#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oqe s PRO 18 N 0.00 3.08 0.35 0.00 0.04 -1.26 -4.97 135.00 132.23 2oqe s PRO 18 Ca 0.00 1.48 -0.28 0.00 0.04 0.00 0.00 61.00 62.23 2oqe s PRO 18 Cb 0.00 -1.98 -0.11 0.00 0.04 0.00 0.00 34.50 32.45 2oqe s PRO 18 CO 0.00 -1.04 1.37 0.00 0.04 0.00 0.00 177.00 177.37 2oqe s ALA 19 N -2.10 3.53 0.66 8.56 0.00 -1.26 -4.92 121.76 126.23 2oqe s ALA 19 Ca 0.69 1.37 -0.18 0.00 0.00 0.00 0.00 51.96 53.85 2oqe s ALA 19 Cb -0.22 -3.53 -0.00 0.00 0.00 0.00 0.00 23.12 19.37 2oqe s ALA 19 CO 0.35 -0.79 1.29 0.54 0.00 0.00 0.00 175.76 177.15 2oqe n ARG 20 N 0.70 1.05 -1.65 0.00 1.74 -1.26 -4.96 116.66 112.28 2oqe n ARG 20 Ca 0.00 0.42 -0.29 0.00 -0.77 0.00 0.00 57.85 57.21 2oqe n ARG 20 Cb 0.41 -2.53 0.10 0.00 -1.02 0.00 0.00 32.46 29.42 2oqe n ARG 20 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2oqe s PRO 21 N -3.42 1.92 0.53 5.56 0.04 -1.26 -4.95 135.00 133.42 2oqe s PRO 21 Ca 0.82 0.43 0.18 0.00 0.04 0.00 0.00 61.00 62.47 2oqe s PRO 21 Cb -0.37 -1.92 1.32 0.00 0.04 0.00 0.00 34.50 33.57 2oqe s PRO 21 CO 0.41 -1.69 2.15 0.00 0.04 0.00 0.00 177.00 177.91 2oqe h ALA 22 N -1.13 2.00 -3.06 8.56 0.00 -1.99 -3.44 119.26 120.19 2oqe h ALA 22 Ca -0.48 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.27 2oqe h ALA 22 Cb 1.29 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.82 2oqe h ALA 22 CO 0.62 -0.04 -0.41 -1.58 0.00 0.00 0.00 179.25 177.83 2oqe s HIS 23 N -5.03 -0.31 0.66 0.00 5.65 -1.26 -5.05 115.29 109.94 2oqe s HIS 23 Ca -0.05 0.75 0.41 0.00 0.25 0.00 0.00 55.06 56.41 2oqe s HIS 23 Cb 0.17 0.10 2.24 0.00 -1.18 0.00 0.00 32.58 33.91 2oqe s HIS 23 CO 0.66 -0.16 2.28 -1.35 -0.65 0.00 0.00 174.74 175.53 2oqe h PRO 24 N 6.01 0.00 -0.04 2.88 0.11 -1.97 -1.80 132.00 137.20 2oqe h PRO 24 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2oqe h PRO 24 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2oqe h PRO 24 CO 0.34 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.41 2oqe n LEU 25 N -3.13 2.75 -4.77 2.35 4.77 -1.26 -4.73 117.00 112.98 2oqe n LEU 25 Ca -0.03 -0.93 -0.41 0.00 -0.03 0.00 0.00 56.01 54.62 2oqe n LEU 25 Cb 0.13 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 2oqe n LEU 25 CO 0.20 0.46 1.18 -1.81 -1.33 0.00 0.00 177.39 176.09 2oqe s ASP 26 N -1.99 6.33 0.84 -1.43 1.01 -0.68 -4.81 116.67 115.95 2oqe s ASP 26 Ca 0.30 3.04 -0.12 0.00 0.71 0.00 0.00 52.55 56.48 2oqe s ASP 26 Cb 0.20 -2.66 0.10 0.00 1.01 0.00 0.00 42.92 41.58 2oqe s ASP 26 CO 0.31 -0.90 1.16 -2.84 0.21 0.00 0.00 175.17 173.11 2oqe s PRO 27 N -1.55 1.47 0.26 8.23 0.02 -1.26 -4.91 135.00 137.25 2oqe s PRO 27 Ca 0.57 1.59 -0.31 0.00 0.02 0.00 0.00 61.00 62.87 2oqe s PRO 27 Cb -0.47 -1.77 -0.13 0.00 0.02 0.00 0.00 34.50 32.15 2oqe s PRO 27 CO 0.58 -2.31 1.46 1.28 -0.33 0.00 0.00 177.00 177.69 2oqe n LEU 28 N -3.70 3.49 -4.79 -5.54 4.77 -1.26 -5.00 117.00 104.97 2oqe n LEU 28 Ca 0.12 1.14 -0.30 0.00 -0.03 0.00 0.00 56.01 56.95 2oqe n LEU 28 Cb 0.51 -1.48 0.11 0.00 -2.33 0.00 0.00 43.42 40.24 2oqe n LEU 28 CO 0.49 -0.30 0.71 -0.94 -1.33 0.00 0.00 177.39 176.02 2oqe s SER 29 N 0.34 4.06 0.29 -1.43 1.04 -1.26 -4.78 113.70 111.96 2oqe s SER 29 Ca 0.67 1.22 -0.01 0.00 0.48 0.00 0.00 55.95 58.30 2oqe s SER 29 Cb -0.60 -1.90 0.47 0.00 0.10 0.00 0.00 66.02 64.09 2oqe s SER 29 CO 0.50 -2.23 1.91 0.71 0.98 0.00 0.00 173.24 175.11 2oqe h THR 30 N -1.27 1.11 -0.76 2.02 1.35 -1.94 -0.06 112.91 113.34 2oqe h THR 30 Ca -0.48 -0.38 -0.05 0.00 -0.55 0.00 0.00 66.41 64.94 2oqe h THR 30 Cb 1.29 -0.10 -0.03 0.00 -1.73 0.00 0.00 68.15 67.58 2oqe h THR 30 CO 0.60 0.20 0.27 0.00 -0.25 0.00 0.00 175.52 176.34 2oqe h ALA 31 N 1.48 1.04 -0.38 6.62 0.00 -1.99 -1.16 119.26 124.87 2oqe h ALA 31 Ca 0.39 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.94 2oqe h ALA 31 Cb 0.12 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2oqe h ALA 31 CO -0.14 0.66 -0.35 0.93 0.00 0.00 0.00 179.25 180.36 2oqe h GLU 32 N 1.12 0.87 0.10 0.00 5.08 -1.73 -1.10 114.58 118.92 2oqe h GLU 32 Ca 0.25 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.18 2oqe h GLU 32 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 2oqe h GLU 32 CO -0.01 1.08 -0.05 0.82 -1.00 0.00 0.00 179.01 179.84 2oqe h ILE 33 N 0.72 0.97 -0.73 3.13 2.04 -0.84 -0.41 117.51 122.39 2oqe h ILE 33 Ca 0.07 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.76 2oqe h ILE 33 Cb 0.92 1.11 -0.06 0.00 -0.74 0.00 0.00 36.82 38.05 2oqe h ILE 33 CO 0.08 0.06 0.43 0.50 0.00 0.00 0.00 178.15 179.22 2oqe h LYS 34 N -0.23 0.77 -0.79 2.37 1.63 -1.19 -1.02 116.57 118.10 2oqe h LYS 34 Ca -0.01 -0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.69 2oqe h LYS 34 Cb 0.19 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 2oqe h LYS 34 CO 0.02 0.51 0.31 0.00 -3.45 0.00 0.00 179.45 176.84 2oqe h ALA 35 N 1.36 1.03 -0.35 5.00 0.00 -0.99 -0.50 119.26 124.81 2oqe h ALA 35 Ca 0.32 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2oqe h ALA 35 Cb 0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2oqe h ALA 35 CO -0.17 0.66 -0.05 0.00 0.00 0.00 0.00 179.25 179.69 2oqe h ALA 36 N 1.17 0.48 -0.24 0.00 0.00 -0.66 -1.90 119.26 118.10 2oqe h ALA 36 Ca 0.26 -0.28 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 2oqe h ALA 36 Cb 0.23 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2oqe h ALA 36 CO -0.02 0.30 -0.43 1.79 0.00 0.00 0.00 179.25 180.88 2oqe h THR 37 N 0.45 1.30 -0.68 0.00 1.35 -1.03 -1.75 112.91 112.56 2oqe h THR 37 Ca 0.09 -1.62 0.05 0.00 -0.55 0.00 0.00 66.41 64.38 2oqe h THR 37 Cb 0.54 1.59 -0.05 0.00 -1.73 0.00 0.00 68.15 68.50 2oqe h THR 37 CO 0.03 0.51 0.40 0.78 -0.25 0.00 0.00 175.52 176.99 2oqe h ASN 38 N 0.48 0.61 -0.45 5.36 2.35 -1.06 -0.04 115.58 122.84 2oqe h ASN 38 Ca 0.03 0.02 -0.05 0.00 -0.55 0.00 0.00 56.30 55.76 2oqe h ASN 38 Cb 0.95 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 39.20 2oqe h ASN 38 CO 0.09 0.41 0.09 0.74 -1.65 0.00 0.00 177.43 177.10 2oqe h THR 39 N 0.75 1.24 -0.13 2.81 2.02 -1.03 -2.22 112.91 116.35 2oqe h THR 39 Ca 0.29 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 2oqe h THR 39 Cb 0.13 0.94 -0.00 0.00 -1.74 0.00 0.00 68.15 67.47 2oqe h THR 39 CO -0.16 0.30 -0.04 0.58 0.37 0.00 0.00 175.52 176.57 2oqe h VAL 40 N 0.59 1.30 -0.85 3.16 2.07 -1.17 -1.77 116.25 119.59 2oqe h VAL 40 Ca 0.14 -1.02 0.20 0.00 0.82 0.00 0.00 66.70 66.84 2oqe h VAL 40 Cb 0.35 1.71 -0.12 0.00 -1.52 0.00 0.00 31.29 31.71 2oqe h VAL 40 CO 0.00 0.29 0.31 0.11 0.02 0.00 0.00 177.57 178.31 2oqe h LYS 41 N -0.07 0.33 -0.02 1.57 1.57 -0.96 -1.14 116.57 117.86 2oqe h LYS 41 Ca 0.03 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.61 2oqe h LYS 41 Cb 0.48 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 2oqe h LYS 41 CO 0.01 0.22 -0.81 0.77 -0.57 0.00 0.00 179.45 179.07 2oqe h SER 42 N 0.34 0.26 -0.31 0.86 0.02 -1.28 -3.14 113.55 110.31 2oqe h SER 42 Ca 0.52 -0.20 -0.10 0.00 -0.84 0.00 0.00 61.79 61.17 2oqe h SER 42 Cb 0.96 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.41 2oqe h SER 42 CO -0.54 0.96 -0.14 0.22 -1.14 0.00 0.00 176.83 176.19 2oqe h TYR 43 N 0.13 0.83 -1.97 3.45 3.20 -0.40 -2.75 116.97 119.47 2oqe h TYR 43 Ca -0.03 -0.16 -0.77 0.00 3.14 0.00 0.00 58.73 60.91 2oqe h TYR 43 Cb 1.41 -0.21 -0.27 0.00 1.54 0.00 0.00 36.73 39.20 2oqe h TYR 43 CO 0.03 0.85 1.06 1.19 -1.64 0.00 0.00 178.16 179.65 2oqe n PHE 44 N -4.15 2.99 -1.68 -3.82 3.72 -0.52 -5.01 117.46 108.99 2oqe n PHE 44 Ca 0.01 -2.34 -0.45 0.00 -0.05 0.00 0.00 57.45 54.61 2oqe n PHE 44 Cb 0.38 -1.20 -0.04 0.00 -0.94 0.00 0.00 39.48 37.68 2oqe n PHE 44 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oqe n ALA 45 N -0.55 1.58 -0.50 4.37 0.00 -1.04 -1.65 120.51 122.73 2oqe n ALA 45 Ca 0.54 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.38 2oqe n ALA 45 Cb 0.24 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.27 2oqe n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oqe n GLY 46 N 3.74 1.28 3.84 0.00 0.00 -1.26 -5.03 105.19 107.75 2oqe n GLY 46 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 2oqe n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oqe s LYS 47 N -0.27 3.30 -0.72 1.61 1.02 -0.66 -5.05 119.74 118.97 2oqe s LYS 47 Ca 0.00 -0.29 -0.23 0.00 0.02 0.00 0.00 55.97 55.47 2oqe s LYS 47 Cb 0.00 -3.04 0.07 0.00 -0.52 0.00 0.00 37.83 34.34 2oqe s LYS 47 CO 0.00 0.71 1.05 0.21 -0.92 0.00 0.00 175.35 176.40 2oqe s LYS 48 N -1.40 3.20 0.15 1.68 2.20 -1.26 -5.01 119.74 119.30 2oqe s LYS 48 Ca 0.20 -0.88 0.10 0.00 -0.36 0.00 0.00 55.97 55.03 2oqe s LYS 48 Cb -0.12 -4.35 -0.04 0.00 -1.51 0.00 0.00 37.83 31.80 2oqe s LYS 48 CO 0.10 -1.88 -0.21 0.96 -0.36 0.00 0.00 175.35 173.97 2oqe s ILE 49 N 4.17 2.62 0.09 5.43 -4.36 -1.26 -2.11 121.20 125.78 2oqe s ILE 49 Ca 0.26 -1.73 0.06 0.00 -0.26 0.00 0.00 60.65 58.99 2oqe s ILE 49 Cb -0.14 -2.22 -0.03 0.00 1.25 0.00 0.00 42.46 41.32 2oqe s ILE 49 CO 0.08 0.01 -0.16 -0.94 0.24 0.00 0.00 174.94 174.17 2oqe s SER 50 N -2.35 1.96 -0.21 4.36 1.04 0.05 -4.98 113.70 113.57 2oqe s SER 50 Ca 0.19 -0.69 -0.11 0.00 0.48 0.00 0.00 55.95 55.81 2oqe s SER 50 Cb -0.09 -0.08 -0.05 0.00 0.10 0.00 0.00 66.02 65.90 2oqe s SER 50 CO 0.10 -0.07 0.19 -0.36 0.98 0.00 0.00 173.24 174.08 2oqe s PHE 51 N -1.50 3.38 -0.25 5.02 0.08 0.33 -1.11 117.98 123.92 2oqe s PHE 51 Ca 0.03 0.36 -0.03 0.00 0.12 0.00 0.00 56.93 57.41 2oqe s PHE 51 Cb -0.09 -2.27 -0.15 0.00 -0.57 0.00 0.00 43.02 39.95 2oqe s PHE 51 CO 0.03 0.16 -0.26 -1.71 -0.10 0.00 0.00 175.22 173.34 2oqe n ASN 52 N 3.92 2.01 -3.74 1.36 2.85 0.13 -3.75 115.26 118.04 2oqe n ASN 52 Ca -0.14 0.02 -0.13 0.00 -0.11 0.00 0.00 54.58 54.21 2oqe n ASN 52 Cb 0.52 -0.52 -0.14 0.00 1.24 0.00 0.00 39.78 40.88 2oqe n ASN 52 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 2oqe s THR 53 N -2.49 -0.05 -0.19 -0.44 2.01 -1.01 -4.89 115.64 108.58 2oqe s THR 53 Ca -0.35 0.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.81 2oqe s THR 53 Cb 0.10 -0.28 0.06 0.00 0.01 0.00 0.00 72.50 72.39 2oqe s THR 53 CO 0.54 0.07 0.01 -0.69 -0.69 0.00 0.00 174.62 173.86 2oqe s VAL 54 N 1.20 0.74 0.07 3.82 1.01 -1.26 -1.15 120.40 124.83 2oqe s VAL 54 Ca -0.09 -0.63 -0.06 0.00 0.00 0.00 0.00 61.98 61.20 2oqe s VAL 54 Cb -0.11 -1.15 -0.01 0.00 0.00 0.00 0.00 36.38 35.10 2oqe s VAL 54 CO -0.07 -0.12 0.12 0.28 0.00 0.00 0.00 175.10 175.31 2oqe s THR 55 N 1.77 0.17 0.24 3.92 -1.32 -0.24 -4.50 115.64 115.67 2oqe s THR 55 Ca -0.01 -1.36 -0.31 0.00 -1.21 0.00 0.00 61.69 58.79 2oqe s THR 55 Cb -0.17 -1.37 -0.12 0.00 -1.51 0.00 0.00 72.50 69.33 2oqe s THR 55 CO -0.07 -0.75 1.65 -0.11 -2.21 0.00 0.00 174.62 173.12 2oqe n LEU 56 N 0.04 4.02 -4.53 9.08 7.94 -1.26 0.03 117.00 132.31 2oqe n LEU 56 Ca -0.15 1.10 -0.43 0.00 -1.11 0.00 0.00 56.01 55.42 2oqe n LEU 56 Cb 0.62 -1.56 -0.06 0.00 0.53 0.00 0.00 43.42 42.94 2oqe n LEU 56 CO 0.24 0.10 0.45 -0.60 -1.11 0.00 0.00 177.39 176.47 2oqe s ARG 57 N 0.42 3.36 0.49 1.96 6.06 -0.47 -4.68 118.95 126.10 2oqe s ARG 57 Ca 0.71 -0.24 -0.23 0.00 -2.50 0.00 0.00 55.73 53.47 2oqe s ARG 57 Cb -0.52 -3.93 -0.06 0.00 0.06 0.00 0.00 34.95 30.49 2oqe s ARG 57 CO 0.40 -1.02 1.27 -1.21 -2.50 0.00 0.00 175.30 172.23 2oqe s GLU 58 N 2.98 3.50 0.84 5.12 2.02 -1.26 -4.42 118.70 127.47 2oqe s GLU 58 Ca 0.25 2.02 -0.12 0.00 0.02 0.00 0.00 54.97 57.14 2oqe s GLU 58 Cb -0.13 -2.37 0.10 0.00 0.10 0.00 0.00 34.13 31.82 2oqe s GLU 58 CO 0.20 -0.84 1.19 -2.14 0.02 0.00 0.00 175.26 173.69 2oqe s PRO 59 N -2.75 1.46 0.39 0.39 0.02 -1.26 -4.95 135.00 128.30 2oqe s PRO 59 Ca 0.67 1.71 -0.27 0.00 0.02 0.00 0.00 61.00 63.12 2oqe s PRO 59 Cb -0.35 -1.76 -0.11 0.00 0.02 0.00 0.00 34.50 32.31 2oqe s PRO 59 CO 0.42 -2.34 1.41 0.00 -0.33 0.00 0.00 177.00 176.16 2oqe n ALA 60 N -3.56 1.96 -0.06 -1.55 0.00 -1.26 -4.80 120.51 111.23 2oqe n ALA 60 Ca 0.13 0.31 -0.07 0.00 0.00 0.00 0.00 53.44 53.81 2oqe n ALA 60 Cb 0.51 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.58 2oqe n ALA 60 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2oqe h ARG 61 N 2.61 -0.00 0.04 0.00 2.43 -1.98 0.16 114.38 117.63 2oqe h ARG 61 Ca -0.50 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 58.67 2oqe h ARG 61 Cb 1.26 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.81 2oqe h ARG 61 CO 0.62 -0.00 -0.02 -0.22 -1.51 0.00 0.00 179.97 178.84 2oqe h LYS 62 N -0.00 -0.06 -0.69 0.20 3.64 -1.99 -0.98 116.57 116.69 2oqe h LYS 62 Ca 0.12 0.00 0.07 0.00 -1.27 0.00 0.00 60.65 59.57 2oqe h LYS 62 Cb 0.19 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.97 2oqe h LYS 62 CO -0.27 -0.04 0.37 0.00 -2.27 0.00 0.00 179.45 177.25 2oqe h ALA 63 N 0.90 0.93 0.02 5.00 0.00 -1.86 -0.21 119.26 124.04 2oqe h ALA 63 Ca -0.00 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2oqe h ALA 63 Cb 0.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2oqe h ALA 63 CO 0.00 0.04 -0.01 -0.92 0.00 0.00 0.00 179.25 178.36 2oqe h TYR 64 N 0.68 -0.02 -0.72 0.00 3.20 -0.33 -1.31 116.97 118.46 2oqe h TYR 64 Ca 0.31 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.14 2oqe h TYR 64 Cb 0.23 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2oqe h TYR 64 CO -0.08 0.12 0.29 0.82 -1.64 0.00 0.00 178.16 177.67 2oqe h ILE 65 N -0.17 1.24 -0.69 1.81 2.04 -1.00 0.15 117.51 120.90 2oqe h ILE 65 Ca -0.00 -0.75 -0.04 0.00 1.00 0.00 0.00 64.86 65.06 2oqe h ILE 65 Cb 0.16 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.59 2oqe h ILE 65 CO 0.00 0.31 0.26 1.56 0.00 0.00 0.00 178.15 180.28 2oqe h GLN 66 N 1.04 1.04 -0.27 2.37 4.20 -0.95 0.24 115.11 122.78 2oqe h GLN 66 Ca 0.24 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 2oqe h GLN 66 Cb 0.19 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2oqe h GLN 66 CO -0.02 0.87 0.07 2.35 -0.67 0.00 0.00 178.83 181.43 2oqe h TRP 67 N 0.98 0.44 -0.62 2.96 7.01 -0.81 0.18 115.95 126.10 2oqe h TRP 67 Ca 0.23 -0.05 -0.08 0.00 2.11 0.00 0.00 58.89 61.10 2oqe h TRP 67 Cb 0.23 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.14 2oqe h TRP 67 CO 0.02 0.49 0.08 -0.22 -2.79 0.00 0.00 178.44 176.01 2oqe h LYS 68 N 0.26 1.04 0.00 2.65 3.64 -0.33 -3.37 116.57 120.46 2oqe h LYS 68 Ca 0.08 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2oqe h LYS 68 Cb 0.26 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 2oqe h LYS 68 CO -0.00 0.98 -0.91 0.39 -2.27 0.00 0.00 179.45 177.64 2oqe n GLU 69 N -4.26 0.54 -0.11 1.90 1.02 0.81 -4.80 120.64 115.74 2oqe n GLU 69 Ca 0.03 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.25 2oqe n GLU 69 Cb 0.30 -0.96 0.11 0.00 -0.02 0.00 0.00 31.44 30.87 2oqe n GLU 69 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2oqe n GLN 70 N -1.38 1.28 -2.07 3.49 6.02 -0.14 -4.98 117.38 119.60 2oqe n GLN 70 Ca 0.00 -2.29 -0.17 0.00 -0.01 0.00 0.00 57.00 54.53 2oqe n GLN 70 Cb 0.00 -1.33 -0.03 0.00 1.02 0.00 0.00 30.24 29.90 2oqe n GLN 70 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2oqe n GLY 71 N -1.18 0.30 3.69 1.08 0.00 -1.00 -4.92 105.19 103.17 2oqe n GLY 71 Ca 0.13 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2oqe n GLY 71 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oqe s GLY 72 N -2.41 1.56 0.50 -0.02 0.00 0.47 -4.93 107.32 102.49 2oqe s GLY 72 Ca 0.00 -0.44 -0.20 0.00 0.00 0.00 0.00 44.72 44.07 2oqe s GLY 72 CO 0.00 0.18 1.09 2.56 0.00 0.00 0.00 173.10 176.93 2oqe s PRO 73 N -5.05 3.64 0.02 2.90 0.04 -1.26 -4.43 135.00 130.85 2oqe s PRO 73 Ca 0.65 1.50 -0.31 0.00 0.04 0.00 0.00 61.00 62.88 2oqe s PRO 73 Cb -0.18 -2.11 -0.10 0.00 0.04 0.00 0.00 34.50 32.16 2oqe s PRO 73 CO 0.57 -0.59 1.93 -0.11 0.04 0.00 0.00 177.00 178.83 2oqe n LEU 74 N -1.01 3.95 -4.71 -3.56 7.94 -1.26 -4.52 117.00 113.83 2oqe n LEU 74 Ca 0.10 0.93 -0.38 0.00 -1.11 0.00 0.00 56.01 55.55 2oqe n LEU 74 Cb 0.51 -1.49 0.05 0.00 0.53 0.00 0.00 43.42 43.03 2oqe n LEU 74 CO 0.42 0.12 0.85 -2.65 -1.11 0.00 0.00 177.39 175.02 2oqe n PRO 75 N 7.00 1.35 -1.67 1.96 -0.02 -1.26 -4.93 135.00 137.43 2oqe n PRO 75 Ca 0.20 0.51 -0.39 0.00 -2.02 0.00 0.00 63.50 61.80 2oqe n PRO 75 Cb 0.37 -2.45 0.03 0.00 -0.02 0.00 0.00 33.50 31.44 2oqe n PRO 75 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2oqe n PRO 76 N -1.20 1.41 -3.13 0.52 -0.04 -1.26 -4.95 135.00 126.35 2oqe n PRO 76 Ca 0.13 0.52 -0.42 0.00 -0.04 0.00 0.00 63.50 63.68 2oqe n PRO 76 Cb 0.46 -2.30 -0.07 0.00 -0.04 0.00 0.00 33.50 31.55 2oqe n PRO 76 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2oqe s ARG 77 N -2.55 3.57 -0.01 0.54 6.06 -1.26 -4.86 118.95 120.44 2oqe s ARG 77 Ca 0.69 -0.09 0.07 0.00 -2.50 0.00 0.00 55.73 53.90 2oqe s ARG 77 Cb -0.46 -3.85 -0.02 0.00 0.06 0.00 0.00 34.95 30.69 2oqe s ARG 77 CO 0.52 -0.79 -0.22 -0.51 -2.50 0.00 0.00 175.30 171.79 2oqe s LEU 78 N 2.69 2.05 -0.08 -0.88 1.43 -1.26 -1.93 118.68 120.71 2oqe s LEU 78 Ca 0.23 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.94 2oqe s LEU 78 Cb -0.14 -1.14 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 2oqe s LEU 78 CO 0.16 0.27 -0.14 0.00 0.23 0.00 0.00 176.35 176.87 2oqe s ALA 79 N -0.55 2.65 -0.16 4.21 0.00 -0.21 -1.37 121.76 126.33 2oqe s ALA 79 Ca 0.09 -0.94 -0.08 0.00 0.00 0.00 0.00 51.96 51.03 2oqe s ALA 79 Cb -0.09 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.93 2oqe s ALA 79 CO -0.01 0.44 0.10 -0.47 0.00 0.00 0.00 175.76 175.83 2oqe s TYR 80 N -0.34 3.38 0.10 0.00 5.04 0.10 -0.14 117.35 125.49 2oqe s TYR 80 Ca 0.03 0.28 0.08 0.00 -2.44 0.00 0.00 57.07 55.02 2oqe s TYR 80 Cb -0.13 -2.05 -0.03 0.00 0.35 0.00 0.00 41.96 40.10 2oqe s TYR 80 CO 0.02 0.37 -0.20 1.52 -1.34 0.00 0.00 175.55 175.92 2oqe s TYR 81 N -0.09 1.71 -0.08 4.97 1.13 -0.53 -1.08 117.35 123.38 2oqe s TYR 81 Ca 0.08 -0.42 0.02 0.00 -1.41 0.00 0.00 57.07 55.35 2oqe s TYR 81 Cb -0.12 -0.95 0.01 0.00 -1.10 0.00 0.00 41.96 39.81 2oqe s TYR 81 CO 0.01 0.18 -0.15 0.08 -2.51 0.00 0.00 175.55 173.16 2oqe s VAL 82 N -1.16 1.35 0.11 -3.49 1.01 -0.30 -1.98 120.40 115.94 2oqe s VAL 82 Ca 0.05 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.48 2oqe s VAL 82 Cb -0.10 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2oqe s VAL 82 CO 0.04 0.40 -0.10 0.27 0.00 0.00 0.00 175.10 175.71 2oqe s ILE 83 N 0.67 1.01 0.09 2.22 -4.36 0.32 -0.69 121.20 120.45 2oqe s ILE 83 Ca -0.14 -1.75 0.05 0.00 -0.26 0.00 0.00 60.65 58.55 2oqe s ILE 83 Cb -0.16 -1.49 -0.04 0.00 1.25 0.00 0.00 42.46 42.02 2oqe s ILE 83 CO 0.04 -0.60 -0.03 -0.76 0.24 0.00 0.00 174.94 173.83 2oqe s LEU 84 N -2.63 3.35 -0.08 0.37 1.02 -0.27 -0.63 118.68 119.82 2oqe s LEU 84 Ca 0.08 -0.23 0.04 0.00 0.02 0.00 0.00 54.13 54.05 2oqe s LEU 84 Cb -0.01 -2.10 -0.00 0.00 0.02 0.00 0.00 46.19 44.09 2oqe s LEU 84 CO 0.00 0.18 -0.23 -0.70 0.02 0.00 0.00 176.35 175.62 2oqe s GLU 85 N -2.28 2.69 0.23 1.70 2.12 -1.26 -0.77 118.70 121.13 2oqe s GLU 85 Ca 0.25 -0.82 -0.31 0.00 0.36 0.00 0.00 54.97 54.44 2oqe s GLU 85 Cb -0.12 -2.12 -0.13 0.00 0.26 0.00 0.00 34.13 32.02 2oqe s GLU 85 CO 0.17 0.22 1.42 0.00 -0.54 0.00 0.00 175.26 176.53 2oqe n ALA 86 N 3.38 1.09 -0.91 6.30 0.00 -0.90 -1.39 120.51 128.07 2oqe n ALA 86 Ca -0.19 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2oqe n ALA 86 Cb 0.53 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.70 2oqe n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oqe n GLY 87 N 2.24 0.67 3.51 0.00 0.00 -1.26 -4.97 105.19 105.38 2oqe n GLY 87 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 2oqe n GLY 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oqe s LYS 88 N -0.29 2.69 0.50 1.61 -0.14 -0.49 -5.12 119.74 118.50 2oqe s LYS 88 Ca 0.00 -0.64 -0.18 0.00 -1.36 0.00 0.00 55.97 53.79 2oqe s LYS 88 Cb 0.00 -2.49 -0.08 0.00 -1.68 0.00 0.00 37.83 33.58 2oqe s LYS 88 CO 0.00 0.60 0.98 -1.25 -0.76 0.00 0.00 175.35 174.92 2oqe s PRO 89 N -0.64 3.97 5.50 -1.68 0.04 -1.26 -4.62 135.00 136.30 2oqe s PRO 89 Ca 0.10 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2oqe s PRO 89 Cb -0.11 -2.14 0.00 0.00 0.04 0.00 0.00 34.50 32.29 2oqe s PRO 89 CO 0.01 -0.26 0.00 0.41 0.04 0.00 0.00 177.00 177.21 2oqe n GLY 90 N -1.19 1.75 3.36 0.56 0.00 -1.20 -4.44 105.19 104.02 2oqe n GLY 90 Ca 0.07 -0.59 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 2oqe n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oqe s VAL 91 N 0.00 0.00 0.06 1.61 -7.23 -0.23 -4.75 120.40 109.87 2oqe s VAL 91 Ca 0.00 -1.76 0.09 0.00 -1.81 0.00 0.00 61.98 58.50 2oqe s VAL 91 Cb 0.00 -2.38 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 2oqe s VAL 91 CO 0.00 0.00 -0.25 -0.54 -0.31 0.00 0.00 175.10 174.00 2oqe s LYS 92 N -4.10 1.61 0.13 4.82 1.02 0.20 -0.51 119.74 122.91 2oqe s LYS 92 Ca 0.32 -1.09 0.01 0.00 0.02 0.00 0.00 55.97 55.23 2oqe s LYS 92 Cb 0.04 -1.81 -0.04 0.00 -0.52 0.00 0.00 37.83 35.49 2oqe s LYS 92 CO 0.11 0.46 0.00 -1.83 -0.92 0.00 0.00 175.35 173.17 2oqe s GLU 93 N -1.34 0.94 0.00 1.68 -1.05 -0.12 -0.52 118.70 118.28 2oqe s GLU 93 Ca 0.11 -1.43 0.00 0.00 -0.15 0.00 0.00 54.97 53.49 2oqe s GLU 93 Cb -0.10 -0.03 0.00 0.00 -0.44 0.00 0.00 34.13 33.56 2oqe s GLU 93 CO 0.03 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.49 2oqe n GLY 94 N -0.12 -1.03 3.16 -3.83 0.00 -0.84 -0.72 105.19 101.82 2oqe n GLY 94 Ca -0.08 -0.80 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 2oqe n GLY 94 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oqe s LEU 95 N 0.00 2.07 -0.17 0.99 1.43 -0.42 -1.46 118.68 121.13 2oqe s LEU 95 Ca 0.00 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.73 2oqe s LEU 95 Cb 0.00 -0.81 -0.01 0.00 0.03 0.00 0.00 46.19 45.39 2oqe s LEU 95 CO 0.00 0.17 -0.08 -0.69 0.23 0.00 0.00 176.35 175.97 2oqe s VAL 96 N -0.51 3.28 -0.34 -1.59 1.01 0.80 -1.43 120.40 121.61 2oqe s VAL 96 Ca 0.06 -0.56 -0.27 0.00 0.00 0.00 0.00 61.98 61.21 2oqe s VAL 96 Cb -0.07 -2.43 0.01 0.00 0.00 0.00 0.00 36.38 33.89 2oqe s VAL 96 CO 0.00 0.48 0.99 -0.62 0.00 0.00 0.00 175.10 175.95 2oqe s ASP 97 N 0.81 6.80 0.37 3.32 -1.08 0.07 -1.05 116.67 125.91 2oqe s ASP 97 Ca -0.03 0.82 0.20 0.00 -0.52 0.00 0.00 52.55 53.02 2oqe s ASP 97 Cb -0.15 -2.50 0.50 0.00 -1.46 0.00 0.00 42.92 39.32 2oqe s ASP 97 CO 0.01 -0.85 1.64 -0.07 0.52 0.00 0.00 175.17 176.43 2oqe h LEU 98 N 10.03 0.00 -0.19 -1.34 3.38 -1.69 -0.98 115.31 124.52 2oqe h LEU 98 Ca -0.22 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.54 2oqe h LEU 98 Cb 1.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.83 2oqe h LEU 98 CO 1.00 0.33 -0.68 0.00 0.09 0.00 0.00 178.44 179.17 2oqe h ALA 99 N 1.67 0.34 -0.01 1.53 0.00 -1.92 -3.25 119.26 117.63 2oqe h ALA 99 Ca -0.00 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2oqe h ALA 99 Cb 1.04 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.80 2oqe h ALA 99 CO 0.04 0.65 -0.41 -1.13 0.00 0.00 0.00 179.25 178.41 2oqe n SER 100 N -3.99 1.33 -3.86 0.00 3.41 -1.20 -4.90 113.62 104.41 2oqe n SER 100 Ca -0.07 -1.06 -0.25 0.00 -0.26 0.00 0.00 58.87 57.23 2oqe n SER 100 Cb 0.70 0.33 0.01 0.00 -0.26 0.00 0.00 64.21 64.98 2oqe n SER 100 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oqe n LEU 101 N -0.56 -2.60 -3.96 1.04 4.77 -0.41 -5.00 117.00 110.28 2oqe n LEU 101 Ca 0.10 -0.90 -0.10 0.00 -0.03 0.00 0.00 56.01 55.08 2oqe n LEU 101 Cb 0.39 -2.44 -0.12 0.00 -2.33 0.00 0.00 43.42 38.92 2oqe n LEU 101 CO 0.29 0.42 -0.36 -0.94 -1.33 0.00 0.00 177.39 175.46 2oqe s SER 102 N -4.20 0.23 -0.13 -1.43 1.04 -0.98 -4.88 113.70 103.35 2oqe s SER 102 Ca 0.11 -0.39 -0.29 0.00 0.48 0.00 0.00 55.95 55.86 2oqe s SER 102 Cb -0.06 0.07 -0.02 0.00 0.10 0.00 0.00 66.02 66.11 2oqe s SER 102 CO 0.85 -0.22 1.30 -0.69 0.98 0.00 0.00 173.24 175.46 2oqe s VAL 103 N -1.11 4.18 -0.63 5.02 1.01 -1.26 -0.75 120.40 126.85 2oqe s VAL 103 Ca -0.12 1.45 0.15 0.00 0.00 0.00 0.00 61.98 63.46 2oqe s VAL 103 Cb -0.08 -3.93 -0.17 0.00 0.00 0.00 0.00 36.38 32.20 2oqe s VAL 103 CO -0.01 -0.11 0.61 2.30 0.00 0.00 0.00 175.10 177.89 2oqe n ILE 104 N 5.27 0.00 -3.66 2.22 -5.35 -0.52 -4.95 119.36 112.37 2oqe n ILE 104 Ca 0.14 -0.17 -0.12 0.00 -0.27 0.00 0.00 62.75 62.33 2oqe n ILE 104 Cb 0.45 0.90 -0.08 0.00 -1.74 0.00 0.00 39.64 39.17 2oqe n ILE 104 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2oqe s GLU 105 N -2.50 0.69 -0.02 6.28 2.12 -1.23 -4.97 118.70 119.08 2oqe s GLU 105 Ca 0.04 0.93 -0.18 0.00 0.36 0.00 0.00 54.97 56.13 2oqe s GLU 105 Cb 0.11 0.28 0.03 0.00 0.26 0.00 0.00 34.13 34.81 2oqe s GLU 105 CO 0.62 -0.11 0.38 -0.08 -0.54 0.00 0.00 175.26 175.53 2oqe s THR 106 N 0.70 0.05 -0.14 -1.70 -1.32 -1.26 -1.30 115.64 110.66 2oqe s THR 106 Ca -0.03 -0.39 -0.29 0.00 -1.21 0.00 0.00 61.69 59.77 2oqe s THR 106 Cb -0.05 -0.69 0.09 0.00 -1.51 0.00 0.00 72.50 70.34 2oqe s THR 106 CO -0.05 -0.22 0.79 0.00 -2.21 0.00 0.00 174.62 172.93 2oqe s ARG 107 N -1.32 0.86 -0.11 7.08 1.70 0.10 -4.97 118.95 122.29 2oqe s ARG 107 Ca -0.13 0.43 -0.12 0.00 -0.47 0.00 0.00 55.73 55.44 2oqe s ARG 107 Cb -0.04 0.41 -0.05 0.00 -0.57 0.00 0.00 34.95 34.70 2oqe s ARG 107 CO 0.05 -0.22 0.26 0.00 -1.08 0.00 0.00 175.30 174.31 2oqe s ALA 108 N -0.69 3.71 -0.41 7.88 0.00 -1.26 -0.95 121.76 130.04 2oqe s ALA 108 Ca -0.05 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 51.45 2oqe s ALA 108 Cb -0.02 -2.25 0.12 0.00 0.00 0.00 0.00 23.12 20.97 2oqe s ALA 108 CO 0.05 0.34 0.19 -0.51 0.00 0.00 0.00 175.76 175.82 2oqe s LEU 109 N -0.32 3.00 0.18 0.00 1.43 0.34 -4.98 118.68 118.32 2oqe s LEU 109 Ca 0.17 -2.39 0.26 0.00 -1.03 0.00 0.00 54.13 51.14 2oqe s LEU 109 Cb -0.13 -1.13 0.89 0.00 0.03 0.00 0.00 46.19 45.85 2oqe s LEU 109 CO 0.06 -0.31 1.78 -0.62 0.23 0.00 0.00 176.35 177.49 2oqe n GLU 110 N 3.88 0.21 -0.37 1.70 1.02 -1.26 -1.06 120.64 124.76 2oqe n GLU 110 Ca 0.05 0.21 0.08 0.00 -0.02 0.00 0.00 57.16 57.48 2oqe n GLU 110 Cb 0.37 -1.76 0.18 0.00 -0.02 0.00 0.00 31.44 30.20 2oqe n GLU 110 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2oqe n THR 111 N -2.13 2.06 -4.47 2.62 -2.24 -1.26 -3.27 114.28 105.59 2oqe n THR 111 Ca 0.05 -2.80 -0.23 0.00 -2.27 0.00 0.00 64.05 58.80 2oqe n THR 111 Cb 0.39 -0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 68.28 2oqe n THR 111 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2oqe s VAL 112 N -3.07 1.83 0.01 2.28 -7.23 -1.25 -4.78 120.40 108.19 2oqe s VAL 112 Ca 0.35 -2.15 0.05 0.00 -1.81 0.00 0.00 61.98 58.43 2oqe s VAL 112 Cb 0.33 -2.53 -0.02 0.00 0.56 0.00 0.00 36.38 34.72 2oqe s VAL 112 CO -0.03 -0.26 -0.15 -1.10 -0.31 0.00 0.00 175.10 173.25 2oqe s GLN 113 N -3.69 1.16 0.54 4.82 -1.52 -1.25 -4.29 119.66 115.42 2oqe s GLN 113 Ca 0.31 -0.65 0.03 0.00 -1.95 0.00 0.00 55.36 53.10 2oqe s GLN 113 Cb 0.04 -1.15 0.04 0.00 -0.22 0.00 0.00 33.01 31.72 2oqe s GLN 113 CO 0.14 0.30 0.76 -1.25 -0.25 0.00 0.00 175.29 174.99 2oqe s PRO 114 N -0.68 2.47 0.34 2.91 0.04 -1.26 -3.82 135.00 135.00 2oqe s PRO 114 Ca 0.05 -1.01 -0.26 0.00 0.04 0.00 0.00 61.00 59.82 2oqe s PRO 114 Cb -0.07 -2.55 -0.13 0.00 0.04 0.00 0.00 34.50 31.79 2oqe s PRO 114 CO 0.00 -0.72 0.83 1.51 0.04 0.00 0.00 177.00 178.66 2oqe n ILE 115 N -2.28 2.02 -3.05 0.56 3.06 -1.26 -4.72 119.36 113.69 2oqe n ILE 115 Ca 0.10 -0.50 -0.42 0.00 -2.50 0.00 0.00 62.75 59.43 2oqe n ILE 115 Cb 0.60 -0.79 -0.06 0.00 0.54 0.00 0.00 39.64 39.93 2oqe n ILE 115 CO 0.00 0.00 0.00 -0.76 -2.50 0.00 0.00 176.55 173.29 2oqe s LEU 116 N 0.93 4.17 0.72 9.51 1.43 0.05 -4.97 118.68 130.50 2oqe s LEU 116 Ca 0.61 0.36 -0.10 0.00 -1.03 0.00 0.00 54.13 53.97 2oqe s LEU 116 Cb -0.68 -2.90 0.04 0.00 0.03 0.00 0.00 46.19 42.68 2oqe s LEU 116 CO 0.58 -0.60 1.08 0.42 0.23 0.00 0.00 176.35 178.07 2oqe s THR 117 N 2.81 3.01 0.38 5.49 -4.23 -1.26 -4.49 115.64 117.35 2oqe s THR 117 Ca 0.28 0.21 0.07 0.00 -1.18 0.00 0.00 61.69 61.07 2oqe s THR 117 Cb -0.14 -3.30 0.29 0.00 1.34 0.00 0.00 72.50 70.69 2oqe s THR 117 CO 0.14 -0.38 1.98 0.58 -0.54 0.00 0.00 174.62 176.40 2oqe h VAL 118 N -0.68 1.02 -0.05 2.29 2.07 -1.90 -1.64 116.25 117.36 2oqe h VAL 118 Ca -0.45 -0.23 -0.15 0.00 0.82 0.00 0.00 66.70 66.68 2oqe h VAL 118 Cb 1.28 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 2oqe h VAL 118 CO 0.64 0.12 -0.65 -0.33 0.02 0.00 0.00 177.57 177.36 2oqe h GLU 119 N 0.67 0.21 -0.07 1.57 5.08 -2.00 -1.66 114.58 118.38 2oqe h GLU 119 Ca 0.28 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.44 2oqe h GLU 119 Cb 0.25 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 2oqe h GLU 119 CO -0.09 0.79 -0.13 -0.44 -1.00 0.00 0.00 179.01 178.15 2oqe h ASP 120 N 0.15 0.10 0.02 1.42 3.32 -1.68 -3.37 116.42 116.38 2oqe h ASP 120 Ca -0.01 -0.02 -0.38 0.00 0.02 0.00 0.00 57.03 56.64 2oqe h ASP 120 Cb 1.18 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.65 2oqe h ASP 120 CO 0.10 0.24 -2.16 0.18 -1.72 0.00 0.00 179.24 175.88 2oqe n LEU 121 N -4.33 2.32 0.07 1.55 4.77 -0.87 -4.39 117.00 116.11 2oqe n LEU 121 Ca -0.02 0.21 0.04 0.00 -0.03 0.00 0.00 56.01 56.22 2oqe n LEU 121 Cb 0.23 -0.93 0.23 0.00 -2.33 0.00 0.00 43.42 40.62 2oqe n LEU 121 CO 0.37 0.65 0.64 0.00 -1.33 0.00 0.00 177.39 177.72 2oqe h SER 123 N 0.00 0.00 -0.08 0.00 4.64 -1.77 -3.38 113.55 112.96 2oqe h SER 123 Ca 0.00 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 2oqe h SER 123 Cb 0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 2oqe h SER 123 CO 0.00 0.47 -0.22 0.74 -0.87 0.00 0.00 176.83 176.95 2oqe h THR 124 N 0.00 1.26 -0.70 2.95 2.02 -1.66 -3.04 112.91 113.73 2oqe h THR 124 Ca -0.00 -1.20 -0.01 0.00 0.77 0.00 0.00 66.41 65.97 2oqe h THR 124 Cb 1.16 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 2oqe h THR 124 CO 0.06 0.38 0.41 -0.08 0.37 0.00 0.00 175.52 176.67 2oqe h GLU 125 N 0.44 0.95 -0.01 6.66 4.81 -1.80 -0.67 114.58 124.95 2oqe h GLU 125 Ca 0.07 -0.09 -0.15 0.00 -0.13 0.00 0.00 59.36 59.06 2oqe h GLU 125 Cb 0.62 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 2oqe h GLU 125 CO 0.04 0.68 -0.68 1.49 -0.73 0.00 0.00 179.01 179.82 2oqe h GLU 126 N 0.95 0.06 0.07 1.92 4.57 -1.81 -1.32 114.58 119.02 2oqe h GLU 126 Ca 0.25 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.38 2oqe h GLU 126 Cb -0.02 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 2oqe h GLU 126 CO -0.05 0.71 -0.03 0.28 -1.18 0.00 0.00 179.01 178.74 2oqe h VAL 127 N 0.04 0.95 -0.10 0.32 2.07 -1.32 -2.74 116.25 115.48 2oqe h VAL 127 Ca -0.01 -0.06 -0.13 0.00 0.82 0.00 0.00 66.70 67.32 2oqe h VAL 127 Cb 1.20 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 2oqe h VAL 127 CO 0.09 0.01 -0.52 0.16 0.02 0.00 0.00 177.57 177.34 2oqe h ILE 128 N -0.12 1.35 0.00 4.57 3.07 -0.97 -2.72 117.51 122.70 2oqe h ILE 128 Ca -0.01 -1.77 -0.03 0.00 1.55 0.00 0.00 64.86 64.60 2oqe h ILE 128 Cb 0.09 1.84 -0.00 0.00 -0.27 0.00 0.00 36.82 38.48 2oqe h ILE 128 CO 0.01 0.53 -0.15 0.03 -1.05 0.00 0.00 178.15 177.52 2oqe h ARG 129 N 0.22 0.00 -0.19 0.16 3.08 -1.15 -2.88 114.38 113.62 2oqe h ARG 129 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 2oqe h ARG 129 Cb 0.99 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.04 2oqe h ARG 129 CO 0.08 0.15 0.00 0.09 -1.07 0.00 0.00 179.97 179.22 2oqe n ASN 130 N -3.75 2.74 -4.65 7.04 3.02 -1.04 -4.84 115.26 113.77 2oqe n ASN 130 Ca -0.02 -1.80 -0.41 0.00 -0.03 0.00 0.00 54.58 52.32 2oqe n ASN 130 Cb 0.26 -0.12 -0.05 0.00 -0.61 0.00 0.00 39.78 39.26 2oqe n ASN 130 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2oqe s ASP 131 N -1.26 6.79 0.29 6.41 2.15 -1.04 -4.97 116.67 125.05 2oqe s ASP 131 Ca 0.25 0.97 0.03 0.00 0.43 0.00 0.00 52.55 54.23 2oqe s ASP 131 Cb 0.15 -2.40 0.60 0.00 -0.30 0.00 0.00 42.92 40.97 2oqe s ASP 131 CO 0.22 -0.40 1.84 -0.65 -0.17 0.00 0.00 175.17 176.01 2oqe h PRO 132 N 7.56 0.92 -0.60 4.34 0.11 -1.92 -0.73 132.00 141.68 2oqe h PRO 132 Ca -0.28 -0.06 -0.09 0.00 0.11 0.00 0.00 66.00 65.69 2oqe h PRO 132 Cb 1.12 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.00 2oqe h PRO 132 CO 0.82 0.61 0.01 0.00 -0.21 0.00 0.00 178.00 179.23 2oqe h ALA 133 N 1.55 0.89 -0.44 -0.75 0.00 -1.95 -0.76 119.26 117.80 2oqe h ALA 133 Ca 0.50 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 2oqe h ALA 133 Cb 0.54 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 2oqe h ALA 133 CO -0.26 0.66 0.01 0.28 0.00 0.00 0.00 179.25 179.93 2oqe h VAL 134 N 0.95 1.26 -0.61 0.00 2.07 -1.68 -2.52 116.25 115.72 2oqe h VAL 134 Ca 0.17 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2oqe h VAL 134 Cb 0.53 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 2oqe h VAL 134 CO 0.03 0.35 0.39 0.40 0.02 0.00 0.00 177.57 178.76 2oqe h ILE 135 N 0.62 1.17 -0.93 4.57 2.04 -0.86 -0.87 117.51 123.25 2oqe h ILE 135 Ca 0.13 -0.34 0.08 0.00 1.00 0.00 0.00 64.86 65.73 2oqe h ILE 135 Cb 0.48 0.30 -0.07 0.00 -0.74 0.00 0.00 36.82 36.79 2oqe h ILE 135 CO 0.02 0.17 0.58 -0.08 0.00 0.00 0.00 178.15 178.84 2oqe h GLU 136 N 0.83 0.97 -0.24 2.37 4.81 -1.02 -0.38 114.58 121.92 2oqe h GLU 136 Ca 0.22 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.28 2oqe h GLU 136 Cb -0.06 -0.22 -0.01 0.00 0.63 0.00 0.00 28.75 29.09 2oqe h GLU 136 CO -0.05 0.64 -0.34 1.96 -0.73 0.00 0.00 179.01 180.50 2oqe h GLN 137 N 1.00 0.51 -0.30 1.92 1.08 -0.87 -0.88 115.11 117.58 2oqe h GLN 137 Ca 0.43 -0.23 -0.02 0.00 -1.45 0.00 0.00 58.65 57.38 2oqe h GLN 137 Cb 0.29 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.69 2oqe h GLN 137 CO -0.21 0.79 0.12 0.00 -0.95 0.00 0.00 178.83 178.58 2oqe h VAL 139 N 0.33 1.09 0.00 0.00 2.07 -0.68 0.10 116.25 119.16 2oqe h VAL 139 Ca 0.10 -0.23 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 2oqe h VAL 139 Cb 0.17 0.34 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 2oqe h VAL 139 CO -0.01 0.12 -0.11 -0.07 0.02 0.00 0.00 177.57 177.53 2oqe h LEU 140 N 0.68 0.00 -0.74 2.57 3.38 -1.07 -2.03 115.31 118.11 2oqe h LEU 140 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2oqe h LEU 140 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2oqe h LEU 140 CO -0.08 0.11 0.00 -1.20 0.09 0.00 0.00 178.44 177.36 2oqe n SER 141 N -4.21 1.12 0.00 -0.43 7.64 -0.58 -4.88 113.62 112.28 2oqe n SER 141 Ca -0.03 -1.48 0.00 0.00 1.01 0.00 0.00 58.87 58.37 2oqe n SER 141 Cb 0.19 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.35 2oqe n SER 141 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oqe n GLY 142 N 1.08 0.90 3.21 0.23 0.00 -0.76 -0.64 105.19 109.21 2oqe n GLY 142 Ca 0.18 -0.04 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 2oqe n GLY 142 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oqe s ILE 143 N -2.00 3.14 0.74 -0.61 1.01 -0.07 -4.95 121.20 118.47 2oqe s ILE 143 Ca 0.00 -1.16 -0.15 0.00 0.00 0.00 0.00 60.65 59.34 2oqe s ILE 143 Cb 0.00 -2.71 0.05 0.00 0.01 0.00 0.00 42.46 39.80 2oqe s ILE 143 CO 0.00 0.01 1.20 -2.84 0.00 0.00 0.00 174.94 173.31 2oqe s PRO 144 N 1.32 2.07 0.51 2.79 0.02 -1.26 -2.33 135.00 138.11 2oqe s PRO 144 Ca -0.02 1.74 0.22 0.00 0.02 0.00 0.00 61.00 62.95 2oqe s PRO 144 Cb -0.18 -1.83 1.31 0.00 0.02 0.00 0.00 34.50 33.81 2oqe s PRO 144 CO -0.01 -1.88 2.00 0.00 -0.33 0.00 0.00 177.00 176.78 2oqe h ALA 145 N -0.41 2.35 0.00 -1.55 0.00 -1.94 0.57 119.26 118.28 2oqe h ALA 145 Ca -0.47 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2oqe h ALA 145 Cb 1.29 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2oqe h ALA 145 CO 0.49 -0.49 0.00 0.27 0.00 0.00 0.00 179.25 179.52 2oqe n ASN 146 N -4.42 0.00 -0.58 0.00 0.23 -1.26 -2.86 115.26 106.37 2oqe n ASN 146 Ca 0.09 -1.35 0.08 0.00 -0.53 0.00 0.00 54.58 52.87 2oqe n ASN 146 Cb 0.51 0.00 0.21 0.00 -2.08 0.00 0.00 39.78 38.42 2oqe n ASN 146 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2oqe n GLU 147 N -0.80 2.17 0.30 -3.83 1.02 0.19 -4.70 120.64 115.00 2oqe n GLU 147 Ca 0.14 -2.78 0.17 0.00 -0.02 0.00 0.00 57.16 54.67 2oqe n GLU 147 Cb 0.06 -1.70 0.94 0.00 -0.02 0.00 0.00 31.44 30.72 2oqe n GLU 147 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 2oqe h MET 148 N 1.02 0.00 0.00 3.49 2.86 -1.63 -1.02 114.93 119.65 2oqe h MET 148 Ca 0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.66 2oqe h MET 148 Cb 1.28 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.94 2oqe h MET 148 CO 0.14 0.03 0.00 -2.39 1.06 0.00 0.00 176.91 175.75 2oqe n HIS 149 N -3.53 0.14 1.20 -0.22 1.44 -1.26 -1.76 115.22 111.22 2oqe n HIS 149 Ca -0.02 0.05 0.13 0.00 -2.01 0.00 0.00 57.72 55.87 2oqe n HIS 149 Cb 0.13 -0.59 0.27 0.00 0.12 0.00 0.00 29.99 29.92 2oqe n HIS 149 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2oqe n LYS 150 N -1.62 1.29 -3.55 -1.40 5.02 -0.39 -4.88 118.16 112.63 2oqe n LYS 150 Ca 0.03 -0.91 -0.36 0.00 -2.02 0.00 0.00 58.31 55.05 2oqe n LYS 150 Cb 0.17 -1.48 -0.07 0.00 -0.02 0.00 0.00 35.03 33.62 2oqe n LYS 150 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2oqe s VAL 151 N -2.33 5.31 0.24 -0.18 1.01 -0.73 -0.83 120.40 122.88 2oqe s VAL 151 Ca 0.26 0.54 0.07 0.00 0.00 0.00 0.00 61.98 62.84 2oqe s VAL 151 Cb 0.19 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 2oqe s VAL 151 CO 0.47 0.40 -0.10 -0.31 0.00 0.00 0.00 175.10 175.57 2oqe s TYR 152 N 0.36 1.79 -0.02 5.22 2.02 0.10 -4.96 117.35 121.87 2oqe s TYR 152 Ca 0.16 -0.66 -0.10 0.00 -0.37 0.00 0.00 57.07 56.11 2oqe s TYR 152 Cb -0.13 -0.93 0.01 0.00 -0.40 0.00 0.00 41.96 40.51 2oqe s TYR 152 CO 0.04 0.29 0.20 0.00 -1.57 0.00 0.00 175.55 174.51 2oqe s ASP 154 N -1.15 6.30 -1.37 0.00 1.01 -0.14 -4.85 116.67 116.47 2oqe s ASP 154 Ca -0.12 -0.02 -0.11 0.00 0.71 0.00 0.00 52.55 53.01 2oqe s ASP 154 Cb -0.06 -2.26 0.10 0.00 1.01 0.00 0.00 42.92 41.71 2oqe s ASP 154 CO 0.02 -0.44 2.12 -0.81 0.21 0.00 0.00 175.17 176.27 2oqe n PRO 155 N 5.67 3.44 -1.55 8.23 -0.04 -1.26 -1.60 135.00 147.89 2oqe n PRO 155 Ca -0.05 -3.11 -0.33 0.00 -0.04 0.00 0.00 63.50 59.97 2oqe n PRO 155 Cb 0.49 -3.02 0.07 0.00 -0.04 0.00 0.00 33.50 31.00 2oqe n PRO 155 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2oqe s TRP 156 N 1.35 2.41 0.72 0.54 0.52 -0.58 -4.73 118.94 119.17 2oqe s TRP 156 Ca 0.45 1.58 -0.16 0.00 0.02 0.00 0.00 56.10 57.99 2oqe s TRP 156 Cb 0.13 -3.24 0.01 0.00 -1.15 0.00 0.00 33.47 29.22 2oqe s TRP 156 CO -0.04 -1.99 1.03 -2.37 0.02 0.00 0.00 176.95 173.60 2oqe n THR 157 N -2.75 3.04 0.33 2.01 5.66 -1.26 -0.65 114.28 120.65 2oqe n THR 157 Ca 0.11 -0.37 0.22 0.00 -3.05 0.00 0.00 64.05 60.95 2oqe n THR 157 Cb 0.52 -1.16 1.14 0.00 -1.55 0.00 0.00 70.33 69.27 2oqe n THR 157 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 175.07 171.73 2oqe h ILE 158 N -0.20 0.00 0.00 1.09 2.10 -1.74 -3.38 117.51 115.39 2oqe h ILE 158 Ca -0.48 -0.07 0.00 0.00 1.08 0.00 0.00 64.86 65.40 2oqe h ILE 158 Cb 1.33 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 38.11 2oqe h ILE 158 CO 0.48 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 178.16 2oqe n GLY 159 N -0.94 2.14 3.38 8.18 0.00 -1.26 -4.50 105.19 112.19 2oqe n GLY 159 Ca -0.02 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.80 2oqe n GLY 159 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2oqe s TYR 160 N 0.00 -0.77 -0.13 1.61 5.04 -1.26 -0.79 117.35 121.04 2oqe s TYR 160 Ca 0.00 1.57 -0.01 0.00 -2.44 0.00 0.00 57.07 56.20 2oqe s TYR 160 Cb 0.00 0.39 0.03 0.00 0.35 0.00 0.00 41.96 42.73 2oqe s TYR 160 CO 0.00 -0.42 -0.05 0.34 -1.34 0.00 0.00 175.55 174.08 2oqe s ASP 161 N 1.65 2.42 0.13 4.32 -1.08 -1.26 -4.82 116.67 118.04 2oqe s ASP 161 Ca -0.09 -0.45 0.13 0.00 -0.52 0.00 0.00 52.55 51.62 2oqe s ASP 161 Cb -0.08 -0.81 0.61 0.00 -1.46 0.00 0.00 42.92 41.17 2oqe s ASP 161 CO -0.15 -0.16 1.39 -1.84 0.52 0.00 0.00 175.17 174.92 2oqe n GLU 162 N 4.94 0.07 0.21 4.34 0.00 -1.26 -1.48 120.64 127.46 2oqe n GLU 162 Ca -0.11 0.49 0.09 0.00 0.00 0.00 0.00 57.16 57.63 2oqe n GLU 162 Cb 0.49 -1.69 0.40 0.00 0.00 0.00 0.00 31.44 30.63 2oqe n GLU 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2oqe h ARG 163 N 0.00 0.00 0.00 3.44 3.08 -2.05 -3.38 114.38 115.47 2oqe h ARG 163 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2oqe h ARG 163 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2oqe h ARG 163 CO 0.00 0.24 -0.23 0.91 -1.07 0.00 0.00 179.97 179.82 2oqe n TRP 164 N -3.34 0.00 -1.95 3.04 8.01 -0.55 -5.10 117.44 117.55 2oqe n TRP 164 Ca 0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.20 2oqe n TRP 164 Cb 0.47 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.77 2oqe n TRP 164 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2oqe n GLY 165 N 0.83 2.98 1.51 6.99 0.00 -0.58 -1.22 105.19 115.70 2oqe n GLY 165 Ca 0.00 -0.21 0.10 0.00 0.00 0.00 0.00 46.02 45.91 2oqe n GLY 165 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2oqe n THR 166 N 0.00 1.63 0.24 2.61 -2.24 -1.26 -4.68 114.28 110.58 2oqe n THR 166 Ca 0.00 -1.16 0.11 0.00 -2.27 0.00 0.00 64.05 60.73 2oqe n THR 166 Cb 0.00 0.22 0.60 0.00 -2.10 0.00 0.00 70.33 69.05 2oqe n THR 166 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2oqe h GLY 167 N 4.09 0.00 -3.90 3.38 0.00 -1.54 -3.43 103.07 101.68 2oqe h GLY 167 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.00 2oqe h GLY 167 CO 0.17 0.00 -0.74 0.54 0.00 0.00 0.00 176.54 176.51 2oqe s LYS 168 N -3.94 0.82 -0.31 4.80 1.02 -1.26 -4.94 119.74 115.93 2oqe s LYS 168 Ca -0.01 -1.09 -0.23 0.00 0.02 0.00 0.00 55.97 54.66 2oqe s LYS 168 Cb 0.12 -0.56 -0.00 0.00 -0.52 0.00 0.00 37.83 36.86 2oqe s LYS 168 CO 0.61 0.10 0.75 0.50 -0.92 0.00 0.00 175.35 176.39 2oqe s ARG 169 N -2.53 3.94 0.02 1.68 3.52 -1.26 -4.97 118.95 119.36 2oqe s ARG 169 Ca 0.03 0.51 0.06 0.00 -0.13 0.00 0.00 55.73 56.20 2oqe s ARG 169 Cb -0.05 -3.73 -0.02 0.00 -1.56 0.00 0.00 34.95 29.59 2oqe s ARG 169 CO 0.00 -0.66 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.15 2oqe s LEU 170 N 2.88 2.12 0.23 -0.88 1.43 -1.26 -0.29 118.68 122.90 2oqe s LEU 170 Ca 0.31 -0.43 0.11 0.00 -1.03 0.00 0.00 54.13 53.09 2oqe s LEU 170 Cb -0.14 -0.85 -0.05 0.00 0.03 0.00 0.00 46.19 45.18 2oqe s LEU 170 CO 0.12 0.15 -0.19 -1.10 0.23 0.00 0.00 176.35 175.56 2oqe s GLN 171 N -0.88 1.70 -0.11 1.70 -0.21 0.01 -2.38 119.66 119.49 2oqe s GLN 171 Ca 0.06 -1.56 0.00 0.00 0.02 0.00 0.00 55.36 53.88 2oqe s GLN 171 Cb -0.08 -1.89 -0.02 0.00 1.00 0.00 0.00 33.01 32.03 2oqe s GLN 171 CO 0.01 0.38 -0.12 1.14 -2.12 0.00 0.00 175.29 174.57 2oqe s GLN 172 N -3.04 3.21 -0.43 2.91 -2.07 0.17 -0.73 119.66 119.67 2oqe s GLN 172 Ca 0.25 -0.67 -0.16 0.00 -1.82 0.00 0.00 55.36 52.97 2oqe s GLN 172 Cb -0.07 -2.60 0.04 0.00 -1.09 0.00 0.00 33.01 29.29 2oqe s GLN 172 CO 0.13 0.32 0.36 0.00 -1.32 0.00 0.00 175.29 174.78 2oqe s ALA 173 N 0.09 3.49 -0.36 2.60 0.00 -0.11 -1.53 121.76 125.94 2oqe s ALA 173 Ca -0.05 -1.81 -0.27 0.00 0.00 0.00 0.00 51.96 49.83 2oqe s ALA 173 Cb -0.15 -2.99 0.02 0.00 0.00 0.00 0.00 23.12 20.00 2oqe s ALA 173 CO 0.04 -1.58 0.98 -0.51 0.00 0.00 0.00 175.76 174.69 2oqe s LEU 174 N 1.77 3.95 -0.05 0.00 1.43 -0.63 -3.82 118.68 121.32 2oqe s LEU 174 Ca 0.06 0.71 -0.08 0.00 -1.03 0.00 0.00 54.13 53.80 2oqe s LEU 174 Cb -0.20 -3.36 -0.04 0.00 0.03 0.00 0.00 46.19 42.62 2oqe s LEU 174 CO 0.10 -0.88 0.22 0.68 0.23 0.00 0.00 176.35 176.70 2oqe s VAL 175 N 3.58 5.37 0.20 -1.59 -7.23 -1.26 -0.97 120.40 118.49 2oqe s VAL 175 Ca 0.41 0.26 -0.01 0.00 -1.81 0.00 0.00 61.98 60.83 2oqe s VAL 175 Cb -0.12 -3.51 -0.04 0.00 0.56 0.00 0.00 36.38 33.27 2oqe s VAL 175 CO 0.18 0.51 0.12 -0.31 -0.31 0.00 0.00 175.10 175.29 2oqe s TYR 176 N -1.14 1.16 -0.02 2.82 2.02 0.38 -1.16 117.35 121.41 2oqe s TYR 176 Ca 0.21 -1.34 0.04 0.00 -0.37 0.00 0.00 57.07 55.62 2oqe s TYR 176 Cb -0.13 -0.59 -0.01 0.00 -0.40 0.00 0.00 41.96 40.83 2oqe s TYR 176 CO 0.10 -0.59 -0.15 -0.47 -1.57 0.00 0.00 175.55 172.88 2oqe s TYR 177 N -4.10 1.41 -0.12 2.71 5.04 -0.29 -0.72 117.35 121.29 2oqe s TYR 177 Ca 0.37 -0.32 0.03 0.00 -2.44 0.00 0.00 57.07 54.71 2oqe s TYR 177 Cb 0.07 -0.93 0.00 0.00 0.35 0.00 0.00 41.96 41.45 2oqe s TYR 177 CO 0.11 -0.08 -0.22 1.03 -1.34 0.00 0.00 175.55 175.05 2oqe s ARG 178 N -0.15 3.07 0.30 4.97 0.52 -0.01 -4.57 118.95 123.07 2oqe s ARG 178 Ca 0.02 -0.85 0.11 0.00 -0.52 0.00 0.00 55.73 54.48 2oqe s ARG 178 Cb -0.08 -2.38 0.47 0.00 0.52 0.00 0.00 34.95 33.48 2oqe s ARG 178 CO 0.00 0.12 1.68 0.77 0.02 0.00 0.00 175.30 177.89 2oqe h SER 179 N 6.92 0.00 -4.34 0.23 0.02 -1.97 -3.44 113.55 110.99 2oqe h SER 179 Ca -0.24 -0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.52 2oqe h SER 179 Cb 1.22 -0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.52 2oqe h SER 179 CO 0.51 0.54 -0.61 -0.62 -1.14 0.00 0.00 176.83 175.51 2oqe s ASP 180 N -6.88 0.01 0.57 3.07 2.15 -1.26 -5.05 116.67 109.29 2oqe s ASP 180 Ca -0.02 -0.07 0.27 0.00 0.43 0.00 0.00 52.55 53.15 2oqe s ASP 180 Cb 0.13 0.17 1.59 0.00 -0.30 0.00 0.00 42.92 44.51 2oqe s ASP 180 CO 0.75 -0.18 2.11 1.05 -0.17 0.00 0.00 175.17 178.74 2oqe h GLU 181 N 5.27 0.00 -0.01 4.34 4.11 -1.97 -0.36 114.58 125.96 2oqe h GLU 181 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.15 2oqe h GLU 181 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 2oqe h GLU 181 CO 0.43 0.00 -0.06 -0.25 0.07 0.00 0.00 179.01 179.20 2oqe n ASP 182 N -3.99 0.65 -4.75 3.06 8.00 -1.26 -4.91 116.55 113.35 2oqe n ASP 182 Ca 0.02 -0.93 -0.35 0.00 0.71 0.00 0.00 54.79 54.24 2oqe n ASP 182 Cb 0.31 -0.03 0.06 0.00 -0.02 0.00 0.00 41.12 41.44 2oqe n ASP 182 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2oqe s ASP 183 N -2.24 4.82 -0.30 -2.24 1.01 -0.15 -4.96 116.67 112.61 2oqe s ASP 183 Ca 0.36 2.28 -0.23 0.00 0.71 0.00 0.00 52.55 55.67 2oqe s ASP 183 Cb 0.21 -2.58 -0.00 0.00 1.01 0.00 0.00 42.92 41.55 2oqe s ASP 183 CO 0.42 -1.84 0.75 -0.55 0.21 0.00 0.00 175.17 174.15 2oqe s SER 184 N -1.98 6.63 0.09 0.27 0.15 -1.26 -4.95 113.70 112.65 2oqe s SER 184 Ca 0.74 0.65 0.18 0.00 0.70 0.00 0.00 55.95 58.22 2oqe s SER 184 Cb -0.27 -2.39 0.77 0.00 -1.71 0.00 0.00 66.02 62.42 2oqe s SER 184 CO 0.39 -0.56 1.57 0.00 1.20 0.00 0.00 173.24 175.85 2oqe n GLN 185 N 6.08 0.07 0.00 5.44 10.64 -1.26 -3.89 117.38 134.45 2oqe n GLN 185 Ca 0.03 0.29 0.11 0.00 -1.83 0.00 0.00 57.00 55.60 2oqe n GLN 185 Cb 0.48 -1.63 0.52 0.00 -0.86 0.00 0.00 30.24 28.75 2oqe n GLN 185 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2oqe n TYR 186 N -1.76 0.00 1.06 2.61 4.01 -1.26 -1.15 117.16 120.66 2oqe n TYR 186 Ca 0.03 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.91 2oqe n TYR 186 Cb 0.20 -0.39 0.60 0.00 -0.31 0.00 0.00 39.34 39.44 2oqe n TYR 186 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2oqe n SER 187 N -1.39 0.07 -3.07 7.72 3.41 -1.25 -4.32 113.62 114.77 2oqe n SER 187 Ca 0.08 0.32 -0.22 0.00 -0.26 0.00 0.00 58.87 58.79 2oqe n SER 187 Cb 0.22 -0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 63.74 2oqe n SER 187 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2oqe n HIS 188 N -1.46 2.02 -1.86 7.33 8.25 -0.30 -4.77 115.22 124.43 2oqe n HIS 188 Ca 0.08 -3.90 -0.34 0.00 -0.26 0.00 0.00 57.72 53.29 2oqe n HIS 188 Cb 0.33 -0.45 0.04 0.00 1.12 0.00 0.00 29.99 31.03 2oqe n HIS 188 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2oqe s PRO 189 N -2.92 2.83 0.46 -0.41 0.04 -1.26 -1.13 135.00 132.61 2oqe s PRO 189 Ca 0.44 1.59 0.07 0.00 0.04 0.00 0.00 61.00 63.14 2oqe s PRO 189 Cb 0.31 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.94 2oqe s PRO 189 CO -0.11 -1.26 0.63 -0.51 0.04 0.00 0.00 177.00 175.79 2oqe s LEU 190 N -4.53 3.53 0.00 -3.56 1.43 -0.31 -4.55 118.68 110.70 2oqe s LEU 190 Ca 0.72 -0.41 0.25 0.00 -1.03 0.00 0.00 54.13 53.65 2oqe s LEU 190 Cb -0.25 -2.56 0.51 0.00 0.03 0.00 0.00 46.19 43.92 2oqe s LEU 190 CO 0.37 -0.89 1.42 -0.90 0.23 0.00 0.00 176.35 176.58 2oqe n ASP 191 N -1.98 0.49 -4.63 2.29 5.75 -1.26 -4.49 116.55 112.73 2oqe n ASP 191 Ca 0.09 -0.23 -0.25 0.00 -0.01 0.00 0.00 54.79 54.39 2oqe n ASP 191 Cb 0.59 0.24 -0.09 0.00 -1.03 0.00 0.00 41.12 40.83 2oqe n ASP 191 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 2oqe s PHE 192 N -3.00 2.53 -0.31 2.11 -0.71 -1.26 -4.44 117.98 112.89 2oqe s PHE 192 Ca 0.11 -0.51 -0.03 0.00 -1.04 0.00 0.00 56.93 55.47 2oqe s PHE 192 Cb 0.17 -1.58 0.11 0.00 -1.21 0.00 0.00 43.02 40.51 2oqe s PHE 192 CO 0.70 0.45 0.14 0.00 -1.34 0.00 0.00 175.22 175.17 2oqe s PRO 194 N 1.81 4.16 -0.20 0.00 0.02 -1.25 -1.33 135.00 138.21 2oqe s PRO 194 Ca 0.11 2.08 -0.06 0.00 0.02 0.00 0.00 61.00 63.14 2oqe s PRO 194 Cb -0.17 -2.88 -0.03 0.00 0.02 0.00 0.00 34.50 31.44 2oqe s PRO 194 CO -0.28 -0.30 0.04 0.42 -0.33 0.00 0.00 177.00 176.54 2oqe s ILE 195 N -1.25 4.34 -0.12 2.83 -1.09 0.82 -0.94 121.20 125.80 2oqe s ILE 195 Ca 0.53 -0.18 0.02 0.00 -2.23 0.00 0.00 60.65 58.80 2oqe s ILE 195 Cb -0.37 -2.97 -0.00 0.00 -1.58 0.00 0.00 42.46 37.54 2oqe s ILE 195 CO 0.47 0.42 -0.20 -0.69 -1.23 0.00 0.00 174.94 173.71 2oqe s VAL 196 N 0.92 2.34 -0.36 2.92 1.01 0.09 -0.59 120.40 126.73 2oqe s VAL 196 Ca 0.03 -0.91 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 2oqe s VAL 196 Cb -0.14 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.31 2oqe s VAL 196 CO 0.02 0.54 1.30 -0.62 0.00 0.00 0.00 175.10 176.35 2oqe s ASP 197 N 0.49 6.58 0.17 3.32 -1.08 0.08 -0.81 116.67 125.42 2oqe s ASP 197 Ca -0.13 0.99 -0.14 0.00 -0.52 0.00 0.00 52.55 52.75 2oqe s ASP 197 Cb -0.17 -2.54 0.07 0.00 -1.46 0.00 0.00 42.92 38.82 2oqe s ASP 197 CO 0.05 -1.20 1.82 0.74 0.52 0.00 0.00 175.17 177.10 2oqe h THR 198 N 6.14 1.15 0.00 1.71 2.02 -0.96 0.63 112.91 123.60 2oqe h THR 198 Ca -0.26 -0.32 -0.26 0.00 0.77 0.00 0.00 66.41 66.34 2oqe h THR 198 Cb 1.09 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 67.85 2oqe h THR 198 CO 1.06 0.15 -1.39 -0.33 0.37 0.00 0.00 175.52 175.38 2oqe h GLU 199 N 0.74 0.00 0.00 6.66 4.39 -1.92 -3.26 114.58 121.19 2oqe h GLU 199 Ca 0.20 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2oqe h GLU 199 Cb -0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2oqe h GLU 199 CO -0.04 0.72 -0.36 0.39 -1.16 0.00 0.00 179.01 178.55 2oqe n GLU 200 N -3.18 0.23 -3.67 2.33 -0.58 -1.19 -4.98 120.64 109.60 2oqe n GLU 200 Ca -0.09 0.11 -0.23 0.00 -0.42 0.00 0.00 57.16 56.53 2oqe n GLU 200 Cb 1.00 -1.69 0.03 0.00 -0.57 0.00 0.00 31.44 30.22 2oqe n GLU 200 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2oqe n LYS 201 N -2.04 -4.00 -3.84 3.49 5.02 0.20 -5.01 118.16 111.99 2oqe n LYS 201 Ca 0.05 0.60 -0.12 0.00 -2.02 0.00 0.00 58.31 56.82 2oqe n LYS 201 Cb 0.42 -5.03 -0.09 0.00 -0.02 0.00 0.00 35.03 30.31 2oqe n LYS 201 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2oqe s LYS 202 N -5.88 0.54 -0.04 1.97 -2.85 -1.17 -4.95 119.74 107.35 2oqe s LYS 202 Ca 0.11 -0.36 -0.30 0.00 -1.00 0.00 0.00 55.97 54.43 2oqe s LYS 202 Cb -0.03 0.23 -0.03 0.00 -2.06 0.00 0.00 37.83 35.94 2oqe s LYS 202 CO 0.82 -0.13 1.06 0.08 0.10 0.00 0.00 175.35 177.27 2oqe s VAL 203 N -1.41 4.61 -0.32 1.79 1.01 -1.26 -0.74 120.40 124.08 2oqe s VAL 203 Ca -0.14 1.88 0.14 0.00 0.00 0.00 0.00 61.98 63.86 2oqe s VAL 203 Cb -0.07 -4.21 -0.19 0.00 0.00 0.00 0.00 36.38 31.92 2oqe s VAL 203 CO 0.02 0.07 0.44 2.30 0.00 0.00 0.00 175.10 177.93 2oqe n ILE 204 N 4.28 0.00 -3.52 2.22 -5.35 0.24 -4.94 119.36 112.28 2oqe n ILE 204 Ca 0.08 -0.25 -0.10 0.00 -0.27 0.00 0.00 62.75 62.21 2oqe n ILE 204 Cb 0.49 0.57 -0.03 0.00 -1.74 0.00 0.00 39.64 38.93 2oqe n ILE 204 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 2oqe s PHE 205 N -2.65 -0.38 -0.09 4.28 5.36 -1.21 -5.02 117.98 118.27 2oqe s PHE 205 Ca -0.00 0.40 -0.01 0.00 -0.96 0.00 0.00 56.93 56.36 2oqe s PHE 205 Cb 0.10 0.50 0.03 0.00 -0.34 0.00 0.00 43.02 43.31 2oqe s PHE 205 CO 0.58 -0.49 -0.02 0.42 -1.46 0.00 0.00 175.22 174.24 2oqe s ILE 206 N -2.41 0.63 -0.19 3.12 1.01 -1.26 -0.13 121.20 121.97 2oqe s ILE 206 Ca 0.02 -0.08 -0.29 0.00 0.00 0.00 0.00 60.65 60.30 2oqe s ILE 206 Cb -0.01 -0.76 -0.01 0.00 0.01 0.00 0.00 42.46 41.69 2oqe s ILE 206 CO -0.05 0.27 1.29 -1.81 0.00 0.00 0.00 174.94 174.64 2oqe s ASP 207 N 1.87 6.87 -0.13 3.58 1.01 -0.44 -4.90 116.67 124.52 2oqe s ASP 207 Ca 0.05 1.60 0.03 0.00 0.71 0.00 0.00 52.55 54.93 2oqe s ASP 207 Cb -0.13 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.27 2oqe s ASP 207 CO -0.06 -0.85 -0.22 -0.63 0.21 0.00 0.00 175.17 173.62 2oqe s ILE 208 N 3.74 2.18 0.67 0.77 1.01 -1.26 -1.32 121.20 126.98 2oqe s ILE 208 Ca 0.56 -0.96 -0.12 0.00 0.00 0.00 0.00 60.65 60.13 2oqe s ILE 208 Cb -0.21 -1.86 -0.00 0.00 0.01 0.00 0.00 42.46 40.39 2oqe s ILE 208 CO 0.17 0.55 1.06 -2.16 0.00 0.00 0.00 174.94 174.56 2oqe s PRO 209 N 0.61 3.04 0.22 2.79 0.04 -1.26 -4.95 135.00 135.49 2oqe s PRO 209 Ca -0.11 1.04 -0.04 0.00 0.04 0.00 0.00 61.00 61.93 2oqe s PRO 209 Cb -0.16 -2.00 0.21 0.00 0.04 0.00 0.00 34.50 32.59 2oqe s PRO 209 CO 0.03 -1.03 1.65 -0.91 0.04 0.00 0.00 177.00 176.79 2oqe h ASN 210 N -0.36 0.79 -3.52 6.66 2.35 -1.98 -3.38 115.58 116.13 2oqe h ASN 210 Ca -0.45 -0.26 -0.72 0.00 -0.55 0.00 0.00 56.30 54.32 2oqe h ASN 210 Cb 1.21 -0.21 -0.21 0.00 0.05 0.00 0.00 38.32 39.16 2oqe h ASN 210 CO 0.57 0.96 -0.44 -0.60 -1.65 0.00 0.00 177.43 176.27 2oqe s ARG 211 N -4.69 3.02 0.26 0.81 3.52 -1.26 -5.07 118.95 115.54 2oqe s ARG 211 Ca -0.09 -0.98 -0.29 0.00 -0.13 0.00 0.00 55.73 54.23 2oqe s ARG 211 Cb 0.13 -3.96 -0.09 0.00 -1.56 0.00 0.00 34.95 29.47 2oqe s ARG 211 CO 0.83 -0.72 1.01 1.03 -0.81 0.00 0.00 175.30 176.64 2oqe s ARG 212 N 1.68 4.74 -0.16 5.12 1.81 -1.26 -5.04 118.95 125.84 2oqe s ARG 212 Ca 0.05 1.61 -0.01 0.00 -1.72 0.00 0.00 55.73 55.66 2oqe s ARG 212 Cb -0.19 -3.21 0.05 0.00 -0.45 0.00 0.00 34.95 31.15 2oqe s ARG 212 CO 0.10 0.37 -0.02 1.03 -0.68 0.00 0.00 175.30 176.10 2oqe s ARG 213 N -1.35 1.10 0.75 3.54 3.00 -1.26 -5.06 118.95 119.67 2oqe s ARG 213 Ca 0.43 -0.42 -0.11 0.00 0.00 0.00 0.00 55.73 55.63 2oqe s ARG 213 Cb -0.28 -1.91 0.04 0.00 0.00 0.00 0.00 34.95 32.80 2oqe s ARG 213 CO 0.35 -0.48 1.08 0.15 0.00 0.00 0.00 175.30 176.40 2oqe s LYS 214 N 1.74 2.44 0.29 3.54 1.02 -1.26 -4.32 119.74 123.19 2oqe s LYS 214 Ca 0.01 0.98 -0.30 0.00 0.02 0.00 0.00 55.97 56.68 2oqe s LYS 214 Cb -0.15 -1.93 -0.13 0.00 -0.52 0.00 0.00 37.83 35.10 2oqe s LYS 214 CO -0.07 -1.46 1.34 1.55 -0.92 0.00 0.00 175.35 175.79 2oqe n VAL 215 N -3.37 1.49 -1.71 3.17 3.14 0.19 -4.91 118.33 116.33 2oqe n VAL 215 Ca 0.08 -0.37 -0.42 0.00 -2.96 0.00 0.00 64.34 60.67 2oqe n VAL 215 Cb 0.54 -1.52 -0.00 0.00 -1.06 0.00 0.00 33.84 31.80 2oqe n VAL 215 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2oqe n SER 216 N 1.46 2.88 -0.94 6.55 2.88 -1.26 -4.93 113.62 120.26 2oqe n SER 216 Ca 0.08 1.20 0.12 0.00 -1.33 0.00 0.00 58.87 58.93 2oqe n SER 216 Cb 0.34 -1.51 0.25 0.00 -0.75 0.00 0.00 64.21 62.55 2oqe n SER 216 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2oqe n LYS 217 N 0.47 2.24 -1.59 -1.46 5.02 -1.26 -4.97 118.16 116.61 2oqe n LYS 217 Ca 0.04 -1.86 -0.31 0.00 -2.02 0.00 0.00 58.31 54.16 2oqe n LYS 217 Cb 0.37 -1.47 0.05 0.00 -0.02 0.00 0.00 35.03 33.96 2oqe n LYS 217 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 2oqe s HIS 218 N -1.67 3.13 0.66 2.13 3.76 -1.26 -5.01 115.29 117.02 2oqe s HIS 218 Ca 0.35 1.40 -0.18 0.00 -0.15 0.00 0.00 55.06 56.48 2oqe s HIS 218 Cb 0.21 -2.89 -0.00 0.00 1.11 0.00 0.00 32.58 31.01 2oqe s HIS 218 CO 0.30 -1.24 1.29 0.15 -0.85 0.00 0.00 174.74 174.39 2oqe s LYS 219 N -5.06 2.49 0.60 1.40 1.02 -1.26 -4.97 119.74 113.95 2oqe s LYS 219 Ca 0.58 2.03 -0.18 0.00 0.02 0.00 0.00 55.97 58.42 2oqe s LYS 219 Cb -0.14 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.30 2oqe s LYS 219 CO 0.55 -1.64 1.18 -1.01 -0.92 0.00 0.00 175.35 173.51 2oqe s HIS 220 N -1.46 2.46 -0.68 3.18 3.76 -1.26 -4.96 115.29 116.32 2oqe s HIS 220 Ca 0.82 1.53 -0.18 0.00 -0.15 0.00 0.00 55.06 57.08 2oqe s HIS 220 Cb -0.37 -3.40 0.12 0.00 1.11 0.00 0.00 32.58 30.04 2oqe s HIS 220 CO 0.40 -2.03 0.80 0.00 -0.85 0.00 0.00 174.74 173.06 2oqe s ALA 221 N -1.74 3.47 0.37 -1.40 0.00 -1.26 -5.03 121.76 116.18 2oqe s ALA 221 Ca 0.75 -2.44 0.08 0.00 0.00 0.00 0.00 51.96 50.35 2oqe s ALA 221 Cb -0.28 -3.64 -0.03 0.00 0.00 0.00 0.00 23.12 19.18 2oqe s ALA 221 CO 0.33 -2.48 0.31 -0.80 0.00 0.00 0.00 175.76 173.13 2oqe s ASN 222 N 3.45 5.10 0.00 0.00 0.01 -1.26 -4.62 114.94 117.61 2oqe s ASN 222 Ca 0.17 -0.65 0.00 0.00 -0.71 0.00 0.00 52.86 51.67 2oqe s ASN 222 Cb -0.19 -0.76 0.00 0.00 0.41 0.00 0.00 41.25 40.71 2oqe s ASN 222 CO 0.02 -0.48 0.03 2.22 -1.51 0.00 0.00 177.10 177.38 2oqe n PHE 223 N -1.42 0.00 -1.92 2.20 -1.74 -1.26 -4.78 117.46 108.54 2oqe n PHE 223 Ca 0.00 0.00 -0.32 0.00 -0.56 0.00 0.00 57.45 56.57 2oqe n PHE 223 Cb 0.61 0.00 0.02 0.00 1.52 0.00 0.00 39.48 41.63 2oqe n PHE 223 CO 0.00 0.00 0.00 0.71 -0.56 0.00 0.00 176.76 176.91 2oqe s TYR 224 N 0.00 3.07 0.28 2.97 2.02 -1.26 -4.79 117.35 119.65 2oqe s TYR 224 Ca 0.00 1.48 0.01 0.00 -0.37 0.00 0.00 57.07 58.18 2oqe s TYR 224 Cb 0.00 -2.95 0.66 0.00 -0.40 0.00 0.00 41.96 39.28 2oqe s TYR 224 CO 0.00 -1.09 1.66 -1.35 -1.57 0.00 0.00 175.55 173.20 2oqe h PRO 225 N 0.09 0.22 -0.74 -1.71 0.11 -1.98 0.03 132.00 128.01 2oqe h PRO 225 Ca -0.46 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.64 2oqe h PRO 225 Cb 1.21 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.24 2oqe h PRO 225 CO 0.58 0.15 0.49 1.57 -0.21 0.00 0.00 178.00 180.57 2oqe h LYS 226 N 0.23 0.98 -0.37 1.05 2.10 -2.00 -0.11 116.57 118.45 2oqe h LYS 226 Ca 0.53 -0.06 -0.16 0.00 -2.00 0.00 0.00 60.65 58.96 2oqe h LYS 226 Cb 1.03 -0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 32.13 2oqe h LYS 226 CO -0.62 0.66 -0.38 0.45 -2.00 0.00 0.00 179.45 177.55 2oqe h HIS 227 N 1.01 1.09 -0.32 0.07 3.86 -1.46 -3.04 115.15 116.37 2oqe h HIS 227 Ca 0.27 -0.33 -0.11 0.00 -1.16 0.00 0.00 60.37 59.05 2oqe h HIS 227 Cb -0.11 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.12 2oqe h HIS 227 CO 0.00 1.15 -0.24 0.52 0.86 0.00 0.00 177.93 180.22 2oqe h MET 228 N 0.72 0.62 -0.79 2.45 2.86 -0.01 -1.42 114.93 119.37 2oqe h MET 228 Ca 0.06 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2oqe h MET 228 Cb 0.97 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.56 2oqe h MET 228 CO 0.09 0.81 0.44 0.82 1.06 0.00 0.00 176.91 180.14 2oqe h ILE 229 N 0.55 1.23 -0.51 -1.22 2.04 -1.05 0.17 117.51 118.72 2oqe h ILE 229 Ca 0.08 -0.56 -0.09 0.00 1.00 0.00 0.00 64.86 65.28 2oqe h ILE 229 Cb 0.71 0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 2oqe h ILE 229 CO 0.05 0.25 -0.06 -0.08 0.00 0.00 0.00 178.15 178.32 2oqe h GLU 230 N 1.09 0.90 0.07 2.37 4.81 -1.39 -0.48 114.58 121.95 2oqe h GLU 230 Ca 0.28 -0.29 -0.14 0.00 -0.13 0.00 0.00 59.36 59.08 2oqe h GLU 230 Cb 0.01 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 29.33 2oqe h GLU 230 CO -0.05 0.93 -0.59 -0.22 -0.73 0.00 0.00 179.01 178.36 2oqe h LYS 231 N 0.82 0.28 -0.00 1.92 3.64 -0.60 -3.39 116.57 119.23 2oqe h LYS 231 Ca 0.14 -0.39 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 2oqe h LYS 231 Cb 0.57 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 2oqe h LYS 231 CO 0.03 1.13 -0.01 1.33 -2.27 0.00 0.00 179.45 179.67 2oqe n VAL 232 N -4.26 0.00 0.00 2.00 0.24 0.52 -5.04 118.33 111.80 2oqe n VAL 232 Ca -0.12 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.69 2oqe n VAL 232 Cb 0.70 1.03 0.00 0.00 -1.47 0.00 0.00 33.84 34.10 2oqe n VAL 232 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2oqe n GLY 233 N 0.22 3.10 3.48 7.63 0.00 -0.19 -4.98 105.19 114.45 2oqe n GLY 233 Ca 0.01 -0.95 -0.14 0.00 0.00 0.00 0.00 46.02 44.94 2oqe n GLY 233 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqe s ALA 234 N -0.57 -1.72 0.64 4.61 0.00 -1.25 -4.78 121.76 118.68 2oqe s ALA 234 Ca 0.00 0.97 -0.12 0.00 0.00 0.00 0.00 51.96 52.81 2oqe s ALA 234 Cb 0.00 0.35 -0.02 0.00 0.00 0.00 0.00 23.12 23.44 2oqe s ALA 234 CO 0.00 -0.57 1.04 -1.64 0.00 0.00 0.00 175.76 174.59 2oqe s MET 235 N -2.47 3.34 0.63 0.00 1.00 -1.26 -4.73 119.30 115.80 2oqe s MET 235 Ca -0.03 0.90 -0.17 0.00 0.00 0.00 0.00 55.69 56.39 2oqe s MET 235 Cb -0.01 -2.04 -0.01 0.00 0.00 0.00 0.00 34.83 32.77 2oqe s MET 235 CO -0.03 -0.78 1.17 1.03 0.00 0.00 0.00 175.02 176.41 2oqe s ARG 236 N -4.90 2.81 0.56 2.03 0.52 -1.26 -4.98 118.95 113.74 2oqe s ARG 236 Ca 0.58 1.66 -0.20 0.00 -0.52 0.00 0.00 55.73 57.25 2oqe s ARG 236 Cb -0.13 -1.93 -0.06 0.00 0.52 0.00 0.00 34.95 33.36 2oqe s ARG 236 CO 0.50 -1.29 1.05 -2.30 0.02 0.00 0.00 175.30 173.28 2oqe n PRO 237 N -2.00 1.12 -1.65 3.54 -0.02 -1.26 -4.90 135.00 129.83 2oqe n PRO 237 Ca 0.12 0.42 -0.48 0.00 -2.02 0.00 0.00 63.50 61.55 2oqe n PRO 237 Cb 0.51 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.71 2oqe n PRO 237 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 2oqe n GLU 238 N -0.84 1.85 -2.50 -0.52 4.07 -1.26 -4.97 120.64 116.47 2oqe n GLU 238 Ca 0.12 0.67 -0.32 0.00 -0.06 0.00 0.00 57.16 57.58 2oqe n GLU 238 Cb 0.45 -2.41 -0.03 0.00 -0.06 0.00 0.00 31.44 29.39 2oqe n GLU 238 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2oqe s ALA 239 N 1.12 3.13 0.48 4.31 0.00 -1.26 -5.01 121.76 124.53 2oqe s ALA 239 Ca 0.82 0.09 -0.24 0.00 0.00 0.00 0.00 51.96 52.63 2oqe s ALA 239 Cb -0.77 -3.03 -0.07 0.00 0.00 0.00 0.00 23.12 19.26 2oqe s ALA 239 CO 0.42 -0.19 1.42 -2.30 0.00 0.00 0.00 175.76 175.11 2oqe n PRO 240 N -1.52 2.08 -2.00 0.00 -0.02 -1.26 -4.95 135.00 127.33 2oqe n PRO 240 Ca 0.06 0.75 -0.35 0.00 -2.02 0.00 0.00 63.50 61.93 2oqe n PRO 240 Cb 0.54 -2.62 0.03 0.00 -0.02 0.00 0.00 33.50 31.43 2oqe n PRO 240 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2oqe s PRO 241 N -2.60 2.98 -0.24 0.52 0.04 -1.26 -5.03 135.00 129.41 2oqe s PRO 241 Ca 0.65 1.73 0.01 0.00 0.04 0.00 0.00 61.00 63.43 2oqe s PRO 241 Cb -0.44 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.20 2oqe s PRO 241 CO 0.55 -1.17 -0.12 0.42 0.04 0.00 0.00 177.00 176.71 2oqe s ILE 242 N -1.74 2.31 -0.10 0.56 1.01 -1.26 -5.12 121.20 116.86 2oqe s ILE 242 Ca 0.75 -1.33 -0.02 0.00 0.00 0.00 0.00 60.65 60.05 2oqe s ILE 242 Cb -0.28 -2.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2oqe s ILE 242 CO 0.33 0.16 0.00 0.20 0.00 0.00 0.00 174.94 175.64 2oqe s ASN 243 N 1.20 5.24 -0.18 3.58 0.01 -1.26 -5.08 114.94 118.44 2oqe s ASN 243 Ca -0.03 0.13 0.01 0.00 -0.71 0.00 0.00 52.86 52.25 2oqe s ASN 243 Cb -0.17 -1.53 0.02 0.00 0.41 0.00 0.00 41.25 39.97 2oqe s ASN 243 CO -0.07 0.35 -0.19 -0.69 -1.51 0.00 0.00 177.10 175.00 2oqe s VAL 244 N -0.72 2.19 0.11 1.60 1.01 -1.26 -5.12 120.40 118.21 2oqe s VAL 244 Ca 0.11 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.25 2oqe s VAL 244 Cb -0.12 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.30 2oqe s VAL 244 CO 0.02 0.53 -0.14 0.42 0.00 0.00 0.00 175.10 175.94 2oqe s THR 245 N 1.27 1.25 -0.51 3.92 -4.23 -1.26 -4.53 115.64 111.55 2oqe s THR 245 Ca 0.04 -1.64 0.04 0.00 -1.18 0.00 0.00 61.69 58.95 2oqe s THR 245 Cb -0.13 -1.44 0.17 0.00 1.34 0.00 0.00 72.50 72.44 2oqe s THR 245 CO -0.11 -0.40 0.39 -1.10 -0.54 0.00 0.00 174.62 172.86 2oqe s GLN 246 N -2.53 1.42 0.56 3.99 -0.21 -1.26 -5.00 119.66 116.63 2oqe s GLN 246 Ca 0.07 -2.52 0.30 0.00 0.02 0.00 0.00 55.36 53.23 2oqe s GLN 246 Cb -0.05 -2.08 1.69 0.00 1.00 0.00 0.00 33.01 33.57 2oqe s GLN 246 CO 0.02 -1.35 2.18 -1.00 -2.12 0.00 0.00 175.29 173.02 2oqe h PRO 247 N 5.56 0.00 -0.59 2.91 0.13 -2.05 -0.85 132.00 137.10 2oqe h PRO 247 Ca 0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.36 2oqe h PRO 247 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2oqe h PRO 247 CO 0.49 0.05 0.00 0.39 -0.23 0.00 0.00 178.00 178.70 2oqe n GLU 248 N -3.68 3.51 0.00 0.86 1.02 -1.26 -5.08 120.64 116.01 2oqe n GLU 248 Ca -0.02 -2.79 0.00 0.00 -0.02 0.00 0.00 57.16 54.33 2oqe n GLU 248 Cb 0.16 -1.80 0.00 0.00 -0.02 0.00 0.00 31.44 29.78 2oqe n GLU 248 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oqe n GLY 249 N 0.97 -1.91 3.90 0.62 0.00 -0.33 -4.99 105.19 103.46 2oqe n GLY 249 Ca 0.24 -1.64 -0.21 0.00 0.00 0.00 0.00 46.02 44.41 2oqe n GLY 249 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2oqe s VAL 250 N 0.00 4.11 -0.41 1.61 -7.23 -1.26 -4.82 120.40 112.40 2oqe s VAL 250 Ca 0.00 -1.22 0.23 0.00 -1.81 0.00 0.00 61.98 59.18 2oqe s VAL 250 Cb 0.00 -3.39 0.02 0.00 0.56 0.00 0.00 36.38 33.57 2oqe s VAL 250 CO 0.00 -0.23 1.16 0.77 -0.31 0.00 0.00 175.10 176.49 2oqe h SER 251 N 1.19 0.00 -3.77 4.85 4.64 -1.97 -3.47 113.55 115.02 2oqe h SER 251 Ca -0.47 -0.10 -0.50 0.00 -0.47 0.00 0.00 61.79 60.26 2oqe h SER 251 Cb 1.25 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.37 2oqe h SER 251 CO 0.58 0.05 0.18 0.72 -0.87 0.00 0.00 176.83 177.49 2oqe s PHE 252 N -3.28 3.56 -0.10 4.77 -0.71 -1.26 -4.83 117.98 116.12 2oqe s PHE 252 Ca 0.02 0.96 -0.00 0.00 -1.04 0.00 0.00 56.93 56.87 2oqe s PHE 252 Cb 0.11 -2.42 0.02 0.00 -1.21 0.00 0.00 43.02 39.52 2oqe s PHE 252 CO 0.76 -0.34 -0.07 0.21 -1.34 0.00 0.00 175.22 174.45 2oqe s LYS 253 N -4.67 1.41 -0.16 1.99 2.20 -0.33 -5.00 119.74 115.19 2oqe s LYS 253 Ca 0.50 -0.22 -0.07 0.00 -0.36 0.00 0.00 55.97 55.82 2oqe s LYS 253 Cb -0.10 -1.48 -0.04 0.00 -1.51 0.00 0.00 37.83 34.70 2oqe s LYS 253 CO 0.44 -0.24 0.07 -1.64 -0.36 0.00 0.00 175.35 173.62 2oqe s MET 254 N 1.62 3.79 -0.40 4.03 -1.94 -1.26 -0.82 119.30 124.32 2oqe s MET 254 Ca 0.03 -0.31 0.04 0.00 -1.71 0.00 0.00 55.69 53.73 2oqe s MET 254 Cb -0.13 -3.17 0.11 0.00 2.01 0.00 0.00 34.83 33.65 2oqe s MET 254 CO -0.07 0.40 0.13 0.99 -0.01 0.00 0.00 175.02 176.47 2oqe s THR 255 N 0.00 2.28 0.00 2.05 2.01 0.14 -4.96 115.64 117.17 2oqe s THR 255 Ca 0.06 -2.65 0.00 0.00 0.31 0.00 0.00 61.69 59.41 2oqe s THR 255 Cb -0.12 -2.65 0.00 0.00 0.01 0.00 0.00 72.50 69.74 2oqe s THR 255 CO 0.01 -0.68 0.00 0.61 -0.69 0.00 0.00 174.62 173.86 2oqe n GLY 256 N 3.86 4.08 0.98 4.40 0.00 -1.26 -1.71 105.19 115.53 2oqe n GLY 256 Ca 0.04 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2oqe n GLY 256 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2oqe n ASN 257 N 8.58 2.92 -4.68 1.61 4.13 -1.26 -4.90 115.26 121.65 2oqe n ASN 257 Ca 0.00 -1.92 -0.39 0.00 1.68 0.00 0.00 54.58 53.95 2oqe n ASN 257 Cb 0.00 -0.22 -0.06 0.00 -1.54 0.00 0.00 39.78 37.95 2oqe n ASN 257 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2oqe s VAL 258 N -1.55 5.13 -0.12 2.41 1.01 -0.70 -0.59 120.40 126.00 2oqe s VAL 258 Ca 0.37 0.95 -0.03 0.00 0.00 0.00 0.00 61.98 63.26 2oqe s VAL 258 Cb 0.21 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.72 2oqe s VAL 258 CO 0.29 0.23 0.01 -0.32 0.00 0.00 0.00 175.10 175.31 2oqe s MET 259 N 1.30 3.29 -0.11 2.72 1.75 0.69 -0.68 119.30 128.26 2oqe s MET 259 Ca 0.25 -0.40 0.02 0.00 -1.25 0.00 0.00 55.69 54.30 2oqe s MET 259 Cb -0.15 -2.90 0.01 0.00 2.84 0.00 0.00 34.83 34.63 2oqe s MET 259 CO 0.10 0.55 -0.15 -1.21 -0.65 0.00 0.00 175.02 173.66 2oqe s GLU 260 N -0.46 2.20 -0.29 4.11 2.02 -0.00 -1.59 118.70 124.69 2oqe s GLU 260 Ca 0.09 -0.55 -0.14 0.00 0.02 0.00 0.00 54.97 54.38 2oqe s GLU 260 Cb -0.12 -1.87 0.09 0.00 0.10 0.00 0.00 34.13 32.33 2oqe s GLU 260 CO 0.02 -0.06 0.68 -0.46 0.02 0.00 0.00 175.26 175.46 2oqe s TRP 261 N 0.98 -1.14 -1.50 1.61 -0.00 -0.50 -1.18 118.94 117.21 2oqe s TRP 261 Ca -0.07 2.19 -0.03 0.00 -0.00 0.00 0.00 56.10 58.19 2oqe s TRP 261 Cb -0.15 0.68 0.03 0.00 -0.00 0.00 0.00 33.47 34.03 2oqe s TRP 261 CO -0.01 -0.57 0.34 0.45 -0.00 0.00 0.00 176.95 177.16 2oqe n SER 262 N 4.61 -0.31 0.00 5.86 2.88 -1.26 -0.55 113.62 124.85 2oqe n SER 262 Ca -0.18 -1.10 0.00 0.00 -1.33 0.00 0.00 58.87 56.26 2oqe n SER 262 Cb 0.56 -2.53 0.00 0.00 -0.75 0.00 0.00 64.21 61.49 2oqe n SER 262 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2oqe n ASN 263 N -2.90 0.00 -4.78 -3.46 3.02 -1.26 -4.95 115.26 100.93 2oqe n ASN 263 Ca -0.26 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 53.92 2oqe n ASN 263 Cb 0.66 -0.08 -0.04 0.00 -0.61 0.00 0.00 39.78 39.71 2oqe n ASN 263 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2oqe s PHE 264 N -1.57 3.30 -0.01 3.10 0.08 0.29 -0.36 117.98 122.82 2oqe s PHE 264 Ca 0.00 1.65 0.02 0.00 0.12 0.00 0.00 56.93 58.72 2oqe s PHE 264 Cb 0.00 -3.16 0.00 0.00 -0.57 0.00 0.00 43.02 39.29 2oqe s PHE 264 CO 0.00 -0.64 -0.05 0.21 -0.10 0.00 0.00 175.22 174.64 2oqe s LYS 265 N -2.34 0.51 0.13 0.44 2.20 -0.58 -1.41 119.74 118.69 2oqe s LYS 265 Ca 0.56 -0.17 -0.25 0.00 -0.36 0.00 0.00 55.97 55.75 2oqe s LYS 265 Cb -0.24 -0.51 0.07 0.00 -1.51 0.00 0.00 37.83 35.64 2oqe s LYS 265 CO 0.30 0.07 0.83 -0.59 -0.36 0.00 0.00 175.35 175.60 2oqe s PHE 266 N 0.12 -0.28 -0.19 4.03 -0.71 -0.62 -0.84 117.98 119.49 2oqe s PHE 266 Ca -0.01 0.02 -0.08 0.00 -1.04 0.00 0.00 56.93 55.82 2oqe s PHE 266 Cb -0.05 0.60 -0.04 0.00 -1.21 0.00 0.00 43.02 42.32 2oqe s PHE 266 CO -0.00 -0.81 0.09 -1.58 -1.34 0.00 0.00 175.22 171.58 2oqe s HIS 267 N -3.42 3.31 -0.40 3.49 5.65 0.18 -0.22 115.29 123.88 2oqe s HIS 267 Ca 0.08 0.17 -0.18 0.00 0.25 0.00 0.00 55.06 55.38 2oqe s HIS 267 Cb -0.02 -2.11 0.01 0.00 -1.18 0.00 0.00 32.58 29.28 2oqe s HIS 267 CO -0.03 0.20 0.46 0.42 -0.65 0.00 0.00 174.74 175.14 2oqe s ILE 268 N 0.39 5.05 0.48 0.89 1.01 0.24 -1.16 121.20 128.10 2oqe s ILE 268 Ca 0.05 -0.10 0.06 0.00 0.00 0.00 0.00 60.65 60.66 2oqe s ILE 268 Cb -0.12 -4.01 -0.01 0.00 0.01 0.00 0.00 42.46 38.33 2oqe s ILE 268 CO -0.01 -0.36 0.26 -0.83 0.00 0.00 0.00 174.94 174.00 2oqe s GLY 269 N 1.81 2.43 -0.22 6.18 0.00 0.66 -4.83 107.32 113.36 2oqe s GLY 269 Ca 0.15 -1.53 -0.23 0.00 0.00 0.00 0.00 44.72 43.10 2oqe s GLY 269 CO 0.14 -1.94 0.64 -0.12 0.00 0.00 0.00 173.10 171.82 2oqe s PHE 270 N -2.69 -0.69 0.24 1.90 5.36 -1.26 -1.53 117.98 119.31 2oqe s PHE 270 Ca 0.34 1.64 -0.04 0.00 -0.96 0.00 0.00 56.93 57.91 2oqe s PHE 270 Cb 0.01 0.25 -0.02 0.00 -0.34 0.00 0.00 43.02 42.92 2oqe s PHE 270 CO 0.20 -0.37 0.29 0.54 -1.46 0.00 0.00 175.22 174.42 2oqe s ASN 271 N 0.17 0.25 0.61 6.13 2.20 -0.23 -4.72 114.94 119.34 2oqe s ASN 271 Ca -0.01 -1.28 0.31 0.00 -0.94 0.00 0.00 52.86 50.94 2oqe s ASN 271 Cb -0.04 0.49 1.74 0.00 -2.00 0.00 0.00 41.25 41.44 2oqe s ASN 271 CO 0.02 -1.00 2.10 0.10 -2.94 0.00 0.00 177.10 175.38 2oqe h TYR 272 N 2.42 0.00 0.00 1.54 -0.00 -1.91 -2.01 116.97 117.01 2oqe h TYR 272 Ca -0.31 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.31 2oqe h TYR 272 Cb 1.25 0.00 -0.02 0.00 -0.00 0.00 0.00 36.73 37.96 2oqe h TYR 272 CO 0.57 0.00 -1.09 -2.13 -0.00 0.00 0.00 178.16 175.50 2oqe n ARG 273 N -3.60 0.29 0.15 0.10 0.63 -1.26 -0.88 116.66 112.10 2oqe n ARG 273 Ca 0.01 0.12 0.12 0.00 -0.92 0.00 0.00 57.85 57.18 2oqe n ARG 273 Cb 0.31 -1.00 0.21 0.00 0.45 0.00 0.00 32.46 32.44 2oqe n ARG 273 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2oqe h GLU 274 N -0.52 0.00 0.00 -0.14 5.08 -1.81 0.49 114.58 117.67 2oqe h GLU 274 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.20 2oqe h GLU 274 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2oqe h GLU 274 CO -0.10 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.32 2oqe n GLY 275 N 1.19 2.19 3.73 -3.84 0.00 -0.76 -4.61 105.19 103.10 2oqe n GLY 275 Ca 0.04 -0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.28 2oqe n GLY 275 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oqe s ILE 276 N 0.00 2.43 -0.11 -0.61 1.01 -1.26 -1.06 121.20 121.60 2oqe s ILE 276 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 60.65 60.98 2oqe s ILE 276 Cb 0.00 -3.21 0.02 0.00 0.01 0.00 0.00 42.46 39.28 2oqe s ILE 276 CO 0.00 0.04 -0.09 -0.69 0.00 0.00 0.00 174.94 174.20 2oqe s VAL 277 N 0.74 1.09 -0.23 2.92 1.01 -0.58 -4.54 120.40 120.82 2oqe s VAL 277 Ca 0.68 -0.35 -0.09 0.00 0.00 0.00 0.00 61.98 62.21 2oqe s VAL 277 Cb -0.45 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 2oqe s VAL 277 CO 0.36 0.37 0.12 -0.76 0.00 0.00 0.00 175.10 175.20 2oqe s LEU 278 N 1.50 3.94 0.15 3.92 1.43 -0.56 -0.24 118.68 128.83 2oqe s LEU 278 Ca 0.02 0.06 0.07 0.00 -1.03 0.00 0.00 54.13 53.25 2oqe s LEU 278 Cb -0.13 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.01 2oqe s LEU 278 CO -0.06 0.08 -0.16 -0.44 0.23 0.00 0.00 176.35 175.99 2oqe s SER 279 N 0.96 2.42 -1.23 2.29 0.01 -0.31 -0.54 113.70 117.30 2oqe s SER 279 Ca 0.06 -0.86 -0.01 0.00 1.31 0.00 0.00 55.95 56.45 2oqe s SER 279 Cb -0.13 -0.12 -0.00 0.00 0.21 0.00 0.00 66.02 65.97 2oqe s SER 279 CO 0.03 -0.09 0.87 -0.67 0.41 0.00 0.00 173.24 173.79 2oqe n ASP 280 N 0.29 -2.01 -4.67 2.44 2.03 0.44 -0.65 116.55 114.43 2oqe n ASP 280 Ca -0.13 -0.71 -0.41 0.00 0.52 0.00 0.00 54.79 54.05 2oqe n ASP 280 Cb 0.57 -4.67 -0.05 0.00 -0.72 0.00 0.00 41.12 36.26 2oqe n ASP 280 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2oqe s VAL 281 N -3.49 4.92 0.19 5.18 1.01 0.12 -4.13 120.40 124.20 2oqe s VAL 281 Ca 0.04 1.50 0.03 0.00 0.00 0.00 0.00 61.98 63.54 2oqe s VAL 281 Cb -0.01 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 2oqe s VAL 281 CO 0.77 0.05 -0.01 -0.94 0.00 0.00 0.00 175.10 174.97 2oqe s SER 282 N 1.17 1.51 -0.09 3.32 1.04 -0.02 -0.66 113.70 119.97 2oqe s SER 282 Ca 0.35 -1.17 0.01 0.00 0.48 0.00 0.00 55.95 55.62 2oqe s SER 282 Cb -0.16 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.04 2oqe s SER 282 CO 0.12 -0.52 -0.12 -0.47 0.98 0.00 0.00 173.24 173.22 2oqe s TYR 283 N -3.53 1.64 -0.81 5.02 5.04 0.03 -1.52 117.35 123.23 2oqe s TYR 283 Ca 0.25 -0.72 -0.24 0.00 -2.44 0.00 0.00 57.07 53.92 2oqe s TYR 283 Cb 0.05 -1.23 0.06 0.00 0.35 0.00 0.00 41.96 41.19 2oqe s TYR 283 CO 0.05 -0.40 1.23 1.21 -1.34 0.00 0.00 175.55 176.30 2oqe s ASN 284 N 1.03 6.29 -1.13 4.32 3.84 0.51 -0.82 114.94 128.98 2oqe s ASN 284 Ca -0.07 -0.99 -0.15 0.00 0.21 0.00 0.00 52.86 51.86 2oqe s ASN 284 Cb -0.15 -2.51 0.16 0.00 -0.55 0.00 0.00 41.25 38.20 2oqe s ASN 284 CO -0.01 -1.58 1.36 -0.62 -2.79 0.00 0.00 177.10 173.45 2oqe s ASP 285 N 4.01 6.94 -1.44 -4.21 2.15 0.49 -4.52 116.67 120.09 2oqe s ASP 285 Ca 0.34 -2.72 -0.00 0.00 0.43 0.00 0.00 52.55 50.60 2oqe s ASP 285 Cb -0.08 -2.41 0.00 0.00 -0.30 0.00 0.00 42.92 40.14 2oqe s ASP 285 CO 0.05 -0.85 0.35 1.41 -0.17 0.00 0.00 175.17 175.97 2oqe n HIS 286 N 5.98 -1.58 0.00 -5.34 8.25 -1.26 -1.82 115.22 119.44 2oqe n HIS 286 Ca 0.34 0.72 0.00 0.00 -0.26 0.00 0.00 57.72 58.52 2oqe n HIS 286 Cb 0.45 -3.56 0.00 0.00 1.12 0.00 0.00 29.99 27.99 2oqe n HIS 286 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2oqe n GLY 287 N -2.08 2.76 3.51 -1.41 0.00 -1.26 -5.01 105.19 101.70 2oqe n GLY 287 Ca -0.31 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 2oqe n GLY 287 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2oqe s ASN 288 N -0.13 6.34 -0.51 1.61 2.47 -0.76 -5.01 114.94 118.95 2oqe s ASN 288 Ca 0.00 -0.39 -0.27 0.00 0.42 0.00 0.00 52.86 52.62 2oqe s ASN 288 Cb 0.00 -2.38 0.03 0.00 -1.45 0.00 0.00 41.25 37.45 2oqe s ASN 288 CO 0.00 -1.04 1.05 -0.69 -3.72 0.00 0.00 177.10 172.71 2oqe s VAL 289 N 3.41 4.27 -0.24 -5.21 1.01 -1.26 -0.38 120.40 122.00 2oqe s VAL 289 Ca 0.27 0.82 -0.05 0.00 0.00 0.00 0.00 61.98 63.01 2oqe s VAL 289 Cb -0.14 -4.58 -0.01 0.00 0.00 0.00 0.00 36.38 31.65 2oqe s VAL 289 CO 0.19 -1.07 0.01 -0.13 0.00 0.00 0.00 175.10 174.10 2oqe s ARG 290 N 4.29 3.42 0.66 2.72 0.52 0.00 -4.92 118.95 125.64 2oqe s ARG 290 Ca 0.40 -0.62 -0.18 0.00 -0.52 0.00 0.00 55.73 54.82 2oqe s ARG 290 Cb -0.09 -3.16 -0.01 0.00 0.52 0.00 0.00 34.95 32.21 2oqe s ARG 290 CO 0.26 -0.23 1.30 -2.14 0.02 0.00 0.00 175.30 174.51 2oqe s PRO 291 N 1.52 2.50 0.11 3.54 0.02 -1.26 -0.79 135.00 140.64 2oqe s PRO 291 Ca 0.05 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.14 2oqe s PRO 291 Cb -0.15 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.53 2oqe s PRO 291 CO -0.00 -1.64 0.00 -0.89 -0.33 0.00 0.00 177.00 174.14 2oqe n ILE 292 N -1.96 0.62 -4.24 2.83 5.41 0.16 -0.52 119.36 121.66 2oqe n ILE 292 Ca 0.16 0.21 -0.18 0.00 1.00 0.00 0.00 62.75 63.94 2oqe n ILE 292 Cb 0.48 -1.28 -0.15 0.00 -0.71 0.00 0.00 39.64 37.98 2oqe n ILE 292 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2oqe s PHE 293 N -2.00 0.65 0.15 1.39 0.08 -1.08 -0.75 117.98 116.42 2oqe s PHE 293 Ca 0.00 -0.14 -0.05 0.00 0.12 0.00 0.00 56.93 56.87 2oqe s PHE 293 Cb 0.00 -0.46 -0.03 0.00 -0.57 0.00 0.00 43.02 41.96 2oqe s PHE 293 CO 0.00 -0.05 1.37 1.25 -0.10 0.00 0.00 175.22 177.69 2oqe h HIS 294 N 6.25 0.68 -1.98 0.36 -0.00 -0.36 0.36 115.15 120.47 2oqe h HIS 294 Ca -0.31 -0.32 -0.03 0.00 -0.00 0.00 0.00 60.37 59.71 2oqe h HIS 294 Cb 1.18 -0.10 -0.21 0.00 -0.00 0.00 0.00 27.41 28.28 2oqe h HIS 294 CO 0.43 1.10 0.15 0.50 -0.00 0.00 0.00 177.93 180.11 2oqe s ARG 295 N -3.56 0.82 -0.04 5.26 3.52 -1.02 -0.42 118.95 123.51 2oqe s ARG 295 Ca -0.07 0.98 -0.03 0.00 -0.13 0.00 0.00 55.73 56.48 2oqe s ARG 295 Cb 0.10 0.40 0.02 0.00 -1.56 0.00 0.00 34.95 33.90 2oqe s ARG 295 CO 0.86 -0.10 0.10 -1.50 -0.81 0.00 0.00 175.30 173.85 2oqe s ILE 296 N 0.39 -0.02 0.15 4.11 2.07 0.30 -0.61 121.20 127.61 2oqe s ILE 296 Ca 0.00 0.07 -0.25 0.00 -1.41 0.00 0.00 60.65 59.06 2oqe s ILE 296 Cb -0.05 -0.16 0.06 0.00 0.13 0.00 0.00 42.46 42.44 2oqe s ILE 296 CO 0.00 0.03 0.97 -0.94 -1.91 0.00 0.00 174.94 173.09 2oqe s SER 297 N 0.46 -0.17 -0.12 4.50 1.04 -0.94 -1.50 113.70 116.98 2oqe s SER 297 Ca -0.03 -0.42 -0.19 0.00 0.48 0.00 0.00 55.95 55.79 2oqe s SER 297 Cb -0.05 0.49 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 2oqe s SER 297 CO -0.02 -0.90 0.52 -0.76 0.98 0.00 0.00 173.24 173.06 2oqe s LEU 298 N -2.96 4.27 -0.02 2.42 1.43 -1.26 -0.78 118.68 121.78 2oqe s LEU 298 Ca 0.13 0.87 0.10 0.00 -1.03 0.00 0.00 54.13 54.20 2oqe s LEU 298 Cb -0.01 -2.77 -0.15 0.00 0.03 0.00 0.00 46.19 43.29 2oqe s LEU 298 CO 0.02 -0.04 0.21 -1.54 0.23 0.00 0.00 176.35 175.24 2oqe n SER 299 N 3.78 2.70 -3.62 2.29 3.41 0.70 -4.60 113.62 118.29 2oqe n SER 299 Ca -0.06 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.48 2oqe n SER 299 Cb 0.51 1.41 -0.02 0.00 -0.26 0.00 0.00 64.21 65.86 2oqe n SER 299 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2oqe s GLU 300 N -2.67 1.11 0.15 4.33 2.56 -1.23 -4.53 118.70 118.42 2oqe s GLU 300 Ca -0.04 -0.52 -0.01 0.00 0.00 0.00 0.00 54.97 54.40 2oqe s GLU 300 Cb 0.06 0.44 -0.04 0.00 2.00 0.00 0.00 34.13 36.59 2oqe s GLU 300 CO 0.42 -0.50 0.07 -1.64 -0.56 0.00 0.00 175.26 173.05 2oqe s MET 301 N -3.34 0.99 -0.11 4.30 -1.94 -1.26 -0.62 119.30 117.32 2oqe s MET 301 Ca 0.08 -1.49 -0.13 0.00 -1.71 0.00 0.00 55.69 52.44 2oqe s MET 301 Cb -0.02 0.25 0.03 0.00 2.01 0.00 0.00 34.83 37.11 2oqe s MET 301 CO -0.04 -0.29 0.35 -1.50 -0.01 0.00 0.00 175.02 173.53 2oqe s ILE 302 N -4.08 0.01 -0.59 2.53 2.07 -0.06 -4.02 121.20 117.06 2oqe s ILE 302 Ca 0.28 -0.07 0.06 0.00 -1.41 0.00 0.00 60.65 59.51 2oqe s ILE 302 Cb 0.07 -0.52 0.22 0.00 0.13 0.00 0.00 42.46 42.37 2oqe s ILE 302 CO 0.04 -0.04 0.61 0.52 -1.91 0.00 0.00 174.94 174.17 2oqe n VAL 303 N 2.63 1.35 -2.60 4.00 0.31 -0.29 -0.59 118.33 123.14 2oqe n VAL 303 Ca -0.14 -4.78 -0.42 0.00 -0.01 0.00 0.00 64.34 58.99 2oqe n VAL 303 Cb 0.57 -2.06 -0.03 0.00 -0.91 0.00 0.00 33.84 31.42 2oqe n VAL 303 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2oqe s PRO 304 N -1.80 4.44 0.51 5.55 0.04 -1.13 -3.65 135.00 138.95 2oqe s PRO 304 Ca 0.35 1.52 -0.09 0.00 0.04 0.00 0.00 61.00 62.82 2oqe s PRO 304 Cb 0.10 -3.50 -0.05 0.00 0.04 0.00 0.00 34.50 31.09 2oqe s PRO 304 CO -0.08 -0.28 0.87 0.71 0.04 0.00 0.00 177.00 178.26 2oqe s TYR 305 N 1.71 3.55 -0.40 0.56 2.02 -0.46 -1.39 117.35 122.94 2oqe s TYR 305 Ca 0.52 1.07 0.12 0.00 -0.37 0.00 0.00 57.07 58.42 2oqe s TYR 305 Cb -0.22 -2.50 0.33 0.00 -0.40 0.00 0.00 41.96 39.17 2oqe s TYR 305 CO 0.23 -0.36 1.25 0.41 -1.57 0.00 0.00 175.55 175.51 2oqe n GLY 306 N -2.10 3.55 3.69 0.71 0.00 0.10 -4.93 105.19 106.22 2oqe n GLY 306 Ca 0.03 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 45.01 2oqe n GLY 306 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oqe s SER 307 N -1.60 6.59 0.00 1.61 0.15 -1.26 -4.84 113.70 114.36 2oqe s SER 307 Ca 0.27 0.71 0.30 0.00 0.70 0.00 0.00 55.95 57.93 2oqe s SER 307 Cb 0.20 -2.28 1.41 0.00 -1.71 0.00 0.00 66.02 63.64 2oqe s SER 307 CO 0.09 -0.08 1.99 -0.81 1.20 0.00 0.00 173.24 175.63 2oqe n PRO 308 N 4.25 0.34 -2.55 5.44 -0.04 -1.26 -4.20 135.00 136.99 2oqe n PRO 308 Ca -0.06 -0.02 -0.40 0.00 -0.04 0.00 0.00 63.50 62.97 2oqe n PRO 308 Cb 0.51 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.42 2oqe n PRO 308 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2oqe s GLU 309 N -2.67 4.68 0.34 0.54 2.02 -1.26 -4.74 118.70 117.60 2oqe s GLU 309 Ca 0.25 1.71 -0.29 0.00 0.02 0.00 0.00 54.97 56.67 2oqe s GLU 309 Cb 0.20 -3.23 -0.10 0.00 0.10 0.00 0.00 34.13 31.10 2oqe s GLU 309 CO 0.48 0.25 1.31 0.12 0.02 0.00 0.00 175.26 177.44 2oqe s PHE 310 N -0.96 3.03 -0.39 1.61 5.36 -1.26 -0.47 117.98 124.90 2oqe s PHE 310 Ca 0.45 1.42 0.03 0.00 -0.96 0.00 0.00 56.93 57.87 2oqe s PHE 310 Cb -0.30 -3.68 0.58 0.00 -0.34 0.00 0.00 43.02 39.29 2oqe s PHE 310 CO 0.38 -1.87 1.80 -0.35 -1.46 0.00 0.00 175.22 173.72 2oqe n PRO 311 N 0.75 2.09 0.09 10.12 -0.04 -1.26 -4.99 135.00 141.76 2oqe n PRO 311 Ca 0.00 -2.63 0.11 0.00 -0.04 0.00 0.00 63.50 60.95 2oqe n PRO 311 Cb 0.42 -2.03 0.45 0.00 -0.04 0.00 0.00 33.50 32.30 2oqe n PRO 311 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2oqe n HIS 312 N -0.94 0.61 0.32 0.54 8.25 0.38 -1.80 115.22 122.57 2oqe n HIS 312 Ca 0.52 0.23 0.19 0.00 -0.26 0.00 0.00 57.72 58.41 2oqe n HIS 312 Cb 1.53 -0.87 1.05 0.00 1.12 0.00 0.00 29.99 32.82 2oqe n HIS 312 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 2oqe h GLN 313 N 0.00 0.00 -0.02 -0.41 -0.00 -1.73 -1.83 115.11 111.12 2oqe h GLN 313 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2oqe h GLN 313 Cb 0.39 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.87 2oqe h GLN 313 CO 0.00 0.01 0.00 0.54 -0.00 0.00 0.00 178.83 179.38 2oqe n ARG 314 N -3.35 1.10 -3.18 0.06 1.74 -0.75 -4.49 116.66 107.78 2oqe n ARG 314 Ca -0.03 -0.14 -0.46 0.00 -0.77 0.00 0.00 57.85 56.45 2oqe n ARG 314 Cb 0.11 -1.32 -0.03 0.00 -1.02 0.00 0.00 32.46 30.20 2oqe n ARG 314 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2oqe s LYS 315 N -1.97 3.47 -0.44 5.56 1.02 -0.69 -4.58 119.74 122.11 2oqe s LYS 315 Ca 0.30 -2.03 0.07 0.00 0.02 0.00 0.00 55.97 54.33 2oqe s LYS 315 Cb 0.14 -4.53 0.34 0.00 -0.52 0.00 0.00 37.83 33.26 2oqe s LYS 315 CO 0.23 -1.47 1.12 -2.39 -0.92 0.00 0.00 175.35 171.92 2oqe n HIS 316 N 5.16 -2.42 -1.71 3.18 1.44 -1.26 -1.35 115.22 118.27 2oqe n HIS 316 Ca 0.11 -2.27 -0.43 0.00 -2.01 0.00 0.00 57.72 53.11 2oqe n HIS 316 Cb 0.46 1.39 -0.03 0.00 0.12 0.00 0.00 29.99 31.93 2oqe n HIS 316 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2oqe n ALA 317 N 0.17 1.99 -3.40 1.59 0.00 -1.24 -4.40 120.51 115.22 2oqe n ALA 317 Ca 0.06 0.40 -0.44 0.00 0.00 0.00 0.00 53.44 53.47 2oqe n ALA 317 Cb 0.73 -2.40 -0.02 0.00 0.00 0.00 0.00 19.45 17.75 2oqe n ALA 317 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2oqe s LEU 318 N 0.23 6.29 0.24 0.00 1.02 -1.26 -1.14 118.68 124.07 2oqe s LEU 318 Ca 0.70 -3.30 -0.06 0.00 0.02 0.00 0.00 54.13 51.48 2oqe s LEU 318 Cb -0.57 -2.15 0.27 0.00 0.02 0.00 0.00 46.19 43.76 2oqe s LEU 318 CO 0.44 -0.36 1.90 0.44 0.02 0.00 0.00 176.35 178.78 2oqe h ASP 319 N 6.92 1.01 0.07 2.29 3.32 -1.92 0.34 116.42 128.46 2oqe h ASP 319 Ca 0.14 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 2oqe h ASP 319 Cb 0.92 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 40.23 2oqe h ASP 319 CO 0.89 0.70 -0.03 0.40 -1.72 0.00 0.00 179.24 179.49 2oqe h ILE 320 N 1.18 1.07 0.00 0.35 2.04 -1.86 0.54 117.51 120.84 2oqe h ILE 320 Ca 0.36 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2oqe h ILE 320 Cb -0.04 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 2oqe h ILE 320 CO -0.11 0.12 -0.06 1.23 0.00 0.00 0.00 178.15 179.34 2oqe h GLY 321 N -0.31 0.00 0.00 5.37 0.00 -1.72 -2.64 103.07 103.77 2oqe h GLY 321 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 2oqe h GLY 321 CO 0.02 0.00 -1.87 1.18 0.00 0.00 0.00 176.54 175.87 2oqe n GLU 322 N -3.12 0.59 0.00 4.80 1.02 0.11 -4.37 120.64 119.67 2oqe n GLU 322 Ca 0.03 -0.16 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 2oqe n GLU 322 Cb 0.51 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.49 2oqe n GLU 322 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2oqe n TYR 323 N -2.17 0.00 -0.02 -0.32 4.01 -0.24 -0.77 117.16 117.65 2oqe n TYR 323 Ca -0.05 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.69 2oqe n TYR 323 Cb 0.51 0.05 0.00 0.00 -0.31 0.00 0.00 39.34 39.60 2oqe n TYR 323 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oqe n GLY 324 N 2.38 1.20 0.29 2.72 0.00 0.02 -4.50 105.19 107.30 2oqe n GLY 324 Ca 0.00 -1.22 0.19 0.00 0.00 0.00 0.00 46.02 45.00 2oqe n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqe h ALA 325 N 0.00 1.00 0.00 4.61 0.00 -0.91 -0.47 119.26 123.49 2oqe h ALA 325 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2oqe h ALA 325 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2oqe h ALA 325 CO 0.00 0.00 -0.53 0.78 0.00 0.00 0.00 179.25 179.50 2oqe h GLY 326 N 0.93 0.00 0.83 0.00 0.00 -1.08 -3.23 103.07 100.52 2oqe h GLY 326 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 47.33 47.44 2oqe h GLY 326 CO 0.00 0.00 0.49 -0.97 0.00 0.00 0.00 176.54 176.06 2oqe h TYR 327 N -1.00 0.61 -0.35 5.60 0.05 -0.96 -1.97 116.97 118.95 2oqe h TYR 327 Ca -0.12 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.67 2oqe h TYR 327 Cb 0.86 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.40 2oqe h TYR 327 CO 0.08 0.27 0.00 -1.33 -1.05 0.00 0.00 178.16 176.13 2oqe n MET 328 N -4.49 1.99 -2.51 4.88 2.81 -0.20 -4.84 117.12 114.75 2oqe n MET 328 Ca 0.13 -1.52 -0.40 0.00 -1.81 0.00 0.00 57.70 54.11 2oqe n MET 328 Cb 0.40 -1.38 -0.04 0.00 -0.71 0.00 0.00 33.22 31.49 2oqe n MET 328 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 2oqe s THR 329 N -1.54 3.56 0.14 2.03 -1.32 -0.74 -1.18 115.64 116.58 2oqe s THR 329 Ca 0.32 1.52 -0.27 0.00 -1.21 0.00 0.00 61.69 62.04 2oqe s THR 329 Cb 0.17 -3.95 -0.07 0.00 -1.51 0.00 0.00 72.50 67.14 2oqe s THR 329 CO 0.23 0.33 0.86 0.20 -2.21 0.00 0.00 174.62 174.03 2oqe s ASN 330 N -0.99 7.43 0.12 8.08 0.02 0.11 -4.91 114.94 124.79 2oqe s ASN 330 Ca 0.46 1.70 -0.31 0.00 -1.02 0.00 0.00 52.86 53.68 2oqe s ASN 330 Cb -0.30 -2.54 -0.09 0.00 0.02 0.00 0.00 41.25 38.34 2oqe s ASN 330 CO 0.39 0.08 1.59 -2.84 0.02 0.00 0.00 177.10 176.34 2oqe s PRO 331 N -0.58 4.21 0.02 -0.60 0.02 -1.26 -4.53 135.00 132.28 2oqe s PRO 331 Ca 0.40 2.33 0.17 0.00 0.02 0.00 0.00 61.00 63.93 2oqe s PRO 331 Cb -0.23 -3.34 -0.17 0.00 0.02 0.00 0.00 34.50 30.78 2oqe s PRO 331 CO 0.28 -0.65 0.70 1.28 -0.33 0.00 0.00 177.00 178.27 2oqe n LEU 332 N 4.64 0.67 -0.35 -5.54 4.77 -0.16 -4.52 117.00 116.52 2oqe n LEU 332 Ca 0.14 0.30 0.16 0.00 -0.03 0.00 0.00 56.01 56.58 2oqe n LEU 332 Cb 0.40 0.12 0.37 0.00 -2.33 0.00 0.00 43.42 41.97 2oqe n LEU 332 CO 0.62 0.18 1.17 -1.28 -1.33 0.00 0.00 177.39 176.74 2oqe h SER 333 N 0.00 0.69 -2.15 -1.43 0.87 -1.87 -3.35 113.55 106.32 2oqe h SER 333 Ca -0.20 0.13 -0.57 0.00 -1.23 0.00 0.00 61.79 59.92 2oqe h SER 333 Cb 1.62 0.02 -0.09 0.00 -0.44 0.00 0.00 62.40 63.50 2oqe h SER 333 CO 0.04 0.14 1.08 -0.76 -0.53 0.00 0.00 176.83 176.80 2oqe s LEU 334 N -10.34 3.42 0.00 2.23 1.02 -1.26 -4.64 118.68 109.11 2oqe s LEU 334 Ca -0.11 -0.75 0.00 0.00 0.02 0.00 0.00 54.13 53.29 2oqe s LEU 334 Cb 0.27 -2.54 0.00 0.00 0.02 0.00 0.00 46.19 43.93 2oqe s LEU 334 CO 0.80 -1.71 0.00 0.61 0.02 0.00 0.00 176.35 176.07 2oqe n GLY 335 N 5.68 -0.27 3.64 -3.19 0.00 -1.25 -4.55 105.19 105.24 2oqe n GLY 335 Ca 0.09 0.30 -0.43 0.00 0.00 0.00 0.00 46.02 45.98 2oqe n GLY 335 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqe h ASP 337 N 8.85 0.54 -3.30 0.00 5.19 -1.80 -3.42 116.42 122.48 2oqe h ASP 337 Ca -0.25 -0.13 -0.55 0.00 -0.62 0.00 0.00 57.03 55.48 2oqe h ASP 337 Cb 1.09 -0.14 -0.35 0.00 0.18 0.00 0.00 39.33 40.11 2oqe h ASP 337 CO 1.02 0.67 -0.82 0.00 -3.12 0.00 0.00 179.24 176.99 2oqe s LYS 339 N 1.03 3.32 0.00 0.00 2.20 -1.26 -4.99 119.74 120.05 2oqe s LYS 339 Ca -0.07 -0.35 0.00 0.00 -0.36 0.00 0.00 55.97 55.19 2oqe s LYS 339 Cb -0.15 -2.96 0.00 0.00 -1.51 0.00 0.00 37.83 33.21 2oqe s LYS 339 CO -0.01 0.60 0.00 0.41 -0.36 0.00 0.00 175.35 175.98 2oqe n GLY 340 N 2.49 -0.35 3.51 5.54 0.00 -1.26 -4.93 105.19 110.19 2oqe n GLY 340 Ca -0.18 -2.06 -0.43 0.00 0.00 0.00 0.00 46.02 43.35 2oqe n GLY 340 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oqe s VAL 341 N 0.00 4.93 -0.11 1.61 1.01 -1.26 -5.03 120.40 121.55 2oqe s VAL 341 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.92 2oqe s VAL 341 Cb 0.00 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 2oqe s VAL 341 CO 0.00 -0.52 -0.08 -0.63 0.00 0.00 0.00 175.10 173.87 2oqe s ILE 342 N 2.54 3.56 -0.26 2.22 -1.09 -1.26 -4.59 121.20 122.32 2oqe s ILE 342 Ca 0.18 -0.50 -0.11 0.00 -2.23 0.00 0.00 60.65 57.99 2oqe s ILE 342 Cb -0.15 -2.49 -0.05 0.00 -1.58 0.00 0.00 42.46 38.19 2oqe s ILE 342 CO 0.17 0.55 0.17 -2.28 -1.23 0.00 0.00 174.94 172.32 2oqe s HIS 343 N -0.17 3.26 0.08 3.97 5.65 -0.07 -4.95 115.29 123.06 2oqe s HIS 343 Ca 0.02 0.16 0.02 0.00 0.25 0.00 0.00 55.06 55.50 2oqe s HIS 343 Cb -0.13 -2.32 -0.04 0.00 -1.18 0.00 0.00 32.58 28.91 2oqe s HIS 343 CO 0.03 -0.06 0.13 0.71 -0.65 0.00 0.00 174.74 174.91 2oqe s TYR 344 N 1.41 3.31 0.05 3.88 2.02 -1.26 -0.64 117.35 126.11 2oqe s TYR 344 Ca 0.07 0.13 0.08 0.00 -0.37 0.00 0.00 57.07 56.98 2oqe s TYR 344 Cb -0.15 -1.66 -0.03 0.00 -0.40 0.00 0.00 41.96 39.72 2oqe s TYR 344 CO 0.08 0.54 -0.22 -0.51 -1.57 0.00 0.00 175.55 173.87 2oqe s LEU 345 N -2.51 2.41 0.19 -1.29 1.43 -0.60 -4.98 118.68 113.32 2oqe s LEU 345 Ca 0.31 -0.51 -0.03 0.00 -1.03 0.00 0.00 54.13 52.87 2oqe s LEU 345 Cb -0.12 -1.41 -0.05 0.00 0.03 0.00 0.00 46.19 44.64 2oqe s LEU 345 CO 0.24 0.25 0.40 -1.81 0.23 0.00 0.00 176.35 175.67 2oqe s ASP 346 N -1.39 6.43 -0.03 2.29 1.01 -1.26 0.02 116.67 123.74 2oqe s ASP 346 Ca 0.13 0.51 0.00 0.00 0.71 0.00 0.00 52.55 53.90 2oqe s ASP 346 Cb -0.10 -2.05 -0.03 0.00 1.01 0.00 0.00 42.92 41.74 2oqe s ASP 346 CO 0.04 -0.02 -0.00 0.00 0.21 0.00 0.00 175.17 175.40 2oqe s ALA 347 N -1.81 3.28 -0.09 5.23 0.00 -0.18 -4.86 121.76 123.32 2oqe s ALA 347 Ca 0.40 -0.91 0.02 0.00 0.00 0.00 0.00 51.96 51.48 2oqe s ALA 347 Cb -0.11 -1.38 0.01 0.00 0.00 0.00 0.00 23.12 21.64 2oqe s ALA 347 CO 0.28 0.63 -0.15 -1.01 0.00 0.00 0.00 175.76 175.51 2oqe s HIS 348 N -1.02 1.81 0.40 0.00 3.76 -1.26 -0.79 115.29 118.19 2oqe s HIS 348 Ca 0.18 -0.77 0.04 0.00 -0.15 0.00 0.00 55.06 54.36 2oqe s HIS 348 Cb -0.11 -1.30 -0.02 0.00 1.11 0.00 0.00 32.58 32.25 2oqe s HIS 348 CO 0.08 -0.39 0.15 -0.06 -0.85 0.00 0.00 174.74 173.67 2oqe s PHE 349 N 0.80 1.78 0.02 1.40 0.08 -0.50 -4.90 117.98 116.65 2oqe s PHE 349 Ca -0.11 -1.34 0.01 0.00 0.12 0.00 0.00 56.93 55.60 2oqe s PHE 349 Cb -0.16 -1.10 -0.04 0.00 -0.57 0.00 0.00 43.02 41.15 2oqe s PHE 349 CO 0.02 -0.37 0.07 0.45 -0.10 0.00 0.00 175.22 175.29 2oqe s SER 350 N -3.59 5.60 0.70 1.36 0.15 -1.26 -0.35 113.70 116.31 2oqe s SER 350 Ca 0.25 0.10 -0.00 0.00 0.70 0.00 0.00 55.95 56.99 2oqe s SER 350 Cb 0.02 -1.57 0.13 0.00 -1.71 0.00 0.00 66.02 62.89 2oqe s SER 350 CO 0.16 0.25 0.88 -0.90 1.20 0.00 0.00 173.24 174.83 2oqe n ASP 351 N 1.03 1.16 -0.17 5.45 5.68 -0.45 -4.84 116.55 124.42 2oqe n ASP 351 Ca -0.12 -1.99 -0.01 0.00 -0.50 0.00 0.00 54.79 52.18 2oqe n ASP 351 Cb 0.52 -0.57 0.24 0.00 -1.14 0.00 0.00 41.12 40.17 2oqe n ASP 351 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 2oqe h ARG 352 N 0.00 0.90 0.00 0.11 2.43 -1.89 -0.98 114.38 114.94 2oqe h ARG 352 Ca -0.29 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 58.78 2oqe h ARG 352 Cb 1.07 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.44 2oqe h ARG 352 CO 0.31 0.67 0.00 0.00 -1.51 0.00 0.00 179.97 179.44 2oqe h ALA 353 N 1.47 1.00 0.00 2.80 0.00 -1.94 0.95 119.26 123.54 2oqe h ALA 353 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2oqe h ALA 353 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2oqe h ALA 353 CO -0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.63 2oqe n GLY 354 N 0.15 0.93 3.85 0.00 0.00 -0.37 -4.92 105.19 104.83 2oqe n GLY 354 Ca 0.02 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 2oqe n GLY 354 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oqe s ASP 355 N -2.01 6.68 0.37 1.61 1.01 -1.26 -4.61 116.67 118.45 2oqe s ASP 355 Ca 0.00 0.81 -0.28 0.00 0.71 0.00 0.00 52.55 53.79 2oqe s ASP 355 Cb 0.00 -2.19 -0.11 0.00 1.01 0.00 0.00 42.92 41.63 2oqe s ASP 355 CO 0.00 0.34 1.43 -2.84 0.21 0.00 0.00 175.17 174.31 2oqe s PRO 356 N -1.12 4.13 0.21 8.23 0.02 -1.26 -1.34 135.00 143.87 2oqe s PRO 356 Ca 0.22 2.46 0.11 0.00 0.02 0.00 0.00 61.00 63.80 2oqe s PRO 356 Cb -0.15 -2.96 -0.04 0.00 0.02 0.00 0.00 34.50 31.36 2oqe s PRO 356 CO 0.11 -0.47 -0.21 0.96 -0.33 0.00 0.00 177.00 177.06 2oqe s ILE 357 N -1.14 2.22 -0.05 2.83 -4.36 0.53 -4.85 121.20 116.38 2oqe s ILE 357 Ca 0.53 -2.10 0.04 0.00 -0.26 0.00 0.00 60.65 58.86 2oqe s ILE 357 Cb -0.44 -2.09 -0.00 0.00 1.25 0.00 0.00 42.46 41.17 2oqe s ILE 357 CO 0.60 -0.25 -0.18 -0.89 0.24 0.00 0.00 174.94 174.46 2oqe s THR 358 N -2.01 1.53 -0.34 8.37 2.01 -1.26 -1.41 115.64 122.53 2oqe s THR 358 Ca 0.22 -0.75 -0.08 0.00 0.31 0.00 0.00 61.69 61.38 2oqe s THR 358 Cb -0.06 -1.32 0.03 0.00 0.01 0.00 0.00 72.50 71.16 2oqe s THR 358 CO 0.10 0.44 0.13 -0.69 -0.69 0.00 0.00 174.62 173.91 2oqe s VAL 359 N 0.15 4.06 0.31 3.82 1.01 0.03 -4.98 120.40 124.80 2oqe s VAL 359 Ca -0.07 -0.98 -0.28 0.00 0.00 0.00 0.00 61.98 60.65 2oqe s VAL 359 Cb -0.13 -3.26 -0.09 0.00 0.00 0.00 0.00 36.38 32.90 2oqe s VAL 359 CO 0.03 -0.16 1.12 -0.54 0.00 0.00 0.00 175.10 175.55 2oqe s LYS 360 N 1.46 4.50 -1.30 2.72 -0.14 -1.26 -1.01 119.74 124.72 2oqe s LYS 360 Ca 0.00 1.80 -0.03 0.00 -1.36 0.00 0.00 55.97 56.38 2oqe s LYS 360 Cb -0.19 -3.05 0.01 0.00 -1.68 0.00 0.00 37.83 32.92 2oqe s LYS 360 CO 0.04 0.09 0.95 0.09 -0.76 0.00 0.00 175.35 175.76 2oqe n ASN 361 N 0.89 -3.01 0.06 2.83 5.03 -1.21 -3.96 115.26 115.88 2oqe n ASN 361 Ca 0.00 -0.68 -0.09 0.00 0.87 0.00 0.00 54.58 54.69 2oqe n ASN 361 Cb 0.45 -4.67 0.04 0.00 -1.02 0.00 0.00 39.78 34.58 2oqe n ASN 361 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2oqe h ALA 362 N 0.92 0.63 -4.41 5.41 0.00 -0.50 -0.39 119.26 120.91 2oqe h ALA 362 Ca -0.59 -0.61 -0.62 0.00 0.00 0.00 0.00 54.91 53.09 2oqe h ALA 362 Cb 1.36 -0.07 -0.30 0.00 0.00 0.00 0.00 17.79 18.78 2oqe h ALA 362 CO 0.55 0.77 -0.86 0.08 0.00 0.00 0.00 179.25 179.79 2oqe s VAL 363 N -3.60 1.72 -0.12 0.00 1.01 -0.87 -4.54 120.40 114.00 2oqe s VAL 363 Ca -0.05 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 2oqe s VAL 363 Cb 0.11 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 2oqe s VAL 363 CO 0.83 0.49 -0.09 0.00 0.00 0.00 0.00 175.10 176.33 2oqe s ILE 365 N 0.11 1.37 0.19 0.00 1.01 0.18 -0.81 121.20 123.25 2oqe s ILE 365 Ca -0.04 -0.54 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 2oqe s ILE 365 Cb -0.14 -1.28 0.05 0.00 0.01 0.00 0.00 42.46 41.09 2oqe s ILE 365 CO 0.04 0.42 0.59 -1.38 0.00 0.00 0.00 174.94 174.61 2oqe s HIS 366 N 1.26 -0.34 0.05 3.97 -3.43 -0.57 -0.89 115.29 115.34 2oqe s HIS 366 Ca -0.01 0.04 0.05 0.00 -0.80 0.00 0.00 55.06 54.33 2oqe s HIS 366 Cb -0.14 0.53 -0.04 0.00 -1.43 0.00 0.00 32.58 31.51 2oqe s HIS 366 CO -0.05 -0.94 -0.06 -1.83 -2.00 0.00 0.00 174.74 169.86 2oqe s GLU 367 N -3.82 2.43 0.01 -0.38 -1.05 -1.26 -0.45 118.70 114.19 2oqe s GLU 367 Ca 0.05 -0.83 -0.04 0.00 -0.15 0.00 0.00 54.97 54.00 2oqe s GLU 367 Cb -0.02 -2.46 -0.01 0.00 -0.44 0.00 0.00 34.13 31.21 2oqe s GLU 367 CO -0.06 0.56 0.06 -1.21 0.95 0.00 0.00 175.26 175.56 2oqe s GLU 368 N -1.83 0.41 0.43 -4.83 2.02 -0.03 -4.88 118.70 109.99 2oqe s GLU 368 Ca 0.20 -0.52 -0.26 0.00 0.02 0.00 0.00 54.97 54.41 2oqe s GLU 368 Cb -0.11 0.16 -0.09 0.00 0.10 0.00 0.00 34.13 34.19 2oqe s GLU 368 CO 0.12 -0.09 1.45 0.34 0.02 0.00 0.00 175.26 177.10 2oqe s ASP 369 N -1.46 5.96 -0.22 -0.19 -1.08 -1.26 -0.51 116.67 117.91 2oqe s ASP 369 Ca -0.15 2.98 0.18 0.00 -0.52 0.00 0.00 52.55 55.04 2oqe s ASP 369 Cb -0.08 -2.66 0.48 0.00 -1.46 0.00 0.00 42.92 39.19 2oqe s ASP 369 CO 0.00 -1.12 1.15 -0.67 0.52 0.00 0.00 175.17 175.05 2oqe n ASP 370 N -0.05 2.35 0.00 -0.34 2.03 0.26 -4.74 116.55 116.05 2oqe n ASP 370 Ca 0.04 -2.62 0.00 0.00 0.52 0.00 0.00 54.79 52.73 2oqe n ASP 370 Cb 0.41 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 2oqe n ASP 370 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2oqe n GLY 371 N -0.49 -0.22 3.75 0.27 0.00 -1.26 -4.64 105.19 102.58 2oqe n GLY 371 Ca 0.17 -1.03 -0.40 0.00 0.00 0.00 0.00 46.02 44.76 2oqe n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oqe s LEU 372 N 0.00 4.60 -0.15 0.99 1.43 -1.26 0.33 118.68 124.63 2oqe s LEU 372 Ca 0.00 1.94 -0.17 0.00 -1.03 0.00 0.00 54.13 54.87 2oqe s LEU 372 Cb 0.00 -3.61 -0.24 0.00 0.03 0.00 0.00 46.19 42.37 2oqe s LEU 372 CO 0.00 0.08 0.40 0.25 0.23 0.00 0.00 176.35 177.31 2oqe h LEU 373 N 4.49 0.23 -7.08 1.79 5.85 -1.00 -3.41 115.31 116.18 2oqe h LEU 373 Ca -0.45 -0.76 0.10 0.00 0.84 0.00 0.00 57.88 57.62 2oqe h LEU 373 Cb 1.20 -0.07 -0.14 0.00 0.37 0.00 0.00 40.66 42.02 2oqe h LEU 373 CO 0.69 1.59 0.45 0.72 -0.34 0.00 0.00 178.44 181.55 2oqe s PHE 374 N -2.44 -0.35 -0.20 1.25 -0.71 -1.10 -5.00 117.98 109.43 2oqe s PHE 374 Ca -0.24 0.18 -0.25 0.00 -1.04 0.00 0.00 56.93 55.58 2oqe s PHE 374 Cb 0.05 0.55 0.07 0.00 -1.21 0.00 0.00 43.02 42.48 2oqe s PHE 374 CO 0.70 -0.63 0.67 0.21 -1.34 0.00 0.00 175.22 174.83 2oqe s LYS 375 N -3.24 0.86 -0.19 1.99 2.20 -1.26 -1.69 119.74 118.41 2oqe s LYS 375 Ca 0.05 0.75 -0.16 0.00 -0.36 0.00 0.00 55.97 56.25 2oqe s LYS 375 Cb -0.01 0.41 0.05 0.00 -1.51 0.00 0.00 37.83 36.78 2oqe s LYS 375 CO -0.08 -0.16 0.50 -1.58 -0.36 0.00 0.00 175.35 173.67 2oqe s HIS 376 N -0.07 -0.61 0.12 4.03 2.46 -0.57 -5.01 115.29 115.64 2oqe s HIS 376 Ca -0.03 1.41 0.07 0.00 0.47 0.00 0.00 55.06 56.97 2oqe s HIS 376 Cb -0.04 0.25 -0.04 0.00 -0.13 0.00 0.00 32.58 32.62 2oqe s HIS 376 CO 0.03 -0.31 -0.16 -1.12 -2.47 0.00 0.00 174.74 170.72 2oqe s SER 377 N 0.63 2.17 -0.27 9.88 0.01 -1.26 -1.42 113.70 123.45 2oqe s SER 377 Ca -0.03 -0.79 -0.13 0.00 1.31 0.00 0.00 55.95 56.31 2oqe s SER 377 Cb -0.05 -0.09 -0.04 0.00 0.21 0.00 0.00 66.02 66.05 2oqe s SER 377 CO -0.04 -0.09 0.26 -0.62 0.41 0.00 0.00 173.24 173.16 2oqe s ASP 378 N -2.38 6.13 0.62 2.44 -1.08 -0.27 -4.95 116.67 117.18 2oqe s ASP 378 Ca 0.09 0.14 0.38 0.00 -0.52 0.00 0.00 52.55 52.64 2oqe s ASP 378 Cb -0.06 -2.16 2.07 0.00 -1.46 0.00 0.00 42.92 41.31 2oqe s ASP 378 CO 0.04 -0.09 2.27 2.19 0.52 0.00 0.00 175.17 180.10 2oqe h PHE 379 N 8.17 0.00 0.00 -5.34 -0.00 -1.95 -0.86 116.94 116.97 2oqe h PHE 379 Ca -0.34 0.00 -0.05 0.00 -0.00 0.00 0.00 57.97 57.58 2oqe h PHE 379 Cb 1.18 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 37.12 2oqe h PHE 379 CO 0.75 0.02 -0.21 0.00 -0.00 0.00 0.00 178.31 178.86 2oqe h ARG 380 N 0.00 0.00 -0.53 6.09 3.08 -1.97 -1.99 114.38 119.05 2oqe h ARG 380 Ca -0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.67 2oqe h ARG 380 Cb 0.09 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 29.85 2oqe h ARG 380 CO 0.00 0.21 -0.67 -0.40 -1.07 0.00 0.00 179.97 178.05 2oqe n ASP 381 N -4.22 4.00 -2.82 7.04 5.68 -1.21 -4.95 116.55 120.08 2oqe n ASP 381 Ca -0.02 -3.80 -0.21 0.00 -0.50 0.00 0.00 54.79 50.26 2oqe n ASP 381 Cb 0.28 -0.42 0.01 0.00 -1.14 0.00 0.00 41.12 39.85 2oqe n ASP 381 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2oqe n ASN 382 N -0.84 -5.52 -0.10 -1.12 4.05 -0.75 -2.05 115.26 108.93 2oqe n ASN 382 Ca 0.37 -0.17 -0.01 0.00 0.45 0.00 0.00 54.58 55.22 2oqe n ASN 382 Cb 0.88 -4.53 -0.01 0.00 1.23 0.00 0.00 39.78 37.36 2oqe n ASN 382 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 177.26 174.70 2oqe n PHE 383 N -4.17 0.00 -0.07 1.20 3.72 -0.33 -4.91 117.46 112.90 2oqe n PHE 383 Ca -0.14 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.22 2oqe n PHE 383 Cb 0.63 -0.56 0.18 0.00 -0.94 0.00 0.00 39.48 38.79 2oqe n PHE 383 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2oqe h ALA 384 N 0.00 1.12 -1.97 4.37 0.00 -1.61 -3.38 119.26 117.79 2oqe h ALA 384 Ca -0.03 -0.28 -0.57 0.00 0.00 0.00 0.00 54.91 54.04 2oqe h ALA 384 Cb 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2oqe h ALA 384 CO 0.04 0.55 0.92 0.99 0.00 0.00 0.00 179.25 181.75 2oqe s THR 385 N -4.86 4.28 -0.17 0.00 2.01 -1.26 -4.65 115.64 110.99 2oqe s THR 385 Ca -0.09 1.47 -0.27 0.00 0.31 0.00 0.00 61.69 63.12 2oqe s THR 385 Cb 0.14 -4.23 0.07 0.00 0.01 0.00 0.00 72.50 68.49 2oqe s THR 385 CO 0.80 -0.44 0.68 -0.55 -0.69 0.00 0.00 174.62 174.42 2oqe s SER 386 N 2.31 -0.69 -0.03 3.53 0.15 -0.42 -1.11 113.70 117.44 2oqe s SER 386 Ca 0.52 1.09 0.01 0.00 0.70 0.00 0.00 55.95 58.28 2oqe s SER 386 Cb -0.16 1.04 0.01 0.00 -1.71 0.00 0.00 66.02 65.20 2oqe s SER 386 CO 0.20 -0.40 -0.05 -0.22 1.20 0.00 0.00 173.24 173.96 2oqe s LEU 387 N -0.31 1.60 -0.03 3.45 0.20 -0.51 -0.44 118.68 122.65 2oqe s LEU 387 Ca -0.05 -0.12 0.01 0.00 0.69 0.00 0.00 54.13 54.66 2oqe s LEU 387 Cb -0.03 -0.40 0.02 0.00 -0.43 0.00 0.00 46.19 45.35 2oqe s LEU 387 CO 0.05 -0.00 -0.02 -0.69 -0.29 0.00 0.00 176.35 175.39 2oqe s VAL 388 N 0.48 0.31 -0.09 1.68 1.01 0.03 -1.51 120.40 122.31 2oqe s VAL 388 Ca -0.06 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.89 2oqe s VAL 388 Cb -0.10 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 35.95 2oqe s VAL 388 CO 0.00 0.15 -0.09 -0.89 0.00 0.00 0.00 175.10 174.27 2oqe s THR 389 N 0.72 1.03 0.41 3.92 2.01 -0.68 -0.23 115.64 122.82 2oqe s THR 389 Ca -0.08 -0.35 -0.22 0.00 0.31 0.00 0.00 61.69 61.34 2oqe s THR 389 Cb -0.11 -1.00 -0.11 0.00 0.01 0.00 0.00 72.50 71.29 2oqe s THR 389 CO -0.01 0.35 0.95 -0.13 -0.69 0.00 0.00 174.62 175.09 2oqe s ARG 390 N 1.19 4.30 0.10 4.92 0.52 -1.26 -0.46 118.95 128.26 2oqe s ARG 390 Ca -0.05 1.17 -0.11 0.00 -0.52 0.00 0.00 55.73 56.22 2oqe s ARG 390 Cb -0.14 -2.32 -0.06 0.00 0.52 0.00 0.00 34.95 32.95 2oqe s ARG 390 CO -0.02 0.03 0.45 0.00 0.02 0.00 0.00 175.30 175.78 2oqe s ALA 391 N -2.05 3.68 -0.01 2.13 0.00 0.15 -4.53 121.76 121.13 2oqe s ALA 391 Ca 0.59 -0.30 0.07 0.00 0.00 0.00 0.00 51.96 52.32 2oqe s ALA 391 Cb -0.11 -2.35 -0.02 0.00 0.00 0.00 0.00 23.12 20.63 2oqe s ALA 391 CO 0.16 0.53 -0.22 0.99 0.00 0.00 0.00 175.76 177.22 2oqe s THR 392 N -1.42 2.46 0.17 0.00 2.01 -1.26 -0.58 115.64 117.02 2oqe s THR 392 Ca 0.35 -1.05 0.11 0.00 0.31 0.00 0.00 61.69 61.41 2oqe s THR 392 Cb -0.14 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 2oqe s THR 392 CO 0.18 0.52 -0.24 -1.59 -0.69 0.00 0.00 174.62 172.80 2oqe s LYS 393 N -0.86 1.46 -0.17 4.92 -2.85 0.33 -4.02 119.74 118.56 2oqe s LYS 393 Ca 0.11 -1.46 -0.04 0.00 -1.00 0.00 0.00 55.97 53.58 2oqe s LYS 393 Cb -0.10 -1.82 -0.03 0.00 -2.06 0.00 0.00 37.83 33.82 2oqe s LYS 393 CO 0.01 0.41 -0.03 -1.17 0.10 0.00 0.00 175.35 174.66 2oqe s LEU 394 N -2.48 3.23 -0.11 2.77 2.96 -0.52 -0.85 118.68 123.69 2oqe s LEU 394 Ca 0.18 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 53.97 2oqe s LEU 394 Cb -0.08 -1.79 0.00 0.00 0.50 0.00 0.00 46.19 44.82 2oqe s LEU 394 CO 0.08 0.13 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.33 2oqe s VAL 395 N 0.57 2.02 -0.21 1.68 1.01 0.41 -0.67 120.40 125.20 2oqe s VAL 395 Ca -0.02 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 60.97 2oqe s VAL 395 Cb -0.14 -1.76 0.03 0.00 0.00 0.00 0.00 36.38 34.50 2oqe s VAL 395 CO 0.02 0.55 -0.14 -0.69 0.00 0.00 0.00 175.10 174.85 2oqe s VAL 396 N 0.50 2.38 0.06 2.92 1.01 -0.04 -1.51 120.40 125.72 2oqe s VAL 396 Ca -0.15 -1.05 0.02 0.00 0.00 0.00 0.00 61.98 60.80 2oqe s VAL 396 Cb -0.17 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 2oqe s VAL 396 CO 0.05 0.35 -0.07 -0.55 0.00 0.00 0.00 175.10 174.88 2oqe s SER 397 N 1.28 0.96 0.14 3.32 0.15 0.01 -0.25 113.70 119.32 2oqe s SER 397 Ca 0.01 -0.72 -0.06 0.00 0.70 0.00 0.00 55.95 55.89 2oqe s SER 397 Cb -0.15 0.06 -0.02 0.00 -1.71 0.00 0.00 66.02 64.20 2oqe s SER 397 CO -0.09 -0.30 0.18 0.00 1.20 0.00 0.00 173.24 174.23 2oqe s GLN 398 N -2.42 1.04 -0.05 5.44 -2.07 -0.76 -1.01 119.66 119.82 2oqe s GLN 398 Ca -0.02 -1.26 0.01 0.00 -1.82 0.00 0.00 55.36 52.27 2oqe s GLN 398 Cb -0.04 0.32 0.02 0.00 -1.09 0.00 0.00 33.01 32.22 2oqe s GLN 398 CO -0.02 -0.35 -0.06 0.42 -1.32 0.00 0.00 175.29 173.96 2oqe s ILE 399 N -3.99 0.71 0.17 3.63 1.01 -1.26 -0.93 121.20 120.53 2oqe s ILE 399 Ca 0.19 -0.21 0.11 0.00 0.00 0.00 0.00 60.65 60.74 2oqe s ILE 399 Cb 0.05 -0.71 -0.04 0.00 0.01 0.00 0.00 42.46 41.77 2oqe s ILE 399 CO -0.00 0.27 -0.24 0.72 0.00 0.00 0.00 174.94 175.68 2oqe s PHE 400 N 0.94 2.24 -0.17 3.97 -0.71 -0.42 0.03 117.98 123.87 2oqe s PHE 400 Ca -0.10 -0.38 0.01 0.00 -1.04 0.00 0.00 56.93 55.42 2oqe s PHE 400 Cb -0.15 -1.14 0.01 0.00 -1.21 0.00 0.00 43.02 40.53 2oqe s PHE 400 CO 0.00 0.43 -0.19 0.99 -1.34 0.00 0.00 175.22 175.11 2oqe s THR 401 N -1.50 2.18 -0.67 -4.49 2.01 -0.33 -1.17 115.64 111.67 2oqe s THR 401 Ca 0.18 -0.91 -0.02 0.00 0.31 0.00 0.00 61.69 61.24 2oqe s THR 401 Cb -0.08 -1.91 0.17 0.00 0.01 0.00 0.00 72.50 70.69 2oqe s THR 401 CO 0.08 0.53 0.48 0.00 -0.69 0.00 0.00 174.62 175.03 2oqe s ALA 402 N 1.12 3.68 0.00 7.40 0.00 -1.26 -4.80 121.76 127.90 2oqe s ALA 402 Ca 0.01 -3.38 0.00 0.00 0.00 0.00 0.00 51.96 48.58 2oqe s ALA 402 Cb -0.14 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2oqe s ALA 402 CO -0.08 -2.12 0.00 0.00 0.00 0.00 0.00 175.76 173.56 2oqe n ALA 403 N 3.22 0.00 0.74 0.00 0.00 -1.26 -4.82 120.51 118.40 2oqe n ALA 403 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 2oqe n ALA 403 Cb 0.37 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.86 2oqe n ALA 403 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2oqe n ASN 404 N 6.90 2.22 -3.59 0.00 6.94 -1.26 -4.99 115.26 121.48 2oqe n ASN 404 Ca 0.00 -2.15 -0.02 0.00 -0.02 0.00 0.00 54.58 52.39 2oqe n ASN 404 Cb 0.00 -0.53 -0.06 0.00 -2.36 0.00 0.00 39.78 36.83 2oqe n ASN 404 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 2oqe s GLU 406 N -0.89 0.40 -0.23 -3.83 8.01 -0.76 -0.22 118.70 121.18 2oqe s GLU 406 Ca 0.07 0.76 -0.02 0.00 0.01 0.00 0.00 54.97 55.79 2oqe s GLU 406 Cb 0.06 0.20 0.02 0.00 -4.31 0.00 0.00 34.13 30.09 2oqe s GLU 406 CO 0.02 -0.10 -0.08 0.71 0.01 0.00 0.00 175.26 175.82 2oqe s TYR 407 N 1.68 2.99 -0.27 1.61 2.02 -0.32 -1.26 117.35 123.80 2oqe s TYR 407 Ca -0.08 -1.43 -0.10 0.00 -0.37 0.00 0.00 57.07 55.10 2oqe s TYR 407 Cb -0.05 -2.04 -0.04 0.00 -0.40 0.00 0.00 41.96 39.43 2oqe s TYR 407 CO -0.16 -0.70 0.15 0.00 -1.57 0.00 0.00 175.55 173.27 2oqe s LEU 409 N 1.70 2.66 -0.18 0.00 1.43 -0.11 -1.10 118.68 123.08 2oqe s LEU 409 Ca 0.07 -0.36 -0.00 0.00 -1.03 0.00 0.00 54.13 52.80 2oqe s LEU 409 Cb -0.16 -1.60 0.05 0.00 0.03 0.00 0.00 46.19 44.50 2oqe s LEU 409 CO 0.09 0.14 -0.06 -0.31 0.23 0.00 0.00 176.35 176.44 2oqe s TYR 410 N 0.50 1.88 -0.22 0.29 2.02 0.10 -1.83 117.35 120.09 2oqe s TYR 410 Ca -0.09 -1.25 -0.18 0.00 -0.37 0.00 0.00 57.07 55.18 2oqe s TYR 410 Cb -0.16 -1.39 -0.03 0.00 -0.40 0.00 0.00 41.96 39.98 2oqe s TYR 410 CO 0.04 -0.66 0.53 -1.58 -1.57 0.00 0.00 175.55 172.31 2oqe s TRP 411 N 1.57 3.34 -0.16 2.71 0.52 0.66 -1.34 118.94 126.23 2oqe s TRP 411 Ca -0.01 0.74 0.01 0.00 0.02 0.00 0.00 56.10 56.86 2oqe s TRP 411 Cb -0.16 -2.69 0.02 0.00 -1.15 0.00 0.00 33.47 29.49 2oqe s TRP 411 CO -0.08 -0.16 -0.17 0.08 0.02 0.00 0.00 176.95 176.64 2oqe s VAL 412 N 1.87 1.84 -0.14 4.03 1.01 0.24 -0.86 120.40 128.38 2oqe s VAL 412 Ca 0.23 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.34 2oqe s VAL 412 Cb -0.15 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2oqe s VAL 412 CO 0.09 0.50 0.10 -0.36 0.00 0.00 0.00 175.10 175.44 2oqe s PHE 413 N 1.36 3.42 0.21 5.22 0.08 0.15 -0.34 117.98 128.08 2oqe s PHE 413 Ca 0.04 0.35 0.11 0.00 0.12 0.00 0.00 56.93 57.55 2oqe s PHE 413 Cb -0.13 -1.99 -0.05 0.00 -0.57 0.00 0.00 43.02 40.29 2oqe s PHE 413 CO -0.12 0.49 -0.23 -1.64 -0.10 0.00 0.00 175.22 173.63 2oqe s MET 414 N -0.45 1.53 0.00 0.44 -1.94 -0.33 -1.43 119.30 117.12 2oqe s MET 414 Ca 0.11 -1.56 0.27 0.00 -1.71 0.00 0.00 55.69 52.80 2oqe s MET 414 Cb -0.12 -1.79 1.23 0.00 2.01 0.00 0.00 34.83 36.16 2oqe s MET 414 CO 0.02 0.38 1.88 1.04 -0.01 0.00 0.00 175.02 178.32 2oqe n GLN 415 N 0.11 0.17 -0.06 2.03 6.02 -1.26 -1.59 117.38 122.81 2oqe n GLN 415 Ca -0.11 0.04 0.10 0.00 -0.01 0.00 0.00 57.00 57.01 2oqe n GLN 415 Cb 0.57 -1.50 0.41 0.00 1.02 0.00 0.00 30.24 30.74 2oqe n GLN 415 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2oqe n ASP 416 N -1.41 1.09 0.00 1.08 5.75 -1.26 -4.05 116.55 117.76 2oqe n ASP 416 Ca 0.09 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 53.24 2oqe n ASP 416 Cb 0.27 -0.07 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 2oqe n ASP 416 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2oqe n GLY 417 N 1.00 0.83 3.84 6.12 0.00 -0.62 -4.75 105.19 111.61 2oqe n GLY 417 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2oqe n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oqe s ALA 418 N -3.10 3.10 -0.07 4.61 0.00 -1.25 -4.53 121.76 120.53 2oqe s ALA 418 Ca 0.00 0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.21 2oqe s ALA 418 Cb 0.00 -3.06 -0.00 0.00 0.00 0.00 0.00 23.12 20.06 2oqe s ALA 418 CO 0.00 -0.05 -0.20 0.42 0.00 0.00 0.00 175.76 175.93 2oqe s ILE 419 N -2.41 1.67 0.08 0.00 1.01 -0.37 -1.18 121.20 120.00 2oqe s ILE 419 Ca 0.59 -0.82 0.08 0.00 0.00 0.00 0.00 60.65 60.50 2oqe s ILE 419 Cb -0.10 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.90 2oqe s ILE 419 CO 0.24 0.47 -0.21 -0.60 0.00 0.00 0.00 174.94 174.84 2oqe s ARG 420 N 0.21 1.25 -0.19 2.79 3.52 0.54 0.18 118.95 127.26 2oqe s ARG 420 Ca -0.10 -1.10 -0.01 0.00 -0.13 0.00 0.00 55.73 54.39 2oqe s ARG 420 Cb -0.15 -1.48 0.00 0.00 -1.56 0.00 0.00 34.95 31.77 2oqe s ARG 420 CO 0.05 0.36 -0.13 -1.17 -0.81 0.00 0.00 175.30 173.60 2oqe s LEU 421 N -1.65 2.52 -0.10 -0.88 2.96 -0.52 -0.59 118.68 120.42 2oqe s LEU 421 Ca 0.07 -0.50 -0.01 0.00 -0.22 0.00 0.00 54.13 53.48 2oqe s LEU 421 Cb -0.10 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.97 2oqe s LEU 421 CO 0.03 0.02 -0.06 -1.81 -1.32 0.00 0.00 176.35 173.21 2oqe s ASP 422 N 1.20 4.64 -0.01 3.68 1.01 -0.45 -1.69 116.67 125.05 2oqe s ASP 422 Ca 0.02 -0.08 0.06 0.00 0.71 0.00 0.00 52.55 53.25 2oqe s ASP 422 Cb -0.14 -1.42 -0.01 0.00 1.01 0.00 0.00 42.92 42.36 2oqe s ASP 422 CO -0.05 0.28 -0.18 -0.63 0.21 0.00 0.00 175.17 174.79 2oqe s ILE 423 N -0.32 1.46 -0.11 0.77 1.01 0.94 -0.72 121.20 124.22 2oqe s ILE 423 Ca 0.05 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.93 2oqe s ILE 423 Cb -0.13 -1.21 0.01 0.00 0.01 0.00 0.00 42.46 41.14 2oqe s ILE 423 CO 0.02 0.40 -0.19 -0.13 0.00 0.00 0.00 174.94 175.05 2oqe s ARG 424 N -0.45 2.62 -0.21 2.79 0.52 -0.26 -0.49 118.95 123.46 2oqe s ARG 424 Ca 0.07 -0.71 -0.12 0.00 -0.52 0.00 0.00 55.73 54.44 2oqe s ARG 424 Cb -0.07 -2.11 -0.05 0.00 0.52 0.00 0.00 34.95 33.24 2oqe s ARG 424 CO -0.01 0.02 0.24 -0.51 0.02 0.00 0.00 175.30 175.06 2oqe s LEU 425 N 0.75 4.17 0.00 2.53 1.43 -0.29 -0.73 118.68 126.54 2oqe s LEU 425 Ca -0.10 0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 2oqe s LEU 425 Cb -0.16 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 43.81 2oqe s LEU 425 CO 0.01 0.06 0.00 1.07 0.23 0.00 0.00 176.35 177.72 2oqe n THR 426 N 4.03 0.00 -0.81 5.49 5.66 -0.39 -0.84 114.28 127.43 2oqe n THR 426 Ca -0.13 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.87 2oqe n THR 426 Cb 0.52 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.30 2oqe n THR 426 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2oqe n GLY 427 N 0.00 0.17 3.19 1.09 0.00 -1.26 -1.83 105.19 106.56 2oqe n GLY 427 Ca 0.00 -1.63 -0.24 0.00 0.00 0.00 0.00 46.02 44.15 2oqe n GLY 427 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oqe s ILE 428 N 0.00 1.42 0.36 -0.61 1.01 0.70 -0.52 121.20 123.56 2oqe s ILE 428 Ca 0.00 -0.95 -0.28 0.00 0.00 0.00 0.00 60.65 59.42 2oqe s ILE 428 Cb 0.00 -1.22 -0.11 0.00 0.01 0.00 0.00 42.46 41.14 2oqe s ILE 428 CO 0.00 0.25 1.45 0.18 0.00 0.00 0.00 174.94 176.82 2oqe n LEU 429 N 2.23 4.39 -4.73 2.97 4.77 -1.26 -4.75 117.00 120.62 2oqe n LEU 429 Ca -0.16 1.21 -0.42 0.00 -0.03 0.00 0.00 56.01 56.62 2oqe n LEU 429 Cb 0.54 -1.58 -0.03 0.00 -2.33 0.00 0.00 43.42 40.02 2oqe n LEU 429 CO 0.23 -0.02 1.00 0.21 -1.33 0.00 0.00 177.39 177.48 2oqe s ASN 430 N -0.10 6.90 0.14 -1.43 3.84 -1.26 -5.00 114.94 118.02 2oqe s ASN 430 Ca 0.55 2.33 0.07 0.00 0.21 0.00 0.00 52.86 56.02 2oqe s ASN 430 Cb -0.51 -2.60 -0.04 0.00 -0.55 0.00 0.00 41.25 37.56 2oqe s ASN 430 CO 0.62 -0.56 -0.16 0.42 -2.79 0.00 0.00 177.10 174.63 2oqe s THR 431 N 0.55 1.53 0.17 -5.21 -4.23 -1.26 -4.14 115.64 103.05 2oqe s THR 431 Ca 0.59 -1.77 0.04 0.00 -1.18 0.00 0.00 61.69 59.37 2oqe s THR 431 Cb -0.36 -1.64 -0.05 0.00 1.34 0.00 0.00 72.50 71.80 2oqe s THR 431 CO 0.34 -0.35 -0.08 -0.47 -0.54 0.00 0.00 174.62 173.52 2oqe s TYR 432 N -2.03 1.37 0.44 3.99 5.04 0.26 -4.83 117.35 121.59 2oqe s TYR 432 Ca 0.11 -0.79 -0.22 0.00 -2.44 0.00 0.00 57.07 53.72 2oqe s TYR 432 Cb -0.06 -0.72 -0.09 0.00 0.35 0.00 0.00 41.96 41.45 2oqe s TYR 432 CO 0.04 0.07 1.06 -1.50 -1.34 0.00 0.00 175.55 173.88 2oqe s ILE 433 N -3.33 3.68 -0.08 3.14 2.07 -1.26 -0.36 121.20 125.06 2oqe s ILE 433 Ca 0.20 1.19 0.01 0.00 -1.41 0.00 0.00 60.65 60.65 2oqe s ILE 433 Cb 0.03 -3.57 0.02 0.00 0.13 0.00 0.00 42.46 39.07 2oqe s ILE 433 CO 0.03 -0.09 -0.11 -0.22 -1.91 0.00 0.00 174.94 172.64 2oqe s LEU 434 N -2.99 1.52 0.79 8.50 2.96 -0.55 -4.63 118.68 124.27 2oqe s LEU 434 Ca 0.62 -0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 54.10 2oqe s LEU 434 Cb -0.21 -0.85 0.07 0.00 0.50 0.00 0.00 46.19 45.70 2oqe s LEU 434 CO 0.25 -0.01 1.14 -0.83 -1.32 0.00 0.00 176.35 175.58 2oqe s GLY 435 N 1.01 1.91 0.28 7.98 0.00 -1.26 -4.27 107.32 112.97 2oqe s GLY 435 Ca -0.08 0.55 0.02 0.00 0.00 0.00 0.00 44.72 45.21 2oqe s GLY 435 CO -0.00 0.93 1.74 -0.55 0.00 0.00 0.00 173.10 175.22 2oqe h ASP 436 N -0.97 0.51 -0.45 1.64 3.32 -1.99 -1.73 116.42 116.75 2oqe h ASP 436 Ca -0.45 0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2oqe h ASP 436 Cb 1.26 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.85 2oqe h ASP 436 CO 0.48 0.15 0.00 0.47 -1.72 0.00 0.00 179.24 178.63 2oqe n ASP 437 N -4.91 3.30 -4.76 6.45 8.00 -1.26 -4.98 116.55 118.40 2oqe n ASP 437 Ca 0.20 -1.95 -0.40 0.00 0.71 0.00 0.00 54.79 53.35 2oqe n ASP 437 Cb 0.54 -0.30 -0.05 0.00 -0.02 0.00 0.00 41.12 41.28 2oqe n ASP 437 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2oqe s GLU 438 N -1.11 4.47 -0.03 -1.24 2.12 -0.65 -5.06 118.70 117.20 2oqe s GLU 438 Ca 0.34 1.01 -0.21 0.00 0.36 0.00 0.00 54.97 56.48 2oqe s GLU 438 Cb 0.19 -3.34 -0.05 0.00 0.26 0.00 0.00 34.13 31.19 2oqe s GLU 438 CO 0.25 0.37 0.62 -2.00 -0.54 0.00 0.00 175.26 173.95 2oqe s GLU 439 N -0.33 4.36 0.06 4.30 2.56 -1.26 -4.75 118.70 123.64 2oqe s GLU 439 Ca 0.36 0.75 -0.06 0.00 0.00 0.00 0.00 54.97 56.02 2oqe s GLU 439 Cb -0.21 -3.38 -0.30 0.00 2.00 0.00 0.00 34.13 32.25 2oqe s GLU 439 CO 0.22 0.27 1.09 0.00 -0.56 0.00 0.00 175.26 176.28 2oqe h ALA 440 N 6.02 0.06 -2.34 6.30 0.00 -1.95 -3.46 119.26 123.89 2oqe h ALA 440 Ca -0.44 -0.90 -0.50 0.00 0.00 0.00 0.00 54.91 53.07 2oqe h ALA 440 Cb 1.20 0.06 0.12 0.00 0.00 0.00 0.00 17.79 19.18 2oqe h ALA 440 CO 0.72 0.93 0.32 0.20 0.00 0.00 0.00 179.25 181.42 2oqe s GLY 441 N -4.67 1.65 0.00 0.00 0.00 -1.14 -2.19 107.32 100.97 2oqe s GLY 441 Ca -0.05 0.08 0.29 0.00 0.00 0.00 0.00 44.72 45.04 2oqe s GLY 441 CO 0.89 0.46 1.91 -1.55 0.00 0.00 0.00 173.10 174.82 2oqe n PRO 442 N -3.50 1.01 0.00 2.90 -0.04 -1.26 -4.82 135.00 129.29 2oqe n PRO 442 Ca 0.08 -0.37 0.12 0.00 -0.04 0.00 0.00 63.50 63.29 2oqe n PRO 442 Cb 0.54 -1.49 0.16 0.00 -0.04 0.00 0.00 33.50 32.67 2oqe n PRO 442 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2oqe n TRP 443 N -0.67 0.00 -3.81 0.54 5.03 -1.18 -4.95 117.44 112.39 2oqe n TRP 443 Ca 0.18 0.00 -0.07 0.00 3.03 0.00 0.00 57.50 60.64 2oqe n TRP 443 Cb 0.26 -0.09 0.03 0.00 -1.03 0.00 0.00 31.31 30.47 2oqe n TRP 443 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 2oqe n GLY 444 N 1.42 0.88 3.13 6.99 0.00 -0.93 -0.04 105.19 116.64 2oqe n GLY 444 Ca 0.09 -1.22 -0.24 0.00 0.00 0.00 0.00 46.02 44.64 2oqe n GLY 444 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2oqe s THR 445 N -2.10 1.29 -0.76 2.61 2.01 -0.07 -2.90 115.64 115.72 2oqe s THR 445 Ca 0.18 -0.67 -0.27 0.00 0.31 0.00 0.00 61.69 61.24 2oqe s THR 445 Cb -0.04 -1.09 0.03 0.00 0.01 0.00 0.00 72.50 71.40 2oqe s THR 445 CO 0.10 0.37 1.33 -0.60 -0.69 0.00 0.00 174.62 175.13 2oqe s ARG 446 N -0.18 3.20 0.00 4.92 3.52 -1.26 -1.33 118.95 127.81 2oqe s ARG 446 Ca 0.02 -0.28 0.25 0.00 -0.13 0.00 0.00 55.73 55.59 2oqe s ARG 446 Cb -0.08 -4.31 0.54 0.00 -1.56 0.00 0.00 34.95 29.53 2oqe s ARG 446 CO 0.00 -2.19 1.43 1.33 -0.81 0.00 0.00 175.30 175.06 2oqe n VAL 447 N 6.48 0.00 -3.57 7.11 0.24 -1.10 -4.81 118.33 122.67 2oqe n VAL 447 Ca 0.07 -0.05 -0.09 0.00 -2.04 0.00 0.00 64.34 62.23 2oqe n VAL 447 Cb 0.49 0.36 -0.04 0.00 -1.47 0.00 0.00 33.84 33.18 2oqe n VAL 447 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 2oqe s TYR 448 N -2.82 -0.32 0.29 6.34 5.04 -1.26 -4.70 117.35 119.92 2oqe s TYR 448 Ca 0.15 0.48 -0.30 0.00 -2.44 0.00 0.00 57.07 54.97 2oqe s TYR 448 Cb 0.18 0.47 -0.13 0.00 0.35 0.00 0.00 41.96 42.84 2oqe s TYR 448 CO 0.65 -0.33 1.42 -2.30 -1.34 0.00 0.00 175.55 173.64 2oqe n PRO 449 N 0.51 2.25 -1.42 4.97 -0.02 -1.26 -1.31 135.00 138.71 2oqe n PRO 449 Ca -0.08 0.80 -0.14 0.00 -2.02 0.00 0.00 63.50 62.05 2oqe n PRO 449 Cb 0.59 -2.46 -0.06 0.00 -0.02 0.00 0.00 33.50 31.54 2oqe n PRO 449 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2oqe n ASN 450 N 1.67 -4.93 -4.11 2.55 5.03 -1.26 -4.97 115.26 109.23 2oqe n ASN 450 Ca 0.08 0.36 -0.32 0.00 0.87 0.00 0.00 54.58 55.57 2oqe n ASN 450 Cb 0.34 -3.70 -0.16 0.00 -1.02 0.00 0.00 39.78 35.24 2oqe n ASN 450 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2oqe s VAL 451 N -2.47 1.90 -0.29 2.41 1.01 -0.43 -1.48 120.40 121.05 2oqe s VAL 451 Ca 0.00 -0.86 -0.05 0.00 0.00 0.00 0.00 61.98 61.07 2oqe s VAL 451 Cb 0.00 -1.71 0.02 0.00 0.00 0.00 0.00 36.38 34.69 2oqe s VAL 451 CO 0.00 0.52 0.04 0.21 0.00 0.00 0.00 175.10 175.86 2oqe s ASN 452 N 1.09 4.91 -0.40 3.32 3.84 0.52 -2.72 114.94 125.50 2oqe s ASN 452 Ca -0.01 -0.86 -0.14 0.00 0.21 0.00 0.00 52.86 52.05 2oqe s ASN 452 Cb -0.14 -1.80 0.02 0.00 -0.55 0.00 0.00 41.25 38.77 2oqe s ASN 452 CO -0.07 -0.20 0.28 0.00 -2.79 0.00 0.00 177.10 174.32 2oqe s ALA 453 N 1.42 3.44 0.47 1.71 0.00 -0.45 -0.57 121.76 127.78 2oqe s ALA 453 Ca 0.01 -1.70 -0.21 0.00 0.00 0.00 0.00 51.96 50.05 2oqe s ALA 453 Cb -0.18 -2.82 -0.08 0.00 0.00 0.00 0.00 23.12 20.04 2oqe s ALA 453 CO 0.00 -1.42 1.07 -1.01 0.00 0.00 0.00 175.76 174.40 2oqe s HIS 454 N 1.66 2.99 0.55 0.00 3.76 -1.26 -0.89 115.29 122.09 2oqe s HIS 454 Ca 0.04 1.58 -0.22 0.00 -0.15 0.00 0.00 55.06 56.32 2oqe s HIS 454 Cb -0.19 -3.16 -0.05 0.00 1.11 0.00 0.00 32.58 30.29 2oqe s HIS 454 CO 0.09 -1.00 1.36 -0.80 -0.85 0.00 0.00 174.74 173.55 2oqe s ASN 455 N -1.76 5.27 0.15 1.40 0.01 0.95 -4.74 114.94 116.22 2oqe s ASN 455 Ca 0.65 2.77 -0.24 0.00 -0.71 0.00 0.00 52.86 55.34 2oqe s ASN 455 Cb -0.21 -2.64 0.07 0.00 0.41 0.00 0.00 41.25 38.88 2oqe s ASN 455 CO 0.25 -1.57 0.68 -1.38 -1.51 0.00 0.00 177.10 173.57 2oqe s HIS 456 N -1.30 -0.43 0.15 2.20 -3.43 -0.91 0.03 115.29 111.60 2oqe s HIS 456 Ca 0.71 0.19 0.06 0.00 -0.80 0.00 0.00 55.06 55.22 2oqe s HIS 456 Cb -0.41 0.58 -0.04 0.00 -1.43 0.00 0.00 32.58 31.29 2oqe s HIS 456 CO 0.48 -0.86 0.05 -0.65 -2.00 0.00 0.00 174.74 171.75 2oqe s GLN 457 N -3.65 2.60 -0.25 -0.38 -0.21 -0.49 0.11 119.66 117.40 2oqe s GLN 457 Ca 0.04 -0.97 -0.00 0.00 0.02 0.00 0.00 55.36 54.45 2oqe s GLN 457 Cb -0.02 -2.49 0.04 0.00 1.00 0.00 0.00 33.01 31.53 2oqe s GLN 457 CO -0.08 0.48 -0.09 -1.01 -2.12 0.00 0.00 175.29 172.47 2oqe s HIS 458 N -1.65 3.10 0.04 0.91 3.76 0.13 -2.83 115.29 118.74 2oqe s HIS 458 Ca 0.28 -1.79 0.08 0.00 -0.15 0.00 0.00 55.06 53.49 2oqe s HIS 458 Cb -0.10 -2.01 -0.03 0.00 1.11 0.00 0.00 32.58 31.55 2oqe s HIS 458 CO 0.20 -0.79 -0.24 -0.51 -0.85 0.00 0.00 174.74 172.55 2oqe s LEU 459 N 1.26 2.15 0.05 0.89 1.43 0.24 -1.28 118.68 123.41 2oqe s LEU 459 Ca -0.02 -0.55 0.05 0.00 -1.03 0.00 0.00 54.13 52.58 2oqe s LEU 459 Cb -0.17 -1.19 -0.02 0.00 0.03 0.00 0.00 46.19 44.83 2oqe s LEU 459 CO -0.05 0.24 -0.14 -0.36 0.23 0.00 0.00 176.35 176.27 2oqe s PHE 460 N -0.77 1.20 -0.36 0.29 0.08 0.05 -0.88 117.98 117.60 2oqe s PHE 460 Ca 0.10 -0.40 -0.01 0.00 0.12 0.00 0.00 56.93 56.75 2oqe s PHE 460 Cb -0.10 -0.70 0.09 0.00 -0.57 0.00 0.00 43.02 41.75 2oqe s PHE 460 CO 0.02 0.04 0.10 0.45 -0.10 0.00 0.00 175.22 175.73 2oqe s SER 461 N -1.39 5.01 -0.06 1.36 0.15 0.20 -2.05 113.70 116.93 2oqe s SER 461 Ca -0.00 -1.86 -0.29 0.00 0.70 0.00 0.00 55.95 54.51 2oqe s SER 461 Cb -0.09 -1.74 -0.02 0.00 -1.71 0.00 0.00 66.02 62.46 2oqe s SER 461 CO 0.02 -0.42 0.95 -0.22 1.20 0.00 0.00 173.24 174.76 2oqe s LEU 462 N 1.11 4.31 -0.24 3.45 2.96 0.34 -0.22 118.68 130.38 2oqe s LEU 462 Ca 0.05 1.53 -0.05 0.00 -0.22 0.00 0.00 54.13 55.44 2oqe s LEU 462 Cb -0.21 -3.49 -0.00 0.00 0.50 0.00 0.00 46.19 42.99 2oqe s LEU 462 CO -0.04 -0.32 -0.01 -0.60 -1.32 0.00 0.00 176.35 174.06 2oqe s ARG 463 N 1.42 3.31 -0.19 1.98 3.52 0.04 -0.52 118.95 128.52 2oqe s ARG 463 Ca 0.48 -0.68 -0.02 0.00 -0.13 0.00 0.00 55.73 55.38 2oqe s ARG 463 Cb -0.19 -3.12 -0.01 0.00 -1.56 0.00 0.00 34.95 30.07 2oqe s ARG 463 CO 0.22 -0.26 -0.08 0.42 -0.81 0.00 0.00 175.30 174.79 2oqe s ILE 464 N 1.49 3.15 -0.56 4.11 1.01 0.39 -2.22 121.20 128.57 2oqe s ILE 464 Ca 0.05 -0.58 -0.10 0.00 0.00 0.00 0.00 60.65 60.01 2oqe s ILE 464 Cb -0.15 -2.39 0.14 0.00 0.01 0.00 0.00 42.46 40.07 2oqe s ILE 464 CO -0.01 0.47 0.45 -0.62 0.00 0.00 0.00 174.94 175.22 2oqe s ASP 465 N 1.11 5.88 0.52 3.58 -1.08 0.23 -1.05 116.67 125.86 2oqe s ASP 465 Ca 0.01 -2.15 -0.10 0.00 -0.52 0.00 0.00 52.55 49.79 2oqe s ASP 465 Cb -0.15 -2.05 -0.05 0.00 -1.46 0.00 0.00 42.92 39.22 2oqe s ASP 465 CO -0.02 -0.65 0.90 -2.16 0.52 0.00 0.00 175.17 173.76 2oqe s PRO 466 N 1.01 3.68 -0.41 4.34 0.04 -1.26 0.32 135.00 142.72 2oqe s PRO 466 Ca 0.09 0.58 0.10 0.00 0.04 0.00 0.00 61.00 61.81 2oqe s PRO 466 Cb -0.23 -2.23 0.35 0.00 0.04 0.00 0.00 34.50 32.43 2oqe s PRO 466 CO -0.02 -0.31 0.96 -2.13 0.04 0.00 0.00 177.00 175.54 2oqe n ARG 467 N -2.13 1.02 -1.98 4.56 0.63 0.07 -4.49 116.66 114.35 2oqe n ARG 467 Ca 0.04 -2.64 -0.42 0.00 -0.92 0.00 0.00 57.85 53.90 2oqe n ARG 467 Cb 0.54 -1.25 -0.03 0.00 0.45 0.00 0.00 32.46 32.17 2oqe n ARG 467 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 2oqe s ILE 468 N -1.16 3.43 -1.58 5.15 -1.09 -1.14 -1.87 121.20 122.95 2oqe s ILE 468 Ca 0.30 0.42 0.00 0.00 -2.23 0.00 0.00 60.65 59.14 2oqe s ILE 468 Cb 0.34 -3.64 0.00 0.00 -1.58 0.00 0.00 42.46 37.58 2oqe s ILE 468 CO -0.06 -0.44 0.00 -0.67 -1.23 0.00 0.00 174.94 172.54 2oqe n ASP 469 N 10.76 -5.08 0.00 3.58 2.03 0.32 -4.44 116.55 123.72 2oqe n ASP 469 Ca 0.23 0.13 0.00 0.00 0.52 0.00 0.00 54.79 55.67 2oqe n ASP 469 Cb 0.47 -4.30 0.00 0.00 -0.72 0.00 0.00 41.12 36.57 2oqe n ASP 469 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2oqe n GLY 470 N -0.83 -0.42 3.84 0.27 0.00 -0.78 -4.84 105.19 102.41 2oqe n GLY 470 Ca -0.20 -2.18 -0.36 0.00 0.00 0.00 0.00 46.02 43.27 2oqe n GLY 470 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oqe s ASP 471 N -4.00 6.88 0.00 1.61 1.01 -1.26 -4.55 116.67 116.36 2oqe s ASP 471 Ca 0.00 1.15 0.00 0.00 0.71 0.00 0.00 52.55 54.41 2oqe s ASP 471 Cb 0.00 -2.32 0.00 0.00 1.01 0.00 0.00 42.92 41.61 2oqe s ASP 471 CO 0.00 0.11 0.00 0.61 0.21 0.00 0.00 175.17 176.10 2oqe n GLY 472 N 0.88 -1.10 3.43 0.21 0.00 -1.26 -4.97 105.19 102.37 2oqe n GLY 472 Ca -0.05 -0.59 -0.21 0.00 0.00 0.00 0.00 46.02 45.16 2oqe n GLY 472 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2oqe s ASN 473 N 0.00 2.83 0.21 1.61 0.02 -0.47 -4.19 114.94 114.95 2oqe s ASN 473 Ca 0.00 -1.17 -0.03 0.00 -1.02 0.00 0.00 52.86 50.65 2oqe s ASN 473 Cb 0.00 -0.18 -0.03 0.00 0.02 0.00 0.00 41.25 41.06 2oqe s ASN 473 CO 0.00 -0.30 0.18 -0.44 0.02 0.00 0.00 177.10 176.56 2oqe s SER 474 N -3.44 0.13 0.13 -1.22 0.01 -0.16 -1.71 113.70 107.45 2oqe s SER 474 Ca 0.29 -1.33 0.03 0.00 1.31 0.00 0.00 55.95 56.26 2oqe s SER 474 Cb 0.03 0.41 -0.04 0.00 0.21 0.00 0.00 66.02 66.63 2oqe s SER 474 CO 0.12 -0.89 -0.08 0.00 0.41 0.00 0.00 173.24 172.80 2oqe s ALA 475 N -4.13 1.30 0.08 1.44 0.00 -1.26 -1.14 121.76 118.05 2oqe s ALA 475 Ca 0.37 -1.46 -0.19 0.00 0.00 0.00 0.00 51.96 50.68 2oqe s ALA 475 Cb 0.06 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.35 2oqe s ALA 475 CO 0.12 -0.16 0.46 0.00 0.00 0.00 0.00 175.76 176.17 2oqe s ALA 476 N -3.45 -1.13 -0.02 0.00 0.00 -0.42 -1.09 121.76 115.65 2oqe s ALA 476 Ca 0.16 0.29 -0.06 0.00 0.00 0.00 0.00 51.96 52.36 2oqe s ALA 476 Cb 0.04 0.52 -0.04 0.00 0.00 0.00 0.00 23.12 23.63 2oqe s ALA 476 CO -0.01 -0.56 0.23 0.00 0.00 0.00 0.00 175.76 175.42 2oqe s ALA 477 N -3.02 3.88 -0.16 0.00 0.00 -0.50 -0.80 121.76 121.16 2oqe s ALA 477 Ca -0.02 -0.63 0.01 0.00 0.00 0.00 0.00 51.96 51.32 2oqe s ALA 477 Cb 0.00 -2.01 0.02 0.00 0.00 0.00 0.00 23.12 21.13 2oqe s ALA 477 CO -0.06 0.67 -0.18 0.00 0.00 0.00 0.00 175.76 176.19 2oqe s ASP 479 N 1.31 2.60 0.06 0.00 1.01 -0.09 -1.75 116.67 119.81 2oqe s ASP 479 Ca 0.03 -0.47 -0.31 0.00 0.71 0.00 0.00 52.55 52.52 2oqe s ASP 479 Cb -0.13 -1.17 -0.06 0.00 1.01 0.00 0.00 42.92 42.56 2oqe s ASP 479 CO -0.11 0.02 1.28 0.00 0.21 0.00 0.00 175.17 176.58 2oqe s ALA 480 N 0.98 3.48 0.01 5.23 0.00 -0.18 -0.49 121.76 130.79 2oqe s ALA 480 Ca -0.06 0.92 0.00 0.00 0.00 0.00 0.00 51.96 52.83 2oqe s ALA 480 Cb -0.15 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 2oqe s ALA 480 CO -0.02 -0.57 -0.02 0.15 0.00 0.00 0.00 175.76 175.30 2oqe s LYS 481 N 1.31 0.17 0.60 0.00 1.02 -0.14 -4.59 119.74 118.12 2oqe s LYS 481 Ca 0.61 -0.19 -0.19 0.00 0.02 0.00 0.00 55.97 56.21 2oqe s LYS 481 Cb -0.32 -0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 36.89 2oqe s LYS 481 CO 0.29 0.01 1.25 -1.12 -0.92 0.00 0.00 175.35 174.86 2oqe s SER 482 N -0.39 5.07 0.34 2.83 0.01 -1.26 -0.76 113.70 119.54 2oqe s SER 482 Ca -0.03 2.50 -0.27 0.00 1.31 0.00 0.00 55.95 59.46 2oqe s SER 482 Cb -0.03 -2.61 -0.13 0.00 0.21 0.00 0.00 66.02 63.46 2oqe s SER 482 CO -0.00 -1.68 1.02 -0.24 0.41 0.00 0.00 173.24 172.74 2oqe n SER 483 N -1.57 1.34 0.11 2.44 2.88 -0.33 -4.81 113.62 113.67 2oqe n SER 483 Ca 0.14 1.13 0.12 0.00 -1.33 0.00 0.00 58.87 58.92 2oqe n SER 483 Cb 0.49 -1.32 0.46 0.00 -0.75 0.00 0.00 64.21 63.09 2oqe n SER 483 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 2oqe n PRO 484 N 0.54 0.18 -2.48 -1.46 -0.04 -1.26 -4.76 135.00 125.72 2oqe n PRO 484 Ca 0.09 0.34 -0.40 0.00 -0.04 0.00 0.00 63.50 63.49 2oqe n PRO 484 Cb 0.35 -1.80 -0.04 0.00 -0.04 0.00 0.00 33.50 31.96 2oqe n PRO 484 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2oqe s TYR 485 N -3.22 3.59 0.71 0.54 2.02 -1.26 -5.01 117.35 114.71 2oqe s TYR 485 Ca 0.06 1.68 -0.11 0.00 -0.37 0.00 0.00 57.07 58.33 2oqe s TYR 485 Cb 0.10 -3.28 0.02 0.00 -0.40 0.00 0.00 41.96 38.40 2oqe s TYR 485 CO 0.43 -0.56 1.07 -1.25 -1.57 0.00 0.00 175.55 173.67 2oqe s PRO 486 N -1.23 2.83 0.18 -1.71 0.04 -1.26 -4.82 135.00 129.03 2oqe s PRO 486 Ca 0.45 0.77 -0.33 0.00 0.04 0.00 0.00 61.00 61.94 2oqe s PRO 486 Cb -0.31 -1.99 -0.15 0.00 0.04 0.00 0.00 34.50 32.08 2oqe s PRO 486 CO 0.40 -1.13 1.29 -0.11 0.04 0.00 0.00 177.00 177.49 2oqe n LEU 487 N -3.12 2.12 0.00 -3.56 7.94 -1.26 -2.27 117.00 116.85 2oqe n LEU 487 Ca 0.07 1.13 0.00 0.00 -1.11 0.00 0.00 56.01 56.10 2oqe n LEU 487 Cb 0.55 -1.29 0.00 0.00 0.53 0.00 0.00 43.42 43.21 2oqe n LEU 487 CO 0.57 -0.95 0.00 0.61 -1.11 0.00 0.00 177.39 176.51 2oqe n GLY 488 N 2.25 1.13 3.84 -3.96 0.00 -0.37 -4.97 105.19 103.11 2oqe n GLY 488 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 2oqe n GLY 488 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oqe s SER 489 N -3.08 6.34 0.53 1.61 1.04 -0.96 -4.83 113.70 114.35 2oqe s SER 489 Ca 0.00 1.56 0.22 0.00 0.48 0.00 0.00 55.95 58.21 2oqe s SER 489 Cb 0.00 -2.50 1.38 0.00 0.10 0.00 0.00 66.02 65.00 2oqe s SER 489 CO 0.00 -0.78 2.09 -0.65 0.98 0.00 0.00 173.24 174.87 2oqe h PRO 490 N 0.43 0.00 0.00 4.02 0.11 -1.96 -1.22 132.00 133.38 2oqe h PRO 490 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2oqe h PRO 490 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2oqe h PRO 490 CO 0.61 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.33 2oqe h GLU 491 N 0.00 0.00 -0.46 1.05 3.07 -1.93 -3.38 114.58 112.93 2oqe h GLU 491 Ca 0.11 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 58.68 2oqe h GLU 491 Cb 0.46 0.00 -0.22 0.00 -0.84 0.00 0.00 28.75 28.15 2oqe h GLU 491 CO -0.00 0.00 -0.63 -1.71 -1.40 0.00 0.00 179.01 175.27 2oqe n ASN 492 N -3.05 -1.29 -0.21 1.42 5.15 -0.83 -4.97 115.26 111.48 2oqe n ASN 492 Ca 0.04 -3.17 0.01 0.00 -0.60 0.00 0.00 54.58 50.86 2oqe n ASN 492 Cb 0.50 1.00 0.12 0.00 -0.53 0.00 0.00 39.78 40.87 2oqe n ASN 492 CO 0.00 0.00 0.00 -0.03 1.40 0.00 0.00 177.26 178.63 2oqe h MET 493 N 2.74 0.32 -0.68 1.20 1.85 -1.44 -1.35 114.93 117.57 2oqe h MET 493 Ca -0.11 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.96 2oqe h MET 493 Cb 1.14 -0.07 0.00 0.00 0.43 0.00 0.00 31.60 33.09 2oqe h MET 493 CO 0.18 0.21 0.00 0.66 -0.40 0.00 0.00 176.91 177.56 2oqe n TYR 494 N -5.07 0.96 -1.17 1.39 4.01 -1.26 -1.24 117.16 114.78 2oqe n TYR 494 Ca 0.09 -0.51 -0.06 0.00 -0.16 0.00 0.00 57.90 57.26 2oqe n TYR 494 Cb 0.32 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.30 2oqe n TYR 494 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2oqe n GLY 495 N 1.47 0.77 0.01 2.72 0.00 -0.52 -4.91 105.19 104.74 2oqe n GLY 495 Ca 0.23 -0.31 0.11 0.00 0.00 0.00 0.00 46.02 46.06 2oqe n GLY 495 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2oqe n ASN 496 N -0.05 0.75 -4.75 1.61 6.94 -1.26 -4.94 115.26 113.56 2oqe n ASN 496 Ca -0.06 -0.61 -0.41 0.00 -0.02 0.00 0.00 54.58 53.48 2oqe n ASN 496 Cb 0.30 0.58 -0.02 0.00 -2.36 0.00 0.00 39.78 38.28 2oqe n ASN 496 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2oqe s ALA 497 N -2.98 3.59 0.11 -2.53 0.00 -1.26 -4.96 121.76 113.72 2oqe s ALA 497 Ca 0.10 1.31 -0.13 0.00 0.00 0.00 0.00 51.96 53.23 2oqe s ALA 497 Cb 0.17 -3.54 0.02 0.00 0.00 0.00 0.00 23.12 19.77 2oqe s ALA 497 CO 0.77 -0.72 0.32 -0.59 0.00 0.00 0.00 175.76 175.54 2oqe s PHE 498 N -0.23 -0.08 0.29 0.00 -0.71 -1.26 -1.19 117.98 114.79 2oqe s PHE 498 Ca 0.57 -0.26 -0.05 0.00 -1.04 0.00 0.00 56.93 56.15 2oqe s PHE 498 Cb -0.41 0.14 -0.01 0.00 -1.21 0.00 0.00 43.02 41.53 2oqe s PHE 498 CO 0.45 -0.63 0.40 1.52 -1.34 0.00 0.00 175.22 175.62 2oqe s TYR 499 N -3.72 0.92 -0.26 3.49 1.13 0.07 -4.89 117.35 114.07 2oqe s TYR 499 Ca 0.03 -1.17 -0.07 0.00 -1.41 0.00 0.00 57.07 54.45 2oqe s TYR 499 Cb 0.03 -0.13 -0.02 0.00 -1.10 0.00 0.00 41.96 40.74 2oqe s TYR 499 CO -0.11 -0.99 0.07 0.45 -2.51 0.00 0.00 175.55 172.47 2oqe s SER 500 N -3.17 5.12 -0.30 -0.18 0.15 -1.26 -0.96 113.70 113.10 2oqe s SER 500 Ca 0.30 -0.35 -0.21 0.00 0.70 0.00 0.00 55.95 56.39 2oqe s SER 500 Cb 0.01 -1.91 -0.01 0.00 -1.71 0.00 0.00 66.02 62.40 2oqe s SER 500 CO 0.16 -0.08 0.67 -0.70 1.20 0.00 0.00 173.24 174.48 2oqe s GLU 501 N 1.58 3.92 -0.28 5.44 2.12 0.36 -4.88 118.70 126.97 2oqe s GLU 501 Ca 0.05 0.38 -0.11 0.00 0.36 0.00 0.00 54.97 55.65 2oqe s GLU 501 Cb -0.16 -3.72 -0.05 0.00 0.26 0.00 0.00 34.13 30.46 2oqe s GLU 501 CO 0.03 -0.59 0.18 0.21 -0.54 0.00 0.00 175.26 174.55 2oqe s LYS 502 N 2.69 3.92 -0.42 4.30 2.20 -1.26 -0.91 119.74 130.25 2oqe s LYS 502 Ca 0.27 -0.34 -0.07 0.00 -0.36 0.00 0.00 55.97 55.47 2oqe s LYS 502 Cb -0.15 -3.62 0.09 0.00 -1.51 0.00 0.00 37.83 32.65 2oqe s LYS 502 CO 0.12 -0.17 0.25 0.99 -0.36 0.00 0.00 175.35 176.18 2oqe s THR 503 N 1.73 3.93 0.05 3.43 2.01 0.28 -4.98 115.64 122.10 2oqe s THR 503 Ca 0.07 -1.65 -0.30 0.00 0.31 0.00 0.00 61.69 60.12 2oqe s THR 503 Cb -0.16 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 68.79 2oqe s THR 503 CO 0.10 -0.59 1.09 -0.89 -0.69 0.00 0.00 174.62 173.63 2oqe s THR 504 N 1.33 4.37 -0.18 -0.82 2.01 -1.26 -1.41 115.64 119.68 2oqe s THR 504 Ca 0.04 1.75 -0.29 0.00 0.31 0.00 0.00 61.69 63.50 2oqe s THR 504 Cb -0.24 -4.12 -0.00 0.00 0.01 0.00 0.00 72.50 68.15 2oqe s THR 504 CO -0.00 0.16 1.07 -0.36 -0.69 0.00 0.00 174.62 174.80 2oqe s PHE 505 N 0.82 3.32 -0.18 4.92 0.08 -0.25 -4.91 117.98 121.78 2oqe s PHE 505 Ca 0.54 1.43 -0.06 0.00 0.12 0.00 0.00 56.93 58.97 2oqe s PHE 505 Cb -0.26 -3.28 -0.22 0.00 -0.57 0.00 0.00 43.02 38.69 2oqe s PHE 505 CO 0.29 -0.60 0.13 1.63 -0.10 0.00 0.00 175.22 176.57 2oqe n LYS 506 N 5.93 0.70 -4.45 0.44 5.02 -1.26 -4.10 118.16 120.44 2oqe n LYS 506 Ca 0.11 0.26 -0.22 0.00 -2.02 0.00 0.00 58.31 56.44 2oqe n LYS 506 Cb 0.47 -1.64 -0.10 0.00 -0.02 0.00 0.00 35.03 33.73 2oqe n LYS 506 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2oqe s THR 507 N -2.53 1.72 0.20 -0.18 -4.23 -1.26 -1.50 115.64 107.87 2oqe s THR 507 Ca -0.28 -2.12 -0.13 0.00 -1.18 0.00 0.00 61.69 57.98 2oqe s THR 507 Cb 0.08 -2.52 0.19 0.00 1.34 0.00 0.00 72.50 71.58 2oqe s THR 507 CO 0.69 -0.25 1.65 0.58 -0.54 0.00 0.00 174.62 176.75 2oqe h VAL 508 N 2.21 0.48 -0.89 2.29 2.07 -1.10 -1.34 116.25 119.97 2oqe h VAL 508 Ca -0.40 -0.02 0.15 0.00 0.82 0.00 0.00 66.70 67.25 2oqe h VAL 508 Cb 1.24 0.41 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 2oqe h VAL 508 CO 0.68 0.01 0.57 0.50 0.02 0.00 0.00 177.57 179.36 2oqe h LYS 509 N 0.06 0.64 0.00 1.57 3.64 -1.42 0.08 116.57 121.15 2oqe h LYS 509 Ca 0.29 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2oqe h LYS 509 Cb 0.46 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 2oqe h LYS 509 CO -0.54 0.42 -0.04 -0.44 -2.27 0.00 0.00 179.45 176.59 2oqe h ASP 510 N 0.65 0.00 1.74 4.20 3.32 -1.51 -2.91 116.42 121.91 2oqe h ASP 510 Ca 0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.50 2oqe h ASP 510 Cb 0.78 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2oqe h ASP 510 CO -0.21 0.04 0.00 0.77 -1.72 0.00 0.00 179.24 178.12 2oqe h SER 511 N 0.00 0.00 -1.02 6.45 4.64 -0.99 -3.43 113.55 119.20 2oqe h SER 511 Ca -0.00 0.00 -0.48 0.00 -0.47 0.00 0.00 61.79 60.84 2oqe h SER 511 Cb 0.08 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.09 2oqe h SER 511 CO 0.00 0.00 1.19 -0.76 -0.87 0.00 0.00 176.83 176.40 2oqe s LEU 512 N -5.43 3.36 0.07 5.97 1.43 -1.10 -4.32 118.68 118.66 2oqe s LEU 512 Ca 0.09 -1.09 0.03 0.00 -1.03 0.00 0.00 54.13 52.13 2oqe s LEU 512 Cb 0.08 -2.56 -0.03 0.00 0.03 0.00 0.00 46.19 43.71 2oqe s LEU 512 CO 0.63 -2.01 -0.10 0.42 0.23 0.00 0.00 176.35 175.53 2oqe s THR 513 N 7.03 0.78 0.21 5.49 -4.23 -1.08 -5.00 115.64 118.82 2oqe s THR 513 Ca 0.55 -1.32 0.08 0.00 -1.18 0.00 0.00 61.69 59.82 2oqe s THR 513 Cb -0.03 -0.97 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 2oqe s THR 513 CO -0.05 -0.42 0.01 0.20 -0.54 0.00 0.00 174.62 173.81 2oqe s ASN 514 N -1.92 4.72 0.48 3.99 0.01 -1.26 -0.90 114.94 120.06 2oqe s ASN 514 Ca -0.03 -0.47 -0.24 0.00 -0.71 0.00 0.00 52.86 51.41 2oqe s ASN 514 Cb -0.07 -0.97 -0.07 0.00 0.41 0.00 0.00 41.25 40.54 2oqe s ASN 514 CO 0.00 0.06 1.38 -0.47 -1.51 0.00 0.00 177.10 176.56 2oqe s TYR 515 N -1.92 2.43 -0.15 2.20 5.04 -1.26 -4.93 117.35 118.76 2oqe s TYR 515 Ca 0.29 1.33 -0.02 0.00 -2.44 0.00 0.00 57.07 56.22 2oqe s TYR 515 Cb -0.08 -3.84 0.05 0.00 0.35 0.00 0.00 41.96 38.43 2oqe s TYR 515 CO 0.19 -2.82 0.01 -1.21 -1.34 0.00 0.00 175.55 170.38 2oqe s GLU 516 N -2.62 0.81 0.42 4.97 0.41 -1.26 -5.01 118.70 116.41 2oqe s GLU 516 Ca 0.65 -0.28 0.13 0.00 -0.41 0.00 0.00 54.97 55.06 2oqe s GLU 516 Cb -0.41 -1.75 0.89 0.00 -1.78 0.00 0.00 34.13 31.08 2oqe s GLU 516 CO 0.52 -0.49 1.93 0.66 -0.49 0.00 0.00 175.26 177.39 2oqe h SER 517 N 8.24 0.03 -0.02 -0.19 4.64 -1.96 -1.60 113.55 122.70 2oqe h SER 517 Ca -0.19 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2oqe h SER 517 Cb 1.12 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.20 2oqe h SER 517 CO 0.33 0.26 0.02 0.00 -0.87 0.00 0.00 176.83 176.57 2oqe h ALA 518 N 1.74 1.66 0.00 5.18 0.00 -1.98 -2.64 119.26 123.21 2oqe h ALA 518 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2oqe h ALA 518 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2oqe h ALA 518 CO 0.03 -0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.51 2oqe n THR 519 N -4.00 0.42 -4.04 0.00 -2.24 -1.11 -4.95 114.28 98.36 2oqe n THR 519 Ca -0.03 -0.64 -0.27 0.00 -2.27 0.00 0.00 64.05 60.85 2oqe n THR 519 Cb 0.10 0.86 -0.04 0.00 -2.10 0.00 0.00 70.33 69.16 2oqe n THR 519 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oqe n GLY 520 N -0.21 -0.21 3.69 3.38 0.00 -0.64 -1.01 105.19 110.18 2oqe n GLY 520 Ca 0.00 0.15 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 2oqe n GLY 520 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2oqe n ARG 521 N -4.44 2.15 -4.48 1.61 0.63 -0.95 -4.70 116.66 106.50 2oqe n ARG 521 Ca -0.29 0.76 -0.23 0.00 -0.92 0.00 0.00 57.85 57.17 2oqe n ARG 521 Cb 0.68 -2.42 -0.10 0.00 0.45 0.00 0.00 32.46 31.08 2oqe n ARG 521 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2oqe s SER 522 N 0.15 2.51 0.05 6.15 1.04 -0.72 -4.76 113.70 118.12 2oqe s SER 522 Ca 0.64 -1.47 0.07 0.00 0.48 0.00 0.00 55.95 55.66 2oqe s SER 522 Cb -0.60 0.11 -0.02 0.00 0.10 0.00 0.00 66.02 65.60 2oqe s SER 522 CO 0.53 -0.71 -0.18 0.26 0.98 0.00 0.00 173.24 174.11 2oqe s TRP 523 N -3.27 1.61 -0.02 5.02 0.51 -1.03 -0.36 118.94 121.40 2oqe s TRP 523 Ca 0.32 -0.37 0.02 0.00 -2.12 0.00 0.00 56.10 53.95 2oqe s TRP 523 Cb 0.07 -0.95 -0.03 0.00 -0.81 0.00 0.00 33.47 31.74 2oqe s TRP 523 CO 0.15 0.08 -0.05 -0.51 -0.51 0.00 0.00 176.95 176.11 2oqe s ASP 524 N -1.22 4.79 -0.16 2.95 1.01 0.01 0.36 116.67 124.42 2oqe s ASP 524 Ca 0.05 -0.06 0.01 0.00 0.71 0.00 0.00 52.55 53.26 2oqe s ASP 524 Cb -0.09 -1.19 0.01 0.00 1.01 0.00 0.00 42.92 42.66 2oqe s ASP 524 CO 0.02 0.31 -0.18 -0.63 0.21 0.00 0.00 175.17 174.90 2oqe s ILE 525 N -0.97 2.39 0.14 0.77 1.01 -0.12 -1.30 121.20 123.11 2oqe s ILE 525 Ca 0.16 -0.85 -0.04 0.00 0.00 0.00 0.00 60.65 59.92 2oqe s ILE 525 Cb -0.11 -2.00 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2oqe s ILE 525 CO 0.06 0.52 0.13 0.72 0.00 0.00 0.00 174.94 176.38 2oqe s PHE 526 N 1.00 0.68 -0.41 3.97 -0.71 -0.29 -1.31 117.98 120.92 2oqe s PHE 526 Ca -0.02 -1.06 -0.07 0.00 -1.04 0.00 0.00 56.93 54.74 2oqe s PHE 526 Cb -0.15 -0.33 0.09 0.00 -1.21 0.00 0.00 43.02 41.42 2oqe s PHE 526 CO -0.04 -0.58 0.23 1.21 -1.34 0.00 0.00 175.22 174.69 2oqe s ASN 527 N -3.01 5.47 0.00 1.98 3.84 -0.69 -0.99 114.94 121.55 2oqe s ASN 527 Ca 0.21 -1.64 0.20 0.00 0.21 0.00 0.00 52.86 51.84 2oqe s ASN 527 Cb 0.06 -1.92 1.06 0.00 -0.55 0.00 0.00 41.25 39.90 2oqe s ASN 527 CO 0.01 -0.52 1.63 -0.81 -2.79 0.00 0.00 177.10 174.61 2oqe n PRO 528 N 4.81 0.37 0.00 0.43 -0.04 -1.26 -2.62 135.00 136.69 2oqe n PRO 528 Ca -0.08 0.07 0.14 0.00 -0.04 0.00 0.00 63.50 63.59 2oqe n PRO 528 Cb 0.42 -1.50 0.52 0.00 -0.04 0.00 0.00 33.50 32.90 2oqe n PRO 528 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2oqe n ASN 529 N -1.22 0.78 -4.21 3.54 3.02 -1.26 -4.92 115.26 110.99 2oqe n ASN 529 Ca 0.11 -0.80 -0.12 0.00 -0.03 0.00 0.00 54.58 53.74 2oqe n ASN 529 Cb 0.14 0.02 -0.10 0.00 -0.61 0.00 0.00 39.78 39.23 2oqe n ASN 529 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2oqe s LYS 530 N -2.42 0.95 -0.02 3.52 1.02 -1.08 -5.16 119.74 116.54 2oqe s LYS 530 Ca 0.28 -1.40 -0.02 0.00 0.02 0.00 0.00 55.97 54.86 2oqe s LYS 530 Cb 0.20 -0.35 0.01 0.00 -0.52 0.00 0.00 37.83 37.17 2oqe s LYS 530 CO 0.48 -0.00 0.06 0.14 -0.92 0.00 0.00 175.35 175.10 2oqe s VAL 531 N -3.53 -0.01 -0.04 3.17 -7.23 -1.26 -4.25 120.40 107.25 2oqe s VAL 531 Ca 0.15 0.02 -0.30 0.00 -1.81 0.00 0.00 61.98 60.04 2oqe s VAL 531 Cb 0.05 -0.09 -0.05 0.00 0.56 0.00 0.00 36.38 36.85 2oqe s VAL 531 CO -0.02 0.01 1.37 0.21 -0.31 0.00 0.00 175.10 176.36 2oqe s ASN 532 N 0.15 6.88 0.30 4.85 3.84 0.57 -4.90 114.94 126.64 2oqe s ASN 532 Ca -0.01 2.01 0.25 0.00 0.21 0.00 0.00 52.86 55.32 2oqe s ASN 532 Cb -0.02 -2.55 1.04 0.00 -0.55 0.00 0.00 41.25 39.17 2oqe s ASN 532 CO -0.00 -0.72 1.75 1.55 -2.79 0.00 0.00 177.10 176.89 2oqe h PRO 533 N 7.96 0.00 0.00 0.43 0.13 -1.94 0.18 132.00 138.76 2oqe h PRO 533 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2oqe h PRO 533 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2oqe h PRO 533 CO 0.91 0.00 -0.33 1.88 -0.23 0.00 0.00 178.00 180.23 2oqe h TYR 534 N 0.00 0.00 0.00 1.56 0.05 -1.95 -3.42 116.97 113.21 2oqe h TYR 534 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2oqe h TYR 534 Cb 0.39 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.13 2oqe h TYR 534 CO 0.00 0.00 -0.39 0.66 -1.05 0.00 0.00 178.16 177.38 2oqe h SER 535 N -0.99 0.00 0.00 3.88 4.64 -1.97 -3.47 113.55 115.64 2oqe h SER 535 Ca 0.00 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 2oqe h SER 535 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2oqe h SER 535 CO 0.00 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.59 2oqe n GLY 536 N 1.22 0.73 3.90 -0.77 0.00 0.05 -5.01 105.19 105.29 2oqe n GLY 536 Ca 0.03 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.79 2oqe n GLY 536 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oqe s LYS 537 N -0.07 3.25 0.54 1.61 -0.14 -1.26 -4.74 119.74 118.93 2oqe s LYS 537 Ca 0.00 -0.71 -0.20 0.00 -1.36 0.00 0.00 55.97 53.70 2oqe s LYS 537 Cb 0.00 -2.85 -0.06 0.00 -1.68 0.00 0.00 37.83 33.24 2oqe s LYS 537 CO 0.00 0.50 1.14 -1.25 -0.76 0.00 0.00 175.35 174.98 2oqe s PRO 538 N -3.25 3.38 0.30 -1.68 0.04 -1.26 -0.32 135.00 132.21 2oqe s PRO 538 Ca 0.33 1.64 -0.29 0.00 0.04 0.00 0.00 61.00 62.72 2oqe s PRO 538 Cb -0.10 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.29 2oqe s PRO 538 CO 0.27 -0.83 1.43 -1.25 0.04 0.00 0.00 177.00 176.65 2oqe s PRO 539 N -3.22 4.25 0.08 0.56 0.04 -1.25 -4.72 135.00 130.73 2oqe s PRO 539 Ca 0.72 2.36 -0.07 0.00 0.04 0.00 0.00 61.00 64.05 2oqe s PRO 539 Cb -0.25 -3.06 -0.01 0.00 0.04 0.00 0.00 34.50 31.22 2oqe s PRO 539 CO 0.28 -0.40 0.13 -1.54 0.04 0.00 0.00 177.00 175.51 2oqe s SER 540 N 0.03 0.22 -0.09 6.66 1.04 -0.95 -1.70 113.70 118.91 2oqe s SER 540 Ca 0.55 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 56.24 2oqe s SER 540 Cb -0.43 0.30 -0.03 0.00 0.10 0.00 0.00 66.02 65.97 2oqe s SER 540 CO 0.51 -0.69 -0.09 -0.31 0.98 0.00 0.00 173.24 173.63 2oqe s TYR 541 N -3.88 2.88 -0.15 5.02 2.02 -0.42 -1.33 117.35 121.49 2oqe s TYR 541 Ca 0.05 -0.17 -0.03 0.00 -0.37 0.00 0.00 57.07 56.56 2oqe s TYR 541 Cb 0.06 -1.76 -0.02 0.00 -0.40 0.00 0.00 41.96 39.84 2oqe s TYR 541 CO -0.11 0.16 -0.06 0.21 -1.57 0.00 0.00 175.55 174.18 2oqe s LYS 542 N -0.42 3.58 -0.31 -0.62 2.20 0.75 -0.95 119.74 123.97 2oqe s LYS 542 Ca 0.06 -0.57 -0.26 0.00 -0.36 0.00 0.00 55.97 54.84 2oqe s LYS 542 Cb -0.12 -2.85 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 2oqe s LYS 542 CO 0.02 0.20 0.92 -1.17 -0.36 0.00 0.00 175.35 174.97 2oqe s LEU 543 N 0.44 4.02 -0.32 5.43 2.96 0.16 -0.92 118.68 130.45 2oqe s LEU 543 Ca -0.05 0.83 -0.04 0.00 -0.22 0.00 0.00 54.13 54.66 2oqe s LEU 543 Cb -0.15 -3.29 0.05 0.00 0.50 0.00 0.00 46.19 43.30 2oqe s LEU 543 CO 0.03 -0.74 0.05 -0.69 -1.32 0.00 0.00 176.35 173.69 2oqe s VAL 544 N 3.27 3.31 -0.23 1.68 1.01 -0.13 -2.45 120.40 126.86 2oqe s VAL 544 Ca 0.38 -1.34 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 2oqe s VAL 544 Cb -0.13 -2.91 0.12 0.00 0.00 0.00 0.00 36.38 33.46 2oqe s VAL 544 CO 0.14 -0.17 0.44 -0.55 0.00 0.00 0.00 175.10 174.95 2oqe s SER 545 N 1.35 -0.25 -0.00 3.32 0.15 -1.26 -1.72 113.70 115.29 2oqe s SER 545 Ca -0.03 0.71 0.08 0.00 0.70 0.00 0.00 55.95 57.41 2oqe s SER 545 Cb -0.20 1.41 -0.10 0.00 -1.71 0.00 0.00 66.02 65.43 2oqe s SER 545 CO 0.00 -0.26 0.26 0.35 1.20 0.00 0.00 173.24 174.79 2oqe n THR 546 N 5.39 0.00 -2.29 6.45 -2.24 -1.26 -4.75 114.28 115.58 2oqe n THR 546 Ca -0.06 -0.26 -0.43 0.00 -2.27 0.00 0.00 64.05 61.03 2oqe n THR 546 Cb 0.50 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 2oqe n THR 546 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2oqe n GLN 547 N -1.43 3.15 -3.60 -0.78 6.02 -1.26 -4.78 117.38 114.69 2oqe n GLN 547 Ca 0.00 -3.14 -0.27 0.00 -0.01 0.00 0.00 57.00 53.58 2oqe n GLN 547 Cb 0.16 -3.29 -0.11 0.00 1.02 0.00 0.00 30.24 28.02 2oqe n GLN 547 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2oqe s PRO 549 N -0.63 3.28 0.60 0.00 0.02 -1.26 -4.79 135.00 132.22 2oqe s PRO 549 Ca 0.30 1.48 -0.17 0.00 0.02 0.00 0.00 61.00 62.63 2oqe s PRO 549 Cb 0.01 -2.01 -0.03 0.00 0.02 0.00 0.00 34.50 32.49 2oqe s PRO 549 CO -0.18 -0.88 1.11 -1.25 -0.33 0.00 0.00 177.00 175.47 2oqe s PRO 550 N -3.55 3.10 -0.15 5.54 0.04 -1.26 -4.96 135.00 133.76 2oqe s PRO 550 Ca 0.70 1.46 -0.29 0.00 0.04 0.00 0.00 61.00 62.90 2oqe s PRO 550 Cb -0.21 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.33 2oqe s PRO 550 CO 0.30 -1.02 1.29 -1.17 0.04 0.00 0.00 177.00 176.45 2oqe s LEU 551 N -4.36 4.19 0.08 -3.56 2.96 -1.26 -4.91 118.68 111.82 2oqe s LEU 551 Ca 0.69 1.74 0.08 0.00 -0.22 0.00 0.00 54.13 56.42 2oqe s LEU 551 Cb -0.21 -3.54 -0.22 0.00 0.50 0.00 0.00 46.19 42.72 2oqe s LEU 551 CO 0.34 -0.77 1.13 -0.07 -1.32 0.00 0.00 176.35 175.66 2oqe h LEU 552 N 9.73 0.00 -9.89 -0.68 3.38 -1.95 -3.45 115.31 112.45 2oqe h LEU 552 Ca -0.28 -0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.13 2oqe h LEU 552 Cb 1.11 -0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.98 2oqe h LEU 552 CO 0.97 1.00 0.57 0.00 0.09 0.00 0.00 178.44 181.07 2oqe n ALA 553 N -2.40 1.58 -1.50 1.53 0.00 -1.26 -4.95 120.51 113.51 2oqe n ALA 553 Ca -0.04 0.26 -0.31 0.00 0.00 0.00 0.00 53.44 53.34 2oqe n ALA 553 Cb 0.97 -2.32 0.06 0.00 0.00 0.00 0.00 19.45 18.16 2oqe n ALA 553 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2oqe s LYS 554 N -2.31 2.79 0.22 0.00 -0.14 -1.26 -4.85 119.74 114.20 2oqe s LYS 554 Ca 0.61 1.04 -0.32 0.00 -1.36 0.00 0.00 55.97 55.94 2oqe s LYS 554 Cb -0.48 -1.97 -0.14 0.00 -1.68 0.00 0.00 37.83 33.56 2oqe s LYS 554 CO 0.58 -1.22 1.35 0.39 -0.76 0.00 0.00 175.35 175.69 2oqe n GLU 555 N -3.13 1.81 -0.44 1.68 1.02 -1.26 -1.58 120.64 118.74 2oqe n GLU 555 Ca 0.08 0.64 0.00 0.00 -0.02 0.00 0.00 57.16 57.87 2oqe n GLU 555 Cb 0.53 -2.26 0.00 0.00 -0.02 0.00 0.00 31.44 29.69 2oqe n GLU 555 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oqe n GLY 556 N 2.15 1.59 3.75 0.62 0.00 -1.26 -5.03 105.19 107.01 2oqe n GLY 556 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2oqe n GLY 556 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2oqe s SER 557 N -3.28 4.45 0.22 1.61 1.04 -0.62 -4.83 113.70 112.29 2oqe s SER 557 Ca 0.00 1.94 -0.08 0.00 0.48 0.00 0.00 55.95 58.29 2oqe s SER 557 Cb 0.00 -2.54 0.32 0.00 0.10 0.00 0.00 66.02 63.91 2oqe s SER 557 CO 0.00 -2.08 1.76 0.25 0.98 0.00 0.00 173.24 174.16 2oqe h LEU 558 N -0.89 0.37 0.02 2.42 5.85 -1.92 -0.19 115.31 120.98 2oqe h LEU 558 Ca -0.44 0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.35 2oqe h LEU 558 Cb 1.24 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2oqe h LEU 558 CO 0.51 0.21 -0.05 0.58 -0.34 0.00 0.00 178.44 179.35 2oqe h VAL 559 N 0.53 0.89 -0.04 1.05 2.07 -1.92 -0.82 116.25 118.00 2oqe h VAL 559 Ca 0.34 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.77 2oqe h VAL 559 Cb 0.39 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 2oqe h VAL 559 CO -0.29 0.00 -0.37 0.00 0.02 0.00 0.00 177.57 176.93 2oqe h ALA 560 N 0.89 1.31 -0.02 1.67 0.00 -1.68 -1.34 119.26 120.09 2oqe h ALA 560 Ca 0.01 -0.35 -0.25 0.00 0.00 0.00 0.00 54.91 54.32 2oqe h ALA 560 Cb 0.10 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.84 2oqe h ALA 560 CO -0.03 0.50 -0.95 0.87 0.00 0.00 0.00 179.25 179.63 2oqe h LYS 561 N 0.07 0.68 0.00 0.00 1.57 -0.86 -3.20 116.57 114.83 2oqe h LYS 561 Ca 0.01 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.08 2oqe h LYS 561 Cb 0.69 0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.19 2oqe h LYS 561 CO 0.05 1.29 -0.02 0.00 -0.57 0.00 0.00 179.45 180.20 2oqe h ARG 562 N 0.35 0.00 -2.13 3.15 3.08 -0.99 -3.36 114.38 114.49 2oqe h ARG 562 Ca -0.11 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.37 2oqe h ARG 562 Cb 1.61 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.25 2oqe h ARG 562 CO 0.19 0.00 -0.85 0.00 -1.07 0.00 0.00 179.97 178.24 2oqe n ALA 563 N -1.85 3.40 0.18 0.04 0.00 -0.52 -4.70 120.51 117.06 2oqe n ALA 563 Ca 0.05 -4.15 0.15 0.00 0.00 0.00 0.00 53.44 49.49 2oqe n ALA 563 Cb 0.45 -0.84 0.75 0.00 0.00 0.00 0.00 19.45 19.81 2oqe n ALA 563 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2oqe h PRO 564 N 3.69 0.00 0.00 0.00 0.13 -1.70 0.64 132.00 134.76 2oqe h PRO 564 Ca 0.13 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.23 2oqe h PRO 564 Cb 0.74 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 2oqe h PRO 564 CO 0.67 0.00 -0.17 0.11 -0.23 0.00 0.00 178.00 178.39 2oqe h TRP 565 N 0.00 0.00 0.00 1.56 5.08 -1.88 -3.30 115.95 117.41 2oqe h TRP 565 Ca 0.09 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.06 2oqe h TRP 565 Cb 0.43 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.59 2oqe h TRP 565 CO 0.00 0.17 0.00 0.00 -1.28 0.00 0.00 178.44 177.33 2oqe n ALA 566 N -2.24 2.25 0.80 0.11 0.00 0.22 -3.37 120.51 118.28 2oqe n ALA 566 Ca -0.01 -0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.52 2oqe n ALA 566 Cb 0.34 -1.46 0.52 0.00 0.00 0.00 0.00 19.45 18.84 2oqe n ALA 566 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2oqe n SER 567 N -2.00 0.32 -4.17 0.00 3.41 -1.24 -4.33 113.62 105.60 2oqe n SER 567 Ca 0.06 0.54 -0.18 0.00 -0.26 0.00 0.00 58.87 59.02 2oqe n SER 567 Cb 0.39 -0.62 -0.12 0.00 -0.26 0.00 0.00 64.21 63.60 2oqe n SER 567 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2oqe s HIS 568 N -3.05 1.19 0.27 7.33 3.76 -1.22 -4.80 115.29 118.77 2oqe s HIS 568 Ca 0.12 -0.47 0.04 0.00 -0.15 0.00 0.00 55.06 54.60 2oqe s HIS 568 Cb 0.15 -0.67 0.36 0.00 1.11 0.00 0.00 32.58 33.53 2oqe s HIS 568 CO 0.53 0.05 1.65 0.77 -0.85 0.00 0.00 174.74 176.89 2oqe h SER 569 N 4.25 0.34 -3.96 1.40 0.02 -1.33 -3.38 113.55 110.89 2oqe h SER 569 Ca -0.40 -0.15 -0.40 0.00 -0.84 0.00 0.00 61.79 59.99 2oqe h SER 569 Cb 1.19 -0.10 -0.29 0.00 0.14 0.00 0.00 62.40 63.34 2oqe h SER 569 CO 0.41 0.75 -0.78 -0.69 -1.14 0.00 0.00 176.83 175.37 2oqe s VAL 570 N -4.10 0.71 -0.06 2.27 1.01 -0.08 -0.46 120.40 119.69 2oqe s VAL 570 Ca -0.05 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.56 2oqe s VAL 570 Cb 0.13 -0.61 0.03 0.00 0.00 0.00 0.00 36.38 35.93 2oqe s VAL 570 CO 0.79 0.21 -0.00 0.20 0.00 0.00 0.00 175.10 176.30 2oqe s ASN 571 N -0.08 1.27 -0.14 3.32 0.01 -0.25 -2.65 114.94 116.43 2oqe s ASN 571 Ca 0.01 -0.07 0.02 0.00 -0.71 0.00 0.00 52.86 52.12 2oqe s ASN 571 Cb -0.05 -0.39 0.01 0.00 0.41 0.00 0.00 41.25 41.23 2oqe s ASN 571 CO -0.00 -0.16 -0.21 -0.69 -1.51 0.00 0.00 177.10 174.53 2oqe s VAL 572 N 1.67 2.20 0.13 1.60 1.01 -1.26 -0.92 120.40 124.83 2oqe s VAL 572 Ca 0.00 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.09 2oqe s VAL 572 Cb -0.13 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 2oqe s VAL 572 CO -0.04 0.54 -0.10 0.68 0.00 0.00 0.00 175.10 176.18 2oqe s VAL 573 N 0.74 1.13 0.54 2.92 -7.23 -0.45 -4.57 120.40 113.47 2oqe s VAL 573 Ca -0.08 -1.95 -0.22 0.00 -1.81 0.00 0.00 61.98 57.92 2oqe s VAL 573 Cb -0.16 -1.72 -0.05 0.00 0.56 0.00 0.00 36.38 35.01 2oqe s VAL 573 CO 0.00 -0.69 1.37 -2.84 -0.31 0.00 0.00 175.10 172.64 2oqe s PRO 574 N -3.47 3.19 0.16 4.82 0.02 -1.26 -0.45 135.00 138.00 2oqe s PRO 574 Ca 0.14 2.27 -0.31 0.00 0.02 0.00 0.00 61.00 63.12 2oqe s PRO 574 Cb 0.01 -2.30 -0.09 0.00 0.02 0.00 0.00 34.50 32.14 2oqe s PRO 574 CO 0.00 -1.16 1.46 -0.47 -0.33 0.00 0.00 177.00 176.50 2oqe s TYR 575 N -1.28 3.15 0.07 6.54 5.04 0.07 -4.60 117.35 126.34 2oqe s TYR 575 Ca 0.70 0.87 0.02 0.00 -2.44 0.00 0.00 57.07 56.22 2oqe s TYR 575 Cb -0.41 -3.79 -0.04 0.00 0.35 0.00 0.00 41.96 38.08 2oqe s TYR 575 CO 0.49 -2.76 -0.06 0.15 -1.34 0.00 0.00 175.55 172.03 2oqe s LYS 576 N 0.80 0.70 0.61 4.97 3.01 -1.26 -4.95 119.74 123.61 2oqe s LYS 576 Ca 0.65 -1.12 -0.19 0.00 -1.01 0.00 0.00 55.97 54.31 2oqe s LYS 576 Cb -0.40 -0.18 -0.03 0.00 -1.01 0.00 0.00 37.83 36.21 2oqe s LYS 576 CO 0.33 -0.01 1.26 -0.51 0.51 0.00 0.00 175.35 176.94 2oqe s ASP 577 N -2.51 4.95 -1.36 2.83 1.01 -1.26 -3.14 116.67 117.17 2oqe s ASP 577 Ca 0.03 2.54 -0.02 0.00 0.71 0.00 0.00 52.55 55.81 2oqe s ASP 577 Cb 0.00 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.32 2oqe s ASP 577 CO -0.04 -1.77 0.24 0.59 0.21 0.00 0.00 175.17 174.41 2oqe n ASN 578 N -1.65 -5.15 -3.84 0.27 3.02 -1.26 -4.94 115.26 101.71 2oqe n ASN 578 Ca 0.14 -0.12 -0.38 0.00 -0.03 0.00 0.00 54.58 54.19 2oqe n ASN 578 Cb 0.48 -4.12 -0.02 0.00 -0.61 0.00 0.00 39.78 35.51 2oqe n ASN 578 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2oqe n ARG 579 N -3.02 3.72 -0.13 3.52 1.74 -1.19 -4.79 116.66 116.52 2oqe n ARG 579 Ca -0.15 -4.59 -0.25 0.00 -0.77 0.00 0.00 57.85 52.09 2oqe n ARG 579 Cb 0.63 -2.43 -0.11 0.00 -1.02 0.00 0.00 32.46 29.53 2oqe n ARG 579 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 2oqe n LEU 580 N 1.29 2.30 -4.15 0.55 4.77 -1.26 -4.98 117.00 115.52 2oqe n LEU 580 Ca 0.27 0.17 -0.35 0.00 -0.03 0.00 0.00 56.01 56.06 2oqe n LEU 580 Cb 0.36 -0.84 -0.13 0.00 -2.33 0.00 0.00 43.42 40.48 2oqe n LEU 580 CO 0.59 0.70 -0.30 -0.31 -1.33 0.00 0.00 177.39 176.74 2oqe s TYR 581 N -2.51 3.38 -0.89 -1.77 2.02 -1.26 -4.84 117.35 111.48 2oqe s TYR 581 Ca -0.37 -2.06 0.22 0.00 -0.37 0.00 0.00 57.07 54.49 2oqe s TYR 581 Cb 0.13 -2.45 0.91 0.00 -0.40 0.00 0.00 41.96 40.15 2oqe s TYR 581 CO 0.52 -0.85 1.70 -0.35 -1.57 0.00 0.00 175.55 175.00 2oqe n PRO 582 N 4.60 0.06 -0.79 -1.71 -0.04 -1.26 -1.52 135.00 134.34 2oqe n PRO 582 Ca -0.09 0.18 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 2oqe n PRO 582 Cb 0.43 -1.59 0.38 0.00 -0.04 0.00 0.00 33.50 32.67 2oqe n PRO 582 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2oqe n SER 583 N -1.71 5.35 0.00 3.54 7.64 -1.26 -0.89 113.62 126.29 2oqe n SER 583 Ca 0.05 -2.83 0.00 0.00 1.01 0.00 0.00 58.87 57.09 2oqe n SER 583 Cb 0.27 -0.65 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 2oqe n SER 583 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2oqe n GLY 584 N 0.62 0.51 0.20 0.23 0.00 -0.57 -4.70 105.19 101.48 2oqe n GLY 584 Ca 0.27 -1.86 -0.14 0.00 0.00 0.00 0.00 46.02 44.28 2oqe n GLY 584 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2oqe h ASP 585 N 0.00 0.75 -3.61 1.61 3.32 -1.98 -3.41 116.42 113.09 2oqe h ASP 585 Ca 0.00 -0.50 -0.64 0.00 0.02 0.00 0.00 57.03 55.90 2oqe h ASP 585 Cb 0.00 -0.22 -0.40 0.00 0.22 0.00 0.00 39.33 38.93 2oqe h ASP 585 CO 0.00 1.28 -0.74 -1.00 -1.72 0.00 0.00 179.24 177.06 2oqe s HIS 586 N -3.64 3.27 -0.14 4.55 3.76 -1.26 -4.91 115.29 116.91 2oqe s HIS 586 Ca -0.08 -2.64 -0.22 0.00 -0.15 0.00 0.00 55.06 51.97 2oqe s HIS 586 Cb 0.09 -2.53 -0.25 0.00 1.11 0.00 0.00 32.58 31.00 2oqe s HIS 586 CO 0.88 -0.92 0.55 0.28 -0.85 0.00 0.00 174.74 174.68 2oqe h VAL 587 N 6.61 1.26 -2.27 -0.90 2.07 -1.76 -3.43 116.25 117.82 2oqe h VAL 587 Ca -0.08 -2.33 -0.61 0.00 0.82 0.00 0.00 66.70 64.50 2oqe h VAL 587 Cb 1.02 2.81 0.07 0.00 -1.52 0.00 0.00 31.29 33.67 2oqe h VAL 587 CO 0.50 0.56 0.57 -2.65 0.02 0.00 0.00 177.57 176.57 2oqe n PRO 588 N -4.28 1.76 -0.89 1.57 -0.02 -1.25 -2.13 135.00 129.75 2oqe n PRO 588 Ca -0.22 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 2oqe n PRO 588 Cb 0.71 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 2oqe n PRO 588 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2oqe n GLN 589 N 2.43 -0.40 -2.04 -0.52 6.02 0.03 -3.88 117.38 119.01 2oqe n GLN 589 Ca 0.15 0.10 -0.42 0.00 -0.01 0.00 0.00 57.00 56.82 2oqe n GLN 589 Cb 0.27 -3.58 -0.03 0.00 1.02 0.00 0.00 30.24 27.92 2oqe n GLN 589 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.06 175.59 2oqe s TRP 590 N -2.19 3.15 -0.22 1.08 -0.00 -0.91 -4.24 118.94 115.62 2oqe s TRP 590 Ca 0.00 0.78 0.28 0.00 -0.00 0.00 0.00 56.10 57.16 2oqe s TRP 590 Cb 0.00 -3.81 1.15 0.00 -0.00 0.00 0.00 33.47 30.81 2oqe s TRP 590 CO 0.00 -2.94 1.84 0.66 -0.00 0.00 0.00 176.95 176.51 2oqe h SER 591 N 6.77 0.00 0.00 5.86 4.64 -1.92 -3.46 113.55 125.44 2oqe h SER 591 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 2oqe h SER 591 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2oqe h SER 591 CO 0.89 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.46 2oqe n GLY 592 N 0.06 0.73 3.74 -0.77 0.00 -1.26 -4.59 105.19 103.11 2oqe n GLY 592 Ca 0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 2oqe n GLY 592 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oqe s ASP 593 N -2.97 6.81 0.00 1.61 1.01 -1.26 -4.61 116.67 117.26 2oqe s ASP 593 Ca 0.00 0.96 0.00 0.00 0.71 0.00 0.00 52.55 54.22 2oqe s ASP 593 Cb 0.00 -2.32 0.00 0.00 1.01 0.00 0.00 42.92 41.61 2oqe s ASP 593 CO 0.00 0.05 0.00 0.61 0.21 0.00 0.00 175.17 176.04 2oqe n GLY 594 N 2.87 3.58 3.41 0.21 0.00 -1.26 -4.98 105.19 109.02 2oqe n GLY 594 Ca -0.07 -1.81 -0.45 0.00 0.00 0.00 0.00 46.02 43.69 2oqe n GLY 594 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oqe s VAL 595 N -2.61 4.98 0.19 1.61 1.01 -1.26 -4.85 120.40 119.47 2oqe s VAL 595 Ca 0.00 -1.75 -0.09 0.00 0.00 0.00 0.00 61.98 60.14 2oqe s VAL 595 Cb 0.00 -4.66 -0.01 0.00 0.00 0.00 0.00 36.38 31.71 2oqe s VAL 595 CO 0.00 -1.34 0.32 0.00 0.00 0.00 0.00 175.10 174.09 2oqe s ARG 596 N 2.00 1.26 3.56 2.72 1.70 -1.26 -4.61 118.95 124.32 2oqe s ARG 596 Ca 0.26 -1.23 0.00 0.00 -0.47 0.00 0.00 55.73 54.30 2oqe s ARG 596 Cb -0.08 0.39 0.00 0.00 -0.57 0.00 0.00 34.95 34.69 2oqe s ARG 596 CO -0.07 -0.48 0.00 0.41 -1.08 0.00 0.00 175.30 174.08 2oqe n GLY 597 N -0.26 2.24 0.36 3.88 0.00 -1.26 -2.13 105.19 108.01 2oqe n GLY 597 Ca -0.05 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.75 2oqe n GLY 597 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2oqe h MET 598 N 0.00 0.40 -0.57 1.61 1.85 -1.27 -0.48 114.93 116.48 2oqe h MET 598 Ca 0.00 -0.02 -0.07 0.00 -0.61 0.00 0.00 59.70 58.99 2oqe h MET 598 Cb 0.00 -0.09 -0.02 0.00 0.43 0.00 0.00 31.60 31.92 2oqe h MET 598 CO 0.00 0.27 0.06 -0.09 -0.40 0.00 0.00 176.91 176.75 2oqe h ARG 599 N 0.41 0.94 -0.27 0.39 2.43 -1.67 -0.41 114.38 116.20 2oqe h ARG 599 Ca 0.29 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 2oqe h ARG 599 Cb 0.57 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2oqe h ARG 599 CO -0.08 0.89 -0.04 1.49 -1.51 0.00 0.00 179.97 180.72 2oqe h GLU 600 N 0.88 0.51 -0.36 0.20 4.81 -0.83 -2.26 114.58 117.52 2oqe h GLU 600 Ca 0.17 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 2oqe h GLU 600 Cb 0.43 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 2oqe h GLU 600 CO 0.01 0.70 -0.11 -1.49 -0.73 0.00 0.00 179.01 177.39 2oqe h TRP 601 N 0.28 0.68 -0.24 0.92 6.55 -1.01 -2.22 115.95 120.90 2oqe h TRP 601 Ca 0.07 -0.11 -0.15 0.00 0.95 0.00 0.00 58.89 59.65 2oqe h TRP 601 Cb 0.49 -0.18 -0.01 0.00 -0.86 0.00 0.00 29.16 28.60 2oqe h TRP 601 CO 0.04 0.71 -0.46 0.82 -1.05 0.00 0.00 178.44 178.51 2oqe h ILE 602 N 0.58 1.30 0.00 1.49 2.04 -1.10 -3.44 117.51 118.38 2oqe h ILE 602 Ca 0.10 -1.66 0.00 0.00 1.00 0.00 0.00 64.86 64.30 2oqe h ILE 602 Cb 0.53 1.61 0.00 0.00 -0.74 0.00 0.00 36.82 38.22 2oqe h ILE 602 CO 0.03 0.53 0.00 0.61 0.00 0.00 0.00 178.15 179.32 2oqe n GLY 603 N 0.12 3.22 0.42 5.37 0.00 -0.84 -0.48 105.19 113.00 2oqe n GLY 603 Ca -0.02 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.00 2oqe n GLY 603 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2oqe n ASP 604 N 3.41 1.25 0.00 1.61 5.68 -1.26 -4.91 116.55 122.33 2oqe n ASP 604 Ca 0.00 -1.67 0.00 0.00 -0.50 0.00 0.00 54.79 52.62 2oqe n ASP 604 Cb 0.00 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 2oqe n ASP 604 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2oqe n GLY 605 N 1.03 0.87 0.03 6.12 0.00 0.37 -4.92 105.19 108.68 2oqe n GLY 605 Ca 0.15 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.28 2oqe n GLY 605 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2oqe n SER 606 N 0.00 0.63 -4.77 1.61 3.41 -1.26 -1.06 113.62 112.18 2oqe n SER 606 Ca 0.00 -0.24 -0.38 0.00 -0.26 0.00 0.00 58.87 57.99 2oqe n SER 606 Cb 0.00 0.56 -0.01 0.00 -0.26 0.00 0.00 64.21 64.49 2oqe n SER 606 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2oqe s GLU 607 N -3.12 3.96 0.25 4.33 2.02 -1.26 -4.68 118.70 120.20 2oqe s GLU 607 Ca 0.07 1.88 -0.30 0.00 0.02 0.00 0.00 54.97 56.64 2oqe s GLU 607 Cb 0.15 -2.63 -0.10 0.00 0.10 0.00 0.00 34.13 31.65 2oqe s GLU 607 CO 0.77 -0.41 1.48 1.21 0.02 0.00 0.00 175.26 178.32 2oqe s ASN 608 N -1.11 6.60 -0.03 -0.19 2.47 -1.26 -1.54 114.94 119.87 2oqe s ASN 608 Ca 0.59 2.71 0.04 0.00 0.42 0.00 0.00 52.86 56.62 2oqe s ASN 608 Cb -0.32 -2.62 0.06 0.00 -1.45 0.00 0.00 41.25 36.93 2oqe s ASN 608 CO 0.40 -0.75 0.90 2.30 -3.72 0.00 0.00 177.10 176.23 2oqe n ILE 609 N 2.44 0.78 -3.41 -5.21 -5.35 -0.56 -4.66 119.36 103.39 2oqe n ILE 609 Ca 0.08 -0.86 -0.39 0.00 -0.27 0.00 0.00 62.75 61.30 2oqe n ILE 609 Cb 0.40 0.47 -0.09 0.00 -1.74 0.00 0.00 39.64 38.67 2oqe n ILE 609 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2oqe s ASP 610 N -1.16 6.26 -1.04 7.28 2.15 -1.23 -4.46 116.67 124.47 2oqe s ASP 610 Ca 0.07 0.30 -0.11 0.00 0.43 0.00 0.00 52.55 53.24 2oqe s ASP 610 Cb 0.06 -2.20 -0.04 0.00 -0.30 0.00 0.00 42.92 40.44 2oqe s ASP 610 CO 0.01 -0.15 0.84 -3.20 -0.17 0.00 0.00 175.17 172.49 2oqe n ASN 611 N 5.13 -6.18 -1.42 -0.34 2.85 -0.70 -4.99 115.26 109.61 2oqe n ASN 611 Ca -0.09 -0.78 -0.02 0.00 -0.11 0.00 0.00 54.58 53.58 2oqe n ASN 611 Cb 0.51 -4.35 0.00 0.00 1.24 0.00 0.00 39.78 37.18 2oqe n ASN 611 CO 0.00 0.00 0.00 1.07 -2.11 0.00 0.00 177.26 176.22 2oqe n THR 612 N -3.45 0.00 -2.96 -0.44 5.66 -0.70 -4.67 114.28 107.73 2oqe n THR 612 Ca -0.08 -0.28 -0.42 0.00 -3.05 0.00 0.00 64.05 60.23 2oqe n THR 612 Cb 0.60 0.23 -0.05 0.00 -1.55 0.00 0.00 70.33 69.56 2oqe n THR 612 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 2oqe s ASP 613 N -1.47 6.71 0.32 1.09 1.01 -1.26 -1.36 116.67 121.70 2oqe s ASP 613 Ca 0.04 0.82 0.06 0.00 0.71 0.00 0.00 52.55 54.18 2oqe s ASP 613 Cb -0.01 -2.40 -0.06 0.00 1.01 0.00 0.00 42.92 41.45 2oqe s ASP 613 CO 0.03 -0.53 -0.01 0.27 0.21 0.00 0.00 175.17 175.15 2oqe s ILE 614 N 2.82 1.57 -0.03 0.77 -4.36 -1.26 -0.75 121.20 119.97 2oqe s ILE 614 Ca 0.32 -2.06 0.04 0.00 -0.26 0.00 0.00 60.65 58.68 2oqe s ILE 614 Cb -0.15 -2.67 -0.00 0.00 1.25 0.00 0.00 42.46 40.89 2oqe s ILE 614 CO 0.10 -0.14 -0.13 -0.76 0.24 0.00 0.00 174.94 174.24 2oqe s LEU 615 N -3.51 1.90 -0.24 0.37 1.43 0.40 -4.21 118.68 114.82 2oqe s LEU 615 Ca 0.33 -0.25 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 2oqe s LEU 615 Cb 0.06 -0.72 0.05 0.00 0.03 0.00 0.00 46.19 45.61 2oqe s LEU 615 CO 0.14 0.12 -0.11 0.12 0.23 0.00 0.00 176.35 176.85 2oqe s PHE 616 N -0.01 2.98 -0.22 0.29 5.36 -0.21 -1.34 117.98 124.82 2oqe s PHE 616 Ca -0.01 -2.07 -0.06 0.00 -0.96 0.00 0.00 56.93 53.83 2oqe s PHE 616 Cb -0.08 -1.85 -0.03 0.00 -0.34 0.00 0.00 43.02 40.73 2oqe s PHE 616 CO 0.01 -0.84 0.03 -0.06 -1.46 0.00 0.00 175.22 172.89 2oqe s PHE 617 N 1.20 3.06 -0.14 10.12 0.08 -0.09 -0.46 117.98 131.75 2oqe s PHE 617 Ca -0.06 -0.47 -0.01 0.00 0.12 0.00 0.00 56.93 56.52 2oqe s PHE 617 Cb -0.18 -2.15 -0.01 0.00 -0.57 0.00 0.00 43.02 40.10 2oqe s PHE 617 CO -0.07 -0.30 -0.12 -1.58 -0.10 0.00 0.00 175.22 173.05 2oqe s HIS 618 N 1.26 2.83 -0.23 0.36 5.65 0.32 -1.09 115.29 124.40 2oqe s HIS 618 Ca 0.04 -0.65 -0.12 0.00 0.25 0.00 0.00 55.06 54.58 2oqe s HIS 618 Cb -0.15 -1.87 -0.05 0.00 -1.18 0.00 0.00 32.58 29.34 2oqe s HIS 618 CO 0.02 -0.23 0.21 0.99 -0.65 0.00 0.00 174.74 175.08 2oqe s THR 619 N 0.42 5.33 0.23 0.89 2.01 0.39 -0.51 115.64 124.40 2oqe s THR 619 Ca -0.09 0.30 -0.06 0.00 0.31 0.00 0.00 61.69 62.15 2oqe s THR 619 Cb -0.16 -3.55 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 2oqe s THR 619 CO 0.05 0.33 0.29 0.72 -0.69 0.00 0.00 174.62 175.32 2oqe s PHE 620 N 1.06 0.85 -5.00 4.92 -0.71 -0.87 -4.64 117.98 113.59 2oqe s PHE 620 Ca 0.10 -1.12 0.00 0.00 -1.04 0.00 0.00 56.93 54.87 2oqe s PHE 620 Cb -0.14 -0.24 0.00 0.00 -1.21 0.00 0.00 43.02 41.43 2oqe s PHE 620 CO 0.05 -0.81 0.00 0.41 -1.34 0.00 0.00 175.22 173.53 2oqe n GLY 621 N -0.34 0.25 3.14 1.99 0.00 0.02 -0.77 105.19 109.49 2oqe n GLY 621 Ca 0.01 -1.36 -0.09 0.00 0.00 0.00 0.00 46.02 44.57 2oqe n GLY 621 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2oqe s ILE 622 N -3.57 0.13 -0.18 -0.61 -4.36 -0.41 -4.21 121.20 107.99 2oqe s ILE 622 Ca 0.00 -1.85 -0.02 0.00 -0.26 0.00 0.00 60.65 58.53 2oqe s ILE 622 Cb 0.00 -1.88 -0.01 0.00 1.25 0.00 0.00 42.46 41.83 2oqe s ILE 622 CO 0.00 -0.61 -0.10 -0.89 0.24 0.00 0.00 174.94 173.58 2oqe s THR 623 N -4.01 3.00 -0.30 8.37 2.01 -1.26 -0.70 115.64 122.76 2oqe s THR 623 Ca 0.19 -0.64 -0.06 0.00 0.31 0.00 0.00 61.69 61.49 2oqe s THR 623 Cb 0.07 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.29 2oqe s THR 623 CO -0.02 0.48 0.07 -2.28 -0.69 0.00 0.00 174.62 172.18 2oqe s HIS 624 N 1.05 3.17 -0.48 4.92 2.46 0.12 -4.99 115.29 121.54 2oqe s HIS 624 Ca -0.00 -1.20 -0.11 0.00 0.47 0.00 0.00 55.06 54.22 2oqe s HIS 624 Cb -0.15 -2.23 0.11 0.00 -0.13 0.00 0.00 32.58 30.19 2oqe s HIS 624 CO -0.02 -0.64 0.37 -0.06 -2.47 0.00 0.00 174.74 171.91 2oqe s PHE 625 N 1.44 3.37 0.57 3.88 0.08 -1.26 -2.14 117.98 123.92 2oqe s PHE 625 Ca 0.01 -1.65 -0.20 0.00 0.12 0.00 0.00 56.93 55.21 2oqe s PHE 625 Cb -0.18 -3.47 -0.05 0.00 -0.57 0.00 0.00 43.02 38.76 2oqe s PHE 625 CO 0.02 -0.97 1.13 -2.30 -0.10 0.00 0.00 175.22 172.99 2oqe n PRO 626 N 5.00 1.20 -4.21 0.24 -0.02 -1.26 -5.04 135.00 130.90 2oqe n PRO 626 Ca -0.10 0.45 -0.12 0.00 -2.02 0.00 0.00 63.50 61.71 2oqe n PRO 626 Cb 0.41 -2.32 -0.10 0.00 -0.02 0.00 0.00 33.50 31.47 2oqe n PRO 626 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2oqe s ALA 627 N -1.40 1.20 0.54 3.55 0.00 -1.26 -4.69 121.76 119.70 2oqe s ALA 627 Ca 0.74 -1.53 0.24 0.00 0.00 0.00 0.00 51.96 51.41 2oqe s ALA 627 Cb -0.43 0.55 1.40 0.00 0.00 0.00 0.00 23.12 24.64 2oqe s ALA 627 CO 0.48 -0.34 2.04 -1.35 0.00 0.00 0.00 175.76 176.59 2oqe h PRO 628 N 2.77 0.00 -0.18 0.00 0.11 -1.87 -0.40 132.00 132.42 2oqe h PRO 628 Ca -0.36 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.80 2oqe h PRO 628 Cb 1.20 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.30 2oqe h PRO 628 CO 0.62 0.00 0.25 0.93 -0.21 0.00 0.00 178.00 179.59 2oqe h GLU 629 N 0.00 0.00 -0.00 1.05 3.07 -1.96 -0.69 114.58 116.05 2oqe h GLU 629 Ca 0.17 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.03 2oqe h GLU 629 Cb 0.72 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 2oqe h GLU 629 CO -0.00 0.00 -0.06 -0.25 -1.40 0.00 0.00 179.01 177.30 2oqe n ASP 630 N -3.61 0.14 -4.34 1.42 8.00 -0.16 -4.49 116.55 113.51 2oqe n ASP 630 Ca 0.02 -0.05 -0.27 0.00 0.71 0.00 0.00 54.79 55.19 2oqe n ASP 630 Cb 0.36 -0.26 -0.13 0.00 -0.02 0.00 0.00 41.12 41.07 2oqe n ASP 630 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 2oqe s PHE 631 N -2.71 2.12 -1.12 1.24 5.36 -0.27 -2.50 117.98 120.10 2oqe s PHE 631 Ca 0.23 -0.39 0.24 0.00 -0.96 0.00 0.00 56.93 56.05 2oqe s PHE 631 Cb 0.20 -1.18 1.09 0.00 -0.34 0.00 0.00 43.02 42.78 2oqe s PHE 631 CO 0.50 0.24 1.79 -0.35 -1.46 0.00 0.00 175.22 175.94 2oqe n PRO 632 N 1.19 0.10 -3.91 10.12 -0.04 -1.26 -4.93 135.00 136.27 2oqe n PRO 632 Ca -0.18 0.08 -0.16 0.00 -0.04 0.00 0.00 63.50 63.20 2oqe n PRO 632 Cb 0.53 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.33 2oqe n PRO 632 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2oqe s LEU 633 N -2.88 1.31 -0.12 1.53 2.96 -1.24 -4.69 118.68 115.56 2oqe s LEU 633 Ca 0.15 -0.02 -0.22 0.00 -0.22 0.00 0.00 54.13 53.83 2oqe s LEU 633 Cb 0.16 -0.17 -0.03 0.00 0.50 0.00 0.00 46.19 46.65 2oqe s LEU 633 CO 0.42 -0.08 0.64 -0.32 -1.32 0.00 0.00 176.35 175.69 2oqe s MET 634 N 0.82 4.35 0.49 1.98 -2.45 0.32 -4.76 119.30 120.05 2oqe s MET 634 Ca -0.08 0.72 -0.24 0.00 -1.25 0.00 0.00 55.69 54.84 2oqe s MET 634 Cb -0.11 -3.49 -0.07 0.00 1.25 0.00 0.00 34.83 32.41 2oqe s MET 634 CO -0.02 -0.01 1.42 -2.14 1.05 0.00 0.00 175.02 175.32 2oqe s PRO 635 N 1.12 3.48 0.22 4.11 0.02 -1.26 -4.12 135.00 138.56 2oqe s PRO 635 Ca 0.33 2.39 -0.32 0.00 0.02 0.00 0.00 61.00 63.42 2oqe s PRO 635 Cb -0.17 -2.52 -0.13 0.00 0.02 0.00 0.00 34.50 31.70 2oqe s PRO 635 CO 0.14 -0.98 1.50 0.00 -0.33 0.00 0.00 177.00 177.33 2oqe n ALA 636 N -0.50 1.43 -3.18 -1.55 0.00 -1.26 -4.78 120.51 110.68 2oqe n ALA 636 Ca 0.07 0.42 -0.35 0.00 0.00 0.00 0.00 53.44 53.58 2oqe n ALA 636 Cb 0.43 -2.33 -0.13 0.00 0.00 0.00 0.00 19.45 17.41 2oqe n ALA 636 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2oqe s GLU 637 N 0.07 3.54 0.25 0.00 2.12 -0.02 -4.89 118.70 119.78 2oqe s GLU 637 Ca 0.71 -0.56 -0.18 0.00 0.36 0.00 0.00 54.97 55.30 2oqe s GLU 637 Cb -0.64 -3.01 -0.08 0.00 0.26 0.00 0.00 34.13 30.66 2oqe s GLU 637 CO 0.45 -0.00 0.73 -1.25 -0.54 0.00 0.00 175.26 174.65 2oqe s PRO 638 N 1.01 4.17 -0.01 4.30 0.04 -1.26 -1.13 135.00 142.11 2oqe s PRO 638 Ca 0.01 0.80 0.01 0.00 0.04 0.00 0.00 61.00 61.86 2oqe s PRO 638 Cb -0.14 -2.73 -0.00 0.00 0.04 0.00 0.00 34.50 31.66 2oqe s PRO 638 CO 0.01 0.32 -0.04 0.42 0.04 0.00 0.00 177.00 177.75 2oqe s ILE 639 N -1.68 0.32 0.02 0.56 1.01 0.35 -4.99 121.20 116.80 2oqe s ILE 639 Ca 0.47 -0.16 -0.13 0.00 0.00 0.00 0.00 60.65 60.82 2oqe s ILE 639 Cb -0.14 -0.28 0.02 0.00 0.01 0.00 0.00 42.46 42.06 2oqe s ILE 639 CO 0.20 0.10 0.28 0.28 0.00 0.00 0.00 174.94 175.80 2oqe s THR 640 N -0.02 0.08 0.08 2.92 -1.32 -1.26 -0.04 115.64 116.08 2oqe s THR 640 Ca 0.01 -0.65 -0.10 0.00 -1.21 0.00 0.00 61.69 59.74 2oqe s THR 640 Cb -0.02 -0.81 0.00 0.00 -1.51 0.00 0.00 72.50 70.16 2oqe s THR 640 CO -0.00 -0.36 0.21 -1.48 -2.21 0.00 0.00 174.62 170.78 2oqe s LEU 641 N -1.80 1.30 0.03 9.08 0.05 -0.68 -4.66 118.68 122.01 2oqe s LEU 641 Ca -0.08 -0.57 0.02 0.00 0.05 0.00 0.00 54.13 53.54 2oqe s LEU 641 Cb -0.03 1.11 -0.02 0.00 -2.05 0.00 0.00 46.19 45.20 2oqe s LEU 641 CO -0.01 -0.72 -0.06 -0.32 -0.55 0.00 0.00 176.35 174.69 2oqe s MET 642 N -3.66 0.46 -0.26 1.48 1.75 -0.70 -1.44 119.30 116.93 2oqe s MET 642 Ca 0.03 -0.71 0.01 0.00 -1.25 0.00 0.00 55.69 53.77 2oqe s MET 642 Cb 0.04 -0.17 0.05 0.00 2.84 0.00 0.00 34.83 37.59 2oqe s MET 642 CO -0.10 0.02 -0.08 -0.51 -0.65 0.00 0.00 175.02 173.70 2oqe s LEU 643 N -1.53 3.41 -0.07 4.11 1.43 0.13 -0.96 118.68 125.20 2oqe s LEU 643 Ca -0.12 -1.20 0.02 0.00 -1.03 0.00 0.00 54.13 51.80 2oqe s LEU 643 Cb -0.10 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 2oqe s LEU 643 CO -0.00 -0.18 -0.11 -0.13 0.23 0.00 0.00 176.35 176.16 2oqe s ARG 644 N 1.20 2.74 0.12 1.70 0.52 -0.10 -1.24 118.95 123.89 2oqe s ARG 644 Ca -0.05 -0.64 -0.31 0.00 -0.52 0.00 0.00 55.73 54.21 2oqe s ARG 644 Cb -0.19 -2.50 -0.08 0.00 0.52 0.00 0.00 34.95 32.70 2oqe s ARG 644 CO -0.05 0.57 1.36 -1.25 0.02 0.00 0.00 175.30 175.96 2oqe s PRO 645 N -0.59 4.34 -0.07 3.54 0.04 -1.26 -0.18 135.00 140.82 2oqe s PRO 645 Ca 0.09 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.16 2oqe s PRO 645 Cb -0.11 -3.25 0.03 0.00 0.04 0.00 0.00 34.50 31.20 2oqe s PRO 645 CO 0.01 -0.40 -0.00 1.03 0.04 0.00 0.00 177.00 177.68 2oqe s ARG 646 N 0.96 0.63 0.00 4.56 1.81 -0.44 -4.74 118.95 121.73 2oqe s ARG 646 Ca 0.63 0.09 0.00 0.00 -1.72 0.00 0.00 55.73 54.73 2oqe s ARG 646 Cb -0.36 -0.96 0.00 0.00 -0.45 0.00 0.00 34.95 33.18 2oqe s ARG 646 CO 0.31 -0.29 0.00 0.72 -0.68 0.00 0.00 175.30 175.36 2oqe n HIS 647 N 5.06 0.00 -0.02 -0.53 8.25 -1.26 -2.24 115.22 124.48 2oqe n HIS 647 Ca -0.09 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.22 2oqe n HIS 647 Cb 0.50 -1.21 -0.11 0.00 1.12 0.00 0.00 29.99 30.30 2oqe n HIS 647 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 2oqe h PHE 648 N 0.00 0.40 -1.92 4.41 3.57 -1.85 -3.33 116.94 118.22 2oqe h PHE 648 Ca 0.00 -0.21 -0.47 0.00 3.53 0.00 0.00 57.97 60.83 2oqe h PHE 648 Cb 0.51 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 2oqe h PHE 648 CO 0.32 0.99 -0.41 -0.06 -2.23 0.00 0.00 178.31 176.93 2oqe s PHE 649 N -3.28 3.11 -1.89 0.41 0.08 -1.26 -4.94 117.98 110.21 2oqe s PHE 649 Ca -0.15 -0.20 0.24 0.00 0.12 0.00 0.00 56.93 56.95 2oqe s PHE 649 Cb 0.02 -1.80 0.33 0.00 -0.57 0.00 0.00 43.02 41.00 2oqe s PHE 649 CO 0.77 0.18 1.30 0.25 -0.10 0.00 0.00 175.22 177.62 2oqe n THR 650 N -1.47 0.00 -3.72 0.64 -2.24 -1.26 -4.97 114.28 101.25 2oqe n THR 650 Ca -0.03 -0.19 -0.08 0.00 -2.27 0.00 0.00 64.05 61.48 2oqe n THR 650 Cb 0.58 0.87 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 2oqe n THR 650 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2oqe s GLU 651 N -2.50 1.55 -0.30 -0.78 -1.05 -1.26 -5.02 118.70 109.34 2oqe s GLU 651 Ca 0.21 -0.79 -0.39 0.00 -0.15 0.00 0.00 54.97 53.85 2oqe s GLU 651 Cb 0.19 0.57 -0.15 0.00 -0.44 0.00 0.00 34.13 34.30 2oqe s GLU 651 CO 0.56 -0.70 1.88 -1.71 0.95 0.00 0.00 175.26 176.24 2oqe n ASN 652 N -0.43 2.31 0.00 0.83 2.85 -1.26 -4.84 115.26 114.72 2oqe n ASN 652 Ca -0.08 0.90 0.11 0.00 -0.11 0.00 0.00 54.58 55.40 2oqe n ASN 652 Cb 0.61 -1.17 0.53 0.00 1.24 0.00 0.00 39.78 40.99 2oqe n ASN 652 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 2oqe n PRO 653 N 6.25 0.23 -0.02 1.20 -0.04 -1.26 -3.39 135.00 137.96 2oqe n PRO 653 Ca 0.31 0.09 0.13 0.00 -0.04 0.00 0.00 63.50 64.00 2oqe n PRO 653 Cb 0.15 -1.50 0.39 0.00 -0.04 0.00 0.00 33.50 32.50 2oqe n PRO 653 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2oqe n GLY 654 N 0.63 0.35 0.18 0.55 0.00 -1.26 -4.45 105.19 101.20 2oqe n GLY 654 Ca 0.09 -0.51 0.14 0.00 0.00 0.00 0.00 46.02 45.73 2oqe n GLY 654 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2oqe h LEU 655 N 3.01 0.00 -1.14 0.99 3.38 -1.92 -1.69 115.31 117.94 2oqe h LEU 655 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2oqe h LEU 655 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2oqe h LEU 655 CO 0.00 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 177.63 2oqe n ASP 656 N -2.54 1.69 -4.71 -0.43 5.75 -1.26 -4.85 116.55 110.19 2oqe n ASP 656 Ca 0.02 -1.82 -0.42 0.00 -0.01 0.00 0.00 54.79 52.56 2oqe n ASP 656 Cb 0.25 -0.15 -0.03 0.00 -1.03 0.00 0.00 41.12 40.16 2oqe n ASP 656 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2oqe s ILE 657 N -1.69 4.51 0.12 2.12 1.01 -0.64 -4.98 121.20 121.66 2oqe s ILE 657 Ca 0.28 1.85 -0.33 0.00 0.00 0.00 0.00 60.65 62.45 2oqe s ILE 657 Cb 0.15 -4.19 -0.13 0.00 0.01 0.00 0.00 42.46 38.31 2oqe s ILE 657 CO 0.22 0.17 1.71 0.00 0.00 0.00 0.00 174.94 177.03 2oqe n GLN 658 N 3.69 2.40 -1.54 2.79 1.13 -1.26 -4.92 117.38 119.66 2oqe n GLN 658 Ca 0.06 0.87 -0.35 0.00 -1.94 0.00 0.00 57.00 55.65 2oqe n GLN 658 Cb 0.49 -2.69 0.08 0.00 0.11 0.00 0.00 30.24 28.23 2oqe n GLN 658 CO 0.00 0.00 0.00 -2.14 -1.44 0.00 0.00 177.06 173.48 2oqe s PRO 659 N 1.85 2.30 0.19 -1.09 0.02 -1.26 -4.87 135.00 132.14 2oqe s PRO 659 Ca 0.81 1.77 0.03 0.00 0.02 0.00 0.00 61.00 63.63 2oqe s PRO 659 Cb -0.61 -1.85 0.11 0.00 0.02 0.00 0.00 34.50 32.16 2oqe s PRO 659 CO 0.39 -1.72 1.46 0.77 -0.33 0.00 0.00 177.00 177.57 2oqe h SER 660 N -0.08 0.29 -3.85 2.53 0.02 -0.96 -3.45 113.55 108.05 2oqe h SER 660 Ca -0.48 -0.20 -0.12 0.00 -0.84 0.00 0.00 61.79 60.15 2oqe h SER 660 Cb 1.30 -0.09 -0.24 0.00 0.14 0.00 0.00 62.40 63.51 2oqe h SER 660 CO 0.51 0.93 -0.25 -0.47 -1.14 0.00 0.00 176.83 176.41 2oqe s TYR 661 N -3.48 -0.45 -0.17 3.45 5.04 -0.86 -5.01 117.35 115.86 2oqe s TYR 661 Ca -0.04 1.09 -0.09 0.00 -2.44 0.00 0.00 57.07 55.60 2oqe s TYR 661 Cb 0.11 0.16 0.06 0.00 0.35 0.00 0.00 41.96 42.64 2oqe s TYR 661 CO 0.82 -0.22 0.42 0.00 -1.34 0.00 0.00 175.55 175.22 2oqe s ALA 662 N 0.27 -1.07 -0.05 3.97 0.00 -1.26 -0.79 121.76 122.83 2oqe s ALA 662 Ca -0.00 1.54 -0.01 0.00 0.00 0.00 0.00 51.96 53.49 2oqe s ALA 662 Cb -0.03 -0.98 0.03 0.00 0.00 0.00 0.00 23.12 22.13 2oqe s ALA 662 CO -0.00 -0.32 0.02 1.41 0.00 0.00 0.00 175.76 176.86 2oqe s MET 663 N 1.55 0.33 0.74 0.00 0.00 0.42 -5.00 119.30 117.34 2oqe s MET 663 Ca -0.09 0.16 -0.08 0.00 0.00 0.00 0.00 55.69 55.68 2oqe s MET 663 Cb -0.09 -0.68 0.07 0.00 0.00 0.00 0.00 34.83 34.13 2oqe s MET 663 CO -0.13 -0.25 1.07 0.95 0.00 0.00 0.00 175.02 176.67 2oqe s THR 664 N 1.68 2.18 0.18 10.11 -4.23 -1.26 -1.30 115.64 123.00 2oqe s THR 664 Ca -0.00 -0.18 -0.12 0.00 -1.18 0.00 0.00 61.69 60.21 2oqe s THR 664 Cb -0.13 -3.00 0.10 0.00 1.34 0.00 0.00 72.50 70.81 2oqe s THR 664 CO -0.03 0.00 1.79 0.74 -0.54 0.00 0.00 174.62 176.57 2oqe h THR 665 N -0.76 1.21 -0.74 3.99 2.02 -1.95 -0.17 112.91 116.50 2oqe h THR 665 Ca -0.45 -0.56 -0.05 0.00 0.77 0.00 0.00 66.41 66.12 2oqe h THR 665 Cb 1.32 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.11 2oqe h THR 665 CO 0.62 0.24 0.25 0.77 0.37 0.00 0.00 175.52 177.77 2oqe h SER 666 N 0.87 1.06 -0.63 4.18 4.64 -1.99 -1.31 113.55 120.37 2oqe h SER 666 Ca 0.22 -0.20 -0.07 0.00 -0.47 0.00 0.00 61.79 61.27 2oqe h SER 666 Cb 0.08 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 2oqe h SER 666 CO -0.03 0.97 0.10 -0.33 -0.87 0.00 0.00 176.83 176.67 2oqe h GLU 667 N 1.08 1.04 -0.24 4.77 5.08 -1.88 -2.05 114.58 122.39 2oqe h GLU 667 Ca 0.24 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 2oqe h GLU 667 Cb 0.28 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2oqe h GLU 667 CO -0.01 0.97 -0.19 0.00 -1.00 0.00 0.00 179.01 178.78 2oqe h ALA 668 N 1.03 1.24 -0.26 3.43 0.00 -0.74 -0.97 119.26 122.98 2oqe h ALA 668 Ca 0.19 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2oqe h ALA 668 Cb 0.43 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2oqe h ALA 668 CO 0.01 0.50 -0.12 0.87 0.00 0.00 0.00 179.25 180.51 2oqe h LYS 669 N 0.38 0.54 -0.53 0.00 1.57 -1.07 -3.18 116.57 114.28 2oqe h LYS 669 Ca 0.07 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.58 2oqe h LYS 669 Cb 0.55 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 2oqe h LYS 669 CO 0.04 0.79 0.19 0.00 -0.57 0.00 0.00 179.45 179.89 2oqe h ARG 670 N 0.27 0.77 0.00 3.15 3.08 -1.14 -1.94 114.38 118.57 2oqe h ARG 670 Ca 0.06 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2oqe h ARG 670 Cb 0.63 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.54 2oqe h ARG 670 CO 0.04 0.65 0.00 0.00 -1.07 0.00 0.00 179.97 179.59 2oqe n ALA 671 N -2.46 1.82 -0.81 0.04 0.00 -0.39 -5.11 120.51 113.60 2oqe n ALA 671 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2oqe n ALA 671 Cb 0.18 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2oqe n ALA 671 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78