#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u0f h ALA 2 N 0.00 1.47 -0.13 0.00 0.00 -1.95 -2.87 119.26 115.79 1u0f h ALA 2 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1u0f h ALA 2 Cb 0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 1u0f h ALA 2 CO 0.00 0.47 0.02 1.25 0.00 0.00 0.00 179.25 180.99 1u0f h LEU 3 N 1.04 0.20 -0.71 0.00 5.85 -1.85 -2.65 115.31 117.19 1u0f h LEU 3 Ca 0.31 -0.26 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1u0f h LEU 3 Cb -0.04 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 1u0f h LEU 3 CO -0.08 0.41 -0.00 0.71 -0.34 0.00 0.00 178.44 179.14 1u0f h THR 4 N -0.01 0.00 0.00 1.05 1.35 -1.91 -2.18 112.91 111.20 1u0f h THR 4 Ca 0.04 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.13 1u0f h THR 4 Cb 0.29 1.76 0.00 0.00 -1.73 0.00 0.00 68.15 68.48 1u0f h THR 4 CO 0.00 0.00 -0.17 0.54 -0.25 0.00 0.00 175.52 175.64 1u0f n ARG 5 N -3.10 0.21 -2.39 4.72 1.74 -1.10 -4.76 116.66 111.99 1u0f n ARG 5 Ca 0.02 0.14 -0.42 0.00 -0.77 0.00 0.00 57.85 56.82 1u0f n ARG 5 Cb 0.42 -1.71 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 1u0f n ARG 5 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1u0f s ASN 6 N -4.13 7.01 0.35 0.55 3.84 -0.82 -4.94 114.94 116.79 1u0f s ASN 6 Ca 0.10 1.93 0.08 0.00 0.21 0.00 0.00 52.86 55.19 1u0f s ASN 6 Cb 0.14 -2.56 0.66 0.00 -0.55 0.00 0.00 41.25 38.93 1u0f s ASN 6 CO 0.62 -0.59 1.84 1.55 -2.79 0.00 0.00 177.10 177.72 1u0f h PRO 7 N 7.41 0.24 -0.28 0.43 0.13 -1.89 -2.09 132.00 135.94 1u0f h PRO 7 Ca -0.37 -0.08 -0.09 0.00 -0.87 0.00 0.00 66.00 64.60 1u0f h PRO 7 Cb 1.18 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1u0f h PRO 7 CO 0.87 0.47 -0.19 1.96 -0.23 0.00 0.00 178.00 180.88 1u0f h GLN 8 N 0.22 0.51 -0.26 0.86 7.50 -1.94 -2.08 115.11 119.92 1u0f h GLN 8 Ca 0.04 -0.17 -0.07 0.00 0.50 0.00 0.00 58.65 58.94 1u0f h GLN 8 Cb 0.53 -0.04 -0.01 0.00 0.05 0.00 0.00 27.48 28.02 1u0f h GLN 8 CO 0.04 0.68 -0.11 0.35 -1.50 0.00 0.00 178.83 178.29 1u0f h PHE 9 N 0.46 0.61 -0.81 2.96 3.57 -1.69 -2.49 116.94 119.54 1u0f h PHE 9 Ca 0.08 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.44 1u0f h PHE 9 Cb 0.60 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.16 1u0f h PHE 9 CO 0.02 0.78 0.54 1.96 -2.23 0.00 0.00 178.31 179.38 1u0f h GLN 10 N 0.26 1.06 -0.14 1.11 4.20 -1.24 -0.17 115.11 120.18 1u0f h GLN 10 Ca 0.06 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1u0f h GLN 10 Cb 0.61 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1u0f h GLN 10 CO 0.04 0.70 0.09 -0.22 -0.67 0.00 0.00 178.83 178.76 1u0f h LYS 11 N 1.09 0.18 -0.37 1.46 3.64 -1.36 0.10 116.57 121.31 1u0f h LYS 11 Ca 0.30 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 59.69 1u0f h LYS 11 Cb -0.10 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1u0f h LYS 11 CO -0.07 0.14 0.21 1.25 -2.27 0.00 0.00 179.45 178.71 1u0f h LEU 12 N 0.17 0.33 -0.45 5.20 5.85 -0.91 -0.35 115.31 125.15 1u0f h LEU 12 Ca 0.05 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1u0f h LEU 12 Cb -0.00 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 1u0f h LEU 12 CO -0.01 0.24 0.22 0.25 -0.34 0.00 0.00 178.44 178.80 1u0f h LEU 13 N 0.42 0.59 -0.46 2.25 5.85 -0.87 -0.39 115.31 122.71 1u0f h LEU 13 Ca 0.15 -0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 1u0f h LEU 13 Cb 0.02 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.87 1u0f h LEU 13 CO -0.08 0.55 0.28 -0.08 -0.34 0.00 0.00 178.44 178.78 1u0f h GLU 14 N 0.59 0.62 -0.33 1.25 4.81 -0.71 -0.61 114.58 120.19 1u0f h GLU 14 Ca 0.15 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1u0f h GLU 14 Cb 0.11 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1u0f h GLU 14 CO -0.02 0.44 0.15 2.35 -0.73 0.00 0.00 179.01 181.20 1u0f h TRP 15 N 0.61 0.28 -0.46 0.92 7.01 -0.89 -1.19 115.95 122.24 1u0f h TRP 15 Ca 0.17 0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.24 1u0f h TRP 15 Cb -0.02 -0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 26.91 1u0f h TRP 15 CO -0.03 0.14 0.15 1.25 -2.79 0.00 0.00 178.44 177.16 1u0f h HIS 16 N 0.32 0.27 -0.50 2.65 2.76 -0.71 0.85 115.15 120.78 1u0f h HIS 16 Ca 0.14 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.40 1u0f h HIS 16 Cb 0.07 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 28.93 1u0f h HIS 16 CO -0.11 0.08 0.21 0.00 -1.30 0.00 0.00 177.93 176.81 1u0f h ARG 17 N 0.32 0.39 0.01 5.26 3.08 -0.78 -1.69 114.38 120.97 1u0f h ARG 17 Ca 0.22 -0.02 -0.20 0.00 0.07 0.00 0.00 59.98 60.05 1u0f h ARG 17 Cb 0.23 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1u0f h ARG 17 CO -0.23 0.26 -0.92 0.00 -1.07 0.00 0.00 179.97 178.01 1u0f h ALA 18 N 1.32 0.49 0.00 0.04 0.00 -0.62 -3.42 119.26 117.06 1u0f h ALA 18 Ca 0.24 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1u0f h ALA 18 Cb 0.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1u0f h ALA 18 CO -0.22 1.03 -0.69 0.09 0.00 0.00 0.00 179.25 179.47 1u0f n ASN 19 N -3.55 3.43 -0.00 0.00 4.13 0.24 -4.83 115.26 114.68 1u0f n ASN 19 Ca -0.02 0.00 0.07 0.00 1.68 0.00 0.00 54.58 56.31 1u0f n ASN 19 Cb 0.85 0.60 0.47 0.00 -1.54 0.00 0.00 39.78 40.16 1u0f n ASN 19 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1u0f h SER 20 N 0.00 0.39 0.02 6.41 4.64 -1.42 -0.40 113.55 123.19 1u0f h SER 20 Ca 0.00 -0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u0f h SER 20 Cb 0.18 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1u0f h SER 20 CO 0.00 0.27 -0.00 0.00 -0.87 0.00 0.00 176.83 176.23 1u0f h ALA 21 N 1.75 1.11 -0.00 5.18 0.00 -1.88 -2.14 119.26 123.28 1u0f h ALA 21 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1u0f h ALA 21 Cb 0.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1u0f h ALA 21 CO -0.04 0.00 -0.35 0.09 0.00 0.00 0.00 179.25 178.94 1u0f n ASN 22 N -3.24 0.64 -4.66 0.00 5.03 -0.16 -4.85 115.26 108.01 1u0f n ASN 22 Ca -0.03 -0.44 -0.43 0.00 0.87 0.00 0.00 54.58 54.55 1u0f n ASN 22 Cb 0.08 0.14 -0.02 0.00 -1.02 0.00 0.00 39.78 38.95 1u0f n ASN 22 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1u0f s LEU 23 N -2.79 4.11 -0.14 3.41 1.43 -0.81 -5.01 118.68 118.88 1u0f s LEU 23 Ca 0.17 1.37 -0.02 0.00 -1.03 0.00 0.00 54.13 54.62 1u0f s LEU 23 Cb 0.18 -3.51 0.04 0.00 0.03 0.00 0.00 46.19 42.93 1u0f s LEU 23 CO 0.61 -0.64 -0.00 -0.54 0.23 0.00 0.00 176.35 176.01 1u0f s LYS 24 N 3.06 0.87 0.20 1.70 -0.14 -1.26 -5.05 119.74 119.13 1u0f s LYS 24 Ca 0.44 -0.26 -0.11 0.00 -1.36 0.00 0.00 55.97 54.68 1u0f s LYS 24 Cb -0.15 -1.69 0.18 0.00 -1.68 0.00 0.00 37.83 34.49 1u0f s LYS 24 CO 0.07 -0.46 1.82 -0.07 -0.76 0.00 0.00 175.35 175.95 1u0f h LEU 25 N 8.24 0.58 -0.68 3.17 3.38 -1.92 0.24 115.31 128.31 1u0f h LEU 25 Ca -0.20 0.01 0.12 0.00 0.09 0.00 0.00 57.88 57.90 1u0f h LEU 25 Cb 1.12 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.68 1u0f h LEU 25 CO 0.33 0.39 0.26 -0.09 0.09 0.00 0.00 178.44 179.42 1u0f h ARG 26 N 0.71 0.41 -0.02 1.13 2.43 -1.92 -1.77 114.38 115.35 1u0f h ARG 26 Ca 0.27 -0.02 -0.20 0.00 -0.81 0.00 0.00 59.98 59.22 1u0f h ARG 26 Cb 0.09 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1u0f h ARG 26 CO -0.14 0.27 -0.84 0.93 -1.51 0.00 0.00 179.97 178.69 1u0f h GLU 27 N 0.43 0.29 -0.80 0.20 5.08 -1.78 -2.17 114.58 115.82 1u0f h GLU 27 Ca 0.36 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 58.40 1u0f h GLU 27 Cb 0.50 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.79 1u0f h GLU 27 CO -0.36 0.97 0.38 -0.07 -1.00 0.00 0.00 179.01 178.93 1u0f h LEU 28 N 0.17 1.06 -0.26 1.33 3.38 -0.38 -1.67 115.31 118.94 1u0f h LEU 28 Ca -0.05 -0.14 -0.16 0.00 0.09 0.00 0.00 57.88 57.62 1u0f h LEU 28 Cb 1.45 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1u0f h LEU 28 CO 0.14 0.90 -0.48 -0.26 0.09 0.00 0.00 178.44 178.83 1u0f h PHE 29 N 1.14 0.97 -0.64 1.13 -1.00 -1.31 -3.05 116.94 114.18 1u0f h PHE 29 Ca 0.27 -0.35 -0.02 0.00 2.81 0.00 0.00 57.97 60.69 1u0f h PHE 29 Cb 0.13 -0.18 -0.03 0.00 3.61 0.00 0.00 35.95 39.48 1u0f h PHE 29 CO 0.01 1.15 0.32 0.93 -1.61 0.00 0.00 178.31 179.11 1u0f h GLU 30 N 0.52 0.90 0.00 1.51 4.39 -1.17 -2.89 114.58 117.85 1u0f h GLU 30 Ca 0.01 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1u0f h GLU 30 Cb 1.08 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.56 1u0f h GLU 30 CO 0.11 0.69 -0.03 0.00 -1.16 0.00 0.00 179.01 178.62 1u0f n ALA 31 N -2.44 2.32 -3.43 3.43 0.00 -0.65 -4.62 120.51 115.12 1u0f n ALA 31 Ca 0.06 -0.05 -0.25 0.00 0.00 0.00 0.00 53.44 53.20 1u0f n ALA 31 Cb 0.12 -1.46 -0.11 0.00 0.00 0.00 0.00 19.45 18.01 1u0f n ALA 31 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1u0f s ASP 32 N -4.23 2.38 0.63 0.00 2.15 -1.09 -4.98 116.67 111.53 1u0f s ASP 32 Ca 0.11 -1.89 0.42 0.00 0.43 0.00 0.00 52.55 51.62 1u0f s ASP 32 Cb 0.14 -0.06 2.30 0.00 -0.30 0.00 0.00 42.92 45.00 1u0f s ASP 32 CO 0.59 -0.30 2.30 -0.65 -0.17 0.00 0.00 175.17 176.93 1u0f h PRO 33 N 7.15 0.00 -0.46 4.34 0.11 -1.82 -1.87 132.00 139.44 1u0f h PRO 33 Ca 0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.15 1u0f h PRO 33 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1u0f h PRO 33 CO 0.25 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.43 1u0f n GLU 34 N -2.98 2.18 0.00 1.05 -0.58 -1.26 -4.62 120.64 114.43 1u0f n GLU 34 Ca -0.03 -1.82 -0.11 0.00 -0.42 0.00 0.00 57.16 54.78 1u0f n GLU 34 Cb 0.07 -1.42 -0.05 0.00 -0.57 0.00 0.00 31.44 29.47 1u0f n GLU 34 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 1u0f h ARG 35 N 3.11 0.05 -0.23 3.49 2.43 -1.69 -1.13 114.38 120.41 1u0f h ARG 35 Ca 0.00 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1u0f h ARG 35 Cb 0.70 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 1u0f h ARG 35 CO 0.00 0.03 -0.04 0.35 -1.51 0.00 0.00 179.97 178.80 1u0f h PHE 36 N 0.05 -0.08 -0.91 2.20 3.57 -1.85 -1.43 116.94 118.49 1u0f h PHE 36 Ca 0.04 0.02 0.13 0.00 3.53 0.00 0.00 57.97 61.69 1u0f h PHE 36 Cb 0.04 0.07 -0.07 0.00 2.79 0.00 0.00 35.95 38.78 1u0f h PHE 36 CO -0.11 -0.08 0.58 -0.91 -2.23 0.00 0.00 178.31 175.56 1u0f h ASN 37 N 0.02 0.73 0.59 0.41 -0.26 -1.74 -2.62 115.58 112.70 1u0f h ASN 37 Ca 0.11 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.89 1u0f h ASN 37 Cb 0.16 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.31 1u0f h ASN 37 CO -0.22 0.38 -0.81 0.59 -1.06 0.00 0.00 177.43 176.31 1u0f n ASN 38 N -4.57 0.64 -2.24 5.81 5.03 -0.48 -4.25 115.26 115.21 1u0f n ASN 38 Ca 0.17 -0.11 -0.19 0.00 0.87 0.00 0.00 54.58 55.33 1u0f n ASN 38 Cb 0.42 0.50 0.03 0.00 -1.02 0.00 0.00 39.78 39.71 1u0f n ASN 38 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1u0f n PHE 39 N -1.95 2.43 -3.84 3.10 3.01 -0.57 -5.03 117.46 114.62 1u0f n PHE 39 Ca 0.03 -2.26 -0.10 0.00 1.01 0.00 0.00 57.45 56.13 1u0f n PHE 39 Cb 0.42 -0.30 -0.08 0.00 -0.01 0.00 0.00 39.48 39.51 1u0f n PHE 39 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1u0f s SER 40 N -3.64 0.03 -0.10 4.37 1.04 -1.11 -1.65 113.70 112.65 1u0f s SER 40 Ca 0.45 -0.40 0.02 0.00 0.48 0.00 0.00 55.95 56.50 1u0f s SER 40 Cb 0.39 0.31 0.01 0.00 0.10 0.00 0.00 66.02 66.83 1u0f s SER 40 CO 0.01 -0.60 -0.15 -0.76 0.98 0.00 0.00 173.24 172.72 1u0f s LEU 41 N -2.23 1.74 -0.41 2.42 1.43 -0.40 -4.99 118.68 116.23 1u0f s LEU 41 Ca -0.03 -0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 52.62 1u0f s LEU 41 Cb 0.00 -1.06 0.11 0.00 0.03 0.00 0.00 46.19 45.27 1u0f s LEU 41 CO -0.05 0.03 0.22 0.21 0.23 0.00 0.00 176.35 176.99 1u0f s ASN 42 N 0.84 5.32 -0.25 2.29 3.04 -1.26 -0.39 114.94 124.53 1u0f s ASN 42 Ca -0.10 -1.96 -0.16 0.00 0.04 0.00 0.00 52.86 50.68 1u0f s ASN 42 Cb -0.15 -1.86 -0.03 0.00 -1.54 0.00 0.00 41.25 37.67 1u0f s ASN 42 CO 0.01 -0.55 0.42 -0.76 -3.04 0.00 0.00 177.10 173.18 1u0f s LEU 43 N 1.19 4.07 -0.44 3.21 1.43 0.24 -4.96 118.68 123.42 1u0f s LEU 43 Ca 0.07 0.42 -0.17 0.00 -1.03 0.00 0.00 54.13 53.42 1u0f s LEU 43 Cb -0.23 -2.52 0.03 0.00 0.03 0.00 0.00 46.19 43.50 1u0f s LEU 43 CO -0.03 -0.19 0.45 0.21 0.23 0.00 0.00 176.35 177.01 1u0f s ASN 44 N 1.47 6.19 0.00 2.29 3.04 -1.26 -0.98 114.94 125.69 1u0f s ASN 44 Ca 0.18 -0.82 0.27 0.00 0.04 0.00 0.00 52.86 52.53 1u0f s ASN 44 Cb -0.15 -2.22 0.93 0.00 -1.54 0.00 0.00 41.25 38.27 1u0f s ASN 44 CO 0.09 -0.62 1.68 0.35 -3.04 0.00 0.00 177.10 175.56 1u0f n THR 45 N 5.41 0.00 -0.83 -5.21 -2.24 -0.77 -4.91 114.28 105.72 1u0f n THR 45 Ca -0.08 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1u0f n THR 45 Cb 0.47 0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1u0f n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1u0f n ASN 46 N -1.04 -0.03 -2.59 3.42 5.03 -1.26 -4.79 115.26 114.00 1u0f n ASN 46 Ca 0.11 0.00 -0.08 0.00 0.87 0.00 0.00 54.58 55.48 1u0f n ASN 46 Cb 0.32 -0.85 0.04 0.00 -1.02 0.00 0.00 39.78 38.27 1u0f n ASN 46 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 1u0f n HIS 47 N -2.01 1.72 0.00 3.10 8.25 -1.26 -5.09 115.22 119.93 1u0f n HIS 47 Ca 0.00 -2.21 0.00 0.00 -0.26 0.00 0.00 57.72 55.25 1u0f n HIS 47 Cb 0.00 -0.26 0.00 0.00 1.12 0.00 0.00 29.99 30.85 1u0f n HIS 47 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1u0f n GLY 48 N -0.61 3.11 3.72 -1.41 0.00 -1.26 -4.81 105.19 103.93 1u0f n GLY 48 Ca 0.18 -1.98 -0.32 0.00 0.00 0.00 0.00 46.02 43.91 1u0f n GLY 48 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1u0f s HIS 49 N -2.97 3.14 -0.19 1.61 0.09 -1.26 -1.84 115.29 113.87 1u0f s HIS 49 Ca 0.00 0.10 0.01 0.00 -0.00 0.00 0.00 55.06 55.18 1u0f s HIS 49 Cb 0.00 -1.67 0.03 0.00 -0.00 0.00 0.00 32.58 30.94 1u0f s HIS 49 CO 0.00 0.50 -0.17 0.42 -0.00 0.00 0.00 174.74 175.49 1u0f s ILE 50 N -1.18 1.99 -0.31 0.60 1.01 -0.15 -1.86 121.20 121.31 1u0f s ILE 50 Ca 0.22 -1.05 -0.12 0.00 0.00 0.00 0.00 60.65 59.70 1u0f s ILE 50 Cb -0.12 -1.89 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1u0f s ILE 50 CO 0.14 0.39 0.24 -0.22 0.00 0.00 0.00 174.94 175.49 1u0f s LEU 51 N 1.28 4.28 -0.51 2.97 2.96 0.47 -0.60 118.68 129.54 1u0f s LEU 51 Ca 0.02 -0.19 -0.13 0.00 -0.22 0.00 0.00 54.13 53.61 1u0f s LEU 51 Cb -0.15 -2.17 0.12 0.00 0.50 0.00 0.00 46.19 44.50 1u0f s LEU 51 CO -0.11 -0.17 0.43 -0.69 -1.32 0.00 0.00 176.35 174.49 1u0f s VAL 52 N 1.79 4.77 -0.42 1.68 1.01 0.47 -1.30 120.40 128.40 1u0f s VAL 52 Ca 0.08 -1.61 -0.14 0.00 0.00 0.00 0.00 61.98 60.30 1u0f s VAL 52 Cb -0.17 -4.08 0.04 0.00 0.00 0.00 0.00 36.38 32.17 1u0f s VAL 52 CO 0.11 -0.82 0.31 -0.62 0.00 0.00 0.00 175.10 174.08 1u0f s ASP 53 N 3.17 6.03 -0.19 3.32 2.15 0.15 -1.28 116.67 130.02 1u0f s ASP 53 Ca 0.04 -1.07 0.16 0.00 0.43 0.00 0.00 52.55 52.11 1u0f s ASP 53 Cb -0.28 -2.13 0.54 0.00 -0.30 0.00 0.00 42.92 40.74 1u0f s ASP 53 CO 0.01 -0.50 1.44 0.00 -0.17 0.00 0.00 175.17 175.95 1u0f n TYR 54 N 5.13 0.99 0.20 -5.34 0.18 -0.66 -1.29 117.16 116.38 1u0f n TYR 54 Ca -0.11 -0.93 0.07 0.00 1.88 0.00 0.00 57.90 58.81 1u0f n TYR 54 Cb 0.46 -0.34 0.41 0.00 -0.38 0.00 0.00 39.34 39.49 1u0f n TYR 54 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 1u0f h SER 55 N 1.78 0.00 -0.33 9.48 4.64 -1.68 -3.10 113.55 124.34 1u0f h SER 55 Ca 0.02 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.15 1u0f h SER 55 Cb 1.48 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.47 1u0f h SER 55 CO 0.25 0.31 0.25 0.29 -0.87 0.00 0.00 176.83 177.05 1u0f n LYS 56 N -3.54 1.47 -4.09 4.77 5.02 -1.26 -4.87 118.16 115.67 1u0f n LYS 56 Ca -0.00 -1.04 -0.27 0.00 -2.02 0.00 0.00 58.31 54.98 1u0f n LYS 56 Cb 0.45 -1.41 -0.06 0.00 -0.02 0.00 0.00 35.03 34.00 1u0f n LYS 56 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1u0f s ASN 57 N 0.42 5.44 -1.30 4.39 0.01 -1.17 -1.75 114.94 120.97 1u0f s ASN 57 Ca 0.20 -0.13 -0.14 0.00 -0.71 0.00 0.00 52.86 52.07 1u0f s ASN 57 Cb 0.16 -1.40 -0.03 0.00 0.41 0.00 0.00 41.25 40.39 1u0f s ASN 57 CO 0.02 0.09 2.28 0.18 -1.51 0.00 0.00 177.10 178.17 1u0f n LEU 58 N -0.14 6.47 -3.97 0.60 4.77 -1.26 -4.83 117.00 118.64 1u0f n LEU 58 Ca -0.09 -3.83 -0.08 0.00 -0.03 0.00 0.00 56.01 51.98 1u0f n LEU 58 Cb 0.54 -1.49 -0.09 0.00 -2.33 0.00 0.00 43.42 40.05 1u0f n LEU 58 CO 0.43 0.93 -0.23 0.68 -1.33 0.00 0.00 177.39 177.87 1u0f s VAL 59 N 3.42 0.17 0.19 4.08 -7.23 -1.26 -5.08 120.40 114.68 1u0f s VAL 59 Ca 0.52 -1.41 0.03 0.00 -1.81 0.00 0.00 61.98 59.31 1u0f s VAL 59 Cb 0.14 -1.29 -0.01 0.00 0.56 0.00 0.00 36.38 35.78 1u0f s VAL 59 CO -0.04 -0.78 0.09 -0.46 -0.31 0.00 0.00 175.10 173.61 1u0f n ASN 60 N 0.22 0.61 -0.20 4.85 0.23 -1.26 -5.02 115.26 114.69 1u0f n ASN 60 Ca -0.16 -2.07 0.00 0.00 -0.53 0.00 0.00 54.58 51.82 1u0f n ASN 60 Cb 0.61 0.61 0.11 0.00 -2.08 0.00 0.00 39.78 39.03 1u0f n ASN 60 CO 0.00 0.00 0.00 0.50 -0.93 0.00 0.00 177.26 176.83 1u0f h LYS 61 N 0.00 0.40 -0.43 -3.83 3.64 -2.00 -2.09 116.57 112.27 1u0f h LYS 61 Ca -0.14 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1u0f h LYS 61 Cb 0.59 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.30 1u0f h LYS 61 CO 0.22 0.26 0.25 0.93 -2.27 0.00 0.00 179.45 178.84 1u0f h GLU 62 N 0.41 0.58 -0.46 1.90 3.07 -1.99 -1.55 114.58 116.54 1u0f h GLU 62 Ca 0.31 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 59.10 1u0f h GLU 62 Cb 0.38 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.15 1u0f h GLU 62 CO -0.31 0.44 0.23 0.28 -1.40 0.00 0.00 179.01 178.25 1u0f h VAL 63 N 0.56 1.18 -0.75 3.13 2.07 -1.87 -0.78 116.25 119.78 1u0f h VAL 63 Ca 0.15 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 1u0f h VAL 63 Cb 0.01 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1u0f h VAL 63 CO -0.03 0.20 0.31 0.24 0.02 0.00 0.00 177.57 178.31 1u0f h MET 64 N 0.60 1.12 -0.21 1.57 2.86 -1.22 -0.13 114.93 119.53 1u0f h MET 64 Ca 0.16 -0.20 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 1u0f h MET 64 Cb 0.10 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1u0f h MET 64 CO -0.02 0.91 0.12 1.96 1.06 0.00 0.00 176.91 180.94 1u0f h GLN 65 N 1.08 0.24 -0.83 1.72 4.20 -0.99 -0.78 115.11 119.77 1u0f h GLN 65 Ca 0.25 -0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.96 1u0f h GLN 65 Cb 0.20 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.89 1u0f h GLN 65 CO -0.02 0.16 0.55 0.52 -0.67 0.00 0.00 178.83 179.37 1u0f h MET 66 N 0.25 1.09 -0.24 1.46 2.86 -0.81 -0.65 114.93 118.91 1u0f h MET 66 Ca 0.08 -0.07 -0.09 0.00 -2.06 0.00 0.00 59.70 57.57 1u0f h MET 66 Cb -0.01 -0.25 -0.00 0.00 0.06 0.00 0.00 31.60 31.40 1u0f h MET 66 CO -0.03 0.72 -0.19 -0.07 1.06 0.00 0.00 176.91 178.40 1u0f h LEU 67 N 1.12 0.57 -0.68 1.22 3.38 -0.77 -1.77 115.31 118.39 1u0f h LEU 67 Ca 0.30 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1u0f h LEU 67 Cb -0.13 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 40.42 1u0f h LEU 67 CO -0.07 0.91 0.45 0.58 0.09 0.00 0.00 178.44 180.40 1u0f h VAL 68 N 0.25 1.16 -0.89 1.22 2.07 -0.96 -1.65 116.25 117.45 1u0f h VAL 68 Ca 0.04 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1u0f h VAL 68 Cb 0.73 0.17 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1u0f h VAL 68 CO 0.05 0.17 0.59 -0.33 0.02 0.00 0.00 177.57 178.07 1u0f h GLU 69 N 0.91 1.14 -0.37 1.57 4.39 -1.04 -1.70 114.58 119.48 1u0f h GLU 69 Ca 0.25 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 1u0f h GLU 69 Cb -0.09 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.29 1u0f h GLU 69 CO -0.06 0.76 0.19 1.25 -1.16 0.00 0.00 179.01 179.98 1u0f h LEU 70 N 1.18 0.48 -0.76 1.33 5.85 -0.80 0.66 115.31 123.25 1u0f h LEU 70 Ca 0.34 -0.11 0.06 0.00 0.84 0.00 0.00 57.88 59.01 1u0f h LEU 70 Cb -0.09 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 40.76 1u0f h LEU 70 CO -0.08 0.45 0.45 0.00 -0.34 0.00 0.00 178.44 178.92 1u0f h ALA 71 N 1.04 1.04 -0.39 1.25 0.00 -0.87 0.12 119.26 121.44 1u0f h ALA 71 Ca 0.13 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1u0f h ALA 71 Cb 0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1u0f h ALA 71 CO -0.02 0.15 0.19 0.87 0.00 0.00 0.00 179.25 180.44 1u0f h LYS 72 N 0.82 0.57 0.00 0.00 1.57 -0.96 -2.59 116.57 115.97 1u0f h LYS 72 Ca 0.34 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 1u0f h LYS 72 Cb 0.19 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 1u0f h LYS 72 CO -0.18 0.50 -0.09 0.66 -0.57 0.00 0.00 179.45 179.76 1u0f h SER 73 N 0.50 0.00 -0.03 0.86 4.64 -0.33 -2.32 113.55 116.85 1u0f h SER 73 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1u0f h SER 73 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1u0f h SER 73 CO -0.02 0.09 0.00 0.54 -0.87 0.00 0.00 176.83 176.58 1u0f n ARG 74 N -3.25 1.69 -2.57 4.77 5.12 -0.02 -4.96 116.66 117.44 1u0f n ARG 74 Ca 0.00 -1.00 -0.09 0.00 -1.93 0.00 0.00 57.85 54.83 1u0f n ARG 74 Cb 0.34 -1.47 0.01 0.00 -1.16 0.00 0.00 32.46 30.19 1u0f n ARG 74 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1u0f n GLY 75 N 1.17 0.22 0.30 -0.13 0.00 -0.87 -4.81 105.19 101.07 1u0f n GLY 75 Ca 0.19 -0.42 -0.06 0.00 0.00 0.00 0.00 46.02 45.72 1u0f n GLY 75 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1u0f h VAL 76 N -0.56 1.24 -0.30 1.61 2.07 -1.69 -1.97 116.25 116.65 1u0f h VAL 76 Ca -0.21 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.61 1u0f h VAL 76 Cb 1.14 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1u0f h VAL 76 CO 0.22 0.28 0.06 -0.33 0.02 0.00 0.00 177.57 177.82 1u0f h GLU 77 N 1.01 0.48 -0.68 1.57 5.08 -1.91 -0.83 114.58 119.30 1u0f h GLU 77 Ca 0.25 -0.12 -0.07 0.00 -1.00 0.00 0.00 59.36 58.42 1u0f h GLU 77 Cb 0.12 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1u0f h GLU 77 CO -0.03 0.57 0.16 0.00 -1.00 0.00 0.00 179.01 178.71 1u0f h ALA 78 N 0.89 0.99 -0.54 3.43 0.00 -1.95 -1.45 119.26 120.63 1u0f h ALA 78 Ca 0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.72 1u0f h ALA 78 Cb 0.32 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1u0f h ALA 78 CO 0.00 0.65 0.18 0.00 0.00 0.00 0.00 179.25 180.08 1u0f h ALA 79 N 1.14 0.70 -0.04 0.00 0.00 -1.15 -1.48 119.26 118.43 1u0f h ALA 79 Ca 0.21 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.96 1u0f h ALA 79 Cb 0.37 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1u0f h ALA 79 CO 0.00 0.35 -0.05 -0.09 0.00 0.00 0.00 179.25 179.46 1u0f h ARG 80 N 0.74 -0.07 -0.81 0.00 2.43 -0.95 -1.03 114.38 114.69 1u0f h ARG 80 Ca 0.17 0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.38 1u0f h ARG 80 Cb 0.26 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.78 1u0f h ARG 80 CO -0.01 -0.05 0.53 -0.44 -1.51 0.00 0.00 179.97 178.50 1u0f h ASP 81 N -0.08 0.88 -0.67 -3.80 3.32 -1.08 -1.64 116.42 113.35 1u0f h ASP 81 Ca 0.04 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.01 1u0f h ASP 81 Cb 0.13 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 1u0f h ASP 81 CO -0.09 0.61 0.16 0.78 -1.72 0.00 0.00 179.24 178.98 1u0f h ASN 82 N 1.02 1.03 0.07 6.45 -0.26 -0.91 -1.58 115.58 121.40 1u0f h ASN 82 Ca 0.32 -0.24 0.01 0.00 -0.56 0.00 0.00 56.30 55.83 1u0f h ASN 82 Cb 0.00 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 36.97 1u0f h ASN 82 CO -0.09 0.99 -0.14 -0.03 -1.06 0.00 0.00 177.43 177.10 1u0f h MET 83 N 1.01 -0.27 0.00 0.81 4.05 -0.38 -1.80 114.93 118.35 1u0f h MET 83 Ca 0.21 0.02 -0.04 0.00 -0.28 0.00 0.00 59.70 59.61 1u0f h MET 83 Cb 0.37 0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.23 1u0f h MET 83 CO 0.00 -0.18 -0.18 0.74 0.23 0.00 0.00 176.91 177.53 1u0f h PHE 84 N -0.28 0.00 -0.02 1.39 -1.00 -1.16 -2.63 116.94 113.24 1u0f h PHE 84 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 1u0f h PHE 84 Cb 0.30 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.86 1u0f h PHE 84 CO -0.16 0.18 -0.03 -1.13 -1.61 0.00 0.00 178.31 175.55 1u0f n SER 85 N -3.76 1.69 0.00 2.17 3.41 -0.61 -4.94 113.62 111.58 1u0f n SER 85 Ca -0.02 -1.52 0.00 0.00 -0.26 0.00 0.00 58.87 57.08 1u0f n SER 85 Cb 0.29 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1u0f n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u0f n GLY 86 N 1.22 0.65 3.74 5.00 0.00 -0.99 -4.24 105.19 110.56 1u0f n GLY 86 Ca 0.17 -0.43 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1u0f n GLY 86 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1u0f s SER 87 N -2.39 4.80 -1.37 1.61 0.01 -0.69 -4.74 113.70 110.93 1u0f s SER 87 Ca 0.00 2.54 -0.11 0.00 1.31 0.00 0.00 55.95 59.69 1u0f s SER 87 Cb 0.00 -2.61 0.10 0.00 0.21 0.00 0.00 66.02 63.72 1u0f s SER 87 CO 0.00 -1.87 2.13 0.29 0.41 0.00 0.00 173.24 174.20 1u0f n LYS 88 N -1.81 3.47 0.12 12.44 5.02 -1.26 -4.15 118.16 131.99 1u0f n LYS 88 Ca 0.15 -3.11 0.13 0.00 -2.02 0.00 0.00 58.31 53.46 1u0f n LYS 88 Cb 0.49 -3.01 0.40 0.00 -0.02 0.00 0.00 35.03 32.89 1u0f n LYS 88 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1u0f h ILE 89 N 3.65 0.00 -0.74 -0.18 3.07 -1.86 -3.34 117.51 118.11 1u0f h ILE 89 Ca 0.52 -0.48 -0.55 0.00 1.55 0.00 0.00 64.86 65.89 1u0f h ILE 89 Cb 0.57 1.45 -0.07 0.00 -0.27 0.00 0.00 36.82 38.51 1u0f h ILE 89 CO 1.71 0.00 1.77 0.21 -1.05 0.00 0.00 178.15 180.79 1u0f s ASN 90 N -4.63 6.20 0.32 2.16 3.04 -0.89 -4.82 114.94 116.31 1u0f s ASN 90 Ca 0.09 -2.10 0.16 0.00 0.04 0.00 0.00 52.86 51.06 1u0f s ASN 90 Cb 0.11 -2.58 0.40 0.00 -1.54 0.00 0.00 41.25 37.64 1u0f s ASN 90 CO 0.58 -1.84 1.60 0.10 -3.04 0.00 0.00 177.10 174.49 1u0f h TYR 91 N 8.48 0.00 0.00 0.43 -0.00 -1.83 0.10 116.97 124.15 1u0f h TYR 91 Ca 0.35 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.97 1u0f h TYR 91 Cb 0.90 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.62 1u0f h TYR 91 CO 1.35 0.48 -0.54 1.79 -0.00 0.00 0.00 178.16 181.24 1u0f h THR 92 N 0.00 1.15 -0.01 -0.90 1.35 -1.93 -3.23 112.91 109.35 1u0f h THR 92 Ca -0.00 -2.01 0.00 0.00 -0.55 0.00 0.00 66.41 63.85 1u0f h THR 92 Cb 1.13 2.16 0.00 0.00 -1.73 0.00 0.00 68.15 69.71 1u0f h THR 92 CO 0.06 0.53 -0.35 -0.62 -0.25 0.00 0.00 175.52 174.89 1u0f n GLU 93 N -3.56 1.74 -3.63 4.72 1.02 -1.15 -5.01 120.64 114.77 1u0f n GLU 93 Ca -0.00 -0.74 -0.28 0.00 -0.02 0.00 0.00 57.16 56.12 1u0f n GLU 93 Cb 0.62 -1.25 0.04 0.00 -0.02 0.00 0.00 31.44 30.83 1u0f n GLU 93 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1u0f n ASP 94 N -0.21 -4.97 -4.20 1.62 2.03 0.26 -5.02 116.55 106.05 1u0f n ASP 94 Ca 0.06 -0.96 -0.18 0.00 0.52 0.00 0.00 54.79 54.23 1u0f n ASP 94 Cb 0.32 -3.68 -0.12 0.00 -0.72 0.00 0.00 41.12 36.92 1u0f n ASP 94 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1u0f s ARG 95 N -5.77 0.91 0.95 -0.67 0.52 -0.68 -5.03 118.95 109.18 1u0f s ARG 95 Ca 0.42 -1.09 -0.12 0.00 -0.52 0.00 0.00 55.73 54.42 1u0f s ARG 95 Cb -0.13 -0.86 0.16 0.00 0.52 0.00 0.00 34.95 34.64 1u0f s ARG 95 CO 0.84 0.18 1.10 0.00 0.02 0.00 0.00 175.30 177.43 1u0f s ALA 96 N -1.70 1.27 -0.33 2.13 0.00 -1.26 -2.09 121.76 119.78 1u0f s ALA 96 Ca 0.03 -0.27 -0.00 0.00 0.00 0.00 0.00 51.96 51.72 1u0f s ALA 96 Cb -0.07 -3.13 0.11 0.00 0.00 0.00 0.00 23.12 20.02 1u0f s ALA 96 CO 0.02 -2.59 0.12 0.08 0.00 0.00 0.00 175.76 173.40 1u0f s VAL 97 N -2.99 0.93 -0.26 0.00 1.01 -1.26 -4.37 120.40 113.46 1u0f s VAL 97 Ca 0.64 -1.57 0.18 0.00 0.00 0.00 0.00 61.98 61.23 1u0f s VAL 97 Cb -0.18 -1.70 0.49 0.00 0.00 0.00 0.00 36.38 34.99 1u0f s VAL 97 CO 0.57 -0.72 1.14 0.18 0.00 0.00 0.00 175.10 176.27 1u0f n LEU 98 N 4.64 2.58 0.12 3.92 4.77 -0.51 -4.72 117.00 127.79 1u0f n LEU 98 Ca -0.00 -3.52 0.15 0.00 -0.03 0.00 0.00 56.01 52.61 1u0f n LEU 98 Cb 0.41 0.20 0.68 0.00 -2.33 0.00 0.00 43.42 42.38 1u0f n LEU 98 CO 0.13 1.34 1.14 1.12 -1.33 0.00 0.00 177.39 179.79 1u0f h HIS 99 N 2.40 0.00 0.00 -1.77 2.07 -1.88 -0.89 115.15 115.09 1u0f h HIS 99 Ca 0.01 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.50 1u0f h HIS 99 Cb 1.37 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.34 1u0f h HIS 99 CO 0.60 0.00 -0.13 -0.39 -3.07 0.00 0.00 177.93 174.93 1u0f h VAL 100 N 0.00 0.78 -0.29 6.12 -1.51 -1.95 -2.04 116.25 117.35 1u0f h VAL 100 Ca 0.14 -0.52 -0.10 0.00 -1.23 0.00 0.00 66.70 64.99 1u0f h VAL 100 Cb 0.57 1.31 -0.01 0.00 -2.13 0.00 0.00 31.29 31.03 1u0f h VAL 100 CO -0.00 0.13 -0.24 0.00 -1.23 0.00 0.00 177.57 176.23 1u0f h ALA 101 N 1.87 1.03 -0.55 5.19 0.00 -1.52 -2.93 119.26 122.35 1u0f h ALA 101 Ca -0.00 -0.35 0.07 0.00 0.00 0.00 0.00 54.91 54.62 1u0f h ALA 101 Cb 0.30 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1u0f h ALA 101 CO 0.02 0.58 0.37 -0.07 0.00 0.00 0.00 179.25 180.15 1u0f h LEU 102 N 0.50 0.42 -3.28 0.00 3.38 -1.37 -2.20 115.31 112.76 1u0f h LEU 102 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1u0f h LEU 102 Cb 0.69 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1u0f h LEU 102 CO 0.05 0.27 0.00 -2.11 0.09 0.00 0.00 178.44 176.74 1u0f n ARG 103 N -4.47 2.73 -2.45 1.13 0.00 -1.20 -4.93 116.66 107.46 1u0f n ARG 103 Ca 0.08 -2.89 -0.39 0.00 -0.00 0.00 0.00 57.85 54.65 1u0f n ARG 103 Cb 0.27 -1.84 -0.02 0.00 -0.00 0.00 0.00 32.46 30.87 1u0f n ARG 103 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1u0f s ASN 104 N -2.03 6.36 0.43 2.89 3.04 -0.83 -4.35 114.94 120.46 1u0f s ASN 104 Ca 0.43 -2.14 0.16 0.00 0.04 0.00 0.00 52.86 51.34 1u0f s ASN 104 Cb 0.35 -2.58 0.97 0.00 -1.54 0.00 0.00 41.25 38.45 1u0f s ASN 104 CO 0.08 -1.67 1.94 0.03 -3.04 0.00 0.00 177.10 174.44 1u0f h ARG 105 N 8.34 0.00 0.00 0.43 2.47 -1.90 -2.11 114.38 121.61 1u0f h ARG 105 Ca 0.37 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 59.07 1u0f h ARG 105 Cb 0.90 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.22 1u0f h ARG 105 CO 1.40 0.24 -0.09 0.77 0.56 0.00 0.00 179.97 182.85 1u0f h SER 106 N 0.00 0.00 -0.63 7.04 0.02 -2.00 -3.46 113.55 114.52 1u0f h SER 106 Ca -0.00 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.68 1u0f h SER 106 Cb 0.45 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 62.89 1u0f h SER 106 CO 0.03 0.09 -0.24 0.59 -1.14 0.00 0.00 176.83 176.15 1u0f n ASN 107 N -3.50 -5.36 -4.73 3.07 3.02 -0.80 -4.98 115.26 101.99 1u0f n ASN 107 Ca -0.02 0.33 -0.42 0.00 -0.03 0.00 0.00 54.58 54.44 1u0f n ASN 107 Cb 0.22 -4.02 -0.02 0.00 -0.61 0.00 0.00 39.78 35.36 1u0f n ASN 107 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1u0f n THR 108 N -2.36 0.91 -1.75 3.41 -2.24 -1.26 -4.90 114.28 106.09 1u0f n THR 108 Ca -0.13 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.00 1u0f n THR 108 Cb 0.56 -1.88 -0.01 0.00 -2.10 0.00 0.00 70.33 66.91 1u0f n THR 108 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1u0f n PRO 109 N 2.29 2.62 -3.88 -0.78 -0.04 -1.26 -4.95 135.00 129.01 1u0f n PRO 109 Ca 0.10 0.93 -0.27 0.00 -0.04 0.00 0.00 63.50 64.21 1u0f n PRO 109 Cb 0.36 -2.66 -0.17 0.00 -0.04 0.00 0.00 33.50 30.99 1u0f n PRO 109 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1u0f s ILE 110 N -0.62 1.01 -0.15 0.52 1.01 -1.26 -5.04 121.20 116.66 1u0f s ILE 110 Ca 0.58 -0.49 -0.10 0.00 0.00 0.00 0.00 60.65 60.65 1u0f s ILE 110 Cb -0.50 -1.16 -0.05 0.00 0.01 0.00 0.00 42.46 40.77 1u0f s ILE 110 CO 0.57 0.18 0.17 -0.54 0.00 0.00 0.00 174.94 175.32 1u0f s LYS 111 N 1.69 3.90 -0.14 2.79 1.02 -1.26 -0.80 119.74 126.94 1u0f s LYS 111 Ca 0.02 -0.11 0.01 0.00 0.02 0.00 0.00 55.97 55.91 1u0f s LYS 111 Cb -0.14 -3.32 0.02 0.00 -0.52 0.00 0.00 37.83 33.86 1u0f s LYS 111 CO -0.08 0.49 -0.18 0.08 -0.92 0.00 0.00 175.35 174.75 1u0f s VAL 112 N -0.22 1.76 -1.34 3.17 1.01 -0.15 -4.42 120.40 120.21 1u0f s VAL 112 Ca 0.12 -0.78 -0.05 0.00 0.00 0.00 0.00 61.98 61.28 1u0f s VAL 112 Cb -0.12 -1.60 0.02 0.00 0.00 0.00 0.00 36.38 34.68 1u0f s VAL 112 CO 0.02 0.49 0.94 0.47 0.00 0.00 0.00 175.10 177.02 1u0f n ASP 113 N 4.37 -3.20 0.00 3.32 8.00 -1.26 -2.25 116.55 125.52 1u0f n ASP 113 Ca -0.19 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.61 1u0f n ASP 113 Cb 0.51 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.10 1u0f n ASP 113 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1u0f n GLY 114 N -1.57 0.37 3.14 0.44 0.00 -1.26 -4.99 105.19 101.31 1u0f n GLY 114 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.56 1u0f n GLY 114 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1u0f s LYS 115 N -0.75 2.57 0.16 1.61 2.20 -0.95 -5.02 119.74 119.55 1u0f s LYS 115 Ca 0.00 -0.71 -0.31 0.00 -0.36 0.00 0.00 55.97 54.59 1u0f s LYS 115 Cb 0.00 -2.02 -0.09 0.00 -1.51 0.00 0.00 37.83 34.21 1u0f s LYS 115 CO 0.00 0.08 1.49 0.34 -0.36 0.00 0.00 175.35 176.90 1u0f s ASP 116 N 0.58 6.67 0.11 1.43 2.15 -1.26 -0.98 116.67 125.38 1u0f s ASP 116 Ca -0.14 2.54 0.24 0.00 0.43 0.00 0.00 52.55 55.61 1u0f s ASP 116 Cb -0.17 -2.60 0.35 0.00 -0.30 0.00 0.00 42.92 40.20 1u0f s ASP 116 CO 0.05 -0.75 1.32 1.33 -0.17 0.00 0.00 175.17 176.95 1u0f n VAL 117 N 3.67 0.34 -0.20 1.11 0.24 0.02 -4.45 118.33 119.05 1u0f n VAL 117 Ca 0.12 -0.26 -0.08 0.00 -2.04 0.00 0.00 64.34 62.08 1u0f n VAL 117 Cb 0.40 -0.11 0.02 0.00 -1.47 0.00 0.00 33.84 32.68 1u0f n VAL 117 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 1u0f h MET 118 N 0.00 0.84 -0.75 7.34 2.86 -1.92 -1.98 114.93 121.32 1u0f h MET 118 Ca 0.00 -0.14 0.14 0.00 -2.06 0.00 0.00 59.70 57.64 1u0f h MET 118 Cb 0.74 -0.14 -0.10 0.00 0.06 0.00 0.00 31.60 32.16 1u0f h MET 118 CO 0.00 0.71 0.29 -1.35 1.06 0.00 0.00 176.91 177.62 1u0f h PRO 119 N 0.77 0.42 -0.08 -0.22 0.11 -1.98 0.15 132.00 131.17 1u0f h PRO 119 Ca 0.19 -0.03 -0.19 0.00 0.11 0.00 0.00 66.00 66.09 1u0f h PRO 119 Cb 0.17 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.19 1u0f h PRO 119 CO -0.02 0.28 -0.74 0.93 -0.21 0.00 0.00 178.00 178.24 1u0f h GLU 120 N 0.43 0.43 -0.27 1.05 4.39 -1.75 -0.71 114.58 118.15 1u0f h GLU 120 Ca 0.41 -0.36 0.03 0.00 0.34 0.00 0.00 59.36 59.78 1u0f h GLU 120 Cb 0.63 0.08 -0.03 0.00 -0.10 0.00 0.00 28.75 29.33 1u0f h GLU 120 CO -0.41 1.00 0.11 0.28 -1.16 0.00 0.00 179.01 178.83 1u0f h VAL 121 N 0.29 0.95 -0.13 3.13 2.07 -1.02 -2.24 116.25 119.30 1u0f h VAL 121 Ca -0.03 -0.08 -0.13 0.00 0.82 0.00 0.00 66.70 67.28 1u0f h VAL 121 Cb 1.32 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 1u0f h VAL 121 CO 0.13 0.04 -0.48 0.78 0.02 0.00 0.00 177.57 178.06 1u0f h ASN 122 N 0.24 0.35 -0.59 0.57 2.35 -0.88 -2.03 115.58 115.58 1u0f h ASN 122 Ca 0.12 -0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1u0f h ASN 122 Cb 0.07 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 38.32 1u0f h ASN 122 CO -0.11 0.78 0.34 -0.09 -1.65 0.00 0.00 177.43 176.70 1u0f h ARG 123 N 0.26 0.82 -0.47 0.81 2.43 -0.98 -0.68 114.38 116.58 1u0f h ARG 123 Ca 0.01 -0.09 -0.13 0.00 -0.81 0.00 0.00 59.98 58.96 1u0f h ARG 123 Cb 0.94 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 1u0f h ARG 123 CO 0.08 0.61 -0.22 0.28 -1.51 0.00 0.00 179.97 179.21 1u0f h VAL 124 N 0.80 1.27 -0.75 0.20 2.07 -1.17 -1.85 116.25 116.82 1u0f h VAL 124 Ca 0.21 -1.38 0.02 0.00 0.82 0.00 0.00 66.70 66.37 1u0f h VAL 124 Cb 0.02 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1u0f h VAL 124 CO -0.04 0.48 0.48 -0.07 0.02 0.00 0.00 177.57 178.44 1u0f h LEU 125 N 0.83 0.81 -0.70 2.57 3.38 -1.24 0.45 115.31 121.40 1u0f h LEU 125 Ca 0.11 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.08 1u0f h LEU 125 Cb 0.80 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1u0f h LEU 125 CO 0.07 0.57 0.46 0.44 0.09 0.00 0.00 178.44 180.07 1u0f h ASP 126 N 0.96 0.80 -0.63 -0.43 3.32 -0.83 -0.47 116.42 119.14 1u0f h ASP 126 Ca 0.29 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.28 1u0f h ASP 126 Cb -0.03 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 1u0f h ASP 126 CO -0.09 0.57 0.21 0.11 -1.72 0.00 0.00 179.24 178.31 1u0f h LYS 127 N 0.94 0.97 -0.40 3.56 1.57 -0.87 -1.39 116.57 120.95 1u0f h LYS 127 Ca 0.26 -0.20 0.01 0.00 -1.87 0.00 0.00 60.65 58.85 1u0f h LYS 127 Cb -0.09 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.05 1u0f h LYS 127 CO -0.06 0.85 0.24 0.52 -0.57 0.00 0.00 179.45 180.43 1u0f h MET 128 N 0.90 0.48 -0.36 3.15 2.86 -0.52 -1.39 114.93 120.04 1u0f h MET 128 Ca 0.20 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.83 1u0f h MET 128 Cb 0.28 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 1u0f h MET 128 CO -0.01 0.32 0.20 -0.22 1.06 0.00 0.00 176.91 178.26 1u0f h LYS 129 N 0.49 0.40 -0.47 1.72 3.64 -0.81 -0.54 116.57 121.01 1u0f h LYS 129 Ca 0.16 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1u0f h LYS 129 Cb -0.01 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 1u0f h LYS 129 CO -0.06 0.27 0.17 1.03 -2.27 0.00 0.00 179.45 178.58 1u0f h SER 130 N 0.42 0.66 -0.60 4.20 0.87 -1.11 -1.78 113.55 116.20 1u0f h SER 130 Ca 0.15 -0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.49 1u0f h SER 130 Cb 0.02 -0.17 -0.03 0.00 -0.44 0.00 0.00 62.40 61.78 1u0f h SER 130 CO -0.08 0.67 0.25 0.15 -0.53 0.00 0.00 176.83 177.29 1u0f h PHE 131 N 0.61 0.89 -0.57 2.24 3.57 -1.02 -2.10 116.94 120.57 1u0f h PHE 131 Ca 0.15 -0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1u0f h PHE 131 Cb 0.22 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 1u0f h PHE 131 CO 0.01 0.71 0.31 0.00 -2.23 0.00 0.00 178.31 177.11 1u0f h GLN 133 N 0.77 0.44 -0.46 0.00 -0.00 -1.08 -0.24 115.11 114.54 1u0f h GLN 133 Ca 0.20 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.65 58.79 1u0f h GLN 133 Cb 0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 27.48 27.41 1u0f h GLN 133 CO -0.03 0.29 0.13 0.00 0.00 0.00 0.00 178.83 179.22 1u0f h ARG 134 N 0.45 0.72 -0.00 1.69 3.08 -0.95 -2.02 114.38 117.35 1u0f h ARG 134 Ca 0.23 -0.16 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 1u0f h ARG 134 Cb 0.18 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1u0f h ARG 134 CO -0.19 0.69 -0.01 0.28 -1.07 0.00 0.00 179.97 179.68 1u0f h VAL 135 N 0.60 1.48 0.00 2.04 2.07 -1.14 0.28 116.25 121.58 1u0f h VAL 135 Ca 0.15 -1.42 -0.08 0.00 0.82 0.00 0.00 66.70 66.16 1u0f h VAL 135 Cb 0.28 2.44 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 1u0f h VAL 135 CO -0.00 0.37 -0.39 0.03 0.02 0.00 0.00 177.57 177.60 1u0f h ARG 136 N -0.59 0.00 0.00 1.57 3.08 -1.06 -2.46 114.38 114.92 1u0f h ARG 136 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1u0f h ARG 136 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1u0f h ARG 136 CO 0.00 0.39 0.00 0.66 -1.07 0.00 0.00 179.97 179.95 1u0f h SER 137 N 0.00 0.00 0.00 7.04 4.64 -1.48 -3.47 113.55 120.28 1u0f h SER 137 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u0f h SER 137 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 1u0f h SER 137 CO 0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.62 1u0f n GLY 138 N 0.57 0.84 0.29 -0.77 0.00 -0.93 -4.96 105.19 100.23 1u0f n GLY 138 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 1u0f n GLY 138 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1u0f h ASP 139 N 0.00 1.04 -2.88 1.61 3.45 -1.64 -3.43 116.42 114.58 1u0f h ASP 139 Ca 0.00 -0.38 -0.55 0.00 0.43 0.00 0.00 57.03 56.52 1u0f h ASP 139 Cb 0.00 -0.29 -0.02 0.00 -0.56 0.00 0.00 39.33 38.46 1u0f h ASP 139 CO 0.00 1.19 0.89 0.86 -1.57 0.00 0.00 179.24 180.61 1u0f s TRP 140 N -4.72 2.73 0.07 4.55 -0.11 0.03 -5.00 118.94 116.49 1u0f s TRP 140 Ca -0.11 0.82 0.05 0.00 1.22 0.00 0.00 56.10 58.08 1u0f s TRP 140 Cb 0.12 -3.62 -0.04 0.00 -1.50 0.00 0.00 33.47 28.44 1u0f s TRP 140 CO 0.87 -2.28 -0.06 0.15 -4.62 0.00 0.00 176.95 171.01 1u0f s LYS 141 N 3.08 2.39 0.73 5.86 -0.14 -1.26 -3.82 119.74 126.58 1u0f s LYS 141 Ca 0.61 -0.87 -0.11 0.00 -1.36 0.00 0.00 55.97 54.24 1u0f s LYS 141 Cb -0.27 -2.44 0.17 0.00 -1.68 0.00 0.00 37.83 33.61 1u0f s LYS 141 CO 0.22 0.55 0.99 0.41 -0.76 0.00 0.00 175.35 176.76 1u0f n GLY 142 N 0.96 -1.16 0.29 -3.33 0.00 0.40 -4.88 105.19 97.47 1u0f n GLY 142 Ca -0.13 -1.74 0.19 0.00 0.00 0.00 0.00 46.02 44.33 1u0f n GLY 142 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 1u0f h TYR 143 N -1.46 0.00 -0.61 1.61 -0.00 -1.89 -0.51 116.97 114.11 1u0f h TYR 143 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.41 1u0f h TYR 143 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.64 1u0f h TYR 143 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.41 1u0f n THR 144 N -3.01 0.99 -0.52 -0.90 -2.24 -1.26 -4.98 114.28 102.36 1u0f n THR 144 Ca -0.00 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.78 1u0f n THR 144 Cb 0.22 0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1u0f n THR 144 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u0f n GLY 145 N 1.31 0.69 3.74 3.38 0.00 -0.20 -5.08 105.19 109.02 1u0f n GLY 145 Ca 0.21 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 1u0f n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u0f s LYS 146 N -0.97 2.83 0.70 1.61 1.02 -1.26 -4.81 119.74 118.87 1u0f s LYS 146 Ca 0.00 -0.65 -0.16 0.00 0.02 0.00 0.00 55.97 55.18 1u0f s LYS 146 Cb 0.00 -2.71 0.02 0.00 -0.52 0.00 0.00 37.83 34.63 1u0f s LYS 146 CO 0.00 0.59 1.21 -1.12 -0.92 0.00 0.00 175.35 175.11 1u0f s SER 147 N -2.03 4.43 0.11 2.83 0.01 -1.26 -0.45 113.70 117.34 1u0f s SER 147 Ca 0.25 2.35 -0.30 0.00 1.31 0.00 0.00 55.95 59.56 1u0f s SER 147 Cb -0.12 -2.59 -0.06 0.00 0.21 0.00 0.00 66.02 63.46 1u0f s SER 147 CO 0.17 -2.11 1.07 -0.63 0.41 0.00 0.00 173.24 172.15 1u0f s ILE 148 N -1.92 4.20 -0.02 1.44 -1.09 -1.25 -4.75 121.20 117.81 1u0f s ILE 148 Ca 0.75 1.76 0.06 0.00 -2.23 0.00 0.00 60.65 60.98 1u0f s ILE 148 Cb -0.29 -4.12 -0.09 0.00 -1.58 0.00 0.00 42.46 36.38 1u0f s ILE 148 CO 0.43 0.24 0.13 0.35 -1.23 0.00 0.00 174.94 174.86 1u0f n THR 149 N 3.02 0.00 -4.05 2.92 -2.24 -0.07 -4.89 114.28 108.97 1u0f n THR 149 Ca 0.04 -0.14 -0.17 0.00 -2.27 0.00 0.00 64.05 61.51 1u0f n THR 149 Cb 0.48 0.39 -0.16 0.00 -2.10 0.00 0.00 70.33 68.95 1u0f n THR 149 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1u0f s ASP 150 N -2.62 0.56 -0.14 3.42 1.11 -1.06 -1.82 116.67 116.13 1u0f s ASP 150 Ca -0.02 -0.07 -0.03 0.00 0.18 0.00 0.00 52.55 52.61 1u0f s ASP 150 Cb 0.04 -0.22 -0.03 0.00 1.07 0.00 0.00 42.92 43.78 1u0f s ASP 150 CO 0.24 -0.04 -0.04 -0.63 1.18 0.00 0.00 175.17 175.89 1u0f s ILE 151 N 0.60 3.89 -0.24 0.77 -1.09 0.43 -0.98 121.20 124.58 1u0f s ILE 151 Ca -0.07 -0.37 0.02 0.00 -2.23 0.00 0.00 60.65 58.00 1u0f s ILE 151 Cb -0.10 -2.68 0.06 0.00 -1.58 0.00 0.00 42.46 38.16 1u0f s ILE 151 CO -0.01 0.52 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.51 1u0f s ILE 152 N 0.11 1.77 -0.13 2.92 1.09 0.38 -0.93 121.20 126.41 1u0f s ILE 152 Ca -0.01 -1.35 -0.25 0.00 -1.10 0.00 0.00 60.65 57.94 1u0f s ILE 152 Cb -0.14 -1.96 -0.02 0.00 -1.06 0.00 0.00 42.46 39.28 1u0f s ILE 152 CO 0.03 -0.05 0.80 0.21 -0.10 0.00 0.00 174.94 175.83 1u0f s ASN 153 N 1.29 6.99 -0.23 3.58 3.84 0.10 -0.36 114.94 130.14 1u0f s ASN 153 Ca -0.07 1.20 -0.02 0.00 0.21 0.00 0.00 52.86 54.19 1u0f s ASN 153 Cb -0.19 -2.45 0.02 0.00 -0.55 0.00 0.00 41.25 38.08 1u0f s ASN 153 CO -0.06 -0.32 -0.07 -0.63 -2.79 0.00 0.00 177.10 173.23 1u0f s ILE 154 N 1.73 2.91 0.00 -5.21 1.01 0.32 -0.70 121.20 121.26 1u0f s ILE 154 Ca 0.39 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 60.16 1u0f s ILE 154 Cb -0.17 -2.41 0.00 0.00 0.01 0.00 0.00 42.46 39.89 1u0f s ILE 154 CO 0.15 0.30 0.00 0.61 0.00 0.00 0.00 174.94 176.00 1u0f n GLY 155 N 4.70 0.56 3.07 6.18 0.00 -0.79 -0.71 105.19 118.19 1u0f n GLY 155 Ca -0.17 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 1u0f n GLY 155 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1u0f s ILE 156 N -2.00 0.37 0.00 -0.61 2.07 -1.26 -3.97 121.20 115.80 1u0f s ILE 156 Ca 0.00 -1.39 0.00 0.00 -1.41 0.00 0.00 60.65 57.85 1u0f s ILE 156 Cb 0.00 -0.95 0.00 0.00 0.13 0.00 0.00 42.46 41.64 1u0f s ILE 156 CO 0.00 -0.67 0.00 0.61 -1.91 0.00 0.00 174.94 172.97 1u0f n GLY 157 N 0.86 4.21 0.33 1.50 0.00 -1.26 -2.04 105.19 108.79 1u0f n GLY 157 Ca -0.19 0.15 0.21 0.00 0.00 0.00 0.00 46.02 46.19 1u0f n GLY 157 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1u0f h GLY 158 N 0.00 0.00 -1.61 -0.02 0.00 -1.98 0.11 103.07 99.57 1u0f h GLY 158 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1u0f h GLY 158 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.98 1u0f n SER 159 N -3.25 2.54 0.01 0.19 7.64 -0.86 -4.53 113.62 115.35 1u0f n SER 159 Ca -0.03 -1.90 0.00 0.00 1.01 0.00 0.00 58.87 57.95 1u0f n SER 159 Cb 0.08 -0.23 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 1u0f n SER 159 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1u0f n ASP 160 N 0.88 0.05 -0.22 6.43 2.03 -0.26 -4.41 116.55 121.05 1u0f n ASP 160 Ca 0.17 0.04 -0.06 0.00 0.52 0.00 0.00 54.79 55.46 1u0f n ASP 160 Cb 0.44 0.01 0.08 0.00 -0.72 0.00 0.00 41.12 40.93 1u0f n ASP 160 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1u0f h LEU 161 N 0.00 1.01 0.54 -2.67 3.38 -1.10 -1.13 115.31 115.34 1u0f h LEU 161 Ca 0.00 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.73 1u0f h LEU 161 Cb 0.42 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 40.91 1u0f h LEU 161 CO 0.00 0.98 -0.26 1.23 0.09 0.00 0.00 178.44 180.48 1u0f h GLY 162 N 1.06 -0.76 0.67 0.83 0.00 -1.80 -0.56 103.07 102.51 1u0f h GLY 162 Ca 0.21 0.28 0.08 0.00 0.00 0.00 0.00 47.33 47.90 1u0f h GLY 162 CO 0.00 -0.28 0.60 -2.55 0.00 0.00 0.00 176.54 174.32 1u0f h PRO 163 N -1.08 1.03 0.18 4.80 0.11 -1.87 -0.68 132.00 134.50 1u0f h PRO 163 Ca -0.07 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.97 1u0f h PRO 163 Cb 0.62 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1u0f h PRO 163 CO 0.12 0.68 -0.09 1.25 -0.21 0.00 0.00 178.00 179.76 1u0f h LEU 164 N 1.06 -0.20 -0.99 2.35 5.85 -1.23 -1.41 115.31 120.74 1u0f h LEU 164 Ca 0.42 -0.12 0.02 0.00 0.84 0.00 0.00 57.88 59.04 1u0f h LEU 164 Cb 0.24 0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 1u0f h LEU 164 CO -0.19 0.00 0.66 -0.03 -0.34 0.00 0.00 178.44 178.53 1u0f h MET 165 N -0.40 1.29 -0.06 1.25 4.05 -0.83 -1.67 114.93 118.55 1u0f h MET 165 Ca -0.02 -0.08 -0.20 0.00 -0.28 0.00 0.00 59.70 59.12 1u0f h MET 165 Cb 0.31 -0.29 0.01 0.00 -0.80 0.00 0.00 31.60 30.84 1u0f h MET 165 CO 0.04 0.85 -0.75 0.28 0.23 0.00 0.00 176.91 177.56 1u0f h VAL 166 N 1.32 1.33 -0.30 -5.77 2.07 -1.10 -0.91 116.25 112.90 1u0f h VAL 166 Ca 0.37 -2.04 -0.06 0.00 0.82 0.00 0.00 66.70 65.79 1u0f h VAL 166 Cb -0.12 2.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.92 1u0f h VAL 166 CO -0.09 0.62 -0.09 0.71 0.02 0.00 0.00 177.57 178.74 1u0f h THR 167 N 0.25 1.22 -0.31 2.57 1.35 -1.16 -0.32 112.91 116.50 1u0f h THR 167 Ca -0.08 -0.94 -0.04 0.00 -0.55 0.00 0.00 66.41 64.80 1u0f h THR 167 Cb 1.41 1.09 -0.01 0.00 -1.73 0.00 0.00 68.15 68.91 1u0f h THR 167 CO 0.15 0.31 0.04 -0.33 -0.25 0.00 0.00 175.52 175.44 1u0f h GLU 168 N 0.46 0.52 0.00 4.72 4.39 -1.22 -2.44 114.58 121.01 1u0f h GLU 168 Ca 0.09 -0.15 -0.09 0.00 0.34 0.00 0.00 59.36 59.55 1u0f h GLU 168 Cb 0.44 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1u0f h GLU 168 CO 0.02 0.63 -0.44 0.00 -1.16 0.00 0.00 179.01 178.06 1u0f h ALA 169 N 0.88 1.12 -0.42 3.43 0.00 -0.77 -3.07 119.26 120.43 1u0f h ALA 169 Ca 0.09 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.55 1u0f h ALA 169 Cb 0.36 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1u0f h ALA 169 CO 0.01 0.54 0.04 1.28 0.00 0.00 0.00 179.25 181.12 1u0f n LEU 170 N -3.79 4.69 -0.32 0.00 4.77 -0.17 -4.76 117.00 117.41 1u0f n LEU 170 Ca -0.01 -3.11 0.15 0.00 -0.03 0.00 0.00 56.01 53.01 1u0f n LEU 170 Cb 0.49 -0.62 0.34 0.00 -2.33 0.00 0.00 43.42 41.31 1u0f n LEU 170 CO 0.39 0.74 1.10 0.50 -1.33 0.00 0.00 177.39 178.79 1u0f h LYS 171 N 2.35 0.48 0.00 3.23 1.63 -1.34 0.35 116.57 123.28 1u0f h LYS 171 Ca 0.07 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 1u0f h LYS 171 Cb 1.74 -0.11 0.00 0.00 -0.60 0.00 0.00 32.23 33.26 1u0f h LYS 171 CO 0.39 0.32 0.00 -1.35 -3.45 0.00 0.00 179.45 175.36 1u0f h PRO 172 N 0.50 0.00 -0.26 1.90 0.11 -1.89 -1.85 132.00 130.51 1u0f h PRO 172 Ca 0.60 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.71 1u0f h PRO 172 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1u0f h PRO 172 CO -0.49 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.96 1u0f n TYR 173 N -2.42 0.34 -0.13 0.65 4.02 0.11 -4.20 117.16 115.53 1u0f n TYR 173 Ca -0.00 -0.17 0.12 0.00 -0.01 0.00 0.00 57.90 57.83 1u0f n TYR 173 Cb 0.12 0.00 0.29 0.00 -0.02 0.00 0.00 39.34 39.73 1u0f n TYR 173 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1u0f n SER 174 N 0.51 3.77 -4.71 7.72 3.41 -0.70 -4.53 113.62 119.09 1u0f n SER 174 Ca 0.15 -2.00 -0.43 0.00 -0.26 0.00 0.00 58.87 56.33 1u0f n SER 174 Cb 0.35 -0.42 -0.03 0.00 -0.26 0.00 0.00 64.21 63.85 1u0f n SER 174 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1u0f n LYS 175 N 1.59 2.48 -0.87 4.33 5.02 -1.26 -0.90 118.16 128.55 1u0f n LYS 175 Ca 0.23 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 57.41 1u0f n LYS 175 Cb 0.61 -2.66 0.00 0.00 -0.02 0.00 0.00 35.03 32.96 1u0f n LYS 175 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u0f n GLY 176 N 2.89 0.79 3.94 0.72 0.00 -1.26 -5.02 105.19 107.25 1u0f n GLY 176 Ca 0.13 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1u0f n GLY 176 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u0f s GLY 177 N -2.00 1.62 0.67 -0.02 0.00 -0.07 -5.04 107.32 102.47 1u0f s GLY 177 Ca 0.00 -0.95 -0.15 0.00 0.00 0.00 0.00 44.72 43.62 1u0f s GLY 177 CO 0.00 -0.71 1.12 2.56 0.00 0.00 0.00 173.10 176.07 1u0f s PRO 178 N -4.78 2.73 0.51 2.90 0.04 -1.26 -5.00 135.00 130.14 1u0f s PRO 178 Ca 0.52 1.41 -0.22 0.00 0.04 0.00 0.00 61.00 62.75 1u0f s PRO 178 Cb -0.10 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.44 1u0f s PRO 178 CO 0.41 -1.31 1.30 1.03 0.04 0.00 0.00 177.00 178.47 1u0f s ARG 179 N -4.11 3.39 -0.04 4.56 0.52 -0.76 -4.74 118.95 117.78 1u0f s ARG 179 Ca 0.67 2.09 0.05 0.00 -0.52 0.00 0.00 55.73 58.03 1u0f s ARG 179 Cb -0.21 -2.34 -0.02 0.00 0.52 0.00 0.00 34.95 32.90 1u0f s ARG 179 CO 0.42 -0.95 -0.19 0.14 0.02 0.00 0.00 175.30 174.74 1u0f s VAL 180 N -1.38 2.66 0.04 3.52 -7.23 -1.26 -0.43 120.40 116.33 1u0f s VAL 180 Ca 0.68 -0.88 0.05 0.00 -1.81 0.00 0.00 61.98 60.02 1u0f s VAL 180 Cb -0.37 -2.00 -0.02 0.00 0.56 0.00 0.00 36.38 34.55 1u0f s VAL 180 CO 0.44 0.58 -0.15 0.26 -0.31 0.00 0.00 175.10 175.92 1u0f s TRP 181 N -0.69 1.33 -0.16 2.82 0.52 -0.10 -4.97 118.94 117.69 1u0f s TRP 181 Ca 0.11 -0.36 0.01 0.00 0.02 0.00 0.00 56.10 55.88 1u0f s TRP 181 Cb -0.10 -0.79 0.02 0.00 -1.15 0.00 0.00 33.47 31.44 1u0f s TRP 181 CO -0.00 0.05 -0.18 -0.06 0.02 0.00 0.00 176.95 176.78 1u0f s PHE 182 N -0.84 2.54 -0.17 -1.98 0.40 -1.26 -0.72 117.98 115.94 1u0f s PHE 182 Ca 0.03 -1.45 -0.02 0.00 -0.60 0.00 0.00 56.93 54.88 1u0f s PHE 182 Cb -0.08 -1.78 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 1u0f s PHE 182 CO 0.01 -0.74 -0.07 0.08 0.70 0.00 0.00 175.22 175.20 1u0f s VAL 183 N 1.31 3.41 0.03 -0.44 1.01 0.12 -4.98 120.40 120.85 1u0f s VAL 183 Ca 0.04 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1u0f s VAL 183 Cb -0.13 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.76 1u0f s VAL 183 CO -0.11 0.48 0.00 -1.54 0.00 0.00 0.00 175.10 173.93 1u0f n SER 184 N 3.95 -0.02 -4.77 3.32 3.41 -1.25 -1.88 113.62 116.37 1u0f n SER 184 Ca -0.18 0.05 -0.40 0.00 -0.26 0.00 0.00 58.87 58.08 1u0f n SER 184 Cb 0.52 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 1u0f n SER 184 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1u0f s ASN 185 N -5.00 6.24 0.41 4.04 3.84 -1.26 -4.65 114.94 118.55 1u0f s ASN 185 Ca 0.00 2.82 0.13 0.00 0.21 0.00 0.00 52.86 56.02 1u0f s ASN 185 Cb 0.00 -2.65 0.86 0.00 -0.55 0.00 0.00 41.25 38.91 1u0f s ASN 185 CO 0.00 -0.92 1.91 -0.29 -2.79 0.00 0.00 177.10 175.02 1u0f h ILE 186 N 2.59 1.19 -1.10 -5.21 6.09 -1.98 -3.44 117.51 115.65 1u0f h ILE 186 Ca -0.50 -0.91 -0.82 0.00 -1.37 0.00 0.00 64.86 61.26 1u0f h ILE 186 Cb 1.25 1.46 0.01 0.00 0.47 0.00 0.00 36.82 40.01 1u0f h ILE 186 CO 0.63 0.26 0.84 -0.67 -3.07 0.00 0.00 178.15 176.14 1u0f n ASP 187 N -4.22 1.60 0.26 2.19 4.64 -1.26 -4.77 116.55 114.99 1u0f n ASP 187 Ca -0.02 1.09 0.18 0.00 -1.38 0.00 0.00 54.79 54.66 1u0f n ASP 187 Cb 0.31 -0.98 0.92 0.00 -1.04 0.00 0.00 41.12 40.33 1u0f n ASP 187 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 1u0f h GLY 188 N 6.30 0.00 0.33 0.27 0.00 -2.02 -0.58 103.07 107.37 1u0f h GLY 188 Ca -0.41 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.08 1u0f h GLY 188 CO 0.98 0.00 0.61 -0.84 0.00 0.00 0.00 176.54 177.30 1u0f h THR 189 N 0.00 0.79 0.33 4.70 2.02 -1.94 -1.18 112.91 117.63 1u0f h THR 189 Ca 0.00 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.90 1u0f h THR 189 Cb 0.09 -0.05 0.00 0.00 -1.74 0.00 0.00 68.15 66.45 1u0f h THR 189 CO 0.00 0.14 -0.16 -0.74 0.37 0.00 0.00 175.52 175.13 1u0f h HIS 190 N 0.78 -0.42 -0.45 3.16 2.76 -1.39 -1.45 115.15 118.14 1u0f h HIS 190 Ca 0.52 -0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.55 1u0f h HIS 190 Cb 0.78 0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.86 1u0f h HIS 190 CO -0.00 -0.08 -0.22 0.97 -1.30 0.00 0.00 177.93 177.30 1u0f h ILE 191 N -0.84 1.27 -0.12 6.26 2.10 -1.72 -2.86 117.51 121.60 1u0f h ILE 191 Ca -0.05 -1.36 -0.00 0.00 1.08 0.00 0.00 64.86 64.53 1u0f h ILE 191 Cb 0.53 1.15 -0.01 0.00 -1.09 0.00 0.00 36.82 37.40 1u0f h ILE 191 CO 0.08 0.47 0.07 0.00 -1.08 0.00 0.00 178.15 177.68 1u0f h ALA 192 N 0.96 0.16 -0.13 0.18 0.00 -1.17 0.16 119.26 119.40 1u0f h ALA 192 Ca 0.11 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 1u0f h ALA 192 Cb 0.77 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1u0f h ALA 192 CO 0.06 -0.33 -0.27 0.87 0.00 0.00 0.00 179.25 179.58 1u0f h LYS 193 N 0.13 0.24 0.06 0.00 1.79 -1.30 -1.83 116.57 115.66 1u0f h LYS 193 Ca 0.04 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1u0f h LYS 193 Cb 0.03 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 1u0f h LYS 193 CO -0.01 0.50 -0.03 1.15 -1.08 0.00 0.00 179.45 179.98 1u0f h THR 194 N 0.22 1.19 0.00 -0.16 2.02 -1.24 -3.25 112.91 111.68 1u0f h THR 194 Ca 0.03 -0.88 -0.04 0.00 0.77 0.00 0.00 66.41 66.29 1u0f h THR 194 Cb 0.60 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.76 1u0f h THR 194 CO 0.04 0.22 -0.20 -0.07 0.37 0.00 0.00 175.52 175.88 1u0f h LEU 195 N -0.48 0.00 -2.07 2.58 3.38 -0.81 -2.21 115.31 115.71 1u0f h LEU 195 Ca -0.01 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1u0f h LEU 195 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 1u0f h LEU 195 CO 0.01 0.20 0.02 0.00 0.09 0.00 0.00 178.44 178.76 1u0f h ALA 196 N 1.80 1.95 -0.67 1.53 0.00 -1.36 -2.00 119.26 120.51 1u0f h ALA 196 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1u0f h ALA 196 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1u0f h ALA 196 CO 0.03 -0.03 0.00 0.43 0.00 0.00 0.00 179.25 179.68 1u0f n SER 197 N -4.43 3.59 -4.31 0.00 7.64 -0.83 -4.99 113.62 110.29 1u0f n SER 197 Ca -0.02 -2.01 -0.18 0.00 1.01 0.00 0.00 58.87 57.67 1u0f n SER 197 Cb 0.11 -0.45 -0.10 0.00 -1.01 0.00 0.00 64.21 62.76 1u0f n SER 197 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1u0f s LEU 198 N -1.01 2.52 -0.12 -3.43 1.43 -0.75 -5.13 118.68 112.20 1u0f s LEU 198 Ca 0.45 -0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 52.56 1u0f s LEU 198 Cb 0.23 -0.60 -0.03 0.00 0.03 0.00 0.00 46.19 45.83 1u0f s LEU 198 CO 0.30 -0.19 -0.07 -0.55 0.23 0.00 0.00 176.35 176.07 1u0f s SER 199 N -3.13 4.55 0.57 2.29 0.15 -1.26 -5.00 113.70 111.87 1u0f s SER 199 Ca 0.19 -0.14 0.27 0.00 0.70 0.00 0.00 55.95 56.97 1u0f s SER 199 Cb -0.01 -1.51 1.65 0.00 -1.71 0.00 0.00 66.02 64.44 1u0f s SER 199 CO 0.05 0.24 2.18 -0.65 1.20 0.00 0.00 173.24 176.26 1u0f h PRO 200 N 6.17 0.00 0.00 5.44 0.11 -1.95 -2.61 132.00 139.16 1u0f h PRO 200 Ca -0.36 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.70 1u0f h PRO 200 Cb 1.19 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1u0f h PRO 200 CO 0.57 0.00 -0.23 0.93 -0.21 0.00 0.00 178.00 179.07 1u0f h GLU 201 N 0.00 0.00 0.00 1.05 5.08 -1.97 -3.31 114.58 115.42 1u0f h GLU 201 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1u0f h GLU 201 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1u0f h GLU 201 CO -0.00 0.23 -0.10 0.25 -1.00 0.00 0.00 179.01 178.38 1u0f n THR 202 N -3.51 0.94 -4.66 1.13 -2.24 -0.99 -4.34 114.28 100.60 1u0f n THR 202 Ca -0.01 -1.07 -0.33 0.00 -2.27 0.00 0.00 64.05 60.37 1u0f n THR 202 Cb 0.39 0.32 -0.13 0.00 -2.10 0.00 0.00 70.33 68.81 1u0f n THR 202 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1u0f s SER 203 N -1.50 4.35 -0.18 3.42 0.01 -1.15 -0.89 113.70 117.76 1u0f s SER 203 Ca 0.11 -0.20 -0.01 0.00 1.31 0.00 0.00 55.95 57.16 1u0f s SER 203 Cb 0.10 -1.48 -0.00 0.00 0.21 0.00 0.00 66.02 64.85 1u0f s SER 203 CO 0.01 0.23 -0.11 -0.22 0.41 0.00 0.00 173.24 173.55 1u0f s LEU 204 N -0.00 2.63 -0.08 2.44 2.96 -0.15 -4.79 118.68 121.68 1u0f s LEU 204 Ca -0.02 -0.44 -0.14 0.00 -0.22 0.00 0.00 54.13 53.32 1u0f s LEU 204 Cb -0.14 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.88 1u0f s LEU 204 CO 0.03 0.05 0.34 -0.36 -1.32 0.00 0.00 176.35 175.09 1u0f s PHE 205 N 1.04 3.61 -0.27 5.38 0.40 0.11 -0.47 117.98 127.79 1u0f s PHE 205 Ca -0.01 0.79 0.00 0.00 -0.60 0.00 0.00 56.93 57.12 1u0f s PHE 205 Cb -0.15 -2.28 0.05 0.00 0.51 0.00 0.00 43.02 41.15 1u0f s PHE 205 CO -0.02 0.49 -0.07 0.42 0.70 0.00 0.00 175.22 176.74 1u0f s ILE 206 N -0.42 2.59 -0.48 0.64 1.01 0.51 -1.15 121.20 123.90 1u0f s ILE 206 Ca 0.20 -1.37 -0.19 0.00 0.00 0.00 0.00 60.65 59.29 1u0f s ILE 206 Cb -0.15 -2.44 0.05 0.00 0.01 0.00 0.00 42.46 39.93 1u0f s ILE 206 CO 0.09 0.03 0.59 -0.63 0.00 0.00 0.00 174.94 175.02 1u0f s ILE 207 N 1.21 4.91 -0.35 2.92 -1.09 0.18 -0.52 121.20 128.47 1u0f s ILE 207 Ca -0.05 -0.38 -0.08 0.00 -2.23 0.00 0.00 60.65 57.90 1u0f s ILE 207 Cb -0.19 -4.24 0.03 0.00 -1.58 0.00 0.00 42.46 36.49 1u0f s ILE 207 CO -0.04 -0.70 0.15 0.00 -1.23 0.00 0.00 174.94 173.11 1u0f s ALA 208 N 2.55 3.15 -0.30 9.38 0.00 0.11 -0.90 121.76 135.76 1u0f s ALA 208 Ca 0.16 -1.69 -0.12 0.00 0.00 0.00 0.00 51.96 50.30 1u0f s ALA 208 Cb -0.18 -2.40 0.13 0.00 0.00 0.00 0.00 23.12 20.68 1u0f s ALA 208 CO 0.13 -1.30 0.76 0.45 0.00 0.00 0.00 175.76 175.80 1u0f s SER 209 N 1.48 -0.95 0.10 0.00 0.15 -0.61 -4.34 113.70 109.54 1u0f s SER 209 Ca 0.01 1.34 -0.24 0.00 0.70 0.00 0.00 55.95 57.75 1u0f s SER 209 Cb -0.19 2.00 -0.11 0.00 -1.71 0.00 0.00 66.02 66.01 1u0f s SER 209 CO 0.05 -0.19 1.70 0.50 1.20 0.00 0.00 173.24 176.50 1u0f h LYS 210 N 7.68 -0.17 0.00 5.44 3.64 -1.95 -2.86 116.57 128.35 1u0f h LYS 210 Ca -0.19 0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.04 1u0f h LYS 210 Cb 1.12 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.96 1u0f h LYS 210 CO 0.11 -0.11 -0.77 1.79 -2.27 0.00 0.00 179.45 178.19 1u0f h THR 211 N -0.18 1.36 -3.03 1.00 1.35 -1.97 -2.15 112.91 109.28 1u0f h THR 211 Ca 0.02 -2.82 -0.34 0.00 -0.55 0.00 0.00 66.41 62.72 1u0f h THR 211 Cb 0.20 2.61 -0.04 0.00 -1.73 0.00 0.00 68.15 69.20 1u0f h THR 211 CO -0.07 0.75 -0.42 0.33 -0.25 0.00 0.00 175.52 175.86 1u0f n PHE 212 N -3.34 -1.03 -0.37 4.73 7.35 -1.08 -4.66 117.46 119.06 1u0f n PHE 212 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 1u0f n PHE 212 Cb 0.83 -3.38 0.00 0.00 0.35 0.00 0.00 39.48 37.28 1u0f n PHE 212 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 1u0f n THR 213 N -3.49 0.00 -1.69 -2.13 -2.24 -1.26 -4.85 114.28 98.62 1u0f n THR 213 Ca -0.20 -0.29 -0.43 0.00 -2.27 0.00 0.00 64.05 60.87 1u0f n THR 213 Cb 0.64 1.37 -0.03 0.00 -2.10 0.00 0.00 70.33 70.21 1u0f n THR 213 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1u0f n THR 214 N -0.08 0.28 -0.14 4.28 -1.04 -1.26 -4.88 114.28 111.45 1u0f n THR 214 Ca 0.00 -0.05 -0.07 0.00 -2.04 0.00 0.00 64.05 61.89 1u0f n THR 214 Cb 0.09 -2.07 0.02 0.00 -1.82 0.00 0.00 70.33 66.55 1u0f n THR 214 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 1u0f h GLN 215 N 8.09 0.51 -0.49 -2.82 4.15 -1.99 -1.22 115.11 121.34 1u0f h GLN 215 Ca -0.46 -0.03 -0.00 0.00 0.77 0.00 0.00 58.65 58.93 1u0f h GLN 215 Cb 1.22 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.77 1u0f h GLN 215 CO 0.95 0.34 0.29 0.93 -1.93 0.00 0.00 178.83 179.41 1u0f h GLU 216 N 0.53 0.67 -0.13 1.69 3.07 -1.92 -1.59 114.58 116.90 1u0f h GLU 216 Ca 0.17 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 58.89 1u0f h GLU 216 Cb -0.01 -0.14 -0.00 0.00 -0.84 0.00 0.00 28.75 27.76 1u0f h GLU 216 CO -0.07 0.49 -0.23 1.15 -1.40 0.00 0.00 179.01 178.96 1u0f h THR 217 N 0.66 1.37 -0.54 1.13 2.02 -1.76 -1.00 112.91 114.78 1u0f h THR 217 Ca 0.18 -1.47 -0.08 0.00 0.77 0.00 0.00 66.41 65.80 1u0f h THR 217 Cb -0.00 2.00 -0.02 0.00 -1.74 0.00 0.00 68.15 68.39 1u0f h THR 217 CO -0.03 0.43 0.01 0.40 0.37 0.00 0.00 175.52 176.70 1u0f h ILE 218 N -0.01 1.25 -0.15 3.11 1.08 -1.22 0.67 117.51 122.25 1u0f h ILE 218 Ca 0.01 -1.05 -0.02 0.00 -0.39 0.00 0.00 64.86 63.40 1u0f h ILE 218 Cb 0.80 0.83 -0.01 0.00 -3.07 0.00 0.00 36.82 35.37 1u0f h ILE 218 CO 0.05 0.38 0.00 0.74 -0.69 0.00 0.00 178.15 178.63 1u0f h THR 219 N 0.84 1.25 -0.61 -0.27 2.02 -1.26 0.17 112.91 115.05 1u0f h THR 219 Ca 0.16 -0.82 0.06 0.00 0.77 0.00 0.00 66.41 66.58 1u0f h THR 219 Cb 0.48 1.50 -0.06 0.00 -1.74 0.00 0.00 68.15 68.33 1u0f h THR 219 CO 0.02 0.24 0.32 0.78 0.37 0.00 0.00 175.52 177.25 1u0f h ASN 220 N 0.01 0.44 -0.71 4.18 2.35 -1.08 -0.71 115.58 120.06 1u0f h ASN 220 Ca 0.04 0.04 -0.06 0.00 -0.55 0.00 0.00 56.30 55.77 1u0f h ASN 220 Cb 0.36 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.66 1u0f h ASN 220 CO 0.01 0.29 0.21 0.00 -1.65 0.00 0.00 177.43 176.28 1u0f h ALA 221 N 1.34 1.01 -0.68 -0.83 0.00 -0.60 -0.68 119.26 118.82 1u0f h ALA 221 Ca 0.28 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1u0f h ALA 221 Cb 0.21 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1u0f h ALA 221 CO -0.20 0.66 0.15 0.93 0.00 0.00 0.00 179.25 180.79 1u0f h GLU 222 N 1.08 1.11 -0.49 0.00 5.08 -0.51 -0.38 114.58 120.47 1u0f h GLU 222 Ca 0.23 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 1u0f h GLU 222 Cb 0.32 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.41 1u0f h GLU 222 CO -0.00 0.99 0.20 1.15 -1.00 0.00 0.00 179.01 180.34 1u0f h THR 223 N 1.04 1.21 -0.56 1.13 2.02 -0.82 -0.51 112.91 116.41 1u0f h THR 223 Ca 0.21 -0.64 -0.00 0.00 0.77 0.00 0.00 66.41 66.75 1u0f h THR 223 Cb 0.39 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 1u0f h THR 223 CO 0.01 0.24 0.33 0.00 0.37 0.00 0.00 175.52 176.47 1u0f h ALA 224 N 1.04 0.71 -0.44 6.16 0.00 -0.90 -1.28 119.26 124.55 1u0f h ALA 224 Ca 0.16 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.92 1u0f h ALA 224 Cb 0.19 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1u0f h ALA 224 CO -0.01 0.20 -0.04 -0.22 0.00 0.00 0.00 179.25 179.17 1u0f h LYS 225 N 0.75 0.74 -0.27 0.00 3.64 -0.85 -0.19 116.57 120.38 1u0f h LYS 225 Ca 0.20 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 1u0f h LYS 225 Cb -0.01 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 1u0f h LYS 225 CO -0.04 0.78 0.02 1.49 -2.27 0.00 0.00 179.45 179.43 1u0f h GLU 226 N 0.69 0.47 -0.69 1.90 4.81 -0.81 -0.02 114.58 120.93 1u0f h GLU 226 Ca 0.13 -0.14 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1u0f h GLU 226 Cb 0.48 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.78 1u0f h GLU 226 CO 0.02 0.61 0.44 2.35 -0.73 0.00 0.00 179.01 181.71 1u0f h TRP 227 N 0.26 0.83 -0.12 0.92 7.01 -1.03 -1.28 115.95 122.53 1u0f h TRP 227 Ca 0.08 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.09 1u0f h TRP 227 Cb 0.39 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 27.17 1u0f h TRP 227 CO 0.03 0.49 0.04 0.35 -2.79 0.00 0.00 178.44 176.56 1u0f h PHE 228 N 0.88 0.20 0.00 2.65 3.57 -0.84 -3.11 116.94 120.29 1u0f h PHE 228 Ca 0.27 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.70 1u0f h PHE 228 Cb -0.03 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1u0f h PHE 228 CO -0.04 0.32 -0.25 -0.07 -2.23 0.00 0.00 178.31 176.05 1u0f h LEU 229 N 0.02 0.00 -1.39 0.59 3.38 -0.77 -0.58 115.31 116.55 1u0f h LEU 229 Ca 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1u0f h LEU 229 Cb 0.21 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1u0f h LEU 229 CO -0.00 0.25 0.04 -0.33 0.09 0.00 0.00 178.44 178.48 1u0f h GLU 230 N 0.00 0.44 0.03 1.13 5.08 -1.17 0.21 114.58 120.30 1u0f h GLU 230 Ca -0.00 -0.07 -0.18 0.00 -1.00 0.00 0.00 59.36 58.11 1u0f h GLU 230 Cb 0.70 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 1u0f h GLU 230 CO 0.03 0.44 -0.93 0.00 -1.00 0.00 0.00 179.01 177.55 1u0f h ALA 231 N 1.62 0.16 0.15 3.43 0.00 -1.44 -3.41 119.26 119.76 1u0f h ALA 231 Ca 0.10 -0.97 -0.28 0.00 0.00 0.00 0.00 54.91 53.76 1u0f h ALA 231 Cb 0.23 0.45 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1u0f h ALA 231 CO 0.00 0.53 -1.27 0.00 0.00 0.00 0.00 179.25 178.51 1u0f h ALA 232 N -0.22 0.06 -3.96 0.00 0.00 -1.11 -3.48 119.26 110.55 1u0f h ALA 232 Ca -0.23 -0.88 -0.39 0.00 0.00 0.00 0.00 54.91 53.41 1u0f h ALA 232 Cb 1.34 0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.18 1u0f h ALA 232 CO -0.07 0.92 -0.55 1.63 0.00 0.00 0.00 179.25 181.18 1u0f n LYS 233 N -3.57 -3.33 -3.29 0.00 5.02 0.06 -4.94 118.16 108.11 1u0f n LYS 233 Ca -0.10 0.88 -0.07 0.00 -2.02 0.00 0.00 58.31 57.01 1u0f n LYS 233 Cb 1.03 -5.64 -0.06 0.00 -0.02 0.00 0.00 35.03 30.35 1u0f n LYS 233 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1u0f s ASP 234 N -2.40 -0.03 0.52 4.39 3.68 -1.26 -5.03 116.67 116.54 1u0f s ASP 234 Ca 0.17 0.05 0.19 0.00 2.13 0.00 0.00 52.55 55.10 1u0f s ASP 234 Cb -0.08 1.31 1.30 0.00 -1.45 0.00 0.00 42.92 44.00 1u0f s ASP 234 CO 0.21 -0.32 2.08 -0.65 0.13 0.00 0.00 175.17 176.62 1u0f h PRO 235 N 8.14 0.03 0.00 4.34 0.11 -1.96 -1.04 132.00 141.62 1u0f h PRO 235 Ca -0.14 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.95 1u0f h PRO 235 Cb 1.14 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 1u0f h PRO 235 CO 0.26 0.02 -0.10 0.66 -0.21 0.00 0.00 178.00 178.63 1u0f h SER 236 N 0.03 0.00 0.98 -2.05 4.64 -2.00 -2.68 113.55 112.47 1u0f h SER 236 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1u0f h SER 236 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 1u0f h SER 236 CO -0.00 0.10 0.00 0.00 -0.87 0.00 0.00 176.83 176.05 1u0f h ALA 237 N 1.90 1.00 -0.96 5.18 0.00 -1.59 -3.12 119.26 121.67 1u0f h ALA 237 Ca -0.00 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.99 1u0f h ALA 237 Cb 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1u0f h ALA 237 CO 0.01 0.00 0.62 0.28 0.00 0.00 0.00 179.25 180.16 1u0f h VAL 238 N 0.00 1.02 0.00 0.00 2.07 -1.61 -1.52 116.25 116.21 1u0f h VAL 238 Ca 0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1u0f h VAL 238 Cb 0.49 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1u0f h VAL 238 CO 0.00 0.19 0.00 0.00 0.02 0.00 0.00 177.57 177.78 1u0f h ALA 239 N 1.51 1.00 0.00 1.67 0.00 -1.77 -0.59 119.26 121.07 1u0f h ALA 239 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.34 1u0f h ALA 239 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1u0f h ALA 239 CO -0.19 0.00 -0.66 1.63 0.00 0.00 0.00 179.25 180.03 1u0f n LYS 240 N -2.83 0.26 0.00 0.00 5.02 -0.58 -4.52 118.16 115.52 1u0f n LYS 240 Ca -0.02 0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.33 1u0f n LYS 240 Cb 0.09 -1.65 0.00 0.00 -0.02 0.00 0.00 35.03 33.45 1u0f n LYS 240 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1u0f n HIS 241 N -2.02 0.00 -4.18 2.13 8.25 -0.46 -4.81 115.22 114.13 1u0f n HIS 241 Ca 0.03 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.30 1u0f n HIS 241 Cb 0.43 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.38 1u0f n HIS 241 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1u0f s PHE 242 N -0.36 0.70 0.06 4.41 0.40 -0.36 0.08 117.98 122.91 1u0f s PHE 242 Ca 0.00 -0.18 0.06 0.00 -0.60 0.00 0.00 56.93 56.21 1u0f s PHE 242 Cb 0.00 -0.59 -0.03 0.00 0.51 0.00 0.00 43.02 42.91 1u0f s PHE 242 CO 0.00 -0.14 -0.16 0.14 0.70 0.00 0.00 175.22 175.76 1u0f s VAL 243 N 0.66 1.24 -0.05 -0.44 -7.23 -0.30 -4.74 120.40 109.54 1u0f s VAL 243 Ca -0.09 -1.19 0.04 0.00 -1.81 0.00 0.00 61.98 58.93 1u0f s VAL 243 Cb -0.12 -1.14 -0.02 0.00 0.56 0.00 0.00 36.38 35.65 1u0f s VAL 243 CO 0.00 -0.06 -0.16 0.00 -0.31 0.00 0.00 175.10 174.57 1u0f s ALA 244 N -1.03 2.60 -0.26 1.32 0.00 -0.07 -0.64 121.76 123.68 1u0f s ALA 244 Ca 0.02 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.01 1u0f s ALA 244 Cb -0.09 -0.93 0.06 0.00 0.00 0.00 0.00 23.12 22.16 1u0f s ALA 244 CO 0.02 0.54 -0.10 -0.51 0.00 0.00 0.00 175.76 175.71 1u0f s LEU 245 N -0.68 3.45 0.24 0.00 1.43 -0.08 -0.31 118.68 122.72 1u0f s LEU 245 Ca 0.10 -1.34 -0.22 0.00 -1.03 0.00 0.00 54.13 51.64 1u0f s LEU 245 Cb -0.11 -1.57 0.03 0.00 0.03 0.00 0.00 46.19 44.58 1u0f s LEU 245 CO 0.01 -0.19 0.79 -0.55 0.23 0.00 0.00 176.35 176.64 1u0f s SER 246 N 1.13 -0.24 -0.00 2.29 0.15 -1.05 -1.57 113.70 114.42 1u0f s SER 246 Ca -0.08 -0.55 0.20 0.00 0.70 0.00 0.00 55.95 56.23 1u0f s SER 246 Cb -0.20 0.66 -0.24 0.00 -1.71 0.00 0.00 66.02 64.53 1u0f s SER 246 CO -0.05 -1.22 0.79 0.35 1.20 0.00 0.00 173.24 174.32 1u0f n THR 247 N -0.46 0.00 -3.60 6.45 -2.24 -0.81 -2.09 114.28 111.52 1u0f n THR 247 Ca -0.05 -0.10 -0.37 0.00 -2.27 0.00 0.00 64.05 61.27 1u0f n THR 247 Cb 0.59 0.84 -0.06 0.00 -2.10 0.00 0.00 70.33 69.60 1u0f n THR 247 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1u0f n ASN 248 N -1.60 4.33 -0.25 3.42 2.85 -1.24 -4.92 115.26 117.84 1u0f n ASN 248 Ca 0.03 -3.14 0.05 0.00 -0.11 0.00 0.00 54.58 51.41 1u0f n ASN 248 Cb 0.35 -1.07 0.18 0.00 1.24 0.00 0.00 39.78 40.49 1u0f n ASN 248 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 1u0f h THR 249 N 3.98 0.62 -0.49 -0.44 2.02 -1.95 -2.07 112.91 114.57 1u0f h THR 249 Ca 0.17 -0.13 0.06 0.00 0.77 0.00 0.00 66.41 67.28 1u0f h THR 249 Cb 0.80 0.20 -0.05 0.00 -1.74 0.00 0.00 68.15 67.36 1u0f h THR 249 CO 0.88 0.07 0.19 0.00 0.37 0.00 0.00 175.52 177.02 1u0f h ALA 250 N 1.56 0.60 -0.06 6.16 0.00 -1.99 -0.45 119.26 125.08 1u0f h ALA 250 Ca 0.41 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 55.22 1u0f h ALA 250 Cb 0.64 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1u0f h ALA 250 CO -0.43 -0.20 -0.66 0.87 0.00 0.00 0.00 179.25 178.82 1u0f h LYS 251 N 0.37 0.24 -0.44 0.00 1.79 -1.79 -1.42 116.57 115.32 1u0f h LYS 251 Ca 0.23 -0.18 -0.02 0.00 -2.18 0.00 0.00 60.65 58.50 1u0f h LYS 251 Cb 0.22 0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 1u0f h LYS 251 CO -0.22 0.82 0.21 0.28 -1.08 0.00 0.00 179.45 179.46 1u0f h VAL 252 N 0.17 1.18 -0.48 0.50 2.07 -0.85 -0.98 116.25 117.86 1u0f h VAL 252 Ca -0.01 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1u0f h VAL 252 Cb 1.19 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 1u0f h VAL 252 CO 0.10 0.20 0.26 0.11 0.02 0.00 0.00 177.57 178.26 1u0f h LYS 253 N 0.57 0.67 -0.87 1.57 1.57 -0.93 -2.25 116.57 116.90 1u0f h LYS 253 Ca 0.15 -0.08 0.03 0.00 -1.87 0.00 0.00 60.65 58.88 1u0f h LYS 253 Cb 0.11 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.25 1u0f h LYS 253 CO -0.02 0.53 0.57 1.49 -0.57 0.00 0.00 179.45 181.46 1u0f h GLU 254 N 0.64 1.06 -0.04 3.15 4.81 -1.08 -1.72 114.58 121.40 1u0f h GLU 254 Ca 0.17 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.27 1u0f h GLU 254 Cb 0.06 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1u0f h GLU 254 CO -0.03 0.70 -0.27 0.35 -0.73 0.00 0.00 179.01 179.04 1u0f h PHE 255 N 1.10 0.07 0.00 0.92 3.57 -0.92 -3.47 116.94 118.21 1u0f h PHE 255 Ca 0.34 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.83 1u0f h PHE 255 Cb 0.00 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 38.73 1u0f h PHE 255 CO -0.00 0.33 0.00 0.41 -2.23 0.00 0.00 178.31 176.82 1u0f n GLY 256 N -0.70 1.86 3.40 2.40 0.00 -0.65 -5.11 105.19 106.40 1u0f n GLY 256 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 1u0f n GLY 256 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u0f s ILE 257 N -2.00 3.17 0.36 -0.61 1.01 -0.87 -4.95 121.20 117.31 1u0f s ILE 257 Ca 0.00 -0.63 -0.26 0.00 0.00 0.00 0.00 60.65 59.76 1u0f s ILE 257 Cb 0.00 -2.33 -0.09 0.00 0.01 0.00 0.00 42.46 40.05 1u0f s ILE 257 CO 0.00 0.53 1.07 -0.62 0.00 0.00 0.00 174.94 175.93 1u0f s ASP 258 N 0.19 6.90 0.61 3.58 2.15 -1.26 -3.24 116.67 125.59 1u0f s ASP 258 Ca -0.07 2.14 0.27 0.00 0.43 0.00 0.00 52.55 55.32 1u0f s ASP 258 Cb -0.15 -2.60 1.37 0.00 -0.30 0.00 0.00 42.92 41.24 1u0f s ASP 258 CO 0.05 -0.40 1.78 -0.65 -0.17 0.00 0.00 175.17 175.78 1u0f h PRO 259 N 2.93 0.00 0.00 4.34 0.11 -1.94 0.25 132.00 137.69 1u0f h PRO 259 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1u0f h PRO 259 Cb 1.22 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 1u0f h PRO 259 CO 0.64 0.00 -0.12 -0.56 -0.21 0.00 0.00 178.00 177.75 1u0f h GLN 260 N 0.00 0.00 -0.71 1.05 3.07 -2.02 -2.36 115.11 114.14 1u0f h GLN 260 Ca 0.19 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.78 1u0f h GLN 260 Cb 1.33 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.80 1u0f h GLN 260 CO -0.00 0.12 0.20 0.09 0.09 0.00 0.00 178.83 179.32 1u0f n ASN 261 N -3.44 5.10 -4.16 0.06 5.03 0.89 -4.92 115.26 113.81 1u0f n ASN 261 Ca -0.01 -3.13 -0.27 0.00 0.87 0.00 0.00 54.58 52.04 1u0f n ASN 261 Cb 0.28 -0.73 -0.16 0.00 -1.02 0.00 0.00 39.78 38.14 1u0f n ASN 261 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 1u0f s MET 262 N -2.90 1.91 -0.20 3.52 1.75 -0.89 -0.89 119.30 121.60 1u0f s MET 262 Ca 0.55 -0.67 -0.03 0.00 -1.25 0.00 0.00 55.69 54.29 1u0f s MET 262 Cb 0.43 -1.66 -0.01 0.00 2.84 0.00 0.00 34.83 36.43 1u0f s MET 262 CO 0.14 0.28 -0.06 -0.51 -0.65 0.00 0.00 175.02 174.22 1u0f s LEU 263 N -0.03 2.89 0.23 4.11 1.43 0.57 -4.96 118.68 122.92 1u0f s LEU 263 Ca -0.03 -0.36 0.00 0.00 -1.03 0.00 0.00 54.13 52.71 1u0f s LEU 263 Cb -0.12 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 1u0f s LEU 263 CO 0.02 0.03 0.41 -1.83 0.23 0.00 0.00 176.35 175.22 1u0f s GLU 264 N 1.15 3.51 0.00 1.70 -1.05 -1.26 -2.52 118.70 120.24 1u0f s GLU 264 Ca 0.02 -0.38 0.00 0.00 -0.15 0.00 0.00 54.97 54.46 1u0f s GLU 264 Cb -0.14 -2.81 0.00 0.00 -0.44 0.00 0.00 34.13 30.73 1u0f s GLU 264 CO -0.01 0.36 0.00 1.97 0.95 0.00 0.00 175.26 178.53 1u0f n PHE 265 N -0.92 0.00 -4.27 4.83 1.16 -0.89 -4.57 117.46 112.80 1u0f n PHE 265 Ca -0.05 0.00 -0.15 0.00 -1.87 0.00 0.00 57.45 55.38 1u0f n PHE 265 Cb 0.55 0.00 -0.10 0.00 -1.61 0.00 0.00 39.48 38.31 1u0f n PHE 265 CO 0.00 0.00 0.00 -1.58 -1.87 0.00 0.00 176.76 173.31 1u0f s TRP 266 N -1.24 1.31 0.50 2.97 0.51 -1.26 -4.38 118.94 117.35 1u0f s TRP 266 Ca 0.00 -0.88 0.31 0.00 -2.12 0.00 0.00 56.10 53.41 1u0f s TRP 266 Cb 0.00 -0.72 1.73 0.00 -0.81 0.00 0.00 33.47 33.67 1u0f s TRP 266 CO 0.00 -0.04 2.18 0.38 -0.51 0.00 0.00 176.95 178.96 1u0f h ASP 267 N 2.68 0.00 -0.08 2.95 3.04 -1.97 -1.61 116.42 121.43 1u0f h ASP 267 Ca -0.37 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.42 1u0f h ASP 267 Cb 1.20 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.49 1u0f h ASP 267 CO 0.64 0.05 0.00 -2.67 -2.04 0.00 0.00 179.24 175.22 1u0f n TRP 268 N -3.60 0.10 -3.32 4.15 4.27 -1.26 -4.52 117.44 113.25 1u0f n TRP 268 Ca -0.02 -0.05 -0.44 0.00 -3.89 0.00 0.00 57.50 53.09 1u0f n TRP 268 Cb 0.16 0.00 -0.07 0.00 -1.36 0.00 0.00 31.31 30.04 1u0f n TRP 268 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 1u0f s VAL 269 N -1.90 5.14 0.48 -1.67 1.01 -0.61 -1.42 120.40 121.43 1u0f s VAL 269 Ca 0.25 -0.96 -0.22 0.00 0.00 0.00 0.00 61.98 61.05 1u0f s VAL 269 Cb 0.12 -4.19 -0.07 0.00 0.00 0.00 0.00 36.38 32.25 1u0f s VAL 269 CO 0.19 -0.66 1.15 -0.83 0.00 0.00 0.00 175.10 174.95 1u0f s GLY 270 N 2.70 2.73 0.24 4.51 0.00 -1.26 -4.89 107.32 111.35 1u0f s GLY 270 Ca 0.07 0.89 -0.06 0.00 0.00 0.00 0.00 44.72 45.62 1u0f s GLY 270 CO 0.08 1.32 1.83 -1.33 0.00 0.00 0.00 173.10 175.00 1u0f h GLY 271 N 1.82 1.24 0.37 0.20 0.00 -1.95 -0.42 103.07 104.33 1u0f h GLY 271 Ca -0.49 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.49 1u0f h GLY 271 CO 0.59 0.21 0.00 -0.96 0.00 0.00 0.00 176.54 176.38 1u0f n ARG 272 N -4.68 1.08 -0.70 4.80 1.85 -1.26 -2.18 116.66 115.56 1u0f n ARG 272 Ca 0.12 -0.12 0.06 0.00 -1.00 0.00 0.00 57.85 56.91 1u0f n ARG 272 Cb 0.20 -1.27 0.16 0.00 -1.05 0.00 0.00 32.46 30.50 1u0f n ARG 272 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1u0f n TYR 273 N -0.64 0.00 0.73 2.89 4.02 -0.20 -4.75 117.16 119.19 1u0f n TYR 273 Ca 0.13 -1.18 0.07 0.00 -0.01 0.00 0.00 57.90 56.91 1u0f n TYR 273 Cb 0.08 -0.21 -0.06 0.00 -0.02 0.00 0.00 39.34 39.13 1u0f n TYR 273 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1u0f n SER 274 N -0.80 1.01 0.32 7.72 3.41 -0.93 -4.46 113.62 119.89 1u0f n SER 274 Ca 0.15 -1.01 0.20 0.00 -0.26 0.00 0.00 58.87 57.95 1u0f n SER 274 Cb 0.77 0.83 1.05 0.00 -0.26 0.00 0.00 64.21 66.60 1u0f n SER 274 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 1u0f h LEU 275 N 0.57 0.00 -0.24 1.04 8.10 -1.84 -1.39 115.31 121.55 1u0f h LEU 275 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 1u0f h LEU 275 Cb 0.42 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.64 1u0f h LEU 275 CO 0.00 0.01 0.00 0.79 -4.11 0.00 0.00 178.44 175.13 1u0f n TRP 276 N -3.30 0.70 -1.95 0.17 7.02 -1.26 -2.79 117.44 116.03 1u0f n TRP 276 Ca -0.02 0.23 0.00 0.00 -1.02 0.00 0.00 57.50 56.69 1u0f n TRP 276 Cb 0.12 -0.88 0.00 0.00 -2.42 0.00 0.00 31.31 28.13 1u0f n TRP 276 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1u0f n SER 277 N -2.10 0.00 -0.33 -0.99 3.41 -0.52 -4.77 113.62 108.32 1u0f n SER 277 Ca 0.04 -0.34 0.35 0.00 -0.26 0.00 0.00 58.87 58.66 1u0f n SER 277 Cb 0.33 0.00 0.74 0.00 -0.26 0.00 0.00 64.21 65.02 1u0f n SER 277 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u0f h ALA 278 N -0.78 3.09 -0.11 7.33 0.00 -1.81 -0.13 119.26 126.86 1u0f h ALA 278 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1u0f h ALA 278 Cb 0.00 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1u0f h ALA 278 CO 0.00 -1.44 0.14 0.82 0.00 0.00 0.00 179.25 178.77 1u0f h ILE 279 N 0.02 0.39 0.00 0.00 1.08 -1.85 -0.04 117.51 117.10 1u0f h ILE 279 Ca 0.57 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.04 1u0f h ILE 279 Cb 2.25 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 36.88 1u0f h ILE 279 CO -0.02 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 178.05 1u0f n GLY 280 N -1.33 -0.86 0.30 5.37 0.00 -0.06 -4.25 105.19 104.36 1u0f n GLY 280 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1u0f n GLY 280 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1u0f h LEU 281 N 0.00 0.61 -1.50 0.99 5.85 -1.19 -1.34 115.31 118.73 1u0f h LEU 281 Ca 0.00 0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 1u0f h LEU 281 Cb 0.02 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1u0f h LEU 281 CO 0.00 0.34 -0.25 0.77 -0.34 0.00 0.00 178.44 178.95 1u0f h SER 282 N 0.73 0.00 0.46 1.25 4.64 -1.85 0.89 113.55 119.66 1u0f h SER 282 Ca 0.39 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.69 1u0f h SER 282 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1u0f h SER 282 CO -0.26 0.25 -0.22 0.40 -0.87 0.00 0.00 176.83 176.13 1u0f h ILE 283 N 0.00 0.52 -0.98 0.95 2.04 -1.57 -2.28 117.51 116.18 1u0f h ILE 283 Ca -0.00 -0.31 0.08 0.00 1.00 0.00 0.00 64.86 65.62 1u0f h ILE 283 Cb 0.52 0.65 -0.07 0.00 -0.74 0.00 0.00 36.82 37.18 1u0f h ILE 283 CO 0.03 0.05 0.63 0.00 0.00 0.00 0.00 178.15 178.87 1u0f h ALA 284 N -0.36 1.46 -0.53 1.87 0.00 -0.92 -0.27 119.26 120.51 1u0f h ALA 284 Ca -0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1u0f h ALA 284 Cb 0.56 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1u0f h ALA 284 CO 0.10 0.37 0.01 -0.07 0.00 0.00 0.00 179.25 179.67 1u0f h LEU 285 N 1.10 0.85 0.02 0.00 3.38 -0.85 0.25 115.31 120.08 1u0f h LEU 285 Ca 0.44 -0.21 -0.15 0.00 0.09 0.00 0.00 57.88 58.04 1u0f h LEU 285 Cb 0.25 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.79 1u0f h LEU 285 CO -0.19 0.91 -0.60 -0.74 0.09 0.00 0.00 178.44 177.92 1u0f h HIS 286 N 0.82 0.56 -0.01 1.13 2.76 -0.78 -3.38 115.15 116.25 1u0f h HIS 286 Ca 0.16 -0.32 0.00 0.00 -2.20 0.00 0.00 60.37 58.01 1u0f h HIS 286 Cb 0.47 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 29.38 1u0f h HIS 286 CO 0.03 1.15 -0.54 1.33 -1.30 0.00 0.00 177.93 178.60 1u0f n VAL 287 N -4.23 0.00 0.00 5.26 0.24 -0.17 -4.41 118.33 115.01 1u0f n VAL 287 Ca -0.11 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.96 1u0f n VAL 287 Cb 0.68 1.10 0.00 0.00 -1.47 0.00 0.00 33.84 34.15 1u0f n VAL 287 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1u0f n GLY 288 N 1.27 0.97 0.33 7.63 0.00 0.88 -4.47 105.19 111.79 1u0f n GLY 288 Ca 0.05 -1.62 -0.02 0.00 0.00 0.00 0.00 46.02 44.43 1u0f n GLY 288 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1u0f h PHE 289 N 0.00 0.92 -0.44 1.61 3.57 -1.91 -2.25 116.94 118.45 1u0f h PHE 289 Ca 0.00 -0.04 0.07 0.00 3.53 0.00 0.00 57.97 61.53 1u0f h PHE 289 Cb 0.00 -0.29 -0.06 0.00 2.79 0.00 0.00 35.95 38.39 1u0f h PHE 289 CO 0.00 0.68 0.09 -0.44 -2.23 0.00 0.00 178.31 176.41 1u0f h ASP 290 N 0.92 0.01 -0.08 0.41 3.32 -1.92 0.97 116.42 120.04 1u0f h ASP 290 Ca 0.23 0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.25 1u0f h ASP 290 Cb 0.12 0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1u0f h ASP 290 CO -0.03 0.04 -0.27 0.45 -1.72 0.00 0.00 179.24 177.71 1u0f h HIS 291 N 0.22 0.60 -0.56 4.55 3.86 -1.72 -1.93 115.15 120.17 1u0f h HIS 291 Ca 0.21 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 1u0f h HIS 291 Cb 0.27 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 1u0f h HIS 291 CO -0.21 0.75 0.33 0.35 0.86 0.00 0.00 177.93 180.01 1u0f h PHE 292 N 0.47 0.75 -0.74 2.45 3.57 -0.77 -1.25 116.94 121.41 1u0f h PHE 292 Ca 0.06 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 1u0f h PHE 292 Cb 0.71 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 1u0f h PHE 292 CO 0.03 0.53 0.45 0.93 -2.23 0.00 0.00 178.31 178.02 1u0f h GLU 293 N 0.76 1.00 -0.40 1.11 5.08 -0.55 -1.35 114.58 120.22 1u0f h GLU 293 Ca 0.20 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1u0f h GLU 293 Cb 0.01 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.02 1u0f h GLU 293 CO -0.04 0.69 -0.08 1.96 -1.00 0.00 0.00 179.01 180.54 1u0f h GLN 294 N 1.02 0.69 -0.21 2.33 4.20 -0.96 0.24 115.11 122.41 1u0f h GLN 294 Ca 0.27 -0.21 0.01 0.00 0.06 0.00 0.00 58.65 58.78 1u0f h GLN 294 Cb -0.05 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1u0f h GLN 294 CO -0.05 0.77 0.13 1.25 -0.67 0.00 0.00 178.83 180.25 1u0f h LEU 295 N 0.64 0.21 -0.85 1.46 5.85 -0.55 -1.55 115.31 120.53 1u0f h LEU 295 Ca 0.12 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1u0f h LEU 295 Cb 0.52 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 1u0f h LEU 295 CO 0.03 0.16 0.54 -0.07 -0.34 0.00 0.00 178.44 178.76 1u0f h LEU 296 N 0.26 0.99 -0.88 2.25 3.38 -1.08 -2.53 115.31 117.71 1u0f h LEU 296 Ca 0.08 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.94 1u0f h LEU 296 Cb -0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1u0f h LEU 296 CO -0.03 0.74 0.04 -1.28 0.09 0.00 0.00 178.44 178.00 1u0f h SER 297 N 1.15 0.84 -0.49 -0.43 0.87 -0.62 -0.70 113.55 114.17 1u0f h SER 297 Ca 0.31 -0.20 -0.08 0.00 -1.23 0.00 0.00 61.79 60.59 1u0f h SER 297 Cb -0.10 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.62 1u0f h SER 297 CO -0.06 0.88 0.00 1.23 -0.53 0.00 0.00 176.83 178.34 1u0f h GLY 298 N 0.99 0.94 0.98 5.77 0.00 -1.14 -1.12 103.07 109.49 1u0f h GLY 298 Ca 0.16 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.80 1u0f h GLY 298 CO 0.02 0.63 0.27 0.00 0.00 0.00 0.00 176.54 177.46 1u0f h ALA 299 N 0.93 0.59 -0.74 3.60 0.00 -1.15 -2.39 119.26 120.10 1u0f h ALA 299 Ca 0.14 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1u0f h ALA 299 Cb 0.51 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.05 1u0f h ALA 299 CO 0.02 0.08 0.40 1.25 0.00 0.00 0.00 179.25 181.01 1u0f h HIS 300 N 0.61 0.72 -0.22 0.00 6.17 -0.87 0.12 115.15 121.68 1u0f h HIS 300 Ca 0.16 0.03 0.03 0.00 0.71 0.00 0.00 60.37 61.30 1u0f h HIS 300 Cb 0.01 -0.21 -0.03 0.00 2.52 0.00 0.00 27.41 29.70 1u0f h HIS 300 CO -0.03 0.30 0.05 2.35 0.71 0.00 0.00 177.93 181.30 1u0f h TRP 301 N 0.69 0.08 -0.36 5.26 7.01 -0.96 -0.94 115.95 126.72 1u0f h TRP 301 Ca 0.35 0.01 -0.06 0.00 2.11 0.00 0.00 58.89 61.31 1u0f h TRP 301 Cb 0.32 -0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 27.36 1u0f h TRP 301 CO -0.08 0.02 -0.01 1.98 -2.79 0.00 0.00 178.44 177.56 1u0f h MET 302 N 0.13 0.58 -0.27 2.65 4.05 -0.86 -1.13 114.93 120.07 1u0f h MET 302 Ca 0.10 -0.13 0.02 0.00 -0.28 0.00 0.00 59.70 59.40 1u0f h MET 302 Cb 0.10 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 30.79 1u0f h MET 302 CO -0.13 0.61 0.13 -0.44 0.23 0.00 0.00 176.91 177.31 1u0f h ASP 303 N 0.55 0.20 -0.36 1.39 3.32 -0.34 -0.26 116.42 120.92 1u0f h ASP 303 Ca 0.11 0.01 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 1u0f h ASP 303 Cb 0.37 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1u0f h ASP 303 CO 0.01 0.15 -0.05 1.56 -1.72 0.00 0.00 179.24 179.20 1u0f h GLN 304 N 0.28 0.76 -0.32 3.56 1.08 -0.89 -0.47 115.11 119.11 1u0f h GLN 304 Ca 0.11 -0.22 -0.00 0.00 -1.45 0.00 0.00 58.65 57.09 1u0f h GLN 304 Cb 0.03 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.37 1u0f h GLN 304 CO -0.08 0.80 0.20 1.25 -0.95 0.00 0.00 178.83 180.05 1u0f h HIS 305 N 0.70 0.42 -0.69 2.96 2.76 -0.90 -1.28 115.15 119.13 1u0f h HIS 305 Ca 0.13 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.27 1u0f h HIS 305 Cb 0.50 -0.14 -0.03 0.00 1.55 0.00 0.00 27.41 29.29 1u0f h HIS 305 CO 0.02 0.30 0.31 0.35 -1.30 0.00 0.00 177.93 177.62 1u0f h PHE 306 N 0.42 1.01 -0.31 5.26 3.57 -0.75 -2.66 116.94 123.48 1u0f h PHE 306 Ca 0.12 -0.06 -0.13 0.00 3.53 0.00 0.00 57.97 61.43 1u0f h PHE 306 Cb 0.00 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.42 1u0f h PHE 306 CO -0.04 0.77 -0.34 1.25 -2.23 0.00 0.00 178.31 177.72 1u0f h LEU 307 N 0.97 0.72 -0.07 0.59 5.85 -0.87 -3.37 115.31 119.13 1u0f h LEU 307 Ca 0.23 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.66 1u0f h LEU 307 Cb 0.15 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 40.98 1u0f h LEU 307 CO -0.03 0.99 -0.45 0.29 -0.34 0.00 0.00 178.44 178.91 1u0f n LYS 308 N -4.06 3.57 -3.51 1.25 4.76 -0.50 -4.99 118.16 114.68 1u0f n LYS 308 Ca -0.01 -0.05 -0.38 0.00 -2.87 0.00 0.00 58.31 55.00 1u0f n LYS 308 Cb 0.49 -0.98 -0.06 0.00 -1.84 0.00 0.00 35.03 32.64 1u0f n LYS 308 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1u0f s THR 309 N -1.89 5.16 0.41 -0.18 2.01 -1.01 -5.05 115.64 115.09 1u0f s THR 309 Ca 0.04 0.74 -0.26 0.00 0.31 0.00 0.00 61.69 62.52 1u0f s THR 309 Cb 0.08 -3.68 -0.10 0.00 0.01 0.00 0.00 72.50 68.80 1u0f s THR 309 CO 0.40 0.50 1.26 -2.65 -0.69 0.00 0.00 174.62 173.43 1u0f n PRO 310 N 2.54 1.91 -0.34 4.92 -0.02 -1.26 -4.75 135.00 138.00 1u0f n PRO 310 Ca -0.13 0.68 0.13 0.00 -2.02 0.00 0.00 63.50 62.16 1u0f n PRO 310 Cb 0.52 -2.36 0.32 0.00 -0.02 0.00 0.00 33.50 31.96 1u0f n PRO 310 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1u0f h LEU 311 N 2.10 0.73 -1.00 2.45 3.38 -1.97 -2.00 115.31 119.00 1u0f h LEU 311 Ca -0.47 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1u0f h LEU 311 Cb 1.30 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1u0f h LEU 311 CO 0.60 0.24 0.00 -1.84 0.09 0.00 0.00 178.44 177.53 1u0f n GLU 312 N -4.80 0.18 -0.14 1.13 0.00 -1.26 -2.32 120.64 113.43 1u0f n GLU 312 Ca 0.23 0.51 0.06 0.00 0.00 0.00 0.00 57.16 57.96 1u0f n GLU 312 Cb 0.58 -1.92 0.08 0.00 0.00 0.00 0.00 31.44 30.19 1u0f n GLU 312 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1u0f n LYS 313 N -2.26 1.25 -3.50 3.44 5.02 -0.77 -5.01 118.16 116.33 1u0f n LYS 313 Ca 0.01 -2.00 -0.41 0.00 -2.02 0.00 0.00 58.31 53.89 1u0f n LYS 313 Cb 0.16 -1.18 -0.10 0.00 -0.02 0.00 0.00 35.03 33.89 1u0f n LYS 313 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1u0f s ASN 314 N -2.07 6.09 0.09 4.39 3.84 -0.98 -4.91 114.94 121.39 1u0f s ASN 314 Ca 0.19 -0.50 -0.31 0.00 0.21 0.00 0.00 52.86 52.46 1u0f s ASN 314 Cb 0.17 -2.15 -0.15 0.00 -0.55 0.00 0.00 41.25 38.57 1u0f s ASN 314 CO 0.02 -0.30 1.63 0.00 -2.79 0.00 0.00 177.10 175.66 1u0f h ALA 315 N 8.52 -0.71 -0.33 1.71 0.00 -1.91 -1.03 119.26 125.52 1u0f h ALA 315 Ca -0.30 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 1u0f h ALA 315 Cb 1.15 0.39 -0.02 0.00 0.00 0.00 0.00 17.79 19.31 1u0f h ALA 315 CO 0.66 -0.92 0.10 -1.00 0.00 0.00 0.00 179.25 178.10 1u0f h PRO 316 N -0.70 0.48 -0.12 0.00 0.13 -1.94 -1.60 132.00 128.23 1u0f h PRO 316 Ca -0.04 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1u0f h PRO 316 Cb 0.60 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.63 1u0f h PRO 316 CO 0.02 0.42 0.08 0.28 -0.23 0.00 0.00 178.00 178.56 1u0f h VAL 317 N 0.47 1.05 -0.67 1.56 2.07 -1.76 -1.36 116.25 117.61 1u0f h VAL 317 Ca 0.12 -0.12 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1u0f h VAL 317 Cb 0.15 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1u0f h VAL 317 CO -0.01 0.05 0.23 -0.07 0.02 0.00 0.00 177.57 177.79 1u0f h LEU 318 N 0.14 0.96 -0.70 2.57 3.38 -0.81 -0.05 115.31 120.80 1u0f h LEU 318 Ca 0.04 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1u0f h LEU 318 Cb 0.01 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 1u0f h LEU 318 CO -0.01 0.89 0.42 -0.07 0.09 0.00 0.00 178.44 179.76 1u0f h LEU 319 N 0.97 0.85 -0.37 1.67 3.38 -1.28 -1.17 115.31 119.37 1u0f h LEU 319 Ca 0.22 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1u0f h LEU 319 Cb 0.26 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1u0f h LEU 319 CO -0.01 0.67 0.16 0.00 0.09 0.00 0.00 178.44 179.35 1u0f h ALA 320 N 1.22 0.48 -0.59 1.53 0.00 -0.72 -2.41 119.26 118.75 1u0f h ALA 320 Ca 0.25 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 1u0f h ALA 320 Cb -0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1u0f h ALA 320 CO -0.05 0.06 0.24 -0.07 0.00 0.00 0.00 179.25 179.44 1u0f h LEU 321 N 0.45 0.82 -1.14 0.00 3.38 -0.76 -1.41 115.31 116.64 1u0f h LEU 321 Ca 0.12 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1u0f h LEU 321 Cb 0.16 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.65 1u0f h LEU 321 CO -0.01 0.76 0.58 -0.07 0.09 0.00 0.00 178.44 179.79 1u0f h LEU 322 N 0.82 0.98 -0.47 1.67 3.38 -1.17 -1.37 115.31 119.15 1u0f h LEU 322 Ca 0.20 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 1u0f h LEU 322 Cb 0.20 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1u0f h LEU 322 CO -0.02 0.68 0.11 1.23 0.09 0.00 0.00 178.44 180.54 1u0f h GLY 323 N 1.14 0.81 1.01 0.83 0.00 -0.88 -2.22 103.07 103.77 1u0f h GLY 323 Ca 0.34 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.16 1u0f h GLY 323 CO -0.09 0.48 0.55 -2.22 0.00 0.00 0.00 176.54 175.26 1u0f h ILE 324 N 0.63 1.24 -0.33 2.60 1.08 -0.84 0.12 117.51 122.01 1u0f h ILE 324 Ca 0.15 -0.51 0.04 0.00 -0.39 0.00 0.00 64.86 64.14 1u0f h ILE 324 Cb 0.33 -0.03 -0.04 0.00 -3.07 0.00 0.00 36.82 34.01 1u0f h ILE 324 CO 0.00 0.25 0.09 -0.25 -0.69 0.00 0.00 178.15 177.56 1u0f h TRP 325 N 1.23 0.16 -0.06 1.37 -0.00 -0.97 0.15 115.95 117.85 1u0f h TRP 325 Ca 0.32 0.02 -0.19 0.00 -0.00 0.00 0.00 58.89 59.04 1u0f h TRP 325 Cb -0.07 -0.02 -0.00 0.00 -0.00 0.00 0.00 29.16 29.06 1u0f h TRP 325 CO -0.00 0.06 -0.78 1.88 -0.00 0.00 0.00 178.44 179.60 1u0f h TYR 326 N 0.22 0.54 0.05 2.65 0.05 -0.97 -2.04 116.97 117.49 1u0f h TYR 326 Ca 0.15 -0.26 -0.00 0.00 0.05 0.00 0.00 58.73 58.67 1u0f h TYR 326 Cb 0.14 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 37.80 1u0f h TYR 326 CO -0.16 1.03 -0.03 0.82 -1.05 0.00 0.00 178.16 178.78 1u0f h ILE 327 N 0.26 1.19 0.00 -2.88 2.04 -0.54 -0.20 117.51 117.37 1u0f h ILE 327 Ca -0.04 -1.60 -0.00 0.00 1.00 0.00 0.00 64.86 64.22 1u0f h ILE 327 Cb 1.37 2.13 -0.00 0.00 -0.74 0.00 0.00 36.82 39.58 1u0f h ILE 327 CO 0.13 0.36 -1.23 0.59 0.00 0.00 0.00 178.15 178.00 1u0f n ASN 328 N -4.77 0.66 -0.12 1.72 5.03 0.52 -2.37 115.26 115.94 1u0f n ASN 328 Ca -0.08 0.26 -0.23 0.00 0.87 0.00 0.00 54.58 55.40 1u0f n ASN 328 Cb 0.31 0.78 -0.10 0.00 -1.02 0.00 0.00 39.78 39.76 1u0f n ASN 328 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1u0f h TYR 330 N -0.54 0.00 -0.28 0.00 0.05 -1.32 -3.49 116.97 111.38 1u0f h TYR 330 Ca -0.59 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.13 1u0f h TYR 330 Cb 1.65 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 39.38 1u0f h TYR 330 CO -0.04 0.15 -0.06 0.41 -1.05 0.00 0.00 178.16 177.57 1u0f n GLY 331 N 1.20 0.42 3.70 3.88 0.00 -0.20 -4.98 105.19 109.21 1u0f n GLY 331 Ca -0.01 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1u0f n GLY 331 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0f h GLU 333 N 7.39 0.00 -5.38 0.00 5.08 -1.90 -3.41 114.58 116.36 1u0f h GLU 333 Ca -0.38 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.52 1u0f h GLU 333 Cb 1.18 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.29 1u0f h GLU 333 CO 0.87 0.46 -0.67 0.95 -1.00 0.00 0.00 179.01 179.61 1u0f s THR 334 N -3.47 1.47 -0.05 1.13 -4.23 -1.26 -0.90 115.64 108.32 1u0f s THR 334 Ca 0.00 -2.10 -0.02 0.00 -1.18 0.00 0.00 61.69 58.39 1u0f s THR 334 Cb 0.11 -2.39 0.03 0.00 1.34 0.00 0.00 72.50 71.59 1u0f s THR 334 CO 0.71 -0.33 0.08 -2.28 -0.54 0.00 0.00 174.62 172.26 1u0f s HIS 335 N -3.13 0.01 -0.13 3.99 2.46 -0.02 -4.22 115.29 114.24 1u0f s HIS 335 Ca 0.28 0.32 -0.11 0.00 0.47 0.00 0.00 55.06 56.02 1u0f s HIS 335 Cb 0.04 -0.40 -0.05 0.00 -0.13 0.00 0.00 32.58 32.04 1u0f s HIS 335 CO 0.10 -0.19 0.23 0.00 -2.47 0.00 0.00 174.74 172.41 1u0f s ALA 336 N 2.05 3.71 -0.29 1.58 0.00 -0.47 -2.58 121.76 125.76 1u0f s ALA 336 Ca 0.03 -0.52 -0.06 0.00 0.00 0.00 0.00 51.96 51.41 1u0f s ALA 336 Cb -0.12 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.78 1u0f s ALA 336 CO -0.04 0.32 0.06 -0.51 0.00 0.00 0.00 175.76 175.60 1u0f s LEU 337 N -0.24 3.73 -0.62 0.00 1.02 -0.16 -0.70 118.68 121.70 1u0f s LEU 337 Ca 0.15 -0.69 0.05 0.00 0.02 0.00 0.00 54.13 53.67 1u0f s LEU 337 Cb -0.13 -1.86 0.18 0.00 0.02 0.00 0.00 46.19 44.40 1u0f s LEU 337 CO 0.04 -0.17 0.48 0.18 0.02 0.00 0.00 176.35 176.90 1u0f n LEU 338 N 4.85 2.12 -4.69 1.79 4.77 0.07 -4.01 117.00 121.90 1u0f n LEU 338 Ca -0.15 -5.01 -0.42 0.00 -0.03 0.00 0.00 56.01 50.40 1u0f n LEU 338 Cb 0.48 -0.38 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 1u0f n LEU 338 CO 0.31 1.82 0.90 -2.16 -1.33 0.00 0.00 177.39 176.92 1u0f s PRO 339 N -1.16 4.37 -1.44 3.23 0.04 -1.26 -2.52 135.00 136.27 1u0f s PRO 339 Ca 0.28 1.57 -0.11 0.00 0.04 0.00 0.00 61.00 62.79 1u0f s PRO 339 Cb -0.00 -3.56 0.05 0.00 0.04 0.00 0.00 34.50 31.04 1u0f s PRO 339 CO -0.16 -0.41 2.33 0.66 0.04 0.00 0.00 177.00 179.46 1u0f n TYR 340 N 5.17 3.01 -3.29 0.56 4.02 0.14 -1.42 117.16 125.34 1u0f n TYR 340 Ca 0.10 -2.94 0.03 0.00 -0.01 0.00 0.00 57.90 55.08 1u0f n TYR 340 Cb 0.47 -2.30 -0.02 0.00 -0.02 0.00 0.00 39.34 37.47 1u0f n TYR 340 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1u0f s ASP 341 N 2.01 -0.93 0.38 7.72 2.15 -1.24 -4.70 116.67 122.04 1u0f s ASP 341 Ca 0.51 0.83 0.06 0.00 0.43 0.00 0.00 52.55 54.39 1u0f s ASP 341 Cb 0.14 1.88 0.74 0.00 -0.30 0.00 0.00 42.92 45.39 1u0f s ASP 341 CO -0.06 -0.18 1.96 -0.61 -0.17 0.00 0.00 175.17 176.12 1u0f h GLN 342 N 7.89 0.49 0.00 4.34 5.75 -1.85 -1.49 115.11 130.24 1u0f h GLN 342 Ca -0.18 -0.07 -0.03 0.00 -0.15 0.00 0.00 58.65 58.22 1u0f h GLN 342 Cb 1.14 -0.09 -0.00 0.00 1.07 0.00 0.00 27.48 29.60 1u0f h GLN 342 CO 0.10 0.44 -0.15 1.88 -2.65 0.00 0.00 178.83 178.46 1u0f h TYR 343 N 0.49 0.00 -0.24 3.99 0.99 -1.91 -2.05 116.97 118.24 1u0f h TYR 343 Ca 0.12 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.80 1u0f h TYR 343 Cb 0.16 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 37.86 1u0f h TYR 343 CO 0.01 0.15 0.06 -1.33 -0.00 0.00 0.00 178.16 177.05 1u0f n MET 344 N -4.08 2.13 0.22 4.88 2.81 -0.56 -2.74 117.12 119.77 1u0f n MET 344 Ca -0.02 -1.10 0.15 0.00 -1.81 0.00 0.00 57.70 54.92 1u0f n MET 344 Cb 0.23 -1.68 0.76 0.00 -0.71 0.00 0.00 33.22 31.82 1u0f n MET 344 CO 0.00 0.00 0.00 1.12 1.51 0.00 0.00 175.97 178.60 1u0f h HIS 345 N 1.13 0.00 -0.36 2.03 2.07 -1.44 -1.39 115.15 117.18 1u0f h HIS 345 Ca 0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.58 1u0f h HIS 345 Cb 1.19 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.17 1u0f h HIS 345 CO 0.43 0.00 0.00 0.54 -3.07 0.00 0.00 177.93 175.83 1u0f n ARG 346 N -2.54 2.91 -0.09 5.12 5.12 -1.26 -4.64 116.66 121.27 1u0f n ARG 346 Ca -0.01 -2.22 -0.11 0.00 -1.93 0.00 0.00 57.85 53.58 1u0f n ARG 346 Cb 0.09 -1.39 -0.04 0.00 -1.16 0.00 0.00 32.46 29.97 1u0f n ARG 346 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 1u0f h PHE 347 N 2.17 0.46 -0.53 -1.55 3.57 -1.59 -2.13 116.94 117.34 1u0f h PHE 347 Ca 0.00 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.40 1u0f h PHE 347 Cb 0.87 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.46 1u0f h PHE 347 CO 0.30 0.53 0.19 0.00 -2.23 0.00 0.00 178.31 177.10 1u0f h ALA 348 N 0.88 0.69 -0.90 2.41 0.00 -1.82 -2.25 119.26 118.26 1u0f h ALA 348 Ca 0.08 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.87 1u0f h ALA 348 Cb 0.31 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.84 1u0f h ALA 348 CO 0.00 0.33 0.59 0.00 0.00 0.00 0.00 179.25 180.17 1u0f h ALA 349 N 1.04 1.46 -0.32 0.00 0.00 -1.84 0.07 119.26 119.67 1u0f h ALA 349 Ca 0.17 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1u0f h ALA 349 Cb 0.24 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1u0f h ALA 349 CO -0.01 0.43 0.19 -0.92 0.00 0.00 0.00 179.25 178.94 1u0f h TYR 350 N 1.09 0.43 0.00 0.00 3.20 -1.05 -2.91 116.97 117.73 1u0f h TYR 350 Ca 0.37 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.24 1u0f h TYR 350 Cb 0.09 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.22 1u0f h TYR 350 CO -0.00 0.32 0.00 1.19 -1.64 0.00 0.00 178.16 178.03 1u0f n PHE 351 N -4.82 0.65 -0.07 -3.82 3.01 -0.87 -1.69 117.46 109.84 1u0f n PHE 351 Ca -0.01 0.21 -0.07 0.00 1.01 0.00 0.00 57.45 58.59 1u0f n PHE 351 Cb 0.06 -0.84 -0.01 0.00 -0.01 0.00 0.00 39.48 38.69 1u0f n PHE 351 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 1u0f h GLN 352 N 0.00 0.06 -0.02 -1.08 4.20 -0.79 0.66 115.11 118.14 1u0f h GLN 352 Ca 0.00 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 1u0f h GLN 352 Cb 0.58 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.35 1u0f h GLN 352 CO 0.00 0.04 -0.01 0.37 -0.67 0.00 0.00 178.83 178.56 1u0f h GLN 353 N 0.06 0.05 -0.55 1.46 4.15 -1.49 -0.97 115.11 117.81 1u0f h GLN 353 Ca 0.14 -0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.57 1u0f h GLN 353 Cb 0.19 -0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.83 1u0f h GLN 353 CO -0.24 0.47 0.31 0.78 -1.93 0.00 0.00 178.83 178.22 1u0f h GLY 354 N -0.38 0.79 0.00 2.39 0.00 -1.22 -1.23 103.07 103.42 1u0f h GLY 354 Ca 0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1u0f h GLY 354 CO 0.00 0.16 -0.13 -1.80 0.00 0.00 0.00 176.54 174.78 1u0f h ASP 355 N 0.60 0.00 -0.07 0.19 1.82 -0.98 -3.30 116.42 114.68 1u0f h ASP 355 Ca 0.24 -0.19 -0.13 0.00 -0.39 0.00 0.00 57.03 56.55 1u0f h ASP 355 Cb 0.10 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.10 1u0f h ASP 355 CO -0.14 0.66 -0.40 0.24 -1.61 0.00 0.00 179.24 178.00 1u0f h MET 356 N -1.00 0.59 0.00 0.28 2.86 -1.17 0.01 114.93 116.50 1u0f h MET 356 Ca -0.01 -0.30 -0.13 0.00 -2.06 0.00 0.00 59.70 57.20 1u0f h MET 356 Cb 0.30 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.95 1u0f h MET 356 CO -0.01 0.89 -0.61 1.49 1.06 0.00 0.00 176.91 179.73 1u0f h GLU 357 N 0.49 0.00 0.12 1.72 4.81 -1.31 -0.81 114.58 119.60 1u0f h GLU 357 Ca 0.04 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1u0f h GLU 357 Cb 0.91 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1u0f h GLU 357 CO 0.08 0.61 -0.06 0.77 -0.73 0.00 0.00 179.01 179.68 1u0f h SER 358 N 0.00 -0.13 -0.24 1.04 0.02 -1.54 -3.40 113.55 109.29 1u0f h SER 358 Ca -0.01 -0.43 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1u0f h SER 358 Cb 1.22 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1u0f h SER 358 CO 0.08 0.44 0.00 0.59 -1.14 0.00 0.00 176.83 176.80 1u0f n ASN 359 N -4.89 2.63 -4.21 3.07 3.02 -0.05 -4.13 115.26 110.70 1u0f n ASN 359 Ca -0.08 -1.81 -0.43 0.00 -0.03 0.00 0.00 54.58 52.23 1u0f n ASN 359 Cb 0.28 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1u0f n ASN 359 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u0f n GLY 360 N 0.65 3.44 3.09 7.41 0.00 -0.31 -1.56 105.19 117.91 1u0f n GLY 360 Ca 0.11 -1.58 -0.09 0.00 0.00 0.00 0.00 46.02 44.46 1u0f n GLY 360 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u0f s LYS 361 N 3.48 0.60 0.00 1.61 -0.14 -1.26 -4.97 119.74 119.06 1u0f s LYS 361 Ca 0.50 -1.08 0.00 0.00 -1.36 0.00 0.00 55.97 54.02 1u0f s LYS 361 Cb 0.08 0.04 0.00 0.00 -1.68 0.00 0.00 37.83 36.27 1u0f s LYS 361 CO 0.01 -0.06 0.07 2.48 -0.76 0.00 0.00 175.35 177.08 1u0f n TYR 362 N 0.49 0.00 -4.80 3.18 0.18 -1.26 -4.72 117.16 110.23 1u0f n TYR 362 Ca -0.16 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.29 1u0f n TYR 362 Cb 0.59 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.42 1u0f n TYR 362 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 1u0f s ILE 363 N -0.03 3.12 0.70 -3.48 -1.09 -1.26 -1.10 121.20 118.06 1u0f s ILE 363 Ca 0.00 -0.67 -0.03 0.00 -2.23 0.00 0.00 60.65 57.73 1u0f s ILE 363 Cb 0.00 -2.28 0.10 0.00 -1.58 0.00 0.00 42.46 38.70 1u0f s ILE 363 CO 0.00 0.55 0.98 0.42 -1.23 0.00 0.00 174.94 175.66 1u0f s THR 364 N -0.16 2.27 0.54 2.92 -4.23 0.11 -4.53 115.64 112.56 1u0f s THR 364 Ca -0.00 -0.49 0.22 0.00 -1.18 0.00 0.00 61.69 60.24 1u0f s THR 364 Cb -0.13 -2.77 0.34 0.00 1.34 0.00 0.00 72.50 71.27 1u0f s THR 364 CO 0.03 0.00 2.08 0.50 -0.54 0.00 0.00 174.62 176.69 1u0f h LYS 365 N -0.51 0.00 0.00 3.99 3.64 -1.49 0.15 116.57 122.35 1u0f h LYS 365 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1u0f h LYS 365 Cb 1.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 1u0f h LYS 365 CO 0.46 0.00 -0.08 -1.13 -2.27 0.00 0.00 179.45 176.43 1u0f n SER 366 N -4.35 0.12 0.00 4.20 3.41 -1.26 -4.90 113.62 110.85 1u0f n SER 366 Ca 0.03 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.03 1u0f n SER 366 Cb 0.36 -0.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 1u0f n SER 366 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1u0f n GLY 367 N 1.49 0.62 3.78 5.00 0.00 0.04 -5.07 105.19 111.05 1u0f n GLY 367 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1u0f n GLY 367 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u0f s ALA 368 N -2.43 3.15 -0.02 4.61 0.00 -1.26 -4.71 121.76 121.10 1u0f s ALA 368 Ca 0.00 0.71 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 1u0f s ALA 368 Cb 0.00 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1u0f s ALA 368 CO 0.00 -0.16 1.14 0.50 0.00 0.00 0.00 175.76 177.24 1u0f s ARG 369 N -2.29 4.42 0.43 0.00 3.52 -1.26 -0.71 118.95 123.06 1u0f s ARG 369 Ca 0.55 1.62 -0.26 0.00 -0.13 0.00 0.00 55.73 57.51 1u0f s ARG 369 Cb -0.23 -3.48 -0.09 0.00 -1.56 0.00 0.00 34.95 29.59 1u0f s ARG 369 CO 0.29 -0.31 1.41 1.33 -0.81 0.00 0.00 175.30 177.21 1u0f n VAL 370 N 4.28 2.63 -1.68 7.11 0.24 -0.26 -4.58 118.33 126.07 1u0f n VAL 370 Ca 0.09 -0.50 -0.11 0.00 -2.04 0.00 0.00 64.34 61.78 1u0f n VAL 370 Cb 0.47 -1.81 0.13 0.00 -1.47 0.00 0.00 33.84 31.16 1u0f n VAL 370 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 1u0f n ASP 371 N -0.01 3.58 -3.91 -1.34 5.75 -1.26 -5.00 116.55 114.36 1u0f n ASP 371 Ca 0.05 -3.81 -0.09 0.00 -0.01 0.00 0.00 54.79 50.93 1u0f n ASP 371 Cb 0.41 -0.54 -0.05 0.00 -1.03 0.00 0.00 41.12 39.91 1u0f n ASP 371 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 1u0f s HIS 372 N -3.42 0.18 0.45 2.11 -3.43 -1.26 -5.04 115.29 104.88 1u0f s HIS 372 Ca 0.47 -0.55 -0.23 0.00 -0.80 0.00 0.00 55.06 53.95 1u0f s HIS 372 Cb 0.41 0.26 -0.07 0.00 -1.43 0.00 0.00 32.58 31.75 1u0f s HIS 372 CO -0.01 -0.96 1.20 -0.65 -2.00 0.00 0.00 174.74 172.32 1u0f s GLN 373 N -3.96 3.76 0.00 -0.38 -1.52 -1.26 -5.06 119.66 111.24 1u0f s GLN 373 Ca 0.17 1.86 0.00 0.00 -1.95 0.00 0.00 55.36 55.44 1u0f s GLN 373 Cb -0.01 -2.47 0.00 0.00 -0.22 0.00 0.00 33.01 30.31 1u0f s GLN 373 CO 0.04 -0.57 0.00 0.25 -0.25 0.00 0.00 175.29 174.76 1u0f n THR 374 N -0.39 0.00 -1.74 -0.19 -2.24 -1.26 -4.91 114.28 103.55 1u0f n THR 374 Ca 0.07 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.47 1u0f n THR 374 Cb 0.47 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.75 1u0f n THR 374 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u0f n GLY 375 N 5.00 0.71 3.92 3.38 0.00 -0.60 -5.00 105.19 112.59 1u0f n GLY 375 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 1u0f n GLY 375 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1u0f s PRO 376 N -2.99 2.58 -0.19 1.61 0.04 -1.26 -4.82 135.00 129.98 1u0f s PRO 376 Ca 0.74 -0.05 -0.29 0.00 0.04 0.00 0.00 61.00 61.44 1u0f s PRO 376 Cb -0.41 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 31.94 1u0f s PRO 376 CO 0.47 -0.99 1.00 0.42 0.04 0.00 0.00 177.00 177.95 1u0f s ILE 377 N -3.15 4.73 -0.11 0.56 1.01 -0.08 -4.68 121.20 119.47 1u0f s ILE 377 Ca 0.57 1.98 -0.09 0.00 0.00 0.00 0.00 60.65 63.11 1u0f s ILE 377 Cb -0.11 -4.29 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1u0f s ILE 377 CO 0.46 -0.11 0.19 -0.69 0.00 0.00 0.00 174.94 174.79 1u0f s VAL 378 N 2.77 5.41 0.31 2.92 1.01 -1.26 -0.84 120.40 130.72 1u0f s VAL 378 Ca 0.44 0.33 -0.17 0.00 0.00 0.00 0.00 61.98 62.58 1u0f s VAL 378 Cb -0.16 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1u0f s VAL 378 CO 0.10 0.57 0.70 -1.66 0.00 0.00 0.00 175.10 174.82 1u0f s TRP 379 N -0.76 0.04 0.00 5.22 1.48 -1.07 -4.77 118.94 119.09 1u0f s TRP 379 Ca 0.16 -0.55 0.00 0.00 -1.06 0.00 0.00 56.10 54.64 1u0f s TRP 379 Cb -0.13 0.65 0.00 0.00 -1.16 0.00 0.00 33.47 32.83 1u0f s TRP 379 CO 0.05 -1.32 0.00 0.41 -4.06 0.00 0.00 176.95 172.03 1u0f n GLY 380 N -0.48 3.82 3.12 3.67 0.00 -1.26 -0.99 105.19 113.06 1u0f n GLY 380 Ca -0.05 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.66 1u0f n GLY 380 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1u0f s GLU 381 N -2.53 0.68 0.52 1.61 0.41 -1.26 -4.83 118.70 113.31 1u0f s GLU 381 Ca 0.00 -1.02 -0.22 0.00 -0.41 0.00 0.00 54.97 53.32 1u0f s GLU 381 Cb 0.00 -0.29 -0.06 0.00 -1.78 0.00 0.00 34.13 32.01 1u0f s GLU 381 CO 0.00 0.03 1.27 -1.25 -0.49 0.00 0.00 175.26 174.82 1u0f s PRO 382 N -2.57 3.35 0.43 0.39 0.04 -1.26 -4.44 135.00 130.94 1u0f s PRO 382 Ca 0.00 2.03 -0.21 0.00 0.04 0.00 0.00 61.00 62.85 1u0f s PRO 382 Cb -0.03 -2.28 -0.10 0.00 0.04 0.00 0.00 34.50 32.13 1u0f s PRO 382 CO -0.02 -0.96 0.98 0.20 0.04 0.00 0.00 177.00 177.24 1u0f s GLY 383 N -1.16 2.48 0.00 0.56 0.00 -0.51 -2.05 107.32 106.64 1u0f s GLY 383 Ca 0.69 0.48 0.28 0.00 0.00 0.00 0.00 44.72 46.18 1u0f s GLY 383 CO 0.42 0.80 1.85 -1.30 0.00 0.00 0.00 173.10 174.86 1u0f n THR 384 N -0.59 0.01 -0.15 0.90 -2.24 -1.26 -3.68 114.28 107.27 1u0f n THR 384 Ca 0.07 -0.19 -0.07 0.00 -2.27 0.00 0.00 64.05 61.59 1u0f n THR 384 Cb 0.53 0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 68.98 1u0f n THR 384 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1u0f h ASN 385 N 1.72 -1.09 -0.96 3.42 2.35 -1.77 -1.71 115.58 117.54 1u0f h ASN 385 Ca 0.00 0.20 0.22 0.00 -0.55 0.00 0.00 56.30 56.17 1u0f h ASN 385 Cb 0.37 0.53 -0.08 0.00 0.05 0.00 0.00 38.32 39.19 1u0f h ASN 385 CO 0.00 -0.31 0.63 1.23 -1.65 0.00 0.00 177.43 177.32 1u0f h GLY 386 N -0.22 1.00 1.13 2.83 0.00 -1.65 -1.73 103.07 104.44 1u0f h GLY 386 Ca 0.19 -0.20 0.09 0.00 0.00 0.00 0.00 47.33 47.42 1u0f h GLY 386 CO -0.58 -0.04 0.36 1.46 0.00 0.00 0.00 176.54 177.73 1u0f h GLN 387 N 0.42 0.31 -0.66 4.80 4.20 -1.62 -0.36 115.11 122.21 1u0f h GLN 387 Ca 0.51 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 59.20 1u0f h GLN 387 Cb 1.27 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1u0f h GLN 387 CO -0.22 0.20 0.00 0.72 -0.67 0.00 0.00 178.83 178.87 1u0f n HIS 388 N -4.46 0.87 0.02 2.96 8.25 -0.66 -4.14 115.22 118.06 1u0f n HIS 388 Ca 0.08 -0.46 -0.01 0.00 -0.26 0.00 0.00 57.72 57.06 1u0f n HIS 388 Cb 0.37 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.47 1u0f n HIS 388 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1u0f n ALA 389 N 1.53 2.54 -0.46 -1.41 0.00 -0.48 -4.99 120.51 117.25 1u0f n ALA 389 Ca 0.23 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1u0f n ALA 389 Cb 0.60 0.16 0.00 0.00 0.00 0.00 0.00 19.45 20.22 1u0f n ALA 389 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1u0f n PHE 390 N -3.44 0.00 0.30 0.00 1.16 -0.27 -4.74 117.46 110.47 1u0f n PHE 390 Ca -0.02 0.00 0.18 0.00 -1.87 0.00 0.00 57.45 55.74 1u0f n PHE 390 Cb 0.08 0.00 0.81 0.00 -1.61 0.00 0.00 39.48 38.76 1u0f n PHE 390 CO 0.00 0.00 0.00 1.88 -1.87 0.00 0.00 176.76 176.77 1u0f h TYR 391 N 0.00 0.00 -0.71 2.97 -1.99 -1.68 -1.90 116.97 113.66 1u0f h TYR 391 Ca 0.00 0.00 0.14 0.00 2.00 0.00 0.00 58.73 60.87 1u0f h TYR 391 Cb 0.23 0.00 -0.10 0.00 2.00 0.00 0.00 36.73 38.86 1u0f h TYR 391 CO 0.00 0.00 0.21 0.37 -0.00 0.00 0.00 178.16 178.74 1u0f h GLN 392 N 0.00 0.32 -0.16 4.88 5.75 -1.85 -0.40 115.11 123.66 1u0f h GLN 392 Ca 0.00 -0.02 -0.15 0.00 -0.15 0.00 0.00 58.65 58.33 1u0f h GLN 392 Cb 0.35 -0.07 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 1u0f h GLN 392 CO 0.00 0.21 -0.54 1.25 -2.65 0.00 0.00 178.83 177.10 1u0f h LEU 393 N 0.33 0.51 -0.72 -2.39 6.46 -1.71 -1.09 115.31 116.70 1u0f h LEU 393 Ca 0.39 -0.27 -0.07 0.00 -0.12 0.00 0.00 57.88 57.81 1u0f h LEU 393 Cb 0.63 -0.15 -0.03 0.00 -0.73 0.00 0.00 40.66 40.38 1u0f h LEU 393 CO -0.45 0.95 0.15 0.40 -0.62 0.00 0.00 178.44 178.87 1u0f h ILE 394 N 0.35 1.26 0.10 4.05 2.04 -1.19 -0.04 117.51 124.09 1u0f h ILE 394 Ca 0.01 -1.00 -0.27 0.00 1.00 0.00 0.00 64.86 64.60 1u0f h ILE 394 Cb 1.06 0.57 0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1u0f h ILE 394 CO 0.10 0.38 -1.17 0.45 0.00 0.00 0.00 178.15 177.91 1u0f h HIS 395 N 1.06 0.62 0.00 1.37 3.86 -1.03 -3.41 115.15 117.62 1u0f h HIS 395 Ca 0.22 -0.41 0.00 0.00 -1.16 0.00 0.00 60.37 59.02 1u0f h HIS 395 Cb 0.40 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.83 1u0f h HIS 395 CO 0.03 1.28 -0.19 1.04 0.86 0.00 0.00 177.93 180.95 1u0f n GLN 396 N -3.64 0.06 -0.05 2.45 6.02 -0.42 -4.62 117.38 117.17 1u0f n GLN 396 Ca -0.09 -0.72 0.00 0.00 -0.01 0.00 0.00 57.00 56.18 1u0f n GLN 396 Cb 0.97 -0.52 0.00 0.00 1.02 0.00 0.00 30.24 31.71 1u0f n GLN 396 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u0f n GLY 397 N -0.02 -0.30 0.47 1.08 0.00 -0.03 -4.94 105.19 101.45 1u0f n GLY 397 Ca 0.00 -1.72 0.06 0.00 0.00 0.00 0.00 46.02 44.36 1u0f n GLY 397 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u0f n THR 398 N -0.46 1.57 -4.65 2.61 -2.24 -1.26 -5.01 114.28 104.83 1u0f n THR 398 Ca 0.00 -1.52 -0.33 0.00 -2.27 0.00 0.00 64.05 59.93 1u0f n THR 398 Cb 0.00 0.12 -0.12 0.00 -2.10 0.00 0.00 70.33 68.24 1u0f n THR 398 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1u0f s LYS 399 N -1.93 2.61 -0.14 -0.78 3.01 -1.26 -5.11 119.74 116.14 1u0f s LYS 399 Ca 0.26 -0.64 -0.19 0.00 -1.01 0.00 0.00 55.97 54.39 1u0f s LYS 399 Cb 0.19 -2.50 -0.04 0.00 -1.01 0.00 0.00 37.83 34.48 1u0f s LYS 399 CO 0.08 0.63 0.51 1.41 0.51 0.00 0.00 175.35 178.50 1u0f s MET 400 N -0.96 4.31 -0.32 1.68 -2.45 -1.26 -4.95 119.30 115.34 1u0f s MET 400 Ca 0.13 0.49 -0.01 0.00 -1.25 0.00 0.00 55.69 55.05 1u0f s MET 400 Cb -0.11 -3.47 0.11 0.00 1.25 0.00 0.00 34.83 32.61 1u0f s MET 400 CO 0.03 0.06 0.14 0.42 1.05 0.00 0.00 175.02 176.72 1u0f s ILE 401 N 0.94 0.50 0.23 10.11 1.01 -1.26 -4.71 121.20 128.02 1u0f s ILE 401 Ca 0.27 -1.37 -0.32 0.00 0.00 0.00 0.00 60.65 59.23 1u0f s ILE 401 Cb -0.15 -1.39 -0.13 0.00 0.01 0.00 0.00 42.46 40.80 1u0f s ILE 401 CO 0.11 -0.77 1.61 -2.65 0.00 0.00 0.00 174.94 173.24 1u0f n PRO 402 N 4.70 2.51 -5.03 2.79 -0.02 -1.26 -4.80 135.00 133.89 1u0f n PRO 402 Ca 0.00 0.90 -0.28 0.00 -2.02 0.00 0.00 63.50 62.10 1u0f n PRO 402 Cb 0.40 -2.69 -0.16 0.00 -0.02 0.00 0.00 33.50 31.04 1u0f n PRO 402 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1u0f s ASP 404 N -0.28 5.77 -0.17 0.00 1.01 0.12 -1.21 116.67 121.93 1u0f s ASP 404 Ca 0.02 -0.21 -0.14 0.00 0.71 0.00 0.00 52.55 52.93 1u0f s ASP 404 Cb -0.10 -2.06 -0.05 0.00 1.01 0.00 0.00 42.92 41.72 1u0f s ASP 404 CO 0.01 -0.11 0.30 -0.36 0.21 0.00 0.00 175.17 175.22 1u0f s PHE 405 N 1.70 3.44 0.02 4.23 0.40 -0.10 -0.75 117.98 126.92 1u0f s PHE 405 Ca 0.06 0.58 0.07 0.00 -0.60 0.00 0.00 56.93 57.04 1u0f s PHE 405 Cb -0.16 -2.36 -0.02 0.00 0.51 0.00 0.00 43.02 40.99 1u0f s PHE 405 CO 0.09 0.20 -0.20 -0.51 0.70 0.00 0.00 175.22 175.50 1u0f s LEU 406 N 0.59 2.12 -0.24 -0.37 1.02 -1.05 -0.29 118.68 120.46 1u0f s LEU 406 Ca 0.16 -0.46 -0.26 0.00 0.02 0.00 0.00 54.13 53.60 1u0f s LEU 406 Cb -0.13 -0.99 0.07 0.00 0.02 0.00 0.00 46.19 45.16 1u0f s LEU 406 CO 0.04 0.19 0.71 -0.51 0.02 0.00 0.00 176.35 176.81 1u0f s ILE 407 N -0.67 0.00 0.20 -0.59 2.07 -0.67 0.24 121.20 121.78 1u0f s ILE 407 Ca 0.07 -0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.01 1u0f s ILE 407 Cb -0.08 -0.99 -0.08 0.00 0.13 0.00 0.00 42.46 41.43 1u0f s ILE 407 CO 0.01 -0.00 0.96 -2.16 -1.91 0.00 0.00 174.94 171.83 1u0f s PRO 408 N 0.18 4.80 0.07 3.50 0.04 -1.26 -1.99 135.00 140.35 1u0f s PRO 408 Ca -0.01 1.50 -0.21 0.00 0.04 0.00 0.00 61.00 62.31 1u0f s PRO 408 Cb -0.04 -3.30 -0.11 0.00 0.04 0.00 0.00 34.50 31.08 1u0f s PRO 408 CO 0.02 0.41 1.57 0.28 0.04 0.00 0.00 177.00 179.33 1u0f h VAL 409 N 3.41 1.19 -3.50 -0.36 2.07 -0.65 -3.42 116.25 114.99 1u0f h VAL 409 Ca -0.44 -0.59 -0.60 0.00 0.82 0.00 0.00 66.70 65.88 1u0f h VAL 409 Cb 1.20 1.30 -0.11 0.00 -1.52 0.00 0.00 31.29 32.16 1u0f h VAL 409 CO 0.69 0.18 -0.15 -1.10 0.02 0.00 0.00 177.57 177.21 1u0f s GLN 410 N -5.35 4.16 0.42 1.57 -0.21 0.47 -5.03 119.66 115.71 1u0f s GLN 410 Ca -0.14 0.26 -0.18 0.00 0.02 0.00 0.00 55.36 55.32 1u0f s GLN 410 Cb 0.06 -3.56 -0.10 0.00 1.00 0.00 0.00 33.01 30.42 1u0f s GLN 410 CO 0.70 -0.10 0.90 -0.08 -2.12 0.00 0.00 175.29 174.59 1u0f s THR 411 N 1.50 4.51 -0.50 -0.19 -1.32 -1.26 -4.44 115.64 113.94 1u0f s THR 411 Ca 0.20 1.25 0.26 0.00 -1.21 0.00 0.00 61.69 62.19 1u0f s THR 411 Cb -0.15 -3.64 0.28 0.00 -1.51 0.00 0.00 72.50 67.49 1u0f s THR 411 CO 0.09 -0.39 1.76 1.56 -2.21 0.00 0.00 174.62 175.43 1u0f h GLN 412 N 1.71 0.00 -2.43 7.08 1.08 -1.98 -3.38 115.11 117.19 1u0f h GLN 412 Ca -0.48 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.13 1u0f h GLN 412 Cb 1.18 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 28.22 1u0f h GLN 412 CO 0.62 0.00 -0.92 0.72 -0.95 0.00 0.00 178.83 178.31 1u0f n HIS 413 N -2.40 -0.01 -1.12 2.96 8.25 -1.26 -5.02 115.22 116.62 1u0f n HIS 413 Ca 0.03 -3.53 -0.30 0.00 -0.26 0.00 0.00 57.72 53.66 1u0f n HIS 413 Cb 0.32 0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.39 1u0f n HIS 413 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1u0f n PRO 414 N 2.43 3.02 -1.26 -0.41 -0.04 -1.26 -4.92 135.00 132.56 1u0f n PRO 414 Ca 0.27 -1.80 -0.31 0.00 -0.04 0.00 0.00 63.50 61.62 1u0f n PRO 414 Cb 0.46 -2.56 0.09 0.00 -0.04 0.00 0.00 33.50 31.45 1u0f n PRO 414 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1u0f s ILE 415 N 2.20 3.29 -1.55 0.52 -4.36 -1.26 -3.44 121.20 116.61 1u0f s ILE 415 Ca 0.62 0.42 -0.14 0.00 -0.26 0.00 0.00 60.65 61.30 1u0f s ILE 415 Cb 0.19 -2.90 0.09 0.00 1.25 0.00 0.00 42.46 41.09 1u0f s ILE 415 CO -0.04 -0.54 0.95 0.54 0.24 0.00 0.00 174.94 176.08 1u0f n ARG 416 N -3.52 -5.21 -2.69 0.37 5.12 -1.26 -1.00 116.66 108.47 1u0f n ARG 416 Ca 0.09 0.57 -0.17 0.00 -1.93 0.00 0.00 57.85 56.41 1u0f n ARG 416 Cb 0.53 -5.43 0.00 0.00 -1.16 0.00 0.00 32.46 26.40 1u0f n ARG 416 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1u0f n LYS 417 N -4.64 -2.76 -0.33 5.56 5.02 -1.25 -2.06 118.16 117.71 1u0f n LYS 417 Ca 0.04 0.70 0.00 0.00 -2.02 0.00 0.00 58.31 57.02 1u0f n LYS 417 Cb 0.53 -5.37 0.00 0.00 -0.02 0.00 0.00 35.03 30.17 1u0f n LYS 417 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u0f n GLY 418 N -1.02 0.76 0.19 0.72 0.00 -0.17 -4.99 105.19 100.68 1u0f n GLY 418 Ca -0.14 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.81 1u0f n GLY 418 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1u0f h LEU 419 N 0.00 0.51 -0.46 0.99 5.85 -1.38 -0.73 115.31 120.09 1u0f h LEU 419 Ca 0.00 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1u0f h LEU 419 Cb 0.00 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 1u0f h LEU 419 CO 0.00 0.38 0.25 0.45 -0.34 0.00 0.00 178.44 179.18 1u0f h HIS 420 N 0.59 0.63 -0.10 1.25 3.86 -1.85 -2.39 115.15 117.14 1u0f h HIS 420 Ca 0.16 -0.01 -0.16 0.00 -1.16 0.00 0.00 60.37 59.20 1u0f h HIS 420 Cb -0.05 -0.20 -0.01 0.00 1.06 0.00 0.00 27.41 28.21 1u0f h HIS 420 CO -0.04 0.47 -0.60 1.25 0.86 0.00 0.00 177.93 179.86 1u0f h HIS 421 N 0.60 0.46 -0.43 2.45 -0.00 -1.82 -0.60 115.15 115.81 1u0f h HIS 421 Ca 0.16 -0.17 0.06 0.00 -0.00 0.00 0.00 60.37 60.42 1u0f h HIS 421 Cb 0.05 -0.08 -0.05 0.00 -0.00 0.00 0.00 27.41 27.33 1u0f h HIS 421 CO -0.02 0.87 0.13 -0.22 -0.00 0.00 0.00 177.93 178.69 1u0f h LYS 422 N 0.26 0.28 -0.27 5.26 3.64 -1.02 0.20 116.57 124.92 1u0f h LYS 422 Ca -0.01 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1u0f h LYS 422 Cb 1.13 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1u0f h LYS 422 CO 0.10 0.18 -0.00 0.82 -2.27 0.00 0.00 179.45 178.28 1u0f h ILE 423 N 0.29 1.26 -0.12 2.00 2.04 -1.15 -1.34 117.51 120.48 1u0f h ILE 423 Ca 0.20 -0.93 0.04 0.00 1.00 0.00 0.00 64.86 65.18 1u0f h ILE 423 Cb 0.21 1.33 -0.05 0.00 -0.74 0.00 0.00 36.82 37.58 1u0f h ILE 423 CO -0.23 0.29 -0.15 0.25 0.00 0.00 0.00 178.15 178.31 1u0f h LEU 424 N 0.26 -0.48 -0.61 1.44 5.85 -0.93 -1.86 115.31 118.98 1u0f h LEU 424 Ca 0.08 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.94 1u0f h LEU 424 Cb 0.43 0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.63 1u0f h LEU 424 CO 0.01 -0.20 0.33 -0.07 -0.34 0.00 0.00 178.44 178.17 1u0f h LEU 425 N -0.19 0.48 -0.69 2.25 3.38 -0.91 -1.25 115.31 118.38 1u0f h LEU 425 Ca 0.09 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1u0f h LEU 425 Cb 0.33 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.96 1u0f h LEU 425 CO -0.24 0.32 0.40 0.00 0.09 0.00 0.00 178.44 179.01 1u0f h ALA 426 N 1.32 0.92 -0.51 1.53 0.00 -0.82 -1.19 119.26 120.52 1u0f h ALA 426 Ca 0.27 0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 1u0f h ALA 426 Cb 0.17 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1u0f h ALA 426 CO -0.18 0.10 0.06 -0.91 0.00 0.00 0.00 179.25 178.33 1u0f h ASN 427 N 0.75 0.83 -0.40 0.00 2.35 -1.08 -0.08 115.58 117.95 1u0f h ASN 427 Ca 0.30 -0.27 0.07 0.00 -0.55 0.00 0.00 56.30 55.85 1u0f h ASN 427 Cb 0.15 -0.22 -0.07 0.00 0.05 0.00 0.00 38.32 38.23 1u0f h ASN 427 CO -0.16 0.89 -0.02 0.15 -1.65 0.00 0.00 177.43 176.64 1u0f h PHE 428 N 0.73 -0.07 -0.23 1.19 3.57 -0.82 -1.16 116.94 120.16 1u0f h PHE 428 Ca 0.15 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.57 1u0f h PHE 428 Cb 0.43 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 1u0f h PHE 428 CO 0.03 -0.10 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.63 1u0f h LEU 429 N 0.08 0.67 -0.87 0.59 3.38 -1.16 -3.31 115.31 114.69 1u0f h LEU 429 Ca 0.19 -0.51 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 1u0f h LEU 429 Cb 0.28 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1u0f h LEU 429 CO -0.35 1.05 -0.17 0.00 0.09 0.00 0.00 178.44 179.07 1u0f h ALA 430 N 0.64 1.04 -0.51 1.53 0.00 -0.80 -2.66 119.26 118.51 1u0f h ALA 430 Ca 0.03 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1u0f h ALA 430 Cb 0.89 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1u0f h ALA 430 CO 0.07 0.58 0.08 1.96 0.00 0.00 0.00 179.25 181.94 1u0f h GLN 431 N 0.59 0.85 -0.03 0.00 1.08 -1.30 0.13 115.11 116.42 1u0f h GLN 431 Ca 0.10 -0.23 -0.15 0.00 -1.45 0.00 0.00 58.65 56.91 1u0f h GLN 431 Cb 0.62 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.94 1u0f h GLN 431 CO 0.04 0.84 -0.68 1.79 -0.95 0.00 0.00 178.83 179.87 1u0f h THR 432 N 0.73 1.43 -0.30 -0.54 1.35 -1.65 -0.75 112.91 113.18 1u0f h THR 432 Ca 0.16 -2.19 -0.03 0.00 -0.55 0.00 0.00 66.41 63.80 1u0f h THR 432 Cb 0.40 2.16 -0.01 0.00 -1.73 0.00 0.00 68.15 68.97 1u0f h THR 432 CO 0.01 0.64 0.09 -0.08 -0.25 0.00 0.00 175.52 175.93 1u0f h GLU 433 N 0.11 0.47 -0.49 4.72 4.81 -1.31 -1.62 114.58 121.27 1u0f h GLU 433 Ca -0.01 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.09 1u0f h GLU 433 Cb 1.21 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.50 1u0f h GLU 433 CO 0.10 0.53 0.24 0.00 -0.73 0.00 0.00 179.01 179.15 1u0f h ALA 434 N 0.92 0.63 -0.93 2.92 0.00 -0.58 0.08 119.26 122.30 1u0f h ALA 434 Ca 0.10 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1u0f h ALA 434 Cb 0.26 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 1u0f h ALA 434 CO -0.00 0.18 0.61 -0.07 0.00 0.00 0.00 179.25 179.96 1u0f h LEU 435 N 0.65 1.08 0.21 0.00 3.38 -1.07 -1.29 115.31 118.26 1u0f h LEU 435 Ca 0.17 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1u0f h LEU 435 Cb 0.10 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.58 1u0f h LEU 435 CO -0.02 0.79 -0.10 -0.03 0.09 0.00 0.00 178.44 179.17 1u0f h MET 436 N 1.27 -0.27 0.13 1.13 4.05 -1.05 -1.05 114.93 119.14 1u0f h MET 436 Ca 0.34 0.02 -0.19 0.00 -0.28 0.00 0.00 59.70 59.59 1u0f h MET 436 Cb -0.13 0.06 0.02 0.00 -0.80 0.00 0.00 31.60 30.76 1u0f h MET 436 CO -0.07 0.10 -0.83 -0.22 0.23 0.00 0.00 176.91 176.12 1u0f h LYS 437 N -0.74 0.33 0.00 0.39 3.64 -0.90 -1.85 116.57 117.43 1u0f h LYS 437 Ca -0.03 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 1u0f h LYS 437 Cb 0.50 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 1u0f h LYS 437 CO 0.05 1.24 0.00 0.41 -2.27 0.00 0.00 179.45 178.88 1u0f n GLY 438 N 1.61 -0.62 2.89 5.01 0.00 -0.50 -4.67 105.19 108.90 1u0f n GLY 438 Ca -0.14 -1.10 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 1u0f n GLY 438 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1u0f s LYS 439 N 0.00 0.14 0.59 1.61 2.20 0.36 -4.91 119.74 119.73 1u0f s LYS 439 Ca 0.00 0.53 -0.17 0.00 -0.36 0.00 0.00 55.97 55.97 1u0f s LYS 439 Cb 0.00 -0.48 -0.04 0.00 -1.51 0.00 0.00 37.83 35.81 1u0f s LYS 439 CO 0.00 -0.42 1.09 -0.51 -0.36 0.00 0.00 175.35 175.15 1u0f s LEU 440 N 2.37 3.57 0.25 5.43 1.02 -1.26 -1.66 118.68 128.41 1u0f s LEU 440 Ca 0.04 1.99 -0.03 0.00 0.02 0.00 0.00 54.13 56.15 1u0f s LEU 440 Cb -0.13 -4.56 0.52 0.00 0.02 0.00 0.00 46.19 42.04 1u0f s LEU 440 CO -0.09 -1.29 1.70 -0.65 0.02 0.00 0.00 176.35 176.04 1u0f h PRO 441 N 0.64 0.35 -0.59 1.29 0.11 -1.95 -0.17 132.00 131.67 1u0f h PRO 441 Ca -0.48 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1u0f h PRO 441 Cb 1.24 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 1u0f h PRO 441 CO 0.56 0.23 0.24 1.05 -0.21 0.00 0.00 178.00 179.87 1u0f h GLU 442 N 0.36 0.86 -0.31 1.05 4.11 -1.99 0.14 114.58 118.80 1u0f h GLU 442 Ca 0.45 -0.13 -0.10 0.00 0.07 0.00 0.00 59.36 59.64 1u0f h GLU 442 Cb 0.75 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 1u0f h GLU 442 CO -0.48 0.70 -0.19 0.93 0.07 0.00 0.00 179.01 180.04 1u0f h GLU 443 N 0.85 0.68 -0.41 1.06 5.08 -1.63 -2.58 114.58 117.63 1u0f h GLU 443 Ca 0.20 -0.32 -0.08 0.00 -1.00 0.00 0.00 59.36 58.16 1u0f h GLU 443 Cb 0.16 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1u0f h GLU 443 CO -0.02 0.92 -0.09 0.00 -1.00 0.00 0.00 179.01 178.82 1u0f h ALA 444 N 0.75 1.07 -0.22 3.43 0.00 -0.70 -2.68 119.26 120.91 1u0f h ALA 444 Ca 0.06 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1u0f h ALA 444 Cb 0.74 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1u0f h ALA 444 CO 0.05 0.57 0.12 -0.09 0.00 0.00 0.00 179.25 179.91 1u0f h ARG 445 N 0.66 0.30 -0.54 0.00 2.43 -0.67 -2.02 114.38 114.54 1u0f h ARG 445 Ca 0.12 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1u0f h ARG 445 Cb 0.54 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.00 1u0f h ARG 445 CO 0.03 0.26 0.32 0.87 -1.51 0.00 0.00 179.97 179.94 1u0f h LYS 446 N 0.25 0.73 -0.53 0.20 1.79 -1.42 -0.10 116.57 117.49 1u0f h LYS 446 Ca 0.08 -0.06 -0.10 0.00 -2.18 0.00 0.00 60.65 58.38 1u0f h LYS 446 Cb 0.05 -0.16 -0.02 0.00 -1.58 0.00 0.00 32.23 30.53 1u0f h LYS 446 CO -0.01 0.52 -0.07 0.93 -1.08 0.00 0.00 179.45 179.74 1u0f h GLU 447 N 0.74 0.98 -0.37 3.15 5.08 -1.23 -1.57 114.58 121.37 1u0f h GLU 447 Ca 0.19 -0.35 -0.15 0.00 -1.00 0.00 0.00 59.36 58.05 1u0f h GLU 447 Cb -0.02 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1u0f h GLU 447 CO -0.04 1.02 -0.37 -0.07 -1.00 0.00 0.00 179.01 178.55 1u0f h LEU 448 N 0.85 0.93 -0.32 1.33 3.38 -0.97 -1.80 115.31 118.71 1u0f h LEU 448 Ca 0.14 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1u0f h LEU 448 Cb 0.62 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 1u0f h LEU 448 CO 0.04 1.20 0.21 1.56 0.09 0.00 0.00 178.44 181.54 1u0f h GLN 449 N 0.72 0.42 0.00 1.13 4.20 -0.93 -2.41 115.11 118.24 1u0f h GLN 449 Ca 0.06 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1u0f h GLN 449 Cb 0.95 -0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.63 1u0f h GLN 449 CO 0.09 0.28 -0.13 0.00 -0.67 0.00 0.00 178.83 178.40 1u0f h ALA 450 N 1.12 1.07 -0.00 3.87 0.00 -1.20 -2.43 119.26 121.69 1u0f h ALA 450 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1u0f h ALA 450 Cb -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1u0f h ALA 450 CO -0.03 0.16 -0.00 0.00 0.00 0.00 0.00 179.25 179.38 1u0f n ALA 451 N -2.19 2.58 -1.92 0.00 0.00 -0.69 -4.91 120.51 113.38 1u0f n ALA 451 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1u0f n ALA 451 Cb 0.33 -1.50 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1u0f n ALA 451 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u0f n GLY 452 N 1.16 0.47 3.80 0.00 0.00 -0.91 -5.05 105.19 104.66 1u0f n GLY 452 Ca 0.18 -0.84 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 1u0f n GLY 452 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u0f s LYS 453 N -3.89 4.39 0.56 1.61 3.01 -1.09 -5.06 119.74 119.27 1u0f s LYS 453 Ca 0.00 1.00 -0.18 0.00 -1.01 0.00 0.00 55.97 55.78 1u0f s LYS 453 Cb 0.00 -3.03 -0.05 0.00 -1.01 0.00 0.00 37.83 33.74 1u0f s LYS 453 CO 0.00 0.46 1.10 -1.54 0.51 0.00 0.00 175.35 175.88 1u0f s SER 454 N -1.44 5.73 0.44 2.83 1.04 -1.26 -4.79 113.70 116.25 1u0f s SER 454 Ca 0.40 2.04 0.21 0.00 0.48 0.00 0.00 55.95 59.08 1u0f s SER 454 Cb -0.19 -2.56 1.18 0.00 0.10 0.00 0.00 66.02 64.54 1u0f s SER 454 CO 0.23 -1.20 1.84 1.55 0.98 0.00 0.00 173.24 176.63 1u0f h PRO 455 N 0.93 0.30 0.23 4.02 0.13 -1.98 0.15 132.00 135.79 1u0f h PRO 455 Ca -0.49 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1u0f h PRO 455 Cb 1.24 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1u0f h PRO 455 CO 0.57 0.20 -0.11 1.49 -0.23 0.00 0.00 178.00 179.92 1u0f h GLU 456 N 0.31 -0.30 -0.40 0.86 4.57 -2.01 -2.75 114.58 114.87 1u0f h GLU 456 Ca 0.50 0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.66 1u0f h GLU 456 Cb 1.40 0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 30.04 1u0f h GLU 456 CO -0.17 0.06 0.07 -0.44 -1.18 0.00 0.00 179.01 177.35 1u0f h ASP 457 N -0.75 0.56 -0.02 1.04 3.45 -1.82 -3.09 116.42 115.78 1u0f h ASP 457 Ca -0.03 -0.09 0.01 0.00 0.43 0.00 0.00 57.03 57.34 1u0f h ASP 457 Cb 0.50 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.12 1u0f h ASP 457 CO 0.05 0.58 -0.01 0.25 -1.57 0.00 0.00 179.24 178.54 1u0f h LEU 458 N 0.58 -0.04 -0.93 1.55 6.46 -0.73 -2.50 115.31 119.71 1u0f h LEU 458 Ca 0.13 0.01 -0.10 0.00 -0.12 0.00 0.00 57.88 57.80 1u0f h LEU 458 Cb 0.27 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.20 1u0f h LEU 458 CO 0.00 -0.02 -0.27 -0.33 -0.62 0.00 0.00 178.44 177.20 1u0f h GLU 459 N -0.01 0.46 -0.40 1.25 4.39 -1.42 -0.83 114.58 118.02 1u0f h GLU 459 Ca 0.01 -0.18 -0.13 0.00 0.34 0.00 0.00 59.36 59.40 1u0f h GLU 459 Cb 0.03 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1u0f h GLU 459 CO -0.03 0.70 -0.28 0.87 -1.16 0.00 0.00 179.01 179.12 1u0f h LYS 460 N 0.41 0.89 0.00 2.33 1.57 -1.51 -3.29 116.57 116.97 1u0f h LYS 460 Ca 0.06 -0.43 -0.20 0.00 -1.87 0.00 0.00 60.65 58.21 1u0f h LYS 460 Cb 0.69 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 1u0f h LYS 460 CO 0.05 1.07 -0.96 -0.07 -0.57 0.00 0.00 179.45 178.98 1u0f h LEU 461 N 0.71 0.00 -0.34 2.94 3.38 -1.28 -3.41 115.31 117.29 1u0f h LEU 461 Ca 0.08 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.11 1u0f h LEU 461 Cb 0.85 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.52 1u0f h LEU 461 CO 0.07 0.91 -0.42 0.25 0.09 0.00 0.00 178.44 179.35 1u0f h LEU 462 N 0.00 -1.39 -1.70 1.67 5.85 -1.22 -2.19 115.31 116.33 1u0f h LEU 462 Ca -0.03 0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.90 1u0f h LEU 462 Cb 1.72 0.60 -0.01 0.00 0.37 0.00 0.00 40.66 43.33 1u0f h LEU 462 CO 0.12 -0.38 0.13 1.55 -0.34 0.00 0.00 178.44 179.52 1u0f h PRO 463 N -0.36 0.33 0.00 5.25 0.13 -1.80 -0.54 132.00 135.01 1u0f h PRO 463 Ca 0.12 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1u0f h PRO 463 Cb 0.59 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.65 1u0f h PRO 463 CO -0.53 0.25 0.00 0.45 -0.23 0.00 0.00 178.00 177.93 1u0f h HIS 464 N 0.33 0.00 -0.02 1.56 3.86 -1.68 -2.96 115.15 116.23 1u0f h HIS 464 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1u0f h HIS 464 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1u0f h HIS 464 CO 0.00 0.00 -0.03 1.63 0.86 0.00 0.00 177.93 180.40 1u0f n LYS 465 N -3.06 2.04 -3.17 2.45 5.02 -0.22 -4.92 118.16 116.30 1u0f n LYS 465 Ca -0.00 -1.55 -0.39 0.00 -2.02 0.00 0.00 58.31 54.35 1u0f n LYS 465 Cb 0.25 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.74 1u0f n LYS 465 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1u0f s VAL 466 N -2.03 4.80 -0.23 -0.18 1.01 -1.12 -4.88 120.40 117.77 1u0f s VAL 466 Ca 0.31 1.33 -0.00 0.00 0.00 0.00 0.00 61.98 63.62 1u0f s VAL 466 Cb 0.20 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.64 1u0f s VAL 466 CO 0.33 0.45 -0.11 -0.36 0.00 0.00 0.00 175.10 175.41 1u0f s PHE 467 N -0.44 3.02 0.23 5.22 0.40 -0.66 -4.94 117.98 120.82 1u0f s PHE 467 Ca 0.32 -1.71 0.27 0.00 -0.60 0.00 0.00 56.93 55.20 1u0f s PHE 467 Cb -0.19 -2.00 1.17 0.00 0.51 0.00 0.00 43.02 42.51 1u0f s PHE 467 CO 0.19 -0.78 1.93 0.93 0.70 0.00 0.00 175.22 178.20 1u0f h GLU 468 N 7.95 0.00 0.00 0.44 5.08 -1.82 0.10 114.58 126.33 1u0f h GLU 468 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1u0f h GLU 468 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1u0f h GLU 468 CO 0.57 0.16 0.00 0.41 -1.00 0.00 0.00 179.01 179.16 1u0f n GLY 469 N -0.15 0.71 2.38 -3.84 0.00 -1.26 -4.78 105.19 98.25 1u0f n GLY 469 Ca -0.01 -0.74 -0.20 0.00 0.00 0.00 0.00 46.02 45.07 1u0f n GLY 469 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1u0f n ASN 470 N -2.31 -5.62 -4.48 1.61 5.15 -0.70 -4.94 115.26 103.97 1u0f n ASN 470 Ca 0.00 -0.01 -0.38 0.00 -0.60 0.00 0.00 54.58 53.59 1u0f n ASN 470 Cb 0.00 -4.66 -0.12 0.00 -0.53 0.00 0.00 39.78 34.47 1u0f n ASN 470 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1u0f s ARG 471 N -4.95 3.55 0.23 1.20 0.52 -0.42 -4.94 118.95 114.13 1u0f s ARG 471 Ca 0.00 -0.57 -0.22 0.00 -0.52 0.00 0.00 55.73 54.42 1u0f s ARG 471 Cb 0.00 -3.56 -0.09 0.00 0.52 0.00 0.00 34.95 31.83 1u0f s ARG 471 CO 0.00 -0.32 0.78 -1.25 0.02 0.00 0.00 175.30 174.53 1u0f s PRO 472 N 1.66 4.37 0.06 3.54 0.04 -1.26 -3.69 135.00 139.72 1u0f s PRO 472 Ca 0.06 1.01 -0.00 0.00 0.04 0.00 0.00 61.00 62.11 1u0f s PRO 472 Cb -0.16 -2.93 -0.04 0.00 0.04 0.00 0.00 34.50 31.40 1u0f s PRO 472 CO 0.07 0.40 -0.04 0.95 0.04 0.00 0.00 177.00 178.42 1u0f s THR 473 N -1.47 0.34 -0.04 1.26 -4.23 -0.72 -3.50 115.64 107.28 1u0f s THR 473 Ca 0.43 -1.82 -0.01 0.00 -1.18 0.00 0.00 61.69 59.11 1u0f s THR 473 Cb -0.18 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.09 1u0f s THR 473 CO 0.22 -0.95 0.03 0.20 -0.54 0.00 0.00 174.62 173.58 1u0f s ASN 474 N -2.92 5.37 -0.17 3.99 0.02 -0.35 -4.06 114.94 116.83 1u0f s ASN 474 Ca 0.08 0.11 0.00 0.00 -1.02 0.00 0.00 52.86 52.03 1u0f s ASN 474 Cb 0.07 -1.50 0.00 0.00 0.02 0.00 0.00 41.25 39.84 1u0f s ASN 474 CO -0.08 0.32 -0.15 -0.44 0.02 0.00 0.00 177.10 176.77 1u0f s SER 475 N -1.33 3.61 -0.25 -1.22 0.01 -0.41 -0.92 113.70 113.19 1u0f s SER 475 Ca 0.18 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.96 1u0f s SER 475 Cb -0.12 -1.56 0.05 0.00 0.21 0.00 0.00 66.02 64.60 1u0f s SER 475 CO 0.08 0.06 -0.12 -0.63 0.41 0.00 0.00 173.24 173.04 1u0f s ILE 476 N 0.97 2.24 -0.04 1.44 1.01 0.61 -0.67 121.20 126.76 1u0f s ILE 476 Ca -0.02 -1.45 0.05 0.00 0.00 0.00 0.00 60.65 59.23 1u0f s ILE 476 Cb -0.15 -2.24 -0.01 0.00 0.01 0.00 0.00 42.46 40.07 1u0f s ILE 476 CO -0.03 0.09 -0.20 -0.69 0.00 0.00 0.00 174.94 174.11 1u0f s VAL 477 N 1.16 1.62 0.04 2.92 1.01 -0.42 -1.68 120.40 125.05 1u0f s VAL 477 Ca -0.06 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.09 1u0f s VAL 477 Cb -0.18 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 34.80 1u0f s VAL 477 CO -0.06 0.46 -0.04 0.72 0.00 0.00 0.00 175.10 176.17 1u0f s PHE 478 N -0.17 0.51 0.18 5.22 -0.12 -0.84 -0.40 117.98 122.36 1u0f s PHE 478 Ca -0.00 -0.74 -0.15 0.00 -0.05 0.00 0.00 56.93 55.99 1u0f s PHE 478 Cb -0.11 -0.34 0.14 0.00 -0.63 0.00 0.00 43.02 42.08 1u0f s PHE 478 CO 0.02 -0.22 1.68 1.15 -0.05 0.00 0.00 175.22 177.80 1u0f h THR 479 N 3.93 0.63 -1.83 -4.49 2.02 -1.70 0.11 112.91 111.58 1u0f h THR 479 Ca -0.34 -0.03 -0.00 0.00 0.77 0.00 0.00 66.41 66.81 1u0f h THR 479 Cb 1.18 0.54 -0.21 0.00 -1.74 0.00 0.00 68.15 67.92 1u0f h THR 479 CO 0.52 0.01 0.32 -0.75 0.37 0.00 0.00 175.52 175.99 1u0f s LYS 480 N -6.19 0.85 -1.29 6.66 2.20 -1.26 -0.39 119.74 120.33 1u0f s LYS 480 Ca -0.14 0.30 -0.15 0.00 -0.36 0.00 0.00 55.97 55.63 1u0f s LYS 480 Cb 0.15 0.40 0.12 0.00 -1.51 0.00 0.00 37.83 36.99 1u0f s LYS 480 CO 0.72 -0.25 1.71 -0.11 -0.36 0.00 0.00 175.35 177.05 1u0f n LEU 481 N 1.07 5.48 -4.95 5.43 7.94 -1.26 -4.74 117.00 125.98 1u0f n LEU 481 Ca -0.15 -4.23 -0.24 0.00 -1.11 0.00 0.00 56.01 50.28 1u0f n LEU 481 Cb 0.57 -1.66 0.04 0.00 0.53 0.00 0.00 43.42 42.90 1u0f n LEU 481 CO 0.18 0.63 0.43 0.42 -1.11 0.00 0.00 177.39 177.94 1u0f s THR 482 N 2.67 3.11 0.24 1.96 -4.23 -1.26 -4.88 115.64 113.24 1u0f s THR 482 Ca 0.47 -0.41 -0.05 0.00 -1.18 0.00 0.00 61.69 60.52 1u0f s THR 482 Cb 0.03 -3.21 0.21 0.00 1.34 0.00 0.00 72.50 70.88 1u0f s THR 482 CO 0.02 -0.18 1.72 -0.65 -0.54 0.00 0.00 174.62 175.00 1u0f h PRO 483 N -0.04 0.38 0.01 3.99 0.11 -1.92 -0.36 132.00 134.18 1u0f h PRO 483 Ca -0.44 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.65 1u0f h PRO 483 Cb 1.28 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1u0f h PRO 483 CO 0.57 0.25 -0.00 0.35 -0.21 0.00 0.00 178.00 178.95 1u0f h PHE 484 N 0.39 -0.01 -0.70 0.65 3.57 -1.87 -1.46 116.94 117.51 1u0f h PHE 484 Ca 0.40 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.82 1u0f h PHE 484 Cb 0.61 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 1u0f h PHE 484 CO -0.19 0.06 0.16 0.82 -2.23 0.00 0.00 178.31 176.92 1u0f h ILE 485 N -0.07 1.26 -0.55 1.41 1.08 -1.77 -1.90 117.51 116.97 1u0f h ILE 485 Ca -0.00 -0.99 0.03 0.00 -0.39 0.00 0.00 64.86 63.51 1u0f h ILE 485 Cb 0.07 0.55 -0.04 0.00 -3.07 0.00 0.00 36.82 34.33 1u0f h ILE 485 CO 0.00 0.38 0.32 0.25 -0.69 0.00 0.00 178.15 178.41 1u0f h LEU 486 N 1.07 0.50 -0.79 1.44 5.85 -0.93 -0.54 115.31 121.90 1u0f h LEU 486 Ca 0.22 0.01 0.05 0.00 0.84 0.00 0.00 57.88 59.00 1u0f h LEU 486 Cb 0.39 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 1u0f h LEU 486 CO 0.01 0.34 0.49 1.23 -0.34 0.00 0.00 178.44 180.17 1u0f h GLY 487 N 0.62 1.18 1.01 3.75 0.00 -0.86 -1.26 103.07 107.51 1u0f h GLY 487 Ca 0.23 -0.36 -0.06 0.00 0.00 0.00 0.00 47.33 47.15 1u0f h GLY 487 CO -0.12 0.26 0.15 0.00 0.00 0.00 0.00 176.54 176.83 1u0f h ALA 488 N 1.37 0.78 -0.42 3.60 0.00 -0.66 -1.89 119.26 122.03 1u0f h ALA 488 Ca 0.34 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 1u0f h ALA 488 Cb 0.13 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1u0f h ALA 488 CO -0.16 0.48 0.10 -0.07 0.00 0.00 0.00 179.25 179.60 1u0f h LEU 489 N 0.85 0.64 -0.28 0.00 3.38 -0.68 -1.14 115.31 118.09 1u0f h LEU 489 Ca 0.19 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 1u0f h LEU 489 Cb 0.34 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1u0f h LEU 489 CO 0.00 0.71 0.10 0.40 0.09 0.00 0.00 178.44 179.75 1u0f h ILE 490 N 0.55 1.18 -0.45 1.22 2.04 -1.13 -2.64 117.51 118.28 1u0f h ILE 490 Ca 0.13 -0.57 -0.03 0.00 1.00 0.00 0.00 64.86 65.39 1u0f h ILE 490 Cb 0.32 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 37.42 1u0f h ILE 490 CO 0.00 0.19 0.16 0.00 0.00 0.00 0.00 178.15 178.50 1u0f h ALA 491 N 0.94 1.43 -0.45 1.87 0.00 -1.30 -1.25 119.26 120.51 1u0f h ALA 491 Ca 0.09 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1u0f h ALA 491 Cb 0.20 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 1u0f h ALA 491 CO -0.01 0.43 0.22 1.98 0.00 0.00 0.00 179.25 181.88 1u0f h MET 492 N 0.65 0.43 -0.12 0.00 1.85 -0.86 -0.98 114.93 115.90 1u0f h MET 492 Ca 0.16 -0.03 -0.16 0.00 -0.61 0.00 0.00 59.70 59.06 1u0f h MET 492 Cb 0.17 -0.10 -0.01 0.00 0.43 0.00 0.00 31.60 32.09 1u0f h MET 492 CO -0.01 0.29 -0.62 1.88 -0.40 0.00 0.00 176.91 178.04 1u0f h TYR 493 N 0.45 0.53 -0.51 1.39 -1.99 -1.17 -1.17 116.97 114.51 1u0f h TYR 493 Ca 0.19 -0.21 0.08 0.00 2.00 0.00 0.00 58.73 60.80 1u0f h TYR 493 Cb 0.10 -0.09 -0.07 0.00 2.00 0.00 0.00 36.73 38.67 1u0f h TYR 493 CO -0.10 0.93 0.12 0.93 -0.00 0.00 0.00 178.16 180.04 1u0f h GLU 494 N 0.30 0.26 -0.10 4.88 5.08 -0.86 -1.20 114.58 122.94 1u0f h GLU 494 Ca -0.01 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.19 1u0f h GLU 494 Cb 1.16 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 1u0f h GLU 494 CO 0.11 0.17 -0.59 0.45 -1.00 0.00 0.00 179.01 178.15 1u0f h HIS 495 N 0.27 0.43 -0.19 4.33 3.86 -0.94 -1.90 115.15 121.01 1u0f h HIS 495 Ca 0.25 -0.16 0.05 0.00 -1.16 0.00 0.00 60.37 59.35 1u0f h HIS 495 Cb 0.33 -0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.67 1u0f h HIS 495 CO -0.21 0.84 -0.13 -0.22 0.86 0.00 0.00 177.93 179.06 1u0f h LYS 496 N 0.25 -0.13 -0.63 2.45 3.64 -0.89 -0.82 116.57 120.45 1u0f h LYS 496 Ca -0.00 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1u0f h LYS 496 Cb 1.10 0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 1u0f h LYS 496 CO 0.10 -0.09 0.33 0.82 -2.27 0.00 0.00 179.45 178.34 1u0f h ILE 497 N -0.13 0.95 0.03 2.00 2.04 -1.02 -1.48 117.51 119.90 1u0f h ILE 497 Ca 0.11 -0.21 0.02 0.00 1.00 0.00 0.00 64.86 65.78 1u0f h ILE 497 Cb 0.30 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 36.63 1u0f h ILE 497 CO -0.27 0.11 -0.14 0.15 0.00 0.00 0.00 178.15 178.01 1u0f h PHE 498 N 0.62 -0.35 -0.47 1.37 3.57 -1.00 -1.72 116.94 118.95 1u0f h PHE 498 Ca 0.28 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.82 1u0f h PHE 498 Cb 0.19 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1u0f h PHE 498 CO -0.09 -0.20 0.27 0.28 -2.23 0.00 0.00 178.31 176.34 1u0f h VAL 499 N -0.25 1.03 -0.58 1.41 2.07 -0.78 -1.43 116.25 117.73 1u0f h VAL 499 Ca 0.04 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 1u0f h VAL 499 Cb 0.29 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1u0f h VAL 499 CO -0.11 0.10 0.36 1.56 0.02 0.00 0.00 177.57 179.50 1u0f h GLN 500 N 0.54 0.78 -0.58 1.57 4.20 -1.13 -1.68 115.11 118.80 1u0f h GLN 500 Ca 0.19 -0.06 0.03 0.00 0.06 0.00 0.00 58.65 58.87 1u0f h GLN 500 Cb 0.04 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.61 1u0f h GLN 500 CO -0.10 0.55 0.34 0.78 -0.67 0.00 0.00 178.83 179.73 1u0f h GLY 501 N 0.78 0.83 1.00 3.46 0.00 -0.90 -0.96 103.07 107.28 1u0f h GLY 501 Ca 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 1u0f h GLY 501 CO -0.04 0.20 0.35 -2.22 0.00 0.00 0.00 176.54 174.83 1u0f h ILE 502 N 0.66 1.20 -0.27 2.60 1.08 -0.98 -1.23 117.51 120.58 1u0f h ILE 502 Ca 0.24 -0.51 -0.07 0.00 -0.39 0.00 0.00 64.86 64.13 1u0f h ILE 502 Cb 0.06 0.37 -0.02 0.00 -3.07 0.00 0.00 36.82 34.17 1u0f h ILE 502 CO -0.12 0.22 -0.13 0.24 -0.69 0.00 0.00 178.15 177.67 1u0f h MET 503 N 0.88 0.46 -0.00 2.37 2.86 -0.85 -1.63 114.93 119.01 1u0f h MET 503 Ca 0.23 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1u0f h MET 503 Cb 0.04 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 31.65 1u0f h MET 503 CO -0.04 0.59 -0.04 0.91 1.06 0.00 0.00 176.91 179.40 1u0f n TRP 504 N -4.21 0.00 -2.31 -0.22 8.01 -0.41 -4.47 117.44 113.83 1u0f n TRP 504 Ca 0.00 0.00 -0.17 0.00 -1.31 0.00 0.00 57.50 56.02 1u0f n TRP 504 Cb 0.32 -0.30 -0.01 0.00 -2.01 0.00 0.00 31.31 29.31 1u0f n TRP 504 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1u0f n ASP 505 N -1.26 -5.13 -4.87 -0.99 2.03 -0.54 -4.74 116.55 101.05 1u0f n ASP 505 Ca 0.13 -0.01 -0.22 0.00 0.52 0.00 0.00 54.79 55.22 1u0f n ASP 505 Cb 0.27 -4.21 -0.03 0.00 -0.72 0.00 0.00 41.12 36.42 1u0f n ASP 505 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1u0f s ILE 506 N -2.87 2.51 -0.52 5.18 -4.36 -0.76 -1.19 121.20 119.20 1u0f s ILE 506 Ca 0.00 -1.39 -0.19 0.00 -0.26 0.00 0.00 60.65 58.81 1u0f s ILE 506 Cb 0.00 -2.90 0.07 0.00 1.25 0.00 0.00 42.46 40.88 1u0f s ILE 506 CO 0.00 0.00 0.63 0.21 0.24 0.00 0.00 174.94 176.02 1u0f s ASN 507 N -4.13 6.21 0.00 4.36 3.84 -1.26 -4.52 114.94 119.44 1u0f s ASN 507 Ca 0.46 -1.01 0.17 0.00 0.21 0.00 0.00 52.86 52.69 1u0f s ASN 507 Cb -0.02 -2.29 0.85 0.00 -0.55 0.00 0.00 41.25 39.24 1u0f s ASN 507 CO 0.27 -0.92 1.48 -1.20 -2.79 0.00 0.00 177.10 173.94 1u0f n SER 508 N 6.17 0.00 -0.12 -4.21 7.64 -1.26 -3.87 113.62 117.97 1u0f n SER 508 Ca -0.07 -0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.82 1u0f n SER 508 Cb 0.45 -0.26 0.01 0.00 -1.01 0.00 0.00 64.21 63.40 1u0f n SER 508 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1u0f n PHE 509 N -1.26 0.00 -3.50 1.43 3.01 -1.26 -4.36 117.46 111.52 1u0f n PHE 509 Ca 0.08 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.31 1u0f n PHE 509 Cb 0.13 0.00 0.03 0.00 -0.01 0.00 0.00 39.48 39.63 1u0f n PHE 509 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1u0f n ASP 510 N 0.03 2.49 -2.73 4.37 5.68 -1.25 -4.97 116.55 120.16 1u0f n ASP 510 Ca 0.02 -2.75 -0.09 0.00 -0.50 0.00 0.00 54.79 51.47 1u0f n ASP 510 Cb 0.08 -0.22 0.08 0.00 -1.14 0.00 0.00 41.12 39.93 1u0f n ASP 510 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1u0f n GLN 511 N -2.02 0.94 0.21 0.11 0.00 -1.26 -4.78 117.38 110.58 1u0f n GLN 511 Ca 0.06 -1.84 0.15 0.00 0.00 0.00 0.00 57.00 55.37 1u0f n GLN 511 Cb 0.62 -1.08 0.63 0.00 0.00 0.00 0.00 30.24 30.42 1u0f n GLN 511 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.06 175.57 1u0f h TRP 512 N 3.16 0.00 0.00 2.61 4.06 -1.99 -3.20 115.95 120.59 1u0f h TRP 512 Ca -0.12 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.83 1u0f h TRP 512 Cb 1.09 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.25 1u0f h TRP 512 CO 0.25 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.54 1u0f n GLY 513 N -0.11 -1.06 0.08 1.49 0.00 -1.26 -2.44 105.19 101.89 1u0f n GLY 513 Ca 0.01 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.05 1u0f n GLY 513 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1u0f n VAL 514 N -1.34 0.00 -0.06 1.61 0.24 -1.21 -4.57 118.33 113.01 1u0f n VAL 514 Ca 0.09 -0.04 -0.13 0.00 -2.04 0.00 0.00 64.34 62.22 1u0f n VAL 514 Cb 0.19 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 32.95 1u0f n VAL 514 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 1u0f h GLU 515 N 0.40 0.39 -0.57 7.34 4.81 -1.72 -3.27 114.58 121.97 1u0f h GLU 515 Ca 0.00 -0.20 0.02 0.00 -0.13 0.00 0.00 59.36 59.05 1u0f h GLU 515 Cb 0.52 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 1u0f h GLU 515 CO 0.00 0.76 0.34 1.25 -0.73 0.00 0.00 179.01 180.63 1u0f h LEU 516 N 0.04 0.56 -1.20 1.64 5.85 -1.80 -2.10 115.31 118.30 1u0f h LEU 516 Ca 0.03 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1u0f h LEU 516 Cb 0.68 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1u0f h LEU 516 CO 0.04 0.39 0.55 1.23 -0.34 0.00 0.00 178.44 180.31 1u0f h GLY 517 N 0.68 1.17 1.02 3.75 0.00 -1.87 -1.06 103.07 106.76 1u0f h GLY 517 Ca 0.23 -0.42 -0.07 0.00 0.00 0.00 0.00 47.33 47.06 1u0f h GLY 517 CO -0.10 0.40 0.07 0.50 0.00 0.00 0.00 176.54 177.42 1u0f h LYS 518 N 1.09 0.94 -0.25 4.80 1.57 -1.46 -2.04 116.57 121.23 1u0f h LYS 518 Ca 0.31 -0.26 -0.03 0.00 -1.87 0.00 0.00 60.65 58.80 1u0f h LYS 518 Cb -0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1u0f h LYS 518 CO -0.08 0.91 0.06 1.96 -0.57 0.00 0.00 179.45 181.73 1u0f h GLN 519 N 0.83 0.40 0.00 3.15 4.20 -0.83 -2.61 115.11 120.25 1u0f h GLN 519 Ca 0.17 -0.10 -0.08 0.00 0.06 0.00 0.00 58.65 58.70 1u0f h GLN 519 Cb 0.44 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1u0f h GLN 519 CO 0.01 0.51 -0.39 -0.07 -0.67 0.00 0.00 178.83 178.22 1u0f h LEU 520 N 0.23 0.00 -0.40 1.46 3.38 -1.18 -2.88 115.31 115.92 1u0f h LEU 520 Ca 0.08 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 1u0f h LEU 520 Cb 0.29 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1u0f h LEU 520 CO 0.00 0.39 -0.39 0.00 0.09 0.00 0.00 178.44 178.53 1u0f h ALA 521 N 1.61 0.58 0.00 1.53 0.00 -1.22 -2.67 119.26 119.08 1u0f h ALA 521 Ca -0.00 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 1u0f h ALA 521 Cb 0.79 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1u0f h ALA 521 CO 0.05 0.68 -0.12 0.87 0.00 0.00 0.00 179.25 180.73 1u0f h LYS 522 N 0.76 0.00 0.02 0.00 1.57 -1.26 -1.82 116.57 115.85 1u0f h LYS 522 Ca 0.06 0.00 -0.24 0.00 -1.87 0.00 0.00 60.65 58.60 1u0f h LYS 522 Cb 0.98 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.30 1u0f h LYS 522 CO 0.10 0.12 -0.99 0.87 -0.57 0.00 0.00 179.45 178.98 1u0f h LYS 523 N 0.00 0.44 0.00 3.15 1.57 -1.36 -3.32 116.57 117.06 1u0f h LYS 523 Ca -0.00 -0.49 -0.19 0.00 -1.87 0.00 0.00 60.65 58.10 1u0f h LYS 523 Cb 0.23 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1u0f h LYS 523 CO 0.02 1.15 -0.86 0.82 -0.57 0.00 0.00 179.45 180.00 1u0f h ILE 524 N 0.24 1.56 -0.40 1.86 2.04 -1.11 -3.38 117.51 118.32 1u0f h ILE 524 Ca -0.09 -2.79 0.07 0.00 1.00 0.00 0.00 64.86 63.05 1u0f h ILE 524 Cb 1.64 2.53 -0.09 0.00 -0.74 0.00 0.00 36.82 40.16 1u0f h ILE 524 CO 0.17 0.80 -0.38 -0.33 0.00 0.00 0.00 178.15 178.41 1u0f h GLU 525 N 0.04 -0.29 0.00 2.37 5.08 -1.44 -0.73 114.58 119.61 1u0f h GLU 525 Ca -0.02 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 1u0f h GLU 525 Cb 1.50 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.81 1u0f h GLU 525 CO 0.12 -0.19 -0.20 -1.35 -1.00 0.00 0.00 179.01 176.39 1u0f h PRO 526 N -0.30 0.00 0.00 2.33 0.11 -1.78 -2.86 132.00 129.50 1u0f h PRO 526 Ca 0.15 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.23 1u0f h PRO 526 Cb 0.57 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 1u0f h PRO 526 CO -0.56 0.20 -0.14 0.93 -0.21 0.00 0.00 178.00 178.22 1u0f h GLU 527 N 0.00 0.00 0.00 1.05 5.08 -1.31 -2.68 114.58 116.72 1u0f h GLU 527 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1u0f h GLU 527 Cb 0.44 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 1u0f h GLU 527 CO 0.03 0.14 -0.29 -0.07 -1.00 0.00 0.00 179.01 177.81 1u0f h LEU 528 N 0.00 0.00 -9.70 1.33 3.38 -1.24 -3.44 115.31 105.63 1u0f h LEU 528 Ca -0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 1u0f h LEU 528 Cb 0.70 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.47 1u0f h LEU 528 CO 0.02 0.29 0.56 -1.61 0.09 0.00 0.00 178.44 177.79 1u0f s GLU 529 N -3.55 4.49 0.00 1.13 2.02 -1.01 -4.85 118.70 116.93 1u0f s GLU 529 Ca 0.01 1.91 0.00 0.00 0.02 0.00 0.00 54.97 56.91 1u0f s GLU 529 Cb 0.10 -3.22 0.00 0.00 0.10 0.00 0.00 34.13 31.11 1u0f s GLU 529 CO 0.66 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 176.28 1u0f n GLY 530 N 2.00 -1.00 0.78 -1.39 0.00 -1.26 -4.77 105.19 99.55 1u0f n GLY 530 Ca 0.04 -1.65 0.09 0.00 0.00 0.00 0.00 46.02 44.49 1u0f n GLY 530 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u0f n SER 531 N -1.49 2.72 -4.77 1.61 3.41 -1.26 -4.99 113.62 108.85 1u0f n SER 531 Ca 0.00 -1.80 -0.38 0.00 -0.26 0.00 0.00 58.87 56.43 1u0f n SER 531 Cb 0.00 -0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 63.84 1u0f n SER 531 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1u0f s SER 532 N -1.35 6.31 0.45 4.04 1.04 -1.26 -5.00 113.70 117.93 1u0f s SER 532 Ca 0.25 2.33 -0.24 0.00 0.48 0.00 0.00 55.95 58.76 1u0f s SER 532 Cb 0.16 -2.61 -0.08 0.00 0.10 0.00 0.00 66.02 63.60 1u0f s SER 532 CO 0.23 -0.82 1.26 0.00 0.98 0.00 0.00 173.24 174.89 1u0f s ALA 533 N -1.49 3.08 -0.16 5.32 0.00 -1.26 -5.03 121.76 122.22 1u0f s ALA 533 Ca 0.61 1.15 -0.07 0.00 0.00 0.00 0.00 51.96 53.64 1u0f s ALA 533 Cb -0.30 -3.46 -0.04 0.00 0.00 0.00 0.00 23.12 19.32 1u0f s ALA 533 CO 0.36 -0.86 0.08 0.08 0.00 0.00 0.00 175.76 175.42 1u0f s VAL 534 N -1.36 4.96 0.00 0.00 1.01 -1.26 -4.97 120.40 118.78 1u0f s VAL 534 Ca 0.62 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.62 1u0f s VAL 534 Cb -0.35 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1u0f s VAL 534 CO 0.44 0.50 0.42 0.35 0.00 0.00 0.00 175.10 176.81 1u0f n THR 535 N 3.09 0.14 1.04 3.92 -2.24 -1.26 -4.74 114.28 114.23 1u0f n THR 535 Ca -0.17 -0.38 0.14 0.00 -2.27 0.00 0.00 64.05 61.37 1u0f n THR 535 Cb 0.53 1.23 0.63 0.00 -2.10 0.00 0.00 70.33 70.61 1u0f n THR 535 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1u0f n SER 536 N -0.07 0.00 -3.20 3.42 3.41 -1.26 -4.88 113.62 111.04 1u0f n SER 536 Ca 0.00 0.42 -0.12 0.00 -0.26 0.00 0.00 58.87 58.91 1u0f n SER 536 Cb 0.16 -0.47 -0.01 0.00 -0.26 0.00 0.00 64.21 63.63 1u0f n SER 536 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1u0f n HIS 537 N -1.47 -0.68 -0.60 7.33 8.25 -1.26 -5.12 115.22 121.67 1u0f n HIS 537 Ca 0.08 -1.02 -0.30 0.00 -0.26 0.00 0.00 57.72 56.22 1u0f n HIS 537 Cb 0.32 -0.18 0.20 0.00 1.12 0.00 0.00 29.99 31.45 1u0f n HIS 537 CO 0.00 0.00 0.00 -0.40 0.64 0.00 0.00 176.34 176.58 1u0f n ASP 538 N -1.72 -0.47 0.24 0.41 5.68 -1.26 -4.75 116.55 114.68 1u0f n ASP 538 Ca -0.03 0.21 0.09 0.00 -0.50 0.00 0.00 54.79 54.56 1u0f n ASP 538 Cb 0.27 -1.39 0.60 0.00 -1.14 0.00 0.00 41.12 39.46 1u0f n ASP 538 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1u0f h SER 539 N -2.19 0.00 0.37 -1.12 4.64 -1.98 -1.73 113.55 111.54 1u0f h SER 539 Ca -0.50 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.80 1u0f h SER 539 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1u0f h SER 539 CO 0.44 0.19 -0.18 -1.28 -0.87 0.00 0.00 176.83 175.13 1u0f h SER 540 N 0.00 -0.42 -0.59 4.97 0.87 -1.98 -0.44 113.55 115.96 1u0f h SER 540 Ca -0.00 -0.14 0.09 0.00 -1.23 0.00 0.00 61.79 60.51 1u0f h SER 540 Cb 0.43 0.11 -0.07 0.00 -0.44 0.00 0.00 62.40 62.43 1u0f h SER 540 CO 0.02 -0.03 0.20 0.74 -0.53 0.00 0.00 176.83 177.24 1u0f h THR 541 N -0.88 0.75 -0.77 2.23 2.02 -1.90 0.12 112.91 114.47 1u0f h THR 541 Ca -0.05 -0.13 0.02 0.00 0.77 0.00 0.00 66.41 67.02 1u0f h THR 541 Cb 0.54 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 1u0f h THR 541 CO 0.08 0.07 0.50 0.78 0.37 0.00 0.00 175.52 177.33 1u0f h ASN 542 N 0.37 0.86 -0.03 4.18 -0.26 -1.35 -1.65 115.58 117.70 1u0f h ASN 542 Ca 0.30 -0.01 -0.16 0.00 -0.56 0.00 0.00 56.30 55.86 1u0f h ASN 542 Cb 0.38 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.43 1u0f h ASN 542 CO -0.31 0.61 -0.54 1.23 -1.06 0.00 0.00 177.43 177.36 1u0f h GLY 543 N 1.01 0.67 1.07 2.83 0.00 -0.06 -1.41 103.07 107.18 1u0f h GLY 543 Ca 0.29 -0.77 -0.11 0.00 0.00 0.00 0.00 47.33 46.75 1u0f h GLY 543 CO -0.08 0.69 -0.11 1.41 0.00 0.00 0.00 176.54 178.45 1u0f h LEU 544 N 0.47 0.97 -0.75 3.11 3.38 -0.67 -1.61 115.31 120.21 1u0f h LEU 544 Ca 0.01 -0.35 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 1u0f h LEU 544 Cb 1.09 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.54 1u0f h LEU 544 CO 0.10 1.10 0.39 0.40 0.09 0.00 0.00 178.44 180.52 1u0f h ILE 545 N 0.83 1.23 -0.44 1.22 2.04 -1.16 -1.34 117.51 119.90 1u0f h ILE 545 Ca 0.13 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.39 1u0f h ILE 545 Cb 0.66 0.26 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1u0f h ILE 545 CO 0.05 0.27 0.26 0.28 0.00 0.00 0.00 178.15 179.00 1u0f h SER 546 N 1.05 0.42 -0.39 1.72 0.02 -1.04 -0.72 113.55 114.60 1u0f h SER 546 Ca 0.26 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.24 1u0f h SER 546 Cb 0.08 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 1u0f h SER 546 CO -0.04 0.30 0.21 0.15 -1.14 0.00 0.00 176.83 176.30 1u0f h PHE 547 N 0.52 0.38 -0.33 3.45 3.57 -1.11 -0.18 116.94 123.24 1u0f h PHE 547 Ca 0.17 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.71 1u0f h PHE 547 Cb 0.01 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.61 1u0f h PHE 547 CO -0.07 0.21 0.18 0.82 -2.23 0.00 0.00 178.31 177.21 1u0f h ILE 548 N 0.42 1.01 -0.52 1.41 2.04 -0.79 0.16 117.51 121.23 1u0f h ILE 548 Ca 0.16 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.82 1u0f h ILE 548 Cb 0.06 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.73 1u0f h ILE 548 CO -0.10 0.07 0.00 0.11 0.00 0.00 0.00 178.15 178.22 1u0f h LYS 549 N 0.36 0.89 -0.43 2.37 1.57 -0.88 -1.22 116.57 119.23 1u0f h LYS 549 Ca 0.13 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.53 1u0f h LYS 549 Cb 0.03 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1u0f h LYS 549 CO -0.08 0.88 -0.25 0.37 -0.57 0.00 0.00 179.45 179.81 1u0f h GLN 550 N 0.82 0.90 0.00 3.15 -0.00 -0.71 -3.27 115.11 116.01 1u0f h GLN 550 Ca 0.16 -0.39 0.00 0.00 -0.00 0.00 0.00 58.65 58.41 1u0f h GLN 550 Cb 0.49 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 27.94 1u0f h GLN 550 CO 0.02 1.05 -0.60 1.04 0.00 0.00 0.00 178.83 180.34 1u0f n GLN 551 N -4.10 0.08 -0.32 1.69 1.13 0.02 -4.38 117.38 111.49 1u0f n GLN 551 Ca -0.00 0.01 0.18 0.00 -1.94 0.00 0.00 57.00 55.25 1u0f n GLN 551 Cb 0.46 -1.54 0.36 0.00 0.11 0.00 0.00 30.24 29.63 1u0f n GLN 551 CO 0.00 0.00 0.00 -0.09 -1.44 0.00 0.00 177.06 175.53 1u0f h ARG 552 N 0.00 0.08 0.00 -1.09 2.43 -1.28 -3.09 114.38 111.43 1u0f h ARG 552 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1u0f h ARG 552 Cb 0.56 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1u0f h ARG 552 CO 0.00 0.05 -0.01 -0.25 -1.51 0.00 0.00 179.97 178.26 1u0f n ASP 553 N -5.35 2.09 -4.64 -3.80 8.00 -1.26 -4.98 116.55 106.61 1u0f n ASP 553 Ca 0.26 -2.43 -0.43 0.00 0.71 0.00 0.00 54.79 52.90 1u0f n ASP 553 Cb 0.85 -0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.75 1u0f n ASP 553 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1u0f s THR 554 N -1.74 3.57 -0.80 -3.53 -4.23 -1.17 -4.94 115.64 102.80 1u0f s THR 554 Ca 0.13 0.67 -0.23 0.00 -1.18 0.00 0.00 61.69 61.08 1u0f s THR 554 Cb 0.11 -3.52 0.07 0.00 1.34 0.00 0.00 72.50 70.50 1u0f s THR 554 CO 0.01 -0.16 1.18 -0.54 -0.54 0.00 0.00 174.62 174.57 1u0f s LYS 555 N 4.51 3.31 0.00 3.99 3.01 -1.26 -5.12 119.74 128.18 1u0f s LYS 555 Ca 0.75 -0.90 0.17 0.00 -1.01 0.00 0.00 55.97 54.99 1u0f s LYS 555 Cb -0.30 -4.56 1.04 0.00 -1.01 0.00 0.00 37.83 33.00 1u0f s LYS 555 CO 0.30 -1.98 1.44 1.28 0.51 0.00 0.00 175.35 176.91