00 0.70 0.00 0.00 55.95 57.69 1kbi s SER 195 Cb -0.16 -2.30 -0.11 0.00 -1.71 0.00 0.00 66.02 61.74 1kbi s SER 195 CO 0.10 -0.51 1.57 0.00 1.20 0.00 0.00 173.24 175.60 1kbi s ALA 196 N -2.59 3.70 -0.16 5.45 0.00 -1.20 -4.71 121.76 122.27 1kbi s ALA 196 Ca 0.50 1.59 -0.11 0.00 0.00 0.00 0.00 51.96 53.93 1kbi s ALA 196 Cb -0.10 -3.64 0.05 0.00 0.00 0.00 0.00 23.12 19.42 1kbi s ALA 196 CO 0.39 -1.02 0.40 0.95 0.00 0.00 0.00 175.76 176.47 1kbi s THR 197 N -0.31 -0.01 0.71 0.00 -4.23 -1.26 -4.89 115.64 105.65 1kbi s THR 197 Ca 0.61 0.05 -0.08 0.00 -1.18 0.00 0.00 61.69 61.09 1kbi s THR 197 Cb -0.48 -0.57 0.06 0.00 1.34 0.00 0.00 72.50 72.85 1kbi s THR 197 CO 0.53 0.02 1.04 0.00 -0.54 0.00 0.00 174.62 175.67 1kbi s ALA 198 N 0.80 3.05 -1.40 3.99 0.00 -1.26 -4.51 121.76 122.43 1kbi s ALA 198 Ca -0.05 -0.81 -0.08 0.00 0.00 0.00 0.00 51.96 51.02 1kbi s ALA 198 Cb -0.06 -2.70 0.04 0.00 0.00 0.00 0.00 23.12 20.40 1kbi s ALA 198 CO -0.06 -1.32 0.99 1.28 0.00 0.00 0.00 175.76 176.66 1kbi n LEU 199 N -2.97 -3.08 0.29 0.00 4.77 -1.26 -4.88 117.00 109.87 1kbi n LEU 199 Ca 0.08 -0.70 0.17 0.00 -0.03 0.00 0.00 56.01 55.53 1kbi n LEU 199 Cb 0.60 -2.79 0.83 0.00 -2.33 0.00 0.00 43.42 39.74 1kbi n LEU 199 CO 0.54 0.50 1.03 0.00 -1.33 0.00 0.00 177.39 178.13 1kbi h LYS 201 N 0.00 0.00 -0.30 0.00 1.57 -1.89 -1.79 116.57 114.15 1kbi h LYS 201 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1kbi h LYS 201 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1kbi h LYS 201 CO 0.01 0.00 0.18 -0.07 -0.57 0.00 0.00 179.45 178.99 1kbi h LEU 202 N 0.00 0.37 0.00 2.94 3.38 -1.66 -1.89 115.31 118.45 1kbi h LEU 202 Ca 0.00 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 1kbi h LEU 202 Cb 0.31 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1kbi h LEU 202 CO 0.00 0.32 -1.43 0.61 0.09 0.00 0.00 178.44 178.03 1kbi n GLY 203 N -1.03 -1.25 2.59 0.83 0.00 -1.14 -4.53 105.19 100.66 1kbi n GLY 203 Ca -0.02 -0.25 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 1kbi n GLY 203 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1kbi n ASN 204 N -2.68 1.18 -0.26 1.61 2.85 -0.69 -4.50 115.26 112.77 1kbi n ASN 204 Ca -0.06 -2.78 0.04 0.00 -0.11 0.00 0.00 54.58 51.66 1kbi n ASN 204 Cb 0.70 -0.65 0.17 0.00 1.24 0.00 0.00 39.78 41.24 1kbi n ASN 204 CO 0.00 0.00 0.00 -0.65 -2.11 0.00 0.00 177.26 174.50 1kbi h PRO 205 N 5.37 0.56 -0.05 1.20 0.11 -1.58 0.25 132.00 137.87 1kbi h PRO 205 Ca 0.21 -0.03 -0.16 0.00 0.11 0.00 0.00 66.00 66.12 1kbi h PRO 205 Cb 0.83 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1kbi h PRO 205 CO 0.54 0.37 -0.68 -0.07 -0.21 0.00 0.00 178.00 177.95 1kbi h LEU 206 N 0.58 0.26 0.00 2.35 4.07 -1.95 -3.41 115.31 117.21 1kbi h LEU 206 Ca 0.39 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 58.19 1kbi h LEU 206 Cb 0.50 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 42.16 1kbi h LEU 206 CO -0.32 0.86 -0.81 -0.62 -1.08 0.00 0.00 178.44 176.47 1kbi n GLU 207 N -3.81 2.77 0.00 1.13 -0.58 -1.09 -5.06 120.64 114.00 1kbi n GLU 207 Ca -0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.71 1kbi n GLU 207 Cb 0.67 -0.91 0.00 0.00 -0.57 0.00 0.00 31.44 30.63 1kbi n GLU 207 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1kbi n GLY 208 N 2.62 3.00 0.33 0.62 0.00 0.85 -1.20 105.19 111.41 1kbi n GLY 208 Ca 0.00 0.01 0.17 0.00 0.00 0.00 0.00 46.02 46.20 1kbi n GLY 208 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1kbi h GLU 209 N 0.00 0.00 -0.23 1.61 3.07 -1.88 -2.00 114.58 115.15 1kbi h GLU 209 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 1kbi h GLU 209 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 1kbi h GLU 209 CO 0.00 0.00 -0.27 0.87 -1.40 0.00 0.00 179.01 178.21 1kbi h LYS 210 N 0.00 0.44 0.00 2.33 1.57 -1.50 -1.68 116.57 117.74 1kbi h LYS 210 Ca 0.07 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1kbi h LYS 210 Cb 0.40 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1kbi h LYS 210 CO -0.00 0.68 -0.30 -0.44 -0.57 0.00 0.00 179.45 178.82 1kbi h ASP 211 N 0.39 0.00 -0.15 0.86 5.19 -1.42 -1.12 116.42 120.17 1kbi h ASP 211 Ca 0.06 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.42 1kbi h ASP 211 Cb 0.68 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.19 1kbi h ASP 211 CO 0.05 0.30 -0.09 0.58 -3.12 0.00 0.00 179.24 176.96 1kbi h VAL 212 N 0.00 1.32 -0.62 -1.35 2.07 -1.39 0.85 116.25 117.14 1kbi h VAL 212 Ca -0.00 -1.17 0.11 0.00 0.82 0.00 0.00 66.70 66.46 1kbi h VAL 212 Cb 0.93 1.78 -0.09 0.00 -1.52 0.00 0.00 31.29 32.39 1kbi h VAL 212 CO 0.04 0.34 0.15 0.00 0.02 0.00 0.00 177.57 178.12 1kbi h ALA 213 N 0.65 0.75 0.08 1.67 0.00 -0.91 0.57 119.26 122.07 1kbi h ALA 213 Ca 0.03 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1kbi h ALA 213 Cb 0.58 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1kbi h ALA 213 CO 0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 179.25 178.95 1kbi h ARG 214 N 0.29 -0.10 -0.95 0.00 3.08 -1.08 -2.36 114.38 113.25 1kbi h ARG 214 Ca 0.32 0.01 0.11 0.00 0.07 0.00 0.00 59.98 60.49 1kbi h ARG 214 Cb 0.48 0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.48 1kbi h ARG 214 CO -0.40 0.19 0.61 0.78 -1.07 0.00 0.00 179.97 180.08 1kbi h GLY 215 N -0.40 1.45 2.00 0.04 0.00 -0.23 0.27 103.07 106.19 1kbi h GLY 215 Ca -0.01 -0.39 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 1kbi h GLY 215 CO 0.02 0.18 -0.15 0.00 0.00 0.00 0.00 176.54 176.58 1kbi n GLY 217 N 0.35 -0.74 0.14 0.00 0.00 -0.74 -1.06 105.19 103.13 1kbi n GLY 217 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 1kbi n GLY 217 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1kbi h GLN 218 N 0.00 0.33 0.00 1.61 3.07 -1.13 -3.36 115.11 115.63 1kbi h GLN 218 Ca 0.00 -0.41 -0.25 0.00 0.09 0.00 0.00 58.65 58.08 1kbi h GLN 218 Cb 0.04 0.13 0.06 0.00 0.08 0.00 0.00 27.48 27.79 1kbi h GLN 218 CO 0.00 1.11 0.11 0.41 0.09 0.00 0.00 178.83 180.55 1kbi n GLY 219 N 1.11 0.12 0.29 0.06 0.00 -1.26 -4.95 105.19 100.56 1kbi n GLY 219 Ca -0.07 -1.91 0.17 0.00 0.00 0.00 0.00 46.02 44.22 1kbi n GLY 219 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1kbi h VAL 220 N -0.77 0.20 -3.53 1.61 -1.51 -1.99 -3.38 116.25 106.88 1kbi h VAL 220 Ca -0.20 -0.39 -0.67 0.00 -1.23 0.00 0.00 66.70 64.21 1kbi h VAL 220 Cb 0.66 1.32 -0.30 0.00 -2.13 0.00 0.00 31.29 30.84 1kbi h VAL 220 CO 0.19 0.04 -0.71 -0.89 -1.23 0.00 0.00 177.57 174.97 1kbi s THR 221 N -3.97 3.24 -0.09 7.19 2.01 -1.26 -5.09 115.64 117.66 1kbi s THR 221 Ca -0.02 -0.87 -0.04 0.00 0.31 0.00 0.00 61.69 61.07 1kbi s THR 221 Cb 0.11 -2.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 1kbi s THR 221 CO 0.52 0.19 0.07 -0.54 -0.69 0.00 0.00 174.62 174.17 1kbi s LYS 222 N 1.39 3.18 0.03 4.92 1.02 -1.26 -4.77 119.74 124.26 1kbi s LYS 222 Ca 0.01 -0.30 0.07 0.00 0.02 0.00 0.00 55.97 55.78 1kbi s LYS 222 Cb -0.17 -2.97 -0.02 0.00 -0.52 0.00 0.00 37.83 34.15 1kbi s LYS 222 CO -0.02 0.73 -0.21 0.08 -0.92 0.00 0.00 175.35 175.01 1kbi s VAL 223 N -0.98 1.67 0.36 3.17 1.01 -0.22 -4.01 120.40 121.39 1kbi s VAL 223 Ca 0.15 -1.16 -0.27 0.00 0.00 0.00 0.00 61.98 60.70 1kbi s VAL 223 Cb -0.12 -1.44 -0.09 0.00 0.00 0.00 0.00 36.38 34.73 1kbi s VAL 223 CO 0.04 0.25 1.21 -2.84 0.00 0.00 0.00 175.10 173.76 1kbi s PRO 224 N -1.08 4.25 -0.15 2.72 0.02 -1.26 -4.60 135.00 134.90 1kbi s PRO 224 Ca 0.08 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.07 1kbi s PRO 224 Cb -0.09 -2.90 -0.00 0.00 0.02 0.00 0.00 34.50 31.53 1kbi s PRO 224 CO 0.01 -0.19 -0.15 -1.14 -0.33 0.00 0.00 177.00 175.20 1kbi s GLN 225 N -1.97 3.25 -0.18 5.54 0.74 -0.68 -1.28 119.66 125.07 1kbi s GLN 225 Ca 0.52 -0.74 -0.11 0.00 0.05 0.00 0.00 55.36 55.09 1kbi s GLN 225 Cb -0.34 -2.63 -0.05 0.00 1.10 0.00 0.00 33.01 31.09 1kbi s GLN 225 CO 0.44 0.06 0.18 1.41 -0.55 0.00 0.00 175.29 176.83 1kbi s MET 226 N 0.72 4.11 -0.23 1.67 -2.45 -0.09 -0.44 119.30 122.59 1kbi s MET 226 Ca -0.07 -0.12 -0.08 0.00 -1.25 0.00 0.00 55.69 54.17 1kbi s MET 226 Cb -0.15 -3.39 -0.03 0.00 1.25 0.00 0.00 34.83 32.50 1kbi s MET 226 CO 0.01 0.35 0.08 0.42 1.05 0.00 0.00 175.02 176.93 1kbi s ILE 227 N 0.20 4.56 0.31 10.11 1.01 0.10 -3.22 121.20 134.27 1kbi s ILE 227 Ca 0.11 -0.09 -0.29 0.00 0.00 0.00 0.00 60.65 60.38 1kbi s ILE 227 Cb -0.12 -3.12 -0.10 0.00 0.01 0.00 0.00 42.46 39.14 1kbi s ILE 227 CO 0.00 0.36 1.25 -0.55 0.00 0.00 0.00 174.94 176.00 1kbi s SER 228 N 1.25 6.93 0.56 3.58 0.15 -1.26 0.11 113.70 125.02 1kbi s SER 228 Ca 0.05 2.55 0.25 0.00 0.70 0.00 0.00 55.95 59.50 1kbi s SER 228 Cb -0.14 -2.64 1.60 0.00 -1.71 0.00 0.00 66.02 63.12 1kbi s SER 228 CO 0.04 -0.42 2.19 0.74 1.20 0.00 0.00 173.24 177.00 1kbi h THR 229 N 3.10 0.69 -0.70 6.45 2.02 -1.84 -0.90 112.91 121.73 1kbi h THR 229 Ca -0.48 -0.10 -0.16 0.00 0.77 0.00 0.00 66.41 66.44 1kbi h THR 229 Cb 1.22 1.06 -0.10 0.00 -1.74 0.00 0.00 68.15 68.60 1kbi h THR 229 CO 0.67 0.03 0.20 0.18 0.37 0.00 0.00 175.52 176.96 1kbi n LEU 230 N -4.02 6.02 -4.57 2.58 4.77 -1.26 -5.01 117.00 115.50 1kbi n LEU 230 Ca -0.03 -3.16 -0.34 0.00 -0.03 0.00 0.00 56.01 52.45 1kbi n LEU 230 Cb 0.11 -0.73 0.11 0.00 -2.33 0.00 0.00 43.42 40.58 1kbi n LEU 230 CO 0.30 0.77 0.39 0.00 -1.33 0.00 0.00 177.39 177.51 1kbi n ALA 231 N 0.03 -0.97 1.69 -1.18 0.00 -0.34 -4.04 120.51 115.70 1kbi n ALA 231 Ca 0.38 -0.36 0.14 0.00 0.00 0.00 0.00 53.44 53.60 1kbi n ALA 231 Cb 1.35 -2.04 0.67 0.00 0.00 0.00 0.00 19.45 19.42 1kbi n ALA 231 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1kbi n SER 232 N -1.98 0.89 -4.39 0.00 3.41 -1.26 -4.30 113.62 105.99 1kbi n SER 232 Ca 0.11 -1.33 -0.21 0.00 -0.26 0.00 0.00 58.87 57.18 1kbi n SER 232 Cb 0.51 -0.01 -0.10 0.00 -0.26 0.00 0.00 64.21 64.35 1kbi n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1kbi s SER 234 N -3.24 6.70 0.41 0.00 1.04 -1.26 -4.77 113.70 112.58 1kbi s SER 234 Ca 0.24 1.59 0.10 0.00 0.48 0.00 0.00 55.95 58.36 1kbi s SER 234 Cb -0.04 -2.51 0.88 0.00 0.10 0.00 0.00 66.02 64.45 1kbi s SER 234 CO 0.10 -0.52 1.98 1.55 0.98 0.00 0.00 173.24 177.32 1kbi h PRO 235 N 1.18 0.24 -0.43 4.02 0.13 -1.97 -1.83 132.00 133.34 1kbi h PRO 235 Ca -0.47 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.54 1kbi h PRO 235 Cb 1.18 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 1kbi h PRO 235 CO 0.61 0.31 -0.03 1.05 -0.23 0.00 0.00 178.00 179.71 1kbi h GLU 236 N 0.23 0.78 -0.08 0.86 9.09 -1.99 -0.77 114.58 122.70 1kbi h GLU 236 Ca 0.05 -0.26 -0.12 0.00 0.05 0.00 0.00 59.36 59.08 1kbi h GLU 236 Cb 0.25 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 27.27 1kbi h GLU 236 CO 0.01 0.87 -0.49 1.05 0.05 0.00 0.00 179.01 180.50 1kbi h GLU 237 N 0.62 0.21 -0.28 1.06 4.11 -1.87 -0.38 114.58 118.04 1kbi h GLU 237 Ca 0.12 -0.11 -0.06 0.00 0.07 0.00 0.00 59.36 59.38 1kbi h GLU 237 Cb 0.53 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1kbi h GLU 237 CO 0.03 0.65 -0.04 0.82 0.07 0.00 0.00 179.01 180.54 1kbi h ILE 238 N 0.17 1.27 -0.03 -1.06 2.04 -1.14 -1.50 117.51 117.26 1kbi h ILE 238 Ca 0.01 -1.02 -0.12 0.00 1.00 0.00 0.00 64.86 64.73 1kbi h ILE 238 Cb 0.92 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.36 1kbi h ILE 238 CO 0.07 0.33 -0.53 0.40 0.00 0.00 0.00 178.15 178.42 1kbi h ILE 239 N 0.30 1.37 0.00 -0.67 2.04 -1.06 -3.05 117.51 116.44 1kbi h ILE 239 Ca 0.08 -1.81 -0.14 0.00 1.00 0.00 0.00 64.86 63.98 1kbi h ILE 239 Cb 0.50 1.94 -0.02 0.00 -0.74 0.00 0.00 36.82 38.50 1kbi h ILE 239 CO 0.02 0.52 -0.67 -0.08 0.00 0.00 0.00 178.15 177.95 1kbi h GLU 240 N 0.06 0.00 0.00 2.37 4.22 -0.90 -2.91 114.58 117.43 1kbi h GLU 240 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1kbi h GLU 240 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1kbi h GLU 240 CO 0.07 0.67 0.00 0.00 -2.18 0.00 0.00 179.01 177.57 1kbi h ALA 241 N 1.33 1.00 -2.01 2.92 0.00 -1.16 -3.44 119.26 117.89 1kbi h ALA 241 Ca -0.01 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.32 1kbi h ALA 241 Cb 1.22 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.02 1kbi h ALA 241 CO 0.09 0.00 1.35 0.00 0.00 0.00 0.00 179.25 180.69 1kbi n ALA 242 N -1.82 1.52 0.25 0.00 0.00 -1.10 -4.45 120.51 114.91 1kbi n ALA 242 Ca 0.02 -0.01 0.12 0.00 0.00 0.00 0.00 53.44 53.57 1kbi n ALA 242 Cb 0.27 -2.75 0.67 0.00 0.00 0.00 0.00 19.45 17.64 1kbi n ALA 242 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1kbi h PRO 243 N 12.58 0.00 -6.51 0.00 0.11 -1.84 -3.45 132.00 132.89 1kbi h PRO 243 Ca -0.43 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 65.04 1kbi h PRO 243 Cb 1.25 0.00 -0.24 0.00 0.11 0.00 0.00 31.00 32.12 1kbi h PRO 243 CO 0.96 0.14 -0.86 0.45 -0.21 0.00 0.00 178.00 178.48 1kbi s SER 244 N -6.16 2.91 0.30 -2.05 0.15 -1.26 -4.97 113.70 102.63 1kbi s SER 244 Ca -0.02 -0.64 0.24 0.00 0.70 0.00 0.00 55.95 56.22 1kbi s SER 244 Cb 0.12 -0.22 0.37 0.00 -1.71 0.00 0.00 66.02 64.58 1kbi s SER 244 CO 0.59 0.17 1.48 0.44 1.20 0.00 0.00 173.24 177.13 1kbi h ASP 245 N 4.39 0.00 0.22 5.45 3.32 -1.94 -3.23 116.42 124.64 1kbi h ASP 245 Ca -0.47 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1kbi h ASP 245 Cb 1.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.71 1kbi h ASP 245 CO 0.41 0.01 -0.19 0.29 -1.72 0.00 0.00 179.24 178.05 1kbi n LYS 246 N -2.70 0.93 -2.94 3.56 5.02 -1.26 -4.89 118.16 115.87 1kbi n LYS 246 Ca 0.03 -0.51 -0.37 0.00 -2.02 0.00 0.00 58.31 55.44 1kbi n LYS 246 Cb 0.50 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.96 1kbi n LYS 246 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1kbi s GLN 247 N -2.42 4.46 -0.08 1.97 -2.07 -1.22 -5.04 119.66 115.26 1kbi s GLN 247 Ca 0.27 1.12 -0.16 0.00 -1.82 0.00 0.00 55.36 54.77 1kbi s GLN 247 Cb 0.20 -2.94 -0.05 0.00 -1.09 0.00 0.00 33.01 29.13 1kbi s GLN 247 CO 0.48 0.39 0.42 0.42 -1.32 0.00 0.00 175.29 175.68 1kbi s ILE 248 N -1.47 5.14 -0.08 3.63 -1.09 -1.26 -5.01 121.20 121.05 1kbi s ILE 248 Ca 0.44 0.84 0.03 0.00 -2.23 0.00 0.00 60.65 59.72 1kbi s ILE 248 Cb -0.19 -3.74 0.01 0.00 -1.58 0.00 0.00 42.46 36.96 1kbi s ILE 248 CO 0.23 0.44 -0.15 -1.10 -1.23 0.00 0.00 174.94 173.13 1kbi s GLN 249 N -0.10 2.10 0.16 2.79 -0.21 -1.26 -1.69 119.66 121.45 1kbi s GLN 249 Ca 0.23 -0.54 0.07 0.00 0.02 0.00 0.00 55.36 55.14 1kbi s GLN 249 Cb -0.15 -1.70 -0.04 0.00 1.00 0.00 0.00 33.01 32.12 1kbi s GLN 249 CO 0.10 0.04 0.01 -1.58 -2.12 0.00 0.00 175.29 171.75 1kbi s TRP 250 N 0.65 2.88 -0.18 0.91 0.51 0.41 -0.74 118.94 123.38 1kbi s TRP 250 Ca -0.14 -0.12 -0.03 0.00 -2.12 0.00 0.00 56.10 53.69 1kbi s TRP 250 Cb -0.16 -1.40 -0.01 0.00 -0.81 0.00 0.00 33.47 31.08 1kbi s TRP 250 CO 0.04 0.51 -0.07 -0.47 -0.51 0.00 0.00 176.95 176.45 1kbi s TYR 251 N -1.68 2.92 -0.21 -1.98 6.14 -0.38 -0.72 117.35 121.44 1kbi s TYR 251 Ca 0.27 -0.72 -0.19 0.00 0.64 0.00 0.00 57.07 57.07 1kbi s TYR 251 Cb -0.10 -1.99 -0.03 0.00 0.42 0.00 0.00 41.96 40.26 1kbi s TYR 251 CO 0.19 -0.34 0.57 -1.14 0.64 0.00 0.00 175.55 175.46 1kbi s GLN 252 N 0.90 4.17 -0.12 4.97 -0.44 0.12 -0.47 119.66 128.79 1kbi s GLN 252 Ca -0.01 0.49 -0.03 0.00 -2.50 0.00 0.00 55.36 53.30 1kbi s GLN 252 Cb -0.15 -3.59 -0.03 0.00 -1.64 0.00 0.00 33.01 27.60 1kbi s GLN 252 CO 0.01 -0.23 -0.00 -1.17 0.50 0.00 0.00 175.29 174.39 1kbi s LEU 253 N 1.91 3.51 -0.27 3.68 2.96 0.11 -2.27 118.68 128.30 1kbi s LEU 253 Ca 0.26 0.05 -0.03 0.00 -0.22 0.00 0.00 54.13 54.19 1kbi s LEU 253 Cb -0.16 -1.83 0.03 0.00 0.50 0.00 0.00 46.19 44.74 1kbi s LEU 253 CO 0.10 0.29 -0.01 -0.31 -1.32 0.00 0.00 176.35 175.09 1kbi s TYR 254 N -0.34 3.15 0.03 5.38 2.02 -1.26 -1.94 117.35 124.38 1kbi s TYR 254 Ca 0.07 -1.56 -0.30 0.00 -0.37 0.00 0.00 57.07 54.91 1kbi s TYR 254 Cb -0.12 -2.11 -0.06 0.00 -0.40 0.00 0.00 41.96 39.26 1kbi s TYR 254 CO 0.02 -0.73 1.42 0.08 -1.57 0.00 0.00 175.55 174.77 1kbi s VAL 255 N 1.33 3.58 0.50 0.71 1.01 -1.26 -4.92 120.40 121.36 1kbi s VAL 255 Ca -0.01 1.01 -0.17 0.00 0.00 0.00 0.00 61.98 62.81 1kbi s VAL 255 Cb -0.18 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.47 1kbi s VAL 255 CO -0.02 0.01 0.98 0.21 0.00 0.00 0.00 175.10 176.29 1kbi s ASN 256 N 1.79 6.63 0.49 3.32 3.84 -1.26 -1.15 114.94 128.61 1kbi s ASN 256 Ca 0.65 1.61 0.20 0.00 0.21 0.00 0.00 52.86 55.53 1kbi s ASN 256 Cb -0.33 -2.52 1.26 0.00 -0.55 0.00 0.00 41.25 39.12 1kbi s ASN 256 CO 0.28 -0.58 2.06 0.28 -2.79 0.00 0.00 177.10 176.35 1kbi h SER 257 N 1.08 0.00 -2.85 -4.21 0.02 -1.02 -3.29 113.55 103.27 1kbi h SER 257 Ca -0.47 0.00 -0.70 0.00 -0.84 0.00 0.00 61.79 59.77 1kbi h SER 257 Cb 1.19 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.53 1kbi h SER 257 CO 0.61 0.12 0.42 -0.62 -1.14 0.00 0.00 176.83 176.23 1kbi s ASP 258 N -6.66 6.44 0.26 3.07 -1.08 -1.26 -4.90 116.67 112.53 1kbi s ASP 258 Ca -0.04 -1.80 0.20 0.00 -0.52 0.00 0.00 52.55 50.39 1kbi s ASP 258 Cb 0.15 -2.34 0.97 0.00 -1.46 0.00 0.00 42.92 40.25 1kbi s ASP 258 CO 0.64 -1.05 1.60 0.54 0.52 0.00 0.00 175.17 177.43 1kbi n ARG 259 N 6.20 0.14 -0.13 4.34 5.12 -1.24 -1.97 116.66 129.11 1kbi n ARG 259 Ca 0.07 0.54 -0.12 0.00 -1.93 0.00 0.00 57.85 56.41 1kbi n ARG 259 Cb 0.46 -1.87 -0.02 0.00 -1.16 0.00 0.00 32.46 29.87 1kbi n ARG 259 CO 0.00 0.00 0.00 -0.22 -1.93 0.00 0.00 177.63 175.48 1kbi h LYS 260 N 0.00 0.88 -0.84 5.56 1.63 -1.91 0.37 116.57 122.25 1kbi h LYS 260 Ca 0.00 -0.41 -0.03 0.00 -0.85 0.00 0.00 60.65 59.36 1kbi h LYS 260 Cb 0.12 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.70 1kbi h LYS 260 CO 0.00 1.06 0.41 0.82 -3.45 0.00 0.00 179.45 178.29 1kbi h ILE 261 N 0.69 1.26 -0.38 2.00 2.04 -1.79 -0.39 117.51 120.94 1kbi h ILE 261 Ca 0.08 -0.72 -0.09 0.00 1.00 0.00 0.00 64.86 65.13 1kbi h ILE 261 Cb 0.83 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.07 1kbi h ILE 261 CO 0.07 0.31 -0.12 0.74 0.00 0.00 0.00 178.15 179.15 1kbi h THR 262 N 1.20 1.28 -0.46 -0.27 2.02 -1.52 -0.31 112.91 114.86 1kbi h THR 262 Ca 0.29 -1.22 0.02 0.00 0.77 0.00 0.00 66.41 66.27 1kbi h THR 262 Cb 0.11 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 1kbi h THR 262 CO -0.04 0.41 0.27 -0.78 0.37 0.00 0.00 175.52 175.74 1kbi h ASP 263 N 0.55 0.43 -0.53 4.18 3.58 -0.49 0.20 116.42 124.33 1kbi h ASP 263 Ca 0.09 0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.51 1kbi h ASP 263 Cb 0.65 -0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.59 1kbi h ASP 263 CO 0.04 0.31 0.20 0.44 -2.88 0.00 0.00 179.24 177.35 1kbi h ASP 264 N 0.54 0.74 -0.51 2.28 3.32 -0.96 -2.28 116.42 119.55 1kbi h ASP 264 Ca 0.18 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 57.03 1kbi h ASP 264 Cb 0.02 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1kbi h ASP 264 CO -0.09 0.72 0.20 0.25 -1.72 0.00 0.00 179.24 178.60 1kbi h LEU 265 N 0.72 0.70 -0.33 1.55 5.85 -0.50 0.78 115.31 124.08 1kbi h LEU 265 Ca 0.18 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.73 1kbi h LEU 265 Cb 0.21 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1kbi h LEU 265 CO -0.01 0.67 0.21 0.58 -0.34 0.00 0.00 178.44 179.55 1kbi h VAL 266 N 0.68 1.10 -0.84 1.05 2.07 -0.48 -0.66 116.25 119.16 1kbi h VAL 266 Ca 0.17 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1kbi h VAL 266 Cb 0.19 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 1kbi h VAL 266 CO -0.01 0.10 0.46 0.11 0.02 0.00 0.00 177.57 178.24 1kbi h LYS 267 N 0.43 1.18 0.39 1.57 1.57 -1.18 -1.67 116.57 118.86 1kbi h LYS 267 Ca 0.12 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1kbi h LYS 267 Cb -0.02 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.06 1kbi h LYS 267 CO -0.02 0.87 -0.19 -0.97 -0.57 0.00 0.00 179.45 178.57 1kbi h ASN 268 N 1.17 -0.44 -0.01 0.86 -1.24 -0.26 -1.35 115.58 114.31 1kbi h ASN 268 Ca 0.30 -0.07 -0.03 0.00 0.71 0.00 0.00 56.30 57.21 1kbi h ASN 268 Cb 0.04 0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.19 1kbi h ASN 268 CO -0.05 -0.20 -0.06 -0.37 -1.29 0.00 0.00 177.43 175.47 1kbi h VAL 269 N -0.68 1.12 -0.40 2.57 -1.51 -1.06 0.41 116.25 116.70 1kbi h VAL 269 Ca -0.05 -0.50 -0.11 0.00 -1.23 0.00 0.00 66.70 64.81 1kbi h VAL 269 Cb 0.49 1.10 -0.01 0.00 -2.13 0.00 0.00 31.29 30.73 1kbi h VAL 269 CO 0.09 0.16 -0.16 -0.08 -1.23 0.00 0.00 177.57 176.34 1kbi h GLU 270 N 0.17 0.81 -0.52 5.19 4.81 -1.22 -1.89 114.58 121.94 1kbi h GLU 270 Ca 0.04 -0.34 -0.06 0.00 -0.13 0.00 0.00 59.36 58.87 1kbi h GLU 270 Cb 0.22 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.55 1kbi h GLU 270 CO 0.01 0.97 0.10 -0.22 -0.73 0.00 0.00 179.01 179.14 1kbi h LYS 271 N 0.62 0.81 0.00 1.92 3.64 -0.46 -1.67 116.57 121.43 1kbi h LYS 271 Ca 0.09 -0.18 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1kbi h LYS 271 Cb 0.71 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1kbi h LYS 271 CO 0.05 0.75 0.00 1.28 -2.27 0.00 0.00 179.45 179.26 1kbi n LEU 272 N -4.26 0.61 0.00 5.20 4.77 0.06 -4.90 117.00 118.48 1kbi n LEU 272 Ca 0.03 0.66 0.00 0.00 -0.03 0.00 0.00 56.01 56.67 1kbi n LEU 272 Cb 0.24 -0.59 0.00 0.00 -2.33 0.00 0.00 43.42 40.75 1kbi n LEU 272 CO 0.40 -0.56 0.00 0.61 -1.33 0.00 0.00 177.39 176.51 1kbi n GLY 273 N -0.09 1.02 3.74 -0.72 0.00 -0.63 -5.05 105.19 103.45 1kbi n GLY 273 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1kbi n GLY 273 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1kbi s VAL 274 N -2.00 2.68 -2.25 1.61 -7.23 -1.00 -4.82 120.40 107.38 1kbi s VAL 274 Ca 0.00 0.31 0.23 0.00 -1.81 0.00 0.00 61.98 60.71 1kbi s VAL 274 Cb 0.00 -2.81 0.06 0.00 0.56 0.00 0.00 36.38 34.20 1kbi s VAL 274 CO 0.00 -0.20 1.17 0.29 -0.31 0.00 0.00 175.10 176.05 1kbi n LYS 275 N -2.80 1.46 -3.59 4.82 4.76 0.08 -4.84 118.16 118.05 1kbi n LYS 275 Ca 0.12 -1.19 -0.05 0.00 -2.87 0.00 0.00 58.31 54.32 1kbi n LYS 275 Cb 0.51 -1.48 -0.02 0.00 -1.84 0.00 0.00 35.03 32.21 1kbi n LYS 275 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1kbi s ALA 276 N -2.36 -1.90 -0.17 7.82 0.00 -1.26 -4.22 121.76 119.67 1kbi s ALA 276 Ca 0.21 0.92 0.01 0.00 0.00 0.00 0.00 51.96 53.10 1kbi s ALA 276 Cb 0.19 0.33 0.02 0.00 0.00 0.00 0.00 23.12 23.66 1kbi s ALA 276 CO 0.50 -0.79 -0.19 -0.51 0.00 0.00 0.00 175.76 174.78 1kbi s LEU 277 N -2.58 2.01 -0.43 0.00 1.43 -0.52 -1.25 118.68 117.34 1kbi s LEU 277 Ca 0.09 -0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 52.47 1kbi s LEU 277 Cb -0.00 -1.39 0.08 0.00 0.03 0.00 0.00 46.19 44.90 1kbi s LEU 277 CO -0.05 -0.01 0.30 -0.36 0.23 0.00 0.00 176.35 176.47 1kbi s PHE 278 N 1.29 3.30 -0.29 0.29 0.40 0.38 -0.48 117.98 122.88 1kbi s PHE 278 Ca 0.04 -1.32 -0.23 0.00 -0.60 0.00 0.00 56.93 54.82 1kbi s PHE 278 Cb -0.13 -3.01 -0.00 0.00 0.51 0.00 0.00 43.02 40.38 1kbi s PHE 278 CO -0.11 -0.83 0.78 0.08 0.70 0.00 0.00 175.22 175.84 1kbi s VAL 279 N 1.50 4.83 -0.16 -0.44 1.01 0.16 0.04 120.40 127.33 1kbi s VAL 279 Ca 0.03 1.26 -0.26 0.00 0.00 0.00 0.00 61.98 63.01 1kbi s VAL 279 Cb -0.23 -4.11 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 1kbi s VAL 279 CO 0.04 -0.18 0.88 -0.89 0.00 0.00 0.00 175.10 174.95 1kbi s THR 280 N 2.88 4.85 -0.37 3.92 2.01 -0.82 -0.17 115.64 127.93 1kbi s THR 280 Ca 0.32 1.75 0.03 0.00 0.31 0.00 0.00 61.69 64.10 1kbi s THR 280 Cb -0.15 -4.19 0.06 0.00 0.01 0.00 0.00 72.50 68.24 1kbi s THR 280 CO 0.11 0.01 0.84 1.33 -0.69 0.00 0.00 174.62 176.22 1kbi n VAL 281 N 4.74 0.49 -0.89 3.82 0.24 0.49 -4.65 118.33 122.57 1kbi n VAL 281 Ca 0.06 -0.74 0.07 0.00 -2.04 0.00 0.00 64.34 61.69 1kbi n VAL 281 Cb 0.49 0.79 0.40 0.00 -1.47 0.00 0.00 33.84 34.05 1kbi n VAL 281 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1kbi n ASP 282 N 0.02 5.69 -2.62 -1.34 5.68 -1.25 -4.47 116.55 118.25 1kbi n ASP 282 Ca 0.03 -2.91 -0.03 0.00 -0.50 0.00 0.00 54.79 51.38 1kbi n ASP 282 Cb 0.20 -0.68 0.05 0.00 -1.14 0.00 0.00 41.12 39.54 1kbi n ASP 282 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1kbi n ALA 283 N 0.65 2.96 0.30 2.12 0.00 -1.26 -4.78 120.51 120.49 1kbi n ALA 283 Ca 0.28 -2.90 0.18 0.00 0.00 0.00 0.00 53.44 51.00 1kbi n ALA 283 Cb 1.18 -0.78 0.99 0.00 0.00 0.00 0.00 19.45 20.84 1kbi n ALA 283 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1kbi h PRO 284 N 2.44 0.00 -4.93 0.00 0.13 -1.88 -3.39 132.00 124.37 1kbi h PRO 284 Ca -0.06 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.66 1kbi h PRO 284 Cb 1.34 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.20 1kbi h PRO 284 CO 0.26 0.00 -0.78 0.45 -0.23 0.00 0.00 178.00 177.70 1kbi s SER 285 N -5.71 1.26 -0.06 1.44 0.15 -1.26 -4.44 113.70 105.08 1kbi s SER 285 Ca -0.05 -0.29 -0.30 0.00 0.70 0.00 0.00 55.95 56.02 1kbi s SER 285 Cb 0.14 -0.11 -0.04 0.00 -1.71 0.00 0.00 66.02 64.30 1kbi s SER 285 CO 0.49 0.07 1.40 -0.22 1.20 0.00 0.00 173.24 176.18 1kbi s LEU 286 N -0.60 4.28 0.40 3.45 2.96 0.54 -4.99 118.68 124.72 1kbi s LEU 286 Ca 0.02 2.00 -0.27 0.00 -0.22 0.00 0.00 54.13 55.66 1kbi s LEU 286 Cb -0.05 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.99 1kbi s LEU 286 CO 0.00 -0.77 1.45 -0.83 -1.32 0.00 0.00 176.35 174.89 1kbi s GLY 287 N 2.20 2.94 -0.52 7.98 0.00 -1.25 -4.93 107.32 113.74 1kbi s GLY 287 Ca 0.63 1.51 -0.22 0.00 0.00 0.00 0.00 44.72 46.64 1kbi s GLY 287 CO 0.24 2.17 0.78 1.20 0.00 0.00 0.00 173.10 177.49 1kbi s GLN 288 N -2.19 3.25 -0.77 2.90 -1.52 -1.26 -4.96 119.66 115.10 1kbi s GLN 288 Ca 0.55 -0.51 -0.16 0.00 -1.95 0.00 0.00 55.36 53.29 1kbi s GLN 288 Cb -0.45 -4.06 0.18 0.00 -0.22 0.00 0.00 33.01 28.46 1kbi s GLN 288 CO 0.60 -1.32 0.78 1.03 -0.25 0.00 0.00 175.29 176.12 1kbi s ARG 289 N 3.30 3.45 0.58 2.91 0.52 -1.26 -1.08 118.95 127.36 1kbi s ARG 289 Ca 0.24 -2.10 0.27 0.00 -0.52 0.00 0.00 55.73 53.62 1kbi s ARG 289 Cb -0.15 -4.47 1.65 0.00 0.52 0.00 0.00 34.95 32.50 1kbi s ARG 289 CO 0.16 -1.40 2.15 0.93 0.02 0.00 0.00 175.30 177.17 1kbi h GLU 290 N 8.28 0.00 -0.55 3.54 5.08 -1.85 -1.78 114.58 127.30 1kbi h GLU 290 Ca 0.01 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1kbi h GLU 290 Cb 1.05 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 1kbi h GLU 290 CO 0.89 0.00 0.08 0.87 -1.00 0.00 0.00 179.01 179.86 1kbi h LYS 291 N 0.00 0.88 0.18 2.33 1.57 -1.92 -0.31 116.57 119.31 1kbi h LYS 291 Ca 0.05 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1kbi h LYS 291 Cb 0.29 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1kbi h LYS 291 CO -0.00 0.83 -0.09 -0.44 -0.57 0.00 0.00 179.45 179.18 1kbi h ASP 292 N 0.84 -0.20 -0.59 0.86 3.45 -1.61 -2.73 116.42 116.44 1kbi h ASP 292 Ca 0.17 -0.25 0.11 0.00 0.43 0.00 0.00 57.03 57.49 1kbi h ASP 292 Cb 0.38 0.05 -0.09 0.00 -0.56 0.00 0.00 39.33 39.12 1kbi h ASP 292 CO 0.01 0.16 0.11 0.24 -1.57 0.00 0.00 179.24 178.19 1kbi h MET 293 N -0.59 0.23 -0.43 3.56 2.86 -1.32 -0.40 114.93 118.84 1kbi h MET 293 Ca -0.02 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1kbi h MET 293 Cb 0.44 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.02 1kbi h MET 293 CO 0.04 0.15 0.26 -0.22 1.06 0.00 0.00 176.91 178.20 1kbi h LYS 294 N 0.24 0.51 -0.56 1.72 3.64 -1.06 -1.28 116.57 119.78 1kbi h LYS 294 Ca 0.31 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.70 1kbi h LYS 294 Cb 0.45 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 1kbi h LYS 294 CO -0.40 0.34 0.29 1.25 -2.27 0.00 0.00 179.45 178.65 1kbi h LEU 295 N 0.53 0.42 -1.59 5.20 6.46 -0.98 -1.03 115.31 124.32 1kbi h LEU 295 Ca 0.17 0.03 -0.04 0.00 -0.12 0.00 0.00 57.88 57.91 1kbi h LEU 295 Cb -0.01 -0.05 -0.01 0.00 -0.73 0.00 0.00 40.66 39.86 1kbi h LEU 295 CO -0.07 0.28 -0.20 0.11 -0.62 0.00 0.00 178.44 177.95 1kbi h LYS 296 N 0.55 0.00 0.23 1.25 1.57 -0.41 -3.14 116.57 116.62 1kbi h LYS 296 Ca 0.25 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.71 1kbi h LYS 296 Cb 0.15 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.50 1kbi h LYS 296 CO -0.17 0.20 -1.41 0.74 -0.57 0.00 0.00 179.45 178.24 1kbi h PHE 297 N 0.00 0.90 0.00 -1.35 0.04 -0.21 -3.25 116.94 113.07 1kbi h PHE 297 Ca -0.00 -0.65 0.00 0.00 2.80 0.00 0.00 57.97 60.11 1kbi h PHE 297 Cb 0.50 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.61 1kbi h PHE 297 CO 0.00 1.54 0.32 0.43 -0.60 0.00 0.00 178.31 180.00 1kbi n SER 298 N -3.77 0.10 0.00 2.17 7.64 -0.49 -3.67 113.62 115.60 1kbi n SER 298 Ca -0.17 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.03 1kbi n SER 298 Cb 1.06 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.97 1kbi n SER 298 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1kbi n ASN 299 N -1.51 0.00 0.00 6.43 3.02 -1.24 -5.02 115.26 116.95 1kbi n ASN 299 Ca -0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1kbi n ASN 299 Cb 0.33 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.50 1kbi n ASN 299 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1kbi n THR 300 N 0.00 0.00 0.00 3.41 -1.04 -1.23 -5.15 114.28 110.27 1kbi n THR 300 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1kbi n THR 300 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1kbi n THR 300 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1kbi n LYS 308 N 0.00 0.00 -0.00 -2.82 4.76 -1.26 -5.15 118.16 113.69 1kbi n LYS 308 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1kbi n LYS 308 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1kbi n LYS 308 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 1kbi n LYS 309 N 0.00 0.00 0.00 1.97 0.00 -1.26 -5.16 118.16 113.71 1kbi n LYS 309 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 1kbi n LYS 309 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.03 1kbi n LYS 309 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1kbi n THR 310 N 0.00 0.00 -4.37 3.15 -1.04 -1.26 -5.11 114.28 105.66 1kbi n THR 310 Ca 0.00 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.67 1kbi n THR 310 Cb 0.26 0.00 -0.15 0.00 -1.82 0.00 0.00 70.33 68.62 1kbi n THR 310 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1kbi s ASN 311 N 0.00 3.77 -0.07 8.00 0.01 -1.26 -5.19 114.94 120.20 1kbi s ASN 311 Ca 0.00 -0.46 -0.03 0.00 -0.71 0.00 0.00 52.86 51.66 1kbi s ASN 311 Cb 0.00 -1.60 0.04 0.00 0.41 0.00 0.00 41.25 40.11 1kbi s ASN 311 CO 0.00 0.06 0.13 -0.69 -1.51 0.00 0.00 177.10 175.09 1kbi s VAL 312 N 0.96 -0.20 0.00 1.60 1.01 -1.26 -5.09 120.40 117.43 1kbi s VAL 312 Ca -0.02 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.31 1kbi s VAL 312 Cb -0.15 -0.25 0.00 0.00 0.00 0.00 0.00 36.38 35.98 1kbi s VAL 312 CO -0.02 0.15 0.00 -0.62 0.00 0.00 0.00 175.10 174.61 1kbi n GLU 313 N 5.15 0.00 -1.10 2.72 1.02 -1.26 -4.98 120.64 122.19 1kbi n GLU 313 Ca -0.08 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.89 1kbi n GLU 313 Cb 0.50 0.00 0.19 0.00 -0.02 0.00 0.00 31.44 32.11 1kbi n GLU 313 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1kbi n GLU 314 N -1.35 2.11 -1.67 3.49 -0.58 -1.26 -5.00 120.64 116.38 1kbi n GLU 314 Ca 0.00 -3.07 -0.43 0.00 -0.42 0.00 0.00 57.16 53.24 1kbi n GLU 314 Cb 0.00 -2.06 -0.03 0.00 -0.57 0.00 0.00 31.44 28.78 1kbi n GLU 314 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 1kbi s SER 315 N -1.71 5.83 0.56 1.62 1.04 -1.26 -4.94 113.70 114.84 1kbi s SER 315 Ca 0.53 2.09 -0.20 0.00 0.48 0.00 0.00 55.95 58.86 1kbi s SER 315 Cb 0.46 -2.52 -0.05 0.00 0.10 0.00 0.00 66.02 64.01 1kbi s SER 315 CO 0.07 -1.63 1.20 -1.58 0.98 0.00 0.00 173.24 172.28 1kbi s GLN 316 N 5.65 3.16 0.00 4.02 0.74 -1.26 -5.03 119.66 126.93 1kbi s GLN 316 Ca 0.94 1.82 0.00 0.00 0.05 0.00 0.00 55.36 58.17 1kbi s GLN 316 Cb -0.35 -2.03 0.00 0.00 1.10 0.00 0.00 33.01 31.73 1kbi s GLN 316 CO 0.37 -1.06 0.00 0.41 -0.55 0.00 0.00 175.29 174.46 1kbi n GLY 317 N 0.46 1.07 0.15 2.59 0.00 -1.26 -4.78 105.19 103.41 1kbi n GLY 317 Ca 0.12 -1.51 0.10 0.00 0.00 0.00 0.00 46.02 44.73 1kbi n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kbi n ALA 318 N -3.00 1.01 0.27 4.61 0.00 -1.26 -1.53 120.51 120.62 1kbi n ALA 318 Ca 0.00 0.18 0.16 0.00 0.00 0.00 0.00 53.44 53.77 1kbi n ALA 318 Cb 0.00 -1.25 0.76 0.00 0.00 0.00 0.00 19.45 18.96 1kbi n ALA 318 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1kbi h SER 319 N 0.00 0.00 0.46 0.00 0.02 -1.96 -2.25 113.55 109.82 1kbi h SER 319 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1kbi h SER 319 Cb 0.04 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 1kbi h SER 319 CO 0.00 0.08 -0.04 0.08 -1.14 0.00 0.00 176.83 175.80 1kbi h ARG 320 N 0.00 0.00 -0.12 3.45 0.11 -1.58 -1.76 114.38 114.48 1kbi h ARG 320 Ca -0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1kbi h ARG 320 Cb 0.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.48 1kbi h ARG 320 CO 0.01 0.04 0.00 0.00 0.10 0.00 0.00 179.97 180.12 1kbi n ALA 321 N -2.16 2.54 -2.86 0.08 0.00 -0.85 -4.86 120.51 112.41 1kbi n ALA 321 Ca -0.01 -0.49 -0.30 0.00 0.00 0.00 0.00 53.44 52.64 1kbi n ALA 321 Cb 0.21 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.49 1kbi n ALA 321 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1kbi s LEU 322 N -1.69 4.11 -0.14 0.00 1.43 -0.66 -0.34 118.68 121.39 1kbi s LEU 322 Ca 0.34 0.12 -0.16 0.00 -1.03 0.00 0.00 54.13 53.39 1kbi s LEU 322 Cb 0.18 -2.73 0.04 0.00 0.03 0.00 0.00 46.19 43.71 1kbi s LEU 322 CO 0.28 0.14 0.44 -0.55 0.23 0.00 0.00 176.35 176.90 1kbi s SER 323 N -2.65 -0.44 0.57 2.29 0.15 -1.26 -4.84 113.70 107.52 1kbi s SER 323 Ca 0.33 0.79 0.38 0.00 0.70 0.00 0.00 55.95 58.14 1kbi s SER 323 Cb -0.12 0.82 1.86 0.00 -1.71 0.00 0.00 66.02 66.87 1kbi s SER 323 CO 0.26 -0.22 2.14 0.07 1.20 0.00 0.00 173.24 176.68 1kbi h LYS 324 N 5.09 0.00 0.00 5.44 2.10 -1.88 -0.92 116.57 126.39 1kbi h LYS 324 Ca -0.27 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.34 1kbi h LYS 324 Cb 1.18 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1kbi h LYS 324 CO 0.25 0.00 -0.15 0.74 -2.00 0.00 0.00 179.45 178.30 1kbi h PHE 325 N 0.00 0.00 -2.94 0.07 -1.00 -1.89 0.13 116.94 111.31 1kbi h PHE 325 Ca 0.00 0.00 -0.61 0.00 2.81 0.00 0.00 57.97 60.17 1kbi h PHE 325 Cb 0.21 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 39.37 1kbi h PHE 325 CO 0.00 0.15 -0.75 0.42 -1.61 0.00 0.00 178.31 176.52 1kbi s ILE 326 N -4.00 1.41 -0.35 -0.55 1.01 -0.35 -4.14 121.20 114.23 1kbi s ILE 326 Ca -0.02 -2.68 -0.37 0.00 0.00 0.00 0.00 60.65 57.59 1kbi s ILE 326 Cb 0.12 -1.98 -0.13 0.00 0.01 0.00 0.00 42.46 40.49 1kbi s ILE 326 CO 0.59 -0.93 2.13 -0.67 0.00 0.00 0.00 174.94 176.06 1kbi n ASP 327 N 3.38 2.06 0.00 3.58 4.64 -0.30 -4.54 116.55 125.36 1kbi n ASP 327 Ca 0.11 0.52 0.12 0.00 -1.38 0.00 0.00 54.79 54.16 1kbi n ASP 327 Cb 0.36 -1.22 0.62 0.00 -1.04 0.00 0.00 41.12 39.84 1kbi n ASP 327 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1kbi n PRO 328 N 7.81 0.43 -0.35 -0.67 -0.04 -1.26 -3.10 135.00 137.82 1kbi n PRO 328 Ca 0.41 0.05 0.12 0.00 -0.04 0.00 0.00 63.50 64.03 1kbi n PRO 328 Cb 0.19 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.46 1kbi n PRO 328 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1kbi n SER 329 N -1.22 3.81 -4.72 3.54 3.41 -1.26 -4.97 113.62 112.21 1kbi n SER 329 Ca 0.13 -2.00 -0.43 0.00 -0.26 0.00 0.00 58.87 56.31 1kbi n SER 329 Cb 0.16 -0.46 -0.02 0.00 -0.26 0.00 0.00 64.21 63.63 1kbi n SER 329 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1kbi n LEU 330 N 1.60 3.95 -4.37 1.04 7.94 -1.18 -4.99 117.00 120.98 1kbi n LEU 330 Ca 0.24 1.11 -0.19 0.00 -1.11 0.00 0.00 56.01 56.05 1kbi n LEU 330 Cb 0.61 -1.55 -0.10 0.00 0.53 0.00 0.00 43.42 42.91 1kbi n LEU 330 CO 0.16 0.04 -0.23 0.42 -1.11 0.00 0.00 177.39 176.68 1kbi s THR 331 N 0.51 0.59 0.42 1.96 -4.23 -1.26 -5.03 115.64 108.61 1kbi s THR 331 Ca 0.70 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 59.37 1kbi s THR 331 Cb -0.54 -2.58 0.36 0.00 1.34 0.00 0.00 72.50 71.08 1kbi s THR 331 CO 0.42 0.00 1.91 -0.50 -0.54 0.00 0.00 174.62 175.91 1kbi h TRP 332 N 2.19 0.50 -0.62 3.99 4.06 -2.00 -0.32 115.95 123.74 1kbi h TRP 332 Ca -0.37 0.01 -0.06 0.00 2.06 0.00 0.00 58.89 60.54 1kbi h TRP 332 Cb 1.25 -0.16 -0.03 0.00 -1.00 0.00 0.00 29.16 29.23 1kbi h TRP 332 CO 0.83 0.18 0.15 -0.22 -3.56 0.00 0.00 178.44 175.82 1kbi h LYS 333 N 0.42 0.96 -0.64 0.49 1.63 -1.99 -1.49 116.57 115.95 1kbi h LYS 333 Ca 0.38 -0.21 -0.02 0.00 -0.85 0.00 0.00 60.65 59.95 1kbi h LYS 333 Cb 0.88 -0.14 -0.03 0.00 -0.60 0.00 0.00 32.23 32.34 1kbi h LYS 333 CO -0.13 0.86 0.33 -0.44 -3.45 0.00 0.00 179.45 176.63 1kbi h ASP 334 N 0.92 0.80 -0.17 4.20 3.45 -1.46 -0.42 116.42 123.75 1kbi h ASP 334 Ca 0.20 -0.07 -0.17 0.00 0.43 0.00 0.00 57.03 57.42 1kbi h ASP 334 Cb 0.33 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 38.89 1kbi h ASP 334 CO -0.00 0.66 -0.50 0.40 -1.57 0.00 0.00 179.24 178.23 1kbi h ILE 335 N 0.90 1.29 -0.65 0.35 1.08 -1.22 -0.52 117.51 118.75 1kbi h ILE 335 Ca 0.23 -1.70 -0.02 0.00 -0.39 0.00 0.00 64.86 62.98 1kbi h ILE 335 Cb 0.05 1.62 -0.03 0.00 -3.07 0.00 0.00 36.82 35.39 1kbi h ILE 335 CO -0.03 0.55 0.35 -0.33 -0.69 0.00 0.00 178.15 177.99 1kbi h GLU 336 N 0.58 0.91 -0.63 2.37 5.08 -0.49 -1.76 114.58 120.65 1kbi h GLU 336 Ca 0.02 -0.11 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1kbi h GLU 336 Cb 1.07 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 1kbi h GLU 336 CO 0.11 0.70 0.35 0.93 -1.00 0.00 0.00 179.01 180.09 1kbi h GLU 337 N 0.89 0.88 -0.95 2.33 4.39 -0.91 -2.54 114.58 118.66 1kbi h GLU 337 Ca 0.23 -0.10 0.09 0.00 0.34 0.00 0.00 59.36 59.92 1kbi h GLU 337 Cb 0.06 -0.17 -0.07 0.00 -0.10 0.00 0.00 28.75 28.47 1kbi h GLU 337 CO -0.03 0.66 0.61 1.25 -1.16 0.00 0.00 179.01 180.34 1kbi h LEU 338 N 0.86 0.90 -1.49 1.33 5.85 -0.37 -0.97 115.31 121.42 1kbi h LEU 338 Ca 0.22 0.03 0.13 0.00 0.84 0.00 0.00 57.88 59.09 1kbi h LEU 338 Cb 0.04 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 40.85 1kbi h LEU 338 CO -0.04 0.53 0.50 0.11 -0.34 0.00 0.00 178.44 179.21 1kbi h LYS 339 N 1.00 0.52 0.00 1.25 1.57 -0.90 -1.02 116.57 118.99 1kbi h LYS 339 Ca 0.44 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.19 1kbi h LYS 339 Cb 0.36 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1kbi h LYS 339 CO -0.20 0.34 0.00 1.63 -0.57 0.00 0.00 179.45 180.65 1kbi n LYS 340 N -4.50 0.13 -0.01 3.15 5.02 -0.38 -3.53 118.16 118.05 1kbi n LYS 340 Ca 0.14 0.19 0.09 0.00 -2.02 0.00 0.00 58.31 56.71 1kbi n LYS 340 Cb 0.44 -1.68 0.08 0.00 -0.02 0.00 0.00 35.03 33.86 1kbi n LYS 340 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1kbi n LYS 341 N -1.91 1.59 -3.76 1.97 4.76 -0.40 -5.00 118.16 115.42 1kbi n LYS 341 Ca 0.05 -1.62 -0.12 0.00 -2.87 0.00 0.00 58.31 53.75 1kbi n LYS 341 Cb 0.33 -1.35 -0.07 0.00 -1.84 0.00 0.00 35.03 32.09 1kbi n LYS 341 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1kbi s THR 342 N -1.50 0.08 -1.59 -0.18 -1.32 -1.18 -4.99 115.64 104.97 1kbi s THR 342 Ca 0.22 -0.67 0.24 0.00 -1.21 0.00 0.00 61.69 60.27 1kbi s THR 342 Cb 0.15 -0.91 0.02 0.00 -1.51 0.00 0.00 72.50 70.25 1kbi s THR 342 CO 0.23 -0.37 1.22 0.29 -2.21 0.00 0.00 174.62 173.78 1kbi n LYS 343 N 0.64 0.67 -2.43 7.08 5.02 -1.26 -4.86 118.16 123.03 1kbi n LYS 343 Ca -0.19 -0.51 -0.41 0.00 -2.02 0.00 0.00 58.31 55.19 1kbi n LYS 343 Cb 0.59 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 34.07 1kbi n LYS 343 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1kbi s LEU 344 N -2.67 4.51 0.27 -0.35 1.43 -1.26 -4.98 118.68 115.63 1kbi s LEU 344 Ca 0.17 2.27 -0.30 0.00 -1.03 0.00 0.00 54.13 55.23 1kbi s LEU 344 Cb 0.18 -3.62 -0.12 0.00 0.03 0.00 0.00 46.19 42.65 1kbi s LEU 344 CO 0.64 -0.24 1.51 -2.65 0.23 0.00 0.00 176.35 175.84 1kbi n PRO 345 N 1.68 2.41 -4.23 1.29 -0.02 -1.26 -4.77 135.00 130.11 1kbi n PRO 345 Ca 0.01 0.86 -0.34 0.00 -2.02 0.00 0.00 63.50 62.01 1kbi n PRO 345 Cb 0.45 -2.59 -0.11 0.00 -0.02 0.00 0.00 33.50 31.23 1kbi n PRO 345 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1kbi s ILE 346 N -0.05 4.26 -0.06 4.25 1.01 -1.26 -1.44 121.20 127.91 1kbi s ILE 346 Ca 0.65 -0.22 0.05 0.00 0.00 0.00 0.00 60.65 61.13 1kbi s ILE 346 Cb -0.56 -2.89 -0.01 0.00 0.01 0.00 0.00 42.46 39.01 1kbi s ILE 346 CO 0.49 0.48 -0.23 -0.69 0.00 0.00 0.00 174.94 174.99 1kbi s VAL 347 N 0.39 1.93 -0.40 2.92 1.01 0.37 -0.37 120.40 126.24 1kbi s VAL 347 Ca -0.01 -0.98 -0.20 0.00 0.00 0.00 0.00 61.98 60.79 1kbi s VAL 347 Cb -0.13 -1.64 0.01 0.00 0.00 0.00 0.00 36.38 34.62 1kbi s VAL 347 CO 0.02 0.54 0.59 -0.63 0.00 0.00 0.00 175.10 175.61 1kbi s ILE 348 N -0.00 4.91 -0.26 2.22 1.01 0.06 -0.66 121.20 128.48 1kbi s ILE 348 Ca -0.07 0.20 -0.15 0.00 0.00 0.00 0.00 60.65 60.63 1kbi s ILE 348 Cb -0.14 -4.11 -0.04 0.00 0.01 0.00 0.00 42.46 38.18 1kbi s ILE 348 CO 0.05 -0.44 0.36 -0.75 0.00 0.00 0.00 174.94 174.16 1kbi s LYS 349 N 2.62 4.04 0.00 2.79 2.20 0.76 -0.54 119.74 131.60 1kbi s LYS 349 Ca 0.21 0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.85 1kbi s LYS 349 Cb -0.15 -3.63 0.00 0.00 -1.51 0.00 0.00 37.83 32.54 1kbi s LYS 349 CO 0.16 -0.22 0.00 0.41 -0.36 0.00 0.00 175.35 175.34 1kbi n GLY 350 N 4.56 1.89 3.72 5.54 0.00 -0.77 -0.38 105.19 119.75 1kbi n GLY 350 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 1kbi n GLY 350 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kbi s VAL 351 N -2.00 4.53 -0.06 1.61 1.01 -0.61 -4.47 120.40 120.41 1kbi s VAL 351 Ca 0.00 1.89 0.09 0.00 0.00 0.00 0.00 61.98 63.96 1kbi s VAL 351 Cb 0.00 -4.21 0.14 0.00 0.00 0.00 0.00 36.38 32.31 1kbi s VAL 351 CO 0.00 0.19 1.04 0.00 0.00 0.00 0.00 175.10 176.33 1kbi n GLN 352 N 3.57 1.82 -3.53 2.72 6.02 -1.26 -1.97 117.38 124.75 1kbi n GLN 352 Ca 0.06 -1.92 -0.16 0.00 -0.01 0.00 0.00 57.00 54.96 1kbi n GLN 352 Cb 0.49 -1.18 -0.06 0.00 1.02 0.00 0.00 30.24 30.52 1kbi n GLN 352 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1kbi s ARG 353 N -1.77 0.96 0.41 -1.09 1.70 -1.26 -4.80 118.95 113.11 1kbi s ARG 353 Ca 0.15 0.24 0.08 0.00 -0.47 0.00 0.00 55.73 55.72 1kbi s ARG 353 Cb 0.13 0.46 0.86 0.00 -0.57 0.00 0.00 34.95 35.83 1kbi s ARG 353 CO 0.01 -0.30 2.04 1.15 -1.08 0.00 0.00 175.30 177.12 1kbi h THR 354 N 2.91 1.11 -0.71 4.99 2.02 -1.96 -2.59 112.91 118.68 1kbi h THR 354 Ca -0.25 -0.28 0.10 0.00 0.77 0.00 0.00 66.41 66.75 1kbi h THR 354 Cb 1.14 0.64 -0.07 0.00 -1.74 0.00 0.00 68.15 68.12 1kbi h THR 354 CO 0.37 0.12 0.35 -0.33 0.37 0.00 0.00 175.52 176.40 1kbi h GLU 355 N 0.48 0.57 0.00 6.66 3.07 -2.00 -0.48 114.58 122.88 1kbi h GLU 355 Ca 0.13 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1kbi h GLU 355 Cb 0.01 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.79 1kbi h GLU 355 CO -0.02 0.38 0.00 -0.44 -1.40 0.00 0.00 179.01 177.53 1kbi h ASP 356 N 0.59 0.00 0.48 1.42 3.32 -1.89 -1.85 116.42 118.48 1kbi h ASP 356 Ca 0.35 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 57.22 1kbi h ASP 356 Cb 0.38 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1kbi h ASP 356 CO -0.28 0.00 -0.76 0.58 -1.72 0.00 0.00 179.24 177.06 1kbi h VAL 357 N 0.00 1.44 0.02 -1.35 2.07 -1.07 -2.05 116.25 115.32 1kbi h VAL 357 Ca 0.00 -2.34 -0.00 0.00 0.82 0.00 0.00 66.70 65.18 1kbi h VAL 357 Cb 0.68 2.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.71 1kbi h VAL 357 CO 0.00 0.69 -0.01 0.40 0.02 0.00 0.00 177.57 178.67 1kbi h ILE 358 N 0.15 1.27 -0.92 4.57 1.08 -0.92 -2.16 117.51 120.58 1kbi h ILE 358 Ca -0.03 -0.89 0.12 0.00 -0.39 0.00 0.00 64.86 63.67 1kbi h ILE 358 Cb 1.34 1.87 -0.07 0.00 -3.07 0.00 0.00 36.82 36.88 1kbi h ILE 358 CO 0.12 0.23 0.59 0.11 -0.69 0.00 0.00 178.15 178.50 1kbi h LYS 359 N -0.41 0.82 -0.76 2.37 1.57 -1.31 0.25 116.57 119.09 1kbi h LYS 359 Ca -0.00 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1kbi h LYS 359 Cb 0.40 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 1kbi h LYS 359 CO 0.00 0.54 0.26 0.00 -0.57 0.00 0.00 179.45 179.69 1kbi h ALA 360 N 1.57 1.00 -0.57 3.86 0.00 -1.17 -1.67 119.26 122.27 1kbi h ALA 360 Ca 0.45 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 1kbi h ALA 360 Cb 0.53 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1kbi h ALA 360 CO -0.21 0.66 0.21 0.00 0.00 0.00 0.00 179.25 179.91 1kbi h ALA 361 N 1.14 0.74 -0.71 0.00 0.00 -0.44 -2.43 119.26 117.56 1kbi h ALA 361 Ca 0.25 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.99 1kbi h ALA 361 Cb 0.28 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 1kbi h ALA 361 CO -0.01 0.37 0.46 0.93 0.00 0.00 0.00 179.25 181.00 1kbi h GLU 362 N 0.79 0.93 -0.06 0.00 5.08 -0.51 -0.26 114.58 120.54 1kbi h GLU 362 Ca 0.19 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1kbi h GLU 362 Cb 0.23 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1kbi h GLU 362 CO -0.01 0.62 0.00 0.44 -1.00 0.00 0.00 179.01 179.06 1kbi n ILE 363 N -4.42 0.07 -2.63 3.13 -5.35 -0.68 -4.95 119.36 104.53 1kbi n ILE 363 Ca 0.07 -0.25 -0.12 0.00 -0.27 0.00 0.00 62.75 62.18 1kbi n ILE 363 Cb 0.04 0.35 0.02 0.00 -1.74 0.00 0.00 39.64 38.31 1kbi n ILE 363 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1kbi n GLY 364 N 1.13 0.01 3.92 3.28 0.00 -0.11 -4.94 105.19 108.48 1kbi n GLY 364 Ca 0.18 -0.30 -0.29 0.00 0.00 0.00 0.00 46.02 45.61 1kbi n GLY 364 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1kbi s VAL 365 N -2.85 2.00 0.16 1.61 -7.23 -1.07 -4.99 120.40 108.03 1kbi s VAL 365 Ca 0.15 0.00 0.11 0.00 -1.81 0.00 0.00 61.98 60.43 1kbi s VAL 365 Cb -0.07 -3.00 -0.07 0.00 0.56 0.00 0.00 36.38 33.81 1kbi s VAL 365 CO 0.19 0.00 1.48 0.28 -0.31 0.00 0.00 175.10 176.74 1kbi h SER 366 N -1.35 0.00 -0.82 4.85 0.02 -1.04 -3.46 113.55 111.75 1kbi h SER 366 Ca -0.45 0.00 0.14 0.00 -0.84 0.00 0.00 61.79 60.64 1kbi h SER 366 Cb 1.28 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.80 1kbi h SER 366 CO 0.52 0.72 0.36 0.61 -1.14 0.00 0.00 176.83 177.91 1kbi n GLY 367 N 0.76 0.37 3.11 -3.77 0.00 -1.04 -1.55 105.19 103.08 1kbi n GLY 367 Ca -0.00 -0.90 -0.07 0.00 0.00 0.00 0.00 46.02 45.05 1kbi n GLY 367 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1kbi s VAL 368 N -2.05 0.20 -0.24 1.61 -7.23 -0.90 -0.76 120.40 111.04 1kbi s VAL 368 Ca 0.12 -1.73 -0.01 0.00 -1.81 0.00 0.00 61.98 58.54 1kbi s VAL 368 Cb -0.00 -1.53 0.02 0.00 0.56 0.00 0.00 36.38 35.43 1kbi s VAL 368 CO -0.01 -0.92 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.10 1kbi s VAL 369 N -3.92 2.82 -0.25 1.32 1.01 0.29 -1.21 120.40 120.46 1kbi s VAL 369 Ca 0.08 -0.98 -0.29 0.00 0.00 0.00 0.00 61.98 60.79 1kbi s VAL 369 Cb 0.08 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.05 1kbi s VAL 369 CO -0.09 0.25 1.38 -0.76 0.00 0.00 0.00 175.10 175.88 1kbi s LEU 370 N 1.33 3.95 -0.07 3.92 1.43 0.11 -1.57 118.68 127.78 1kbi s LEU 370 Ca 0.01 1.41 -0.30 0.00 -1.03 0.00 0.00 54.13 54.23 1kbi s LEU 370 Cb -0.16 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 42.62 1kbi s LEU 370 CO -0.05 -1.07 0.82 -0.55 0.23 0.00 0.00 176.35 175.74 1kbi s SER 371 N 3.02 -0.50 -0.18 2.29 0.15 -0.83 -2.70 113.70 114.95 1kbi s SER 371 Ca 0.60 0.45 0.13 0.00 0.70 0.00 0.00 55.95 57.84 1kbi s SER 371 Cb -0.20 0.43 0.42 0.00 -1.71 0.00 0.00 66.02 64.96 1kbi s SER 371 CO 0.23 -0.53 1.21 -0.46 1.20 0.00 0.00 173.24 174.89 1kbi n ASN 372 N 0.60 1.61 -2.69 5.45 0.23 -1.26 -3.73 115.26 115.46 1kbi n ASN 372 Ca -0.14 -3.62 -0.18 0.00 -0.53 0.00 0.00 54.58 50.11 1kbi n ASN 372 Cb 0.59 -0.50 0.05 0.00 -2.08 0.00 0.00 39.78 37.84 1kbi n ASN 372 CO 0.00 0.00 0.00 1.57 -0.93 0.00 0.00 177.26 177.90 1kbi n HIS 373 N -0.87 -2.00 -2.29 -2.53 -0.00 -1.26 -2.40 115.22 103.86 1kbi n HIS 373 Ca 0.17 0.67 -0.18 0.00 -0.00 0.00 0.00 57.72 58.38 1kbi n HIS 373 Cb 0.76 -3.93 -0.01 0.00 -0.00 0.00 0.00 29.99 26.81 1kbi n HIS 373 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1kbi n GLY 374 N -1.56 -0.24 2.36 1.57 0.00 -1.26 -2.13 105.19 103.93 1kbi n GLY 374 Ca -0.01 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 1kbi n GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kbi n GLY 375 N -1.00 1.07 0.84 -0.02 0.00 -1.01 -4.63 105.19 100.45 1kbi n GLY 375 Ca -0.22 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.50 1kbi n GLY 375 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1kbi n ARG 376 N -2.36 2.12 0.00 1.61 1.74 -0.91 -0.36 116.66 118.51 1kbi n ARG 376 Ca -0.09 -1.68 0.00 0.00 -0.77 0.00 0.00 57.85 55.31 1kbi n ARG 376 Cb 0.35 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 1kbi n ARG 376 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1kbi n GLN 377 N 0.93 0.00 -3.08 5.56 1.13 -1.25 -3.85 117.38 116.82 1kbi n GLN 377 Ca 0.17 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.83 1kbi n GLN 377 Cb 0.49 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.78 1kbi n GLN 377 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1kbi s LEU 378 N 0.00 4.08 0.21 1.08 2.96 -1.26 -4.65 118.68 121.10 1kbi s LEU 378 Ca 0.00 0.79 -0.30 0.00 -0.22 0.00 0.00 54.13 54.40 1kbi s LEU 378 Cb 0.00 -2.92 -0.08 0.00 0.50 0.00 0.00 46.19 43.69 1kbi s LEU 378 CO 0.00 -0.37 0.93 -0.62 -1.32 0.00 0.00 176.35 174.97 1kbi s ASP 379 N 1.40 7.60 0.00 3.68 2.15 -1.26 -3.17 116.67 127.07 1kbi s ASP 379 Ca 0.28 1.90 0.00 0.00 0.43 0.00 0.00 52.55 55.16 1kbi s ASP 379 Cb -0.16 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.87 1kbi s ASP 379 CO 0.09 0.12 0.00 0.49 -0.17 0.00 0.00 175.17 175.70 1kbi n PHE 380 N 1.73 0.00 -2.69 -5.34 3.72 -1.26 -4.98 117.46 108.64 1kbi n PHE 380 Ca -0.02 0.00 -0.34 0.00 -0.05 0.00 0.00 57.45 57.04 1kbi n PHE 380 Cb 0.48 -0.26 -0.05 0.00 -0.94 0.00 0.00 39.48 38.70 1kbi n PHE 380 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1kbi s SER 381 N -2.52 6.78 0.76 4.37 0.15 -1.19 -5.02 113.70 117.03 1kbi s SER 381 Ca 0.00 1.84 -0.11 0.00 0.70 0.00 0.00 55.95 58.37 1kbi s SER 381 Cb 0.00 -2.56 0.05 0.00 -1.71 0.00 0.00 66.02 61.80 1kbi s SER 381 CO 0.00 -0.48 1.10 -0.13 1.20 0.00 0.00 173.24 174.93 1kbi s ARG 382 N -2.94 2.37 0.08 5.44 0.52 -1.26 -4.71 118.95 118.45 1kbi s ARG 382 Ca 0.61 0.56 -0.31 0.00 -0.52 0.00 0.00 55.73 56.08 1kbi s ARG 382 Cb -0.15 -1.96 -0.08 0.00 0.52 0.00 0.00 34.95 33.29 1kbi s ARG 382 CO 0.19 -1.40 1.47 0.00 0.02 0.00 0.00 175.30 175.58 1kbi s ALA 383 N -3.24 3.64 0.50 2.13 0.00 -1.26 -4.86 121.76 118.66 1kbi s ALA 383 Ca 0.60 1.12 0.21 0.00 0.00 0.00 0.00 51.96 53.89 1kbi s ALA 383 Cb -0.13 -3.60 1.28 0.00 0.00 0.00 0.00 23.12 20.68 1kbi s ALA 383 CO 0.53 -0.81 2.00 -1.35 0.00 0.00 0.00 175.76 176.13 1kbi h PRO 384 N 7.37 0.11 -0.17 0.00 0.11 -1.87 -0.48 132.00 137.07 1kbi h PRO 384 Ca -0.41 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.68 1kbi h PRO 384 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 1kbi h PRO 384 CO 0.89 0.07 0.03 0.97 -0.21 0.00 0.00 178.00 179.76 1kbi h ILE 385 N 0.11 1.09 0.05 4.15 6.09 -1.89 0.26 117.51 127.38 1kbi h ILE 385 Ca 0.24 -0.32 -0.25 0.00 -1.37 0.00 0.00 64.86 63.16 1kbi h ILE 385 Cb 0.80 0.93 0.01 0.00 0.47 0.00 0.00 36.82 39.02 1kbi h ILE 385 CO -0.03 0.11 -1.05 -0.08 -3.07 0.00 0.00 178.15 174.03 1kbi h GLU 386 N 0.24 0.40 -0.24 2.19 4.81 -1.47 -2.33 114.58 118.17 1kbi h GLU 386 Ca 0.06 -0.49 -0.13 0.00 -0.13 0.00 0.00 59.36 58.66 1kbi h GLU 386 Cb 0.11 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 1kbi h GLU 386 CO -0.00 1.17 -0.39 0.28 -0.73 0.00 0.00 179.01 179.33 1kbi h VAL 387 N 0.20 1.30 -0.72 0.32 2.07 -0.88 -2.75 116.25 115.78 1kbi h VAL 387 Ca -0.11 -1.55 -0.02 0.00 0.82 0.00 0.00 66.70 65.84 1kbi h VAL 387 Cb 1.72 1.54 -0.03 0.00 -1.52 0.00 0.00 31.29 32.99 1kbi h VAL 387 CO 0.18 0.49 0.37 0.25 0.02 0.00 0.00 177.57 178.89 1kbi h LEU 388 N 0.47 0.91 -1.32 2.57 5.85 -0.42 0.50 115.31 123.86 1kbi h LEU 388 Ca 0.04 -0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1kbi h LEU 388 Cb 0.89 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 1kbi h LEU 388 CO 0.08 0.77 0.33 0.00 -0.34 0.00 0.00 178.44 179.27 1kbi h ALA 389 N 1.18 1.49 0.24 1.25 0.00 -1.15 -2.26 119.26 120.01 1kbi h ALA 389 Ca 0.25 -0.08 -0.33 0.00 0.00 0.00 0.00 54.91 54.75 1kbi h ALA 389 Cb 0.07 -0.24 0.04 0.00 0.00 0.00 0.00 17.79 17.66 1kbi h ALA 389 CO -0.04 0.43 -1.46 1.49 0.00 0.00 0.00 179.25 179.68 1kbi h GLU 390 N 0.80 0.52 0.23 0.00 4.81 -1.19 -3.40 114.58 116.36 1kbi h GLU 390 Ca 0.21 -0.89 -0.01 0.00 -0.13 0.00 0.00 59.36 58.54 1kbi h GLU 390 Cb 0.00 0.33 0.00 0.00 0.63 0.00 0.00 28.75 29.71 1kbi h GLU 390 CO -0.04 1.42 -0.11 1.15 -0.73 0.00 0.00 179.01 180.71 1kbi h THR 391 N 0.15 0.84 -0.68 0.32 2.02 -0.60 -3.29 112.91 111.66 1kbi h THR 391 Ca -0.24 -0.57 0.10 0.00 0.77 0.00 0.00 66.41 66.47 1kbi h THR 391 Cb 2.15 1.16 -0.07 0.00 -1.74 0.00 0.00 68.15 69.64 1kbi h THR 391 CO 0.27 0.12 0.31 0.24 0.37 0.00 0.00 175.52 176.83 1kbi h MET 392 N -0.61 0.51 -0.72 6.66 2.86 -1.62 -0.48 114.93 121.52 1kbi h MET 392 Ca -0.03 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1kbi h MET 392 Cb 0.44 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 1kbi h MET 392 CO 0.05 0.34 0.31 -1.35 1.06 0.00 0.00 176.91 177.32 1kbi h PRO 393 N 0.53 1.07 -0.29 -0.22 0.11 -1.77 -2.12 132.00 129.31 1kbi h PRO 393 Ca 0.34 -0.18 -0.04 0.00 0.11 0.00 0.00 66.00 66.23 1kbi h PRO 393 Cb 0.40 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.32 1kbi h PRO 393 CO -0.29 0.87 0.01 0.82 -0.21 0.00 0.00 178.00 179.19 1kbi h ILE 394 N 1.03 1.17 -0.03 4.15 2.04 -1.42 -1.06 117.51 123.40 1kbi h ILE 394 Ca 0.24 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 1kbi h ILE 394 Cb 0.18 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1kbi h ILE 394 CO -0.02 0.23 0.01 -0.07 0.00 0.00 0.00 178.15 178.29 1kbi h LEU 395 N 0.42 0.04 -1.11 1.44 3.38 -0.48 -2.96 115.31 116.04 1kbi h LEU 395 Ca 0.10 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1kbi h LEU 395 Cb 0.27 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1kbi h LEU 395 CO 0.01 0.20 0.61 -0.33 0.09 0.00 0.00 178.44 179.01 1kbi h GLU 396 N -0.13 1.12 -0.10 1.13 5.08 -0.87 -0.26 114.58 120.55 1kbi h GLU 396 Ca 0.01 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1kbi h GLU 396 Cb 0.18 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.17 1kbi h GLU 396 CO -0.00 0.74 0.00 1.04 -1.00 0.00 0.00 179.01 179.79 1kbi n GLN 397 N -4.45 0.14 -0.15 2.33 6.02 -0.45 -0.03 117.38 120.79 1kbi n GLN 397 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1kbi n GLN 397 Cb 0.11 -1.05 0.00 0.00 1.02 0.00 0.00 30.24 30.32 1kbi n GLN 397 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1kbi n ARG 398 N 0.18 0.00 0.00 -1.09 1.74 -0.18 -5.01 116.66 112.31 1kbi n ARG 398 Ca 0.00 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.02 1kbi n ARG 398 Cb 0.03 -0.05 0.00 0.00 -1.02 0.00 0.00 32.46 31.42 1kbi n ARG 398 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1kbi n ASN 399 N 0.00 0.00 0.14 0.55 5.15 0.96 -4.75 115.26 117.31 1kbi n ASN 399 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 1kbi n ASN 399 Cb 0.51 -0.33 0.00 0.00 -0.53 0.00 0.00 39.78 39.42 1kbi n ASN 399 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1kbi n LEU 400 N 0.00 0.00 -4.74 1.20 4.77 -0.97 -4.40 117.00 112.86 1kbi n LEU 400 Ca 0.00 0.21 -0.36 0.00 -0.03 0.00 0.00 56.01 55.83 1kbi n LEU 400 Cb 0.00 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 1kbi n LEU 400 CO 0.00 -0.21 0.85 -0.54 -1.33 0.00 0.00 177.39 176.16 1kbi s LYS 401 N -2.58 2.75 0.00 3.23 -0.14 -1.25 -1.10 119.74 120.64 1kbi s LYS 401 Ca 0.00 1.86 0.00 0.00 -1.36 0.00 0.00 55.97 56.47 1kbi s LYS 401 Cb 0.00 -1.90 0.00 0.00 -1.68 0.00 0.00 37.83 34.25 1kbi s LYS 401 CO 0.00 -1.39 0.00 -0.25 -0.76 0.00 0.00 175.35 172.95 1kbi n ASP 402 N -1.85 0.00 -0.02 2.83 8.00 -1.26 -4.69 116.55 119.56 1kbi n ASP 402 Ca 0.14 0.00 -0.02 0.00 0.71 0.00 0.00 54.79 55.62 1kbi n ASP 402 Cb 0.49 -0.63 -0.13 0.00 -0.02 0.00 0.00 41.12 40.83 1kbi n ASP 402 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1kbi n LYS 403 N -2.00 0.65 -4.20 -1.24 4.76 -0.26 -4.89 118.16 110.99 1kbi n LYS 403 Ca 0.00 0.07 -0.21 0.00 -2.87 0.00 0.00 58.31 55.29 1kbi n LYS 403 Cb 0.00 -1.65 -0.16 0.00 -1.84 0.00 0.00 35.03 31.37 1kbi n LYS 403 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 1kbi s LEU 404 N -5.45 1.33 -0.12 -0.35 2.96 -1.20 -4.85 118.68 111.01 1kbi s LEU 404 Ca -0.06 -0.16 -0.22 0.00 -0.22 0.00 0.00 54.13 53.46 1kbi s LEU 404 Cb 0.09 -0.53 -0.03 0.00 0.50 0.00 0.00 46.19 46.21 1kbi s LEU 404 CO 0.84 -0.05 0.67 -1.61 -1.32 0.00 0.00 176.35 174.88 1kbi s GLU 405 N 0.98 4.36 -0.30 1.98 2.02 -0.59 -4.91 118.70 122.23 1kbi s GLU 405 Ca -0.10 0.78 -0.06 0.00 0.02 0.00 0.00 54.97 55.60 1kbi s GLU 405 Cb -0.14 -3.49 0.02 0.00 0.10 0.00 0.00 34.13 30.61 1kbi s GLU 405 CO -0.00 -0.04 0.08 0.08 0.02 0.00 0.00 175.26 175.40 1kbi s VAL 406 N 1.19 3.86 0.27 2.63 1.01 -1.26 -2.11 120.40 125.99 1kbi s VAL 406 Ca 0.34 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.57 1kbi s VAL 406 Cb -0.17 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.15 1kbi s VAL 406 CO 0.15 0.03 0.33 -0.36 0.00 0.00 0.00 175.10 175.25 1kbi s PHE 407 N 1.47 3.23 0.03 5.22 0.08 -0.35 -0.20 117.98 127.47 1kbi s PHE 407 Ca 0.01 -0.11 -0.00 0.00 0.12 0.00 0.00 56.93 56.95 1kbi s PHE 407 Cb -0.18 -1.64 -0.03 0.00 -0.57 0.00 0.00 43.02 40.61 1kbi s PHE 407 CO 0.02 0.34 -0.03 0.14 -0.10 0.00 0.00 175.22 175.59 1kbi s VAL 408 N -2.09 0.18 0.20 -0.44 -7.23 -1.05 0.07 120.40 110.04 1kbi s VAL 408 Ca 0.37 -1.28 -0.11 0.00 -1.81 0.00 0.00 61.98 59.15 1kbi s VAL 408 Cb -0.08 -0.78 -0.01 0.00 0.56 0.00 0.00 36.38 36.07 1kbi s VAL 408 CO 0.28 -0.69 0.37 1.51 -0.31 0.00 0.00 175.10 176.26 1kbi s ASP 409 N -2.05 -0.03 0.00 4.85 1.47 -1.10 0.00 116.67 119.81 1kbi s ASP 409 Ca -0.06 -0.88 0.00 0.00 1.18 0.00 0.00 52.55 52.78 1kbi s ASP 409 Cb -0.03 0.50 0.00 0.00 -0.34 0.00 0.00 42.92 43.05 1kbi s ASP 409 CO -0.04 -1.00 0.00 0.61 0.68 0.00 0.00 175.17 175.42 1kbi n GLY 410 N -0.29 1.91 2.34 2.12 0.00 -1.25 -4.66 105.19 105.35 1kbi n GLY 410 Ca -0.05 -0.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.95 1kbi n GLY 410 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kbi n GLY 411 N 1.29 0.60 3.64 -0.02 0.00 -1.26 -4.32 105.19 105.12 1kbi n GLY 411 Ca 0.00 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 1kbi n GLY 411 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1kbi s VAL 412 N -1.89 4.72 0.00 1.61 1.01 -1.26 -4.21 120.40 120.39 1kbi s VAL 412 Ca 0.00 1.67 0.00 0.00 0.00 0.00 0.00 61.98 63.65 1kbi s VAL 412 Cb 0.00 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.15 1kbi s VAL 412 CO 0.00 -0.21 0.00 0.54 0.00 0.00 0.00 175.10 175.43 1kbi n ARG 413 N 6.29 2.99 -4.28 2.72 5.12 -1.26 -4.92 116.66 123.31 1kbi n ARG 413 Ca 0.08 0.00 -0.22 0.00 -1.93 0.00 0.00 57.85 55.78 1kbi n ARG 413 Cb 0.47 -0.36 -0.12 0.00 -1.16 0.00 0.00 32.46 31.29 1kbi n ARG 413 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1kbi s ARG 414 N -0.47 1.11 0.49 5.56 1.81 -1.26 -4.54 118.95 121.64 1kbi s ARG 414 Ca 0.00 -1.19 0.14 0.00 -1.72 0.00 0.00 55.73 52.96 1kbi s ARG 414 Cb 0.00 -1.28 1.15 0.00 -0.45 0.00 0.00 34.95 34.36 1kbi s ARG 414 CO 0.00 0.29 2.11 0.78 -0.68 0.00 0.00 175.30 177.79 1kbi h GLY 415 N 3.91 0.12 2.00 -3.53 0.00 -1.84 0.99 103.07 104.73 1kbi h GLY 415 Ca -0.44 -0.05 -0.07 0.00 0.00 0.00 0.00 47.33 46.77 1kbi h GLY 415 CO 0.42 0.05 -0.31 -0.91 0.00 0.00 0.00 176.54 175.79 1kbi h THR 416 N 0.11 1.03 -0.24 4.70 1.35 -1.95 0.16 112.91 118.06 1kbi h THR 416 Ca 0.03 -1.14 -0.07 0.00 -0.55 0.00 0.00 66.41 64.68 1kbi h THR 416 Cb 0.04 1.65 -0.01 0.00 -1.73 0.00 0.00 68.15 68.10 1kbi h THR 416 CO -0.00 0.30 -0.12 0.44 -0.25 0.00 0.00 175.52 175.89 1kbi h ASP 417 N 0.00 0.53 -0.06 5.36 3.32 -1.22 -1.64 116.42 122.71 1kbi h ASP 417 Ca -0.00 -0.41 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1kbi h ASP 417 Cb 0.63 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.03 1kbi h ASP 417 CO 0.04 0.82 0.04 0.58 -1.72 0.00 0.00 179.24 179.00 1kbi h VAL 418 N 0.23 1.03 -0.78 -1.35 2.07 -0.90 -2.57 116.25 113.99 1kbi h VAL 418 Ca 0.05 -0.06 0.12 0.00 0.82 0.00 0.00 66.70 67.63 1kbi h VAL 418 Cb 0.63 0.96 -0.08 0.00 -1.52 0.00 0.00 31.29 31.28 1kbi h VAL 418 CO 0.04 0.02 0.39 -0.07 0.02 0.00 0.00 177.57 177.97 1kbi h LEU 419 N 0.06 0.49 -0.72 2.57 3.38 -0.61 -1.50 115.31 118.99 1kbi h LEU 419 Ca 0.02 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1kbi h LEU 419 Cb 0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 1kbi h LEU 419 CO -0.00 0.25 0.44 0.11 0.09 0.00 0.00 178.44 179.32 1kbi h LYS 420 N 0.62 0.98 -0.45 1.13 1.57 -0.96 -0.74 116.57 118.72 1kbi h LYS 420 Ca 0.40 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 59.01 1kbi h LYS 420 Cb 0.49 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1kbi h LYS 420 CO -0.31 0.69 -0.08 0.00 -0.57 0.00 0.00 179.45 179.18 1kbi h ALA 421 N 1.23 1.03 -0.48 3.86 0.00 -0.98 -2.58 119.26 121.34 1kbi h ALA 421 Ca 0.26 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1kbi h ALA 421 Cb -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1kbi h ALA 421 CO -0.05 0.59 0.00 -0.07 0.00 0.00 0.00 179.25 179.72 1kbi h LEU 422 N 0.71 0.83 -1.66 0.00 3.38 -0.90 -0.53 115.31 117.15 1kbi h LEU 422 Ca 0.13 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.76 1kbi h LEU 422 Cb 0.55 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1kbi h LEU 422 CO 0.03 0.94 -0.16 0.00 0.09 0.00 0.00 178.44 179.34 1kbi n LEU 424 N -4.34 0.27 0.00 0.00 4.77 -0.90 -1.94 117.00 114.86 1kbi n LEU 424 Ca -0.02 0.53 0.00 0.00 -0.03 0.00 0.00 56.01 56.49 1kbi n LEU 424 Cb 0.23 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 40.86 1kbi n LEU 424 CO 0.36 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 1kbi n GLY 425 N 1.14 1.31 3.77 -0.72 0.00 -0.22 -4.81 105.19 105.66 1kbi n GLY 425 Ca 0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1kbi n GLY 425 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kbi s ALA 426 N -2.00 3.22 0.11 4.61 0.00 -0.26 -4.69 121.76 122.74 1kbi s ALA 426 Ca 0.00 1.04 -0.05 0.00 0.00 0.00 0.00 51.96 52.95 1kbi s ALA 426 Cb 0.00 -3.41 -0.16 0.00 0.00 0.00 0.00 23.12 19.55 1kbi s ALA 426 CO 0.00 -0.58 1.24 -0.22 0.00 0.00 0.00 175.76 176.21 1kbi h LYS 427 N 2.78 0.37 -3.13 0.00 1.63 -0.92 -3.42 116.57 113.88 1kbi h LYS 427 Ca -0.49 -0.47 -0.03 0.00 -0.85 0.00 0.00 60.65 58.82 1kbi h LYS 427 Cb 1.23 0.15 -0.12 0.00 -0.60 0.00 0.00 32.23 32.89 1kbi h LYS 427 CO 0.63 1.15 0.12 0.20 -3.45 0.00 0.00 179.45 178.10 1kbi s GLY 428 N -4.50 -0.50 -0.12 5.01 0.00 -1.26 -4.90 107.32 101.05 1kbi s GLY 428 Ca -0.05 0.31 0.03 0.00 0.00 0.00 0.00 44.72 45.00 1kbi s GLY 428 CO 0.87 0.01 -0.20 0.14 0.00 0.00 0.00 173.10 173.92 1kbi s VAL 429 N -3.77 1.85 0.17 1.40 1.01 -0.29 -2.51 120.40 118.25 1kbi s VAL 429 Ca 0.02 -0.86 -0.03 0.00 0.00 0.00 0.00 61.98 61.10 1kbi s VAL 429 Cb -0.00 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.69 1kbi s VAL 429 CO -0.13 0.51 0.39 -0.83 0.00 0.00 0.00 175.10 175.05 1kbi s GLY 430 N 0.74 2.04 -0.01 4.51 0.00 0.10 -1.66 107.32 113.05 1kbi s GLY 430 Ca -0.10 -0.67 0.02 0.00 0.00 0.00 0.00 44.72 43.98 1kbi s GLY 430 CO 0.01 -0.60 -0.07 1.08 0.00 0.00 0.00 173.10 173.52 1kbi s LEU 431 N -2.97 1.99 0.00 0.66 1.02 -0.71 -3.93 118.68 114.74 1kbi s LEU 431 Ca 0.40 -0.14 0.00 0.00 0.02 0.00 0.00 54.13 54.42 1kbi s LEU 431 Cb -0.12 -0.39 0.00 0.00 0.02 0.00 0.00 46.19 45.70 1kbi s LEU 431 CO 0.27 0.09 0.00 0.61 0.02 0.00 0.00 176.35 177.33 1kbi n GLY 432 N 2.94 0.05 0.28 -3.19 0.00 -1.26 -0.49 105.19 103.51 1kbi n GLY 432 Ca -0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.87 1kbi n GLY 432 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1kbi h ARG 433 N 0.00 -0.04 -0.84 1.61 3.08 -1.95 -1.81 114.38 114.44 1kbi h ARG 433 Ca 0.00 0.00 0.19 0.00 0.07 0.00 0.00 59.98 60.24 1kbi h ARG 433 Cb 0.00 0.01 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 1kbi h ARG 433 CO 0.00 -0.02 0.34 -1.35 -1.07 0.00 0.00 179.97 177.86 1kbi h PRO 434 N -0.04 0.40 -0.16 0.04 0.11 -1.91 0.11 132.00 130.54 1kbi h PRO 434 Ca 0.31 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 66.25 1kbi h PRO 434 Cb 0.51 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.52 1kbi h PRO 434 CO -0.70 0.26 -0.49 0.74 -0.21 0.00 0.00 178.00 177.60 1kbi h PHE 435 N 0.41 0.51 -0.83 0.65 -1.00 -1.65 -0.15 116.94 114.88 1kbi h PHE 435 Ca 0.50 -0.17 -0.04 0.00 2.81 0.00 0.00 57.97 61.07 1kbi h PHE 435 Cb 0.87 -0.10 -0.04 0.00 3.61 0.00 0.00 35.95 40.29 1kbi h PHE 435 CO -0.16 0.83 0.36 -0.07 -1.61 0.00 0.00 178.31 177.66 1kbi h LEU 436 N 0.33 1.12 -0.32 1.54 3.38 -0.74 0.13 115.31 120.75 1kbi h LEU 436 Ca 0.02 -0.16 -0.18 0.00 0.09 0.00 0.00 57.88 57.65 1kbi h LEU 436 Cb 0.99 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 1kbi h LEU 436 CO 0.09 0.96 -0.50 1.88 0.09 0.00 0.00 178.44 180.96 1kbi h TYR 437 N 1.19 1.12 -0.46 1.13 0.05 -0.48 -0.56 116.97 118.97 1kbi h TYR 437 Ca 0.28 -0.38 -0.03 0.00 0.05 0.00 0.00 58.73 58.65 1kbi h TYR 437 Cb 0.17 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.68 1kbi h TYR 437 CO 0.02 1.21 0.17 0.00 -1.05 0.00 0.00 178.16 178.51 1kbi h ALA 438 N 0.71 0.59 -0.16 3.88 0.00 -0.75 -2.02 119.26 121.51 1kbi h ALA 438 Ca 0.03 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1kbi h ALA 438 Cb 1.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1kbi h ALA 438 CO 0.11 0.21 -0.33 -0.97 0.00 0.00 0.00 179.25 178.27 1kbi h ASN 439 N 0.59 0.33 -0.30 0.00 -1.24 -0.71 -0.98 115.58 113.27 1kbi h ASN 439 Ca 0.15 -0.12 -0.15 0.00 0.71 0.00 0.00 56.30 56.89 1kbi h ASN 439 Cb 0.21 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.16 1kbi h ASN 439 CO -0.01 0.65 -0.38 0.28 -1.29 0.00 0.00 177.43 176.68 1kbi h SER 440 N 0.28 0.91 0.24 1.15 0.02 -0.86 -1.05 113.55 114.23 1kbi h SER 440 Ca 0.04 -0.41 -0.34 0.00 -0.84 0.00 0.00 61.79 60.23 1kbi h SER 440 Cb 0.72 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.01 1kbi h SER 440 CO 0.06 1.18 -1.76 0.00 -1.14 0.00 0.00 176.83 175.17 1kbi n TYR 442 N -3.52 0.00 -4.82 0.00 4.01 -0.38 -5.05 117.16 107.40 1kbi n TYR 442 Ca -0.24 -0.42 0.00 0.00 -0.16 0.00 0.00 57.90 57.08 1kbi n TYR 442 Cb 1.06 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 40.03 1kbi n TYR 442 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1kbi n GLY 443 N -0.54 1.08 0.36 2.72 0.00 -0.40 -2.39 105.19 106.03 1kbi n GLY 443 Ca 0.05 -0.59 0.06 0.00 0.00 0.00 0.00 46.02 45.53 1kbi n GLY 443 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1kbi h ARG 444 N 0.00 0.91 0.00 1.61 0.11 -1.84 -0.16 114.38 115.01 1kbi h ARG 444 Ca 0.00 -0.05 -0.04 0.00 0.10 0.00 0.00 59.98 59.98 1kbi h ARG 444 Cb 0.00 -0.21 -0.01 0.00 1.11 0.00 0.00 29.97 30.87 1kbi h ARG 444 CO 0.00 0.60 -0.19 -0.91 0.10 0.00 0.00 179.97 179.57 1kbi h ASN 445 N 0.94 0.00 -0.13 0.08 2.35 -1.88 -0.99 115.58 115.96 1kbi h ASN 445 Ca 0.40 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 56.11 1kbi h ASN 445 Cb 0.32 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.68 1kbi h ASN 445 CO -0.16 0.19 -0.09 1.23 -1.65 0.00 0.00 177.43 176.95 1kbi h GLY 446 N 1.69 0.31 0.81 2.83 0.00 -0.67 -0.30 103.07 107.74 1kbi h GLY 446 Ca -0.00 -0.30 0.03 0.00 0.00 0.00 0.00 47.33 47.06 1kbi h GLY 446 CO 0.03 0.27 0.28 -2.08 0.00 0.00 0.00 176.54 175.03 1kbi h VAL 447 N -0.08 1.01 -0.83 4.60 2.07 -0.96 0.64 116.25 122.70 1kbi h VAL 447 Ca 0.02 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 1kbi h VAL 447 Cb 0.58 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 1kbi h VAL 447 CO 0.02 0.10 0.44 -0.08 0.02 0.00 0.00 177.57 178.08 1kbi h GLU 448 N 0.55 1.16 -0.77 1.57 4.81 -1.03 -1.36 114.58 119.52 1kbi h GLU 448 Ca 0.21 -0.14 -0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1kbi h GLU 448 Cb 0.07 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.19 1kbi h GLU 448 CO -0.12 0.86 0.33 -0.22 -0.73 0.00 0.00 179.01 179.13 1kbi h LYS 449 N 1.16 1.12 -0.73 1.92 1.63 0.05 -0.67 116.57 121.05 1kbi h LYS 449 Ca 0.29 -0.18 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1kbi h LYS 449 Cb 0.05 -0.19 -0.03 0.00 -0.60 0.00 0.00 32.23 31.45 1kbi h LYS 449 CO -0.04 0.89 0.33 0.00 -3.45 0.00 0.00 179.45 177.18 1kbi h ALA 450 N 1.26 1.21 -0.55 5.00 0.00 -0.38 0.61 119.26 126.40 1kbi h ALA 450 Ca 0.26 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 1kbi h ALA 450 Cb 0.17 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1kbi h ALA 450 CO -0.03 0.59 -0.04 0.82 0.00 0.00 0.00 179.25 180.60 1kbi h ILE 451 N 1.04 1.26 -0.32 0.00 2.04 -0.21 -1.66 117.51 119.67 1kbi h ILE 451 Ca 0.25 -1.16 -0.13 0.00 1.00 0.00 0.00 64.86 64.82 1kbi h ILE 451 Cb 0.13 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1kbi h ILE 451 CO -0.03 0.41 -0.32 -0.33 0.00 0.00 0.00 178.15 177.88 1kbi h GLU 452 N 0.89 0.78 -0.02 2.37 5.08 -0.41 -0.60 114.58 122.67 1kbi h GLU 452 Ca 0.16 -0.41 0.01 0.00 -1.00 0.00 0.00 59.36 58.12 1kbi h GLU 452 Cb 0.57 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 1kbi h GLU 452 CO 0.03 1.04 -0.06 0.82 -1.00 0.00 0.00 179.01 179.85 1kbi h ILE 453 N 0.55 0.84 -0.50 3.13 2.04 -0.73 0.11 117.51 122.95 1kbi h ILE 453 Ca 0.05 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.78 1kbi h ILE 453 Cb 0.90 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 1kbi h ILE 453 CO 0.08 0.00 -0.20 0.25 0.00 0.00 0.00 178.15 178.28 1kbi h LEU 454 N -0.09 1.04 0.33 1.44 5.85 -1.28 -0.51 115.31 122.09 1kbi h LEU 454 Ca 0.03 -0.39 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 1kbi h LEU 454 Cb 0.14 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1kbi h LEU 454 CO -0.08 1.19 -0.22 -0.09 -0.34 0.00 0.00 178.44 178.90 1kbi h ARG 455 N 0.88 -0.52 -0.68 1.25 2.43 -0.89 -1.32 114.38 115.53 1kbi h ARG 455 Ca 0.12 0.04 0.05 0.00 -0.81 0.00 0.00 59.98 59.37 1kbi h ARG 455 Cb 0.78 0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.39 1kbi h ARG 455 CO 0.06 -0.35 0.40 -0.44 -1.51 0.00 0.00 179.97 178.14 1kbi h ASP 456 N -0.54 0.62 -0.79 -3.80 3.32 -0.65 -1.52 116.42 113.05 1kbi h ASP 456 Ca -0.03 0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.08 1kbi h ASP 456 Cb 0.45 -0.11 -0.05 0.00 0.22 0.00 0.00 39.33 39.85 1kbi h ASP 456 CO 0.02 0.41 0.52 -0.33 -1.72 0.00 0.00 179.24 178.14 1kbi h GLU 457 N 0.75 0.92 -0.20 3.56 5.08 -0.74 -0.18 114.58 123.77 1kbi h GLU 457 Ca 0.30 -0.06 -0.14 0.00 -1.00 0.00 0.00 59.36 58.46 1kbi h GLU 457 Cb 0.13 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1kbi h GLU 457 CO -0.16 0.61 -0.43 0.82 -1.00 0.00 0.00 179.01 178.86 1kbi h ILE 458 N 0.95 1.32 -0.16 3.13 2.04 -0.39 -2.44 117.51 121.96 1kbi h ILE 458 Ca 0.32 -1.66 -0.04 0.00 1.00 0.00 0.00 64.86 64.48 1kbi h ILE 458 Cb 0.08 1.85 -0.00 0.00 -0.74 0.00 0.00 36.82 38.01 1kbi h ILE 458 CO -0.10 0.52 -0.07 -0.33 0.00 0.00 0.00 178.15 178.17 1kbi h GLU 459 N 0.34 0.34 0.18 2.37 5.08 -1.06 0.64 114.58 122.47 1kbi h GLU 459 Ca 0.00 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1kbi h GLU 459 Cb 1.03 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1kbi h GLU 459 CO 0.09 0.64 -0.09 0.52 -1.00 0.00 0.00 179.01 179.18 1kbi h MET 460 N 0.02 -0.23 0.00 2.33 2.86 -1.10 -1.70 114.93 117.11 1kbi h MET 460 Ca 0.04 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.65 1kbi h MET 460 Cb 0.54 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.25 1kbi h MET 460 CO 0.02 -0.14 -0.18 0.77 1.06 0.00 0.00 176.91 178.43 1kbi h SER 461 N -0.26 0.00 -0.27 1.22 0.02 -1.48 -2.58 113.55 110.20 1kbi h SER 461 Ca -0.02 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1kbi h SER 461 Cb 0.20 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 1kbi h SER 461 CO 0.04 0.18 0.09 -0.03 -1.14 0.00 0.00 176.83 175.97 1kbi h MET 462 N 0.00 0.42 -0.80 3.45 -1.53 -0.43 -0.59 114.93 115.46 1kbi h MET 462 Ca -0.00 -0.09 0.11 0.00 -3.44 0.00 0.00 59.70 56.27 1kbi h MET 462 Cb 0.67 -0.06 -0.08 0.00 -0.55 0.00 0.00 31.60 31.58 1kbi h MET 462 CO 0.02 0.48 0.43 0.00 0.14 0.00 0.00 176.91 177.99 1kbi h ARG 463 N 0.28 0.68 0.00 0.39 3.08 -0.93 -1.01 114.38 116.87 1kbi h ARG 463 Ca 0.09 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1kbi h ARG 463 Cb 0.24 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1kbi h ARG 463 CO -0.00 0.45 0.00 -0.07 -1.07 0.00 0.00 179.97 179.28 1kbi h LEU 464 N 0.70 0.00 -0.23 3.04 3.38 -1.25 -2.27 115.31 118.68 1kbi h LEU 464 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 1kbi h LEU 464 Cb 0.43 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1kbi h LEU 464 CO -0.28 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.18 1kbi h LEU 465 N 0.00 0.00 0.00 1.67 3.38 0.22 -3.41 115.31 117.17 1kbi h LEU 465 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1kbi h LEU 465 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1kbi h LEU 465 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1kbi n GLY 466 N 0.94 0.86 3.34 0.83 0.00 -0.85 -1.36 105.19 108.96 1kbi n GLY 466 Ca 0.04 -0.61 -0.18 0.00 0.00 0.00 0.00 46.02 45.27 1kbi n GLY 466 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1kbi s VAL 467 N -2.00 0.92 0.00 1.61 -7.23 -1.19 -4.78 120.40 107.73 1kbi s VAL 467 Ca 0.00 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.15 1kbi s VAL 467 Cb 0.00 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.45 1kbi s VAL 467 CO 0.00 -0.19 0.35 0.35 -0.31 0.00 0.00 175.10 175.29 1kbi n THR 468 N -0.47 0.01 -3.76 5.32 -2.24 -1.26 -4.33 114.28 107.54 1kbi n THR 468 Ca -0.03 -0.34 -0.10 0.00 -2.27 0.00 0.00 64.05 61.31 1kbi n THR 468 Cb 0.65 1.31 -0.06 0.00 -2.10 0.00 0.00 70.33 70.14 1kbi n THR 468 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1kbi s SER 469 N -0.01 -0.10 0.28 3.42 1.04 -1.26 0.22 113.70 117.30 1kbi s SER 469 Ca 0.00 -0.52 -0.03 0.00 0.48 0.00 0.00 55.95 55.88 1kbi s SER 469 Cb 0.00 0.44 0.38 0.00 0.10 0.00 0.00 66.02 66.95 1kbi s SER 469 CO 0.00 -0.85 1.95 0.40 0.98 0.00 0.00 173.24 175.71 1kbi h ILE 470 N 2.48 1.21 0.00 -1.02 1.08 -1.76 -1.35 117.51 118.14 1kbi h ILE 470 Ca -0.33 -0.41 -0.01 0.00 -0.39 0.00 0.00 64.86 63.72 1kbi h ILE 470 Cb 1.24 -0.10 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1kbi h ILE 470 CO 0.48 0.22 -0.03 0.00 -0.69 0.00 0.00 178.15 178.13 1kbi h ALA 471 N 1.44 1.22 -0.00 1.87 0.00 -1.91 -1.85 119.26 120.03 1kbi h ALA 471 Ca 0.34 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1kbi h ALA 471 Cb -0.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1kbi h ALA 471 CO -0.08 0.04 -0.15 0.39 0.00 0.00 0.00 179.25 179.45 1kbi n GLU 472 N -3.44 0.30 -2.44 0.00 1.02 -0.51 -4.73 120.64 110.84 1kbi n GLU 472 Ca -0.02 -0.09 -0.42 0.00 -0.02 0.00 0.00 57.16 56.60 1kbi n GLU 472 Cb 0.14 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.04 1kbi n GLU 472 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1kbi s LEU 473 N -2.76 3.52 0.22 -4.62 1.43 -0.70 -4.96 118.68 110.80 1kbi s LEU 473 Ca 0.20 0.50 0.04 0.00 -1.03 0.00 0.00 54.13 53.83 1kbi s LEU 473 Cb 0.19 -3.34 -0.05 0.00 0.03 0.00 0.00 46.19 43.02 1kbi s LEU 473 CO 0.54 -1.50 -0.02 -0.54 0.23 0.00 0.00 176.35 175.05 1kbi s LYS 474 N 5.05 1.29 0.48 1.70 1.02 -1.26 -4.28 119.74 123.74 1kbi s LYS 474 Ca 0.54 -1.63 0.20 0.00 0.02 0.00 0.00 55.97 55.09 1kbi s LYS 474 Cb -0.11 -0.62 1.23 0.00 -0.52 0.00 0.00 37.83 37.81 1kbi s LYS 474 CO 0.29 -0.06 1.98 -1.35 -0.92 0.00 0.00 175.35 175.29 1kbi h PRO 475 N 2.53 0.18 0.00 -1.68 0.11 -1.75 -1.60 132.00 129.79 1kbi h PRO 475 Ca -0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1kbi h PRO 475 Cb 1.22 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1kbi h PRO 475 CO 0.64 0.12 0.00 -0.40 -0.21 0.00 0.00 178.00 178.15 1kbi n ASP 476 N -4.43 0.00 -0.05 -2.05 5.75 -1.26 -0.67 116.55 113.84 1kbi n ASP 476 Ca 0.10 0.22 0.13 0.00 -0.01 0.00 0.00 54.79 55.23 1kbi n ASP 476 Cb 0.51 -0.34 0.42 0.00 -1.03 0.00 0.00 41.12 40.68 1kbi n ASP 476 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1kbi n LEU 477 N -1.34 0.42 -4.59 -2.12 4.32 -0.60 -4.77 117.00 108.32 1kbi n LEU 477 Ca 0.05 0.10 -0.31 0.00 -0.02 0.00 0.00 56.01 55.82 1kbi n LEU 477 Cb 0.10 -0.29 -0.10 0.00 -1.62 0.00 0.00 43.42 41.51 1kbi n LEU 477 CO 0.09 0.09 -0.40 -0.76 -1.22 0.00 0.00 177.39 175.19 1kbi s LEU 478 N -2.85 3.12 -0.43 2.23 1.43 0.15 -0.07 118.68 122.27 1kbi s LEU 478 Ca 0.16 -0.24 -0.13 0.00 -1.03 0.00 0.00 54.13 52.90 1kbi s LEU 478 Cb 0.19 -1.84 0.06 0.00 0.03 0.00 0.00 46.19 44.62 1kbi s LEU 478 CO 0.60 0.24 0.31 -0.62 0.23 0.00 0.00 176.35 177.10 1kbi s ASP 479 N -1.75 5.90 -0.05 2.29 2.15 0.07 -4.76 116.67 120.52 1kbi s ASP 479 Ca 0.19 -1.28 0.21 0.00 0.43 0.00 0.00 52.55 52.09 1kbi s ASP 479 Cb -0.11 -2.09 0.67 0.00 -0.30 0.00 0.00 42.92 41.10 1kbi s ASP 479 CO 0.10 -0.54 1.58 0.18 -0.17 0.00 0.00 175.17 176.32 1kbi n LEU 480 N 5.07 4.30 0.30 -1.34 4.77 -1.26 -2.66 117.00 126.18 1kbi n LEU 480 Ca -0.11 -2.20 0.18 0.00 -0.03 0.00 0.00 56.01 53.85 1kbi n LEU 480 Cb 0.44 -0.53 0.96 0.00 -2.33 0.00 0.00 43.42 41.96 1kbi n LEU 480 CO 0.42 0.91 1.09 0.77 -1.33 0.00 0.00 177.39 179.25 1kbi h SER 481 N 4.15 0.00 -0.06 -1.43 4.64 -1.91 -2.76 113.55 116.18 1kbi h SER 481 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1kbi h SER 481 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1kbi h SER 481 CO 0.10 0.03 0.00 0.35 -0.87 0.00 0.00 176.83 176.44 1kbi n THR 482 N -3.37 1.98 0.11 2.95 -2.24 -1.26 -4.70 114.28 107.74 1kbi n THR 482 Ca -0.02 -2.16 0.13 0.00 -2.27 0.00 0.00 64.05 59.73 1kbi n THR 482 Cb 0.15 -0.23 0.62 0.00 -2.10 0.00 0.00 70.33 68.77 1kbi n THR 482 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1kbi h LEU 483 N 0.45 0.08 -1.60 3.22 7.12 -1.50 -1.55 115.31 121.52 1kbi h LEU 483 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 1kbi h LEU 483 Cb 1.10 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.22 1kbi h LEU 483 CO 0.05 0.05 0.00 0.29 -0.13 0.00 0.00 178.44 178.71 1kbi n LYS 484 N -4.47 2.04 -1.38 1.25 4.76 -1.26 -4.59 118.16 114.51 1kbi n LYS 484 Ca 0.04 -1.58 -0.36 0.00 -2.87 0.00 0.00 58.31 53.53 1kbi n LYS 484 Cb 0.31 -1.43 -0.04 0.00 -1.84 0.00 0.00 35.03 32.03 1kbi n LYS 484 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1kbi n ALA 485 N 0.80 7.32 -2.68 7.82 0.00 -0.59 -4.81 120.51 128.37 1kbi n ALA 485 Ca 0.17 -3.41 -0.43 0.00 0.00 0.00 0.00 53.44 49.76 1kbi n ALA 485 Cb 0.43 -3.15 -0.06 0.00 0.00 0.00 0.00 19.45 16.67 1kbi n ALA 485 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1kbi s ARG 486 N 1.47 3.17 0.24 0.00 3.52 -1.26 -5.04 118.95 121.06 1kbi s ARG 486 Ca 0.67 -0.72 0.11 0.00 -0.13 0.00 0.00 55.73 55.66 1kbi s ARG 486 Cb 0.20 -4.05 -0.05 0.00 -1.56 0.00 0.00 34.95 29.49 1kbi s ARG 486 CO -0.06 -1.17 -0.13 0.95 -0.81 0.00 0.00 175.30 174.08 1kbi s THR 487 N 2.75 2.90 -0.22 4.11 -4.23 -1.26 -5.10 115.64 114.58 1kbi s THR 487 Ca 0.18 -2.05 -0.01 0.00 -1.18 0.00 0.00 61.69 58.63 1kbi s THR 487 Cb -0.17 -2.50 0.06 0.00 1.34 0.00 0.00 72.50 71.23 1kbi s THR 487 CO 0.14 -0.29 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.24 1kbi s VAL 488 N -2.16 1.03 0.74 2.29 1.01 -1.26 -5.13 120.40 116.92 1kbi s VAL 488 Ca 0.28 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 61.20 1kbi s VAL 488 Cb -0.07 -1.44 0.04 0.00 0.00 0.00 0.00 36.38 34.92 1kbi s VAL 488 CO 0.16 -0.19 1.13 -0.83 0.00 0.00 0.00 175.10 175.37 1kbi s GLY 489 N 1.62 1.99 0.46 4.51 0.00 -1.26 -5.00 107.32 109.64 1kbi s GLY 489 Ca -0.03 0.53 -0.24 0.00 0.00 0.00 0.00 44.72 44.99 1kbi s GLY 489 CO -0.08 0.91 1.30 0.14 0.00 0.00 0.00 173.10 175.37 1kbi s VAL 490 N -2.48 2.51 0.34 1.40 1.01 -1.26 -4.92 120.40 117.00 1kbi s VAL 490 Ca 0.67 0.42 -0.27 0.00 0.00 0.00 0.00 61.98 62.79 1kbi s VAL 490 Cb -0.21 -3.23 -0.12 0.00 0.00 0.00 0.00 36.38 32.81 1kbi s VAL 490 CO 0.49 0.03 1.18 -2.65 0.00 0.00 0.00 175.10 174.14 1kbi n PRO 491 N -0.37 1.80 -1.89 2.72 -0.02 -1.26 -4.88 135.00 131.09 1kbi n PRO 491 Ca 0.07 0.63 -0.39 0.00 -2.02 0.00 0.00 63.50 61.78 1kbi n PRO 491 Cb 0.45 -2.16 0.01 0.00 -0.02 0.00 0.00 33.50 31.78 1kbi n PRO 491 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1kbi s ASN 492 N -0.45 5.93 -0.81 2.55 0.01 -1.26 -4.89 114.94 116.01 1kbi s ASN 492 Ca 0.58 2.80 -0.26 0.00 -0.71 0.00 0.00 52.86 55.27 1kbi s ASN 492 Cb -0.60 -2.64 0.04 0.00 0.41 0.00 0.00 41.25 38.46 1kbi s ASN 492 CO 0.61 -1.13 1.31 -0.62 -1.51 0.00 0.00 177.10 175.76 1kbi s ASP 493 N -0.67 6.25 0.10 -1.22 -1.08 -1.26 -4.89 116.67 113.90 1kbi s ASP 493 Ca 0.61 -0.75 -0.32 0.00 -0.52 0.00 0.00 52.55 51.57 1kbi s ASP 493 Cb -0.41 -2.56 -0.13 0.00 -1.46 0.00 0.00 42.92 38.36 1kbi s ASP 493 CO 0.52 -1.73 1.60 0.58 0.52 0.00 0.00 175.17 176.66 1kbi h VAL 494 N 6.23 0.20 -0.30 1.11 2.07 -1.99 -2.03 116.25 121.54 1kbi h VAL 494 Ca -0.15 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 1kbi h VAL 494 Cb 1.04 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1kbi h VAL 494 CO 1.31 0.00 0.18 -0.07 0.02 0.00 0.00 177.57 179.01 1kbi h LEU 495 N -0.77 0.36 -0.32 2.57 3.38 -1.99 -0.44 115.31 118.10 1kbi h LEU 495 Ca -0.02 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 57.93 1kbi h LEU 495 Cb 0.71 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1kbi h LEU 495 CO -0.10 0.32 0.08 0.22 0.09 0.00 0.00 178.44 179.04 1kbi h TYR 496 N 0.38 0.13 0.00 1.13 5.03 -1.97 -2.42 116.97 119.25 1kbi h TYR 496 Ca 0.11 0.02 -0.07 0.00 2.58 0.00 0.00 58.73 61.37 1kbi h TYR 496 Cb 0.02 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 38.28 1kbi h TYR 496 CO -0.04 0.04 -0.32 -0.91 -1.32 0.00 0.00 178.16 175.61 1kbi h ASN 497 N 0.20 0.00 -0.03 -2.11 2.35 -1.24 -2.68 115.58 112.07 1kbi h ASN 497 Ca 0.15 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.87 1kbi h ASN 497 Cb 0.15 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.52 1kbi h ASN 497 CO -0.18 0.32 -0.09 -0.08 -1.65 0.00 0.00 177.43 175.75 1kbi h GLU 498 N 0.00 0.11 0.00 0.81 4.57 -0.83 -3.28 114.58 115.96 1kbi h GLU 498 Ca -0.00 -0.08 -0.06 0.00 -1.18 0.00 0.00 59.36 58.04 1kbi h GLU 498 Cb 1.10 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.69 1kbi h GLU 498 CO 0.04 0.69 -0.27 -0.24 -1.18 0.00 0.00 179.01 178.05 1kbi h VAL 499 N -0.45 0.57 -3.84 0.32 3.04 -1.50 -3.44 116.25 110.95 1kbi h VAL 499 Ca -0.00 -1.39 -0.53 0.00 -1.01 0.00 0.00 66.70 63.77 1kbi h VAL 499 Cb 0.70 1.96 0.07 0.00 -2.01 0.00 0.00 31.29 32.01 1kbi h VAL 499 CO 0.02 0.27 0.68 -0.47 -1.01 0.00 0.00 177.57 177.05 1kbi s TYR 500 N -3.43 2.96 -0.15 3.17 6.14 -1.01 -5.01 117.35 120.03 1kbi s TYR 500 Ca 0.02 1.33 0.01 0.00 0.64 0.00 0.00 57.07 59.07 1kbi s TYR 500 Cb 0.09 -3.75 0.00 0.00 0.42 0.00 0.00 41.96 38.72 1kbi s TYR 500 CO 0.67 -2.14 -0.17 -1.21 0.64 0.00 0.00 175.55 173.33 1kbi s GLU 501 N -1.69 3.16 0.70 4.97 2.02 -1.26 -4.97 118.70 121.62 1kbi s GLU 501 Ca 0.51 -0.78 -0.08 0.00 0.02 0.00 0.00 54.97 54.64 1kbi s GLU 501 Cb -0.41 -2.57 0.05 0.00 0.10 0.00 0.00 34.13 31.30 1kbi s GLU 501 CO 0.54 0.01 1.03 0.20 0.02 0.00 0.00 175.26 177.05 1kbi s GLY 502 N 0.81 1.65 0.68 -1.39 0.00 -1.26 -5.03 107.32 102.78 1kbi s GLY 502 Ca -0.06 -0.76 -0.17 0.00 0.00 0.00 0.00 44.72 43.73 1kbi s GLY 502 CO -0.01 -0.37 1.05 -1.05 0.00 0.00 0.00 173.10 172.72 1kbi n PRO 503 N -2.92 0.72 -4.39 2.90 -0.02 -1.26 -5.03 135.00 125.00 1kbi n PRO 503 Ca 0.07 0.30 -0.21 0.00 -2.02 0.00 0.00 63.50 61.64 1kbi n PRO 503 Cb 0.60 -2.29 -0.10 0.00 -0.02 0.00 0.00 33.50 31.69 1kbi n PRO 503 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1kbi s THR 504 N -1.66 1.99 0.56 3.45 -4.23 -1.26 -5.14 115.64 109.35 1kbi s THR 504 Ca 0.76 -2.26 -0.14 0.00 -1.18 0.00 0.00 61.69 58.87 1kbi s THR 504 Cb -0.37 -2.11 -0.06 0.00 1.34 0.00 0.00 72.50 71.30 1kbi s THR 504 CO 0.47 -0.51 1.01 -0.76 -0.54 0.00 0.00 174.62 174.29 1kbi s LEU 505 N -3.33 3.47 0.90 4.79 1.43 -1.26 -5.04 118.68 119.64 1kbi s LEU 505 Ca 0.24 1.53 -0.11 0.00 -1.03 0.00 0.00 54.13 54.77 1kbi s LEU 505 Cb -0.02 -4.50 0.13 0.00 0.03 0.00 0.00 46.19 41.83 1kbi s LEU 505 CO 0.09 -0.74 1.10 0.28 0.23 0.00 0.00 176.35 177.32 1kbi s THR 506 N -2.82 2.57 0.26 5.49 -1.32 -1.26 -5.03 115.64 113.53 1kbi s THR 506 Ca 0.58 0.19 0.04 0.00 -1.21 0.00 0.00 61.69 61.28 1kbi s THR 506 Cb -0.11 -2.46 -0.06 0.00 -1.51 0.00 0.00 72.50 68.37 1kbi s THR 506 CO 0.40 -0.24 0.01 -1.83 -2.21 0.00 0.00 174.62 170.75 1kbi s GLU 507 N -4.77 1.44 0.78 7.08 -1.05 -1.26 -5.14 118.70 115.78 1kbi s GLU 507 Ca 0.64 -1.75 -0.11 0.00 -0.15 0.00 0.00 54.97 53.61 1kbi s GLU 507 Cb -0.20 -0.72 0.06 0.00 -0.44 0.00 0.00 34.13 32.83 1kbi s GLU 507 CO 0.58 -0.11 1.09 -0.06 0.95 0.00 0.00 175.26 177.71 1kbi s PHE 508 N -3.36 2.54 0.54 4.83 0.40 -1.26 -5.00 117.98 116.67 1kbi s PHE 508 Ca 0.31 1.57 -0.19 0.00 -0.60 0.00 0.00 56.93 58.01 1kbi s PHE 508 Cb 0.06 -3.06 -0.06 0.00 0.51 0.00 0.00 43.02 40.47 1kbi s PHE 508 CO 0.11 -1.84 1.10 -1.21 0.70 0.00 0.00 175.22 174.09 1kbi s GLU 509 N -4.88 3.40 0.28 0.44 0.41 -1.26 -4.96 118.70 112.14 1kbi s GLU 509 Ca 0.61 1.52 -0.30 0.00 -0.41 0.00 0.00 54.97 56.39 1kbi s GLU 509 Cb -0.17 -2.02 -0.11 0.00 -1.78 0.00 0.00 34.13 30.05 1kbi s GLU 509 CO 0.56 -0.79 1.49 -0.51 -0.49 0.00 0.00 175.26 175.52 1kbi s ASP 510 N -1.94 6.53 0.00 -0.19 -0.00 -1.26 -5.35 116.67 114.46 1kbi s ASP 510 Ca 0.71 2.81 0.00 0.00 -0.00 0.00 0.00 52.55 56.07 1kbi s ASP 510 Cb -0.22 -2.63 0.00 0.00 -0.00 0.00 0.00 42.92 40.07 1kbi s ASP 510 CO 0.27 -0.78 0.17 0.00 -0.00 0.00 0.00 175.17 174.83