#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m02 s ARG 15 N 0.00 1.15 0.53 1.45 1.81 -1.26 -5.06 118.95 117.56 3m02 s ARG 15 Ca 0.00 -1.57 -0.19 0.00 -1.72 0.00 0.00 55.73 52.24 3m02 s ARG 15 Cb 0.00 -0.16 -0.06 0.00 -0.45 0.00 0.00 34.95 34.27 3m02 s ARG 15 CO 0.00 -0.20 1.10 -1.25 -0.68 0.00 0.00 175.30 174.27 3m02 s PRO 16 N -3.97 3.48 -0.12 3.54 0.04 -1.26 -4.94 135.00 131.77 3m02 s PRO 16 Ca 0.28 1.52 -0.29 0.00 0.04 0.00 0.00 61.00 62.54 3m02 s PRO 16 Cb 0.07 -2.03 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 3m02 s PRO 16 CO 0.06 -0.72 1.90 0.14 0.04 0.00 0.00 177.00 178.42 3m02 s VAL 17 N -1.87 3.27 -0.19 -0.36 -7.23 -1.26 -4.92 120.40 107.84 3m02 s VAL 17 Ca 0.71 0.31 -0.29 0.00 -1.81 0.00 0.00 61.98 60.90 3m02 s VAL 17 Cb -0.21 -3.27 -0.05 0.00 0.56 0.00 0.00 36.38 33.42 3m02 s VAL 17 CO 0.25 -0.10 1.98 0.00 -0.31 0.00 0.00 175.10 176.93 3m02 s ALA 18 N 5.69 3.01 -0.17 1.32 0.00 -1.26 -4.87 121.76 125.49 3m02 s ALA 18 Ca 0.85 0.73 -0.15 0.00 0.00 0.00 0.00 51.96 53.39 3m02 s ALA 18 Cb -0.34 -3.98 -0.06 0.00 0.00 0.00 0.00 23.12 18.74 3m02 s ALA 18 CO 0.35 -2.38 -0.31 -3.47 0.00 0.00 0.00 175.76 169.95 3m02 n ASP 19 N 10.05 1.83 -0.70 0.00 -0.08 -1.26 -5.02 116.55 121.38 3m02 n ASP 19 Ca 0.25 0.31 -0.10 0.00 -1.51 0.00 0.00 54.79 53.73 3m02 n ASP 19 Cb 0.45 -0.70 -0.02 0.00 2.34 0.00 0.00 41.12 43.19 3m02 n ASP 19 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 3m02 n PHE 20 N -4.31 0.24 -2.10 -0.67 0.99 -1.26 -4.91 117.46 105.44 3m02 n PHE 20 Ca -0.19 0.16 -0.29 0.00 -0.00 0.00 0.00 57.45 57.12 3m02 n PHE 20 Cb 0.53 -0.34 0.02 0.00 -1.00 0.00 0.00 39.48 38.69 3m02 n PHE 20 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.76 175.22 3m02 s SER 21 N 0.61 5.89 1.29 4.37 1.04 -1.26 -5.02 113.70 120.62 3m02 s SER 21 Ca 0.17 1.12 -0.17 0.00 0.48 0.00 0.00 55.95 57.55 3m02 s SER 21 Cb -0.23 -2.14 0.32 0.00 0.10 0.00 0.00 66.02 64.08 3m02 s SER 21 CO 0.12 -0.99 0.91 -2.65 0.98 0.00 0.00 173.24 171.60 3m02 n PRO 22 N -2.71 -3.32 -2.63 4.02 -0.02 -1.26 -4.77 135.00 124.31 3m02 n PRO 22 Ca 0.05 -0.96 -0.43 0.00 -2.02 0.00 0.00 63.50 60.14 3m02 n PRO 22 Cb 0.56 -2.05 -0.02 0.00 -0.02 0.00 0.00 33.50 31.97 3m02 n PRO 22 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3m02 s SER 23 N -2.56 7.08 0.00 2.55 0.15 -1.26 -4.88 113.70 114.79 3m02 s SER 23 Ca 0.67 1.43 0.00 0.00 0.70 0.00 0.00 55.95 58.75 3m02 s SER 23 Cb -0.21 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.56 3m02 s SER 23 CO 0.63 -0.68 0.52 0.00 1.20 0.00 0.00 173.24 174.90 3m02 n LEU 24 N 6.33 0.00 -0.05 3.45 -0.00 -1.26 -2.83 117.00 122.64 3m02 n LEU 24 Ca 0.12 -0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 56.12 3m02 n LEU 24 Cb 0.46 -0.00 -0.16 0.00 -0.00 0.00 0.00 43.42 43.72 3m02 n LEU 24 CO 0.53 0.00 -0.94 0.79 -0.00 0.00 0.00 177.39 177.77 3m02 n TRP 25 N -0.50 0.07 -1.50 1.47 7.02 -1.26 -5.06 117.44 117.69 3m02 n TRP 25 Ca 0.00 0.02 0.00 0.00 -1.02 0.00 0.00 57.50 56.50 3m02 n TRP 25 Cb 0.00 -0.81 0.00 0.00 -2.42 0.00 0.00 31.31 28.08 3m02 n TRP 25 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3m02 n GLY 26 N 1.53 3.29 0.95 6.99 0.00 -1.13 -2.75 105.19 114.08 3m02 n GLY 26 Ca -0.20 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.70 3m02 n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3m02 n ASP 27 N 3.90 3.95 -0.34 1.61 8.00 -1.26 -4.71 116.55 127.68 3m02 n ASP 27 Ca 0.00 -3.04 0.22 0.00 0.71 0.00 0.00 54.79 52.68 3m02 n ASP 27 Cb 0.00 -0.56 0.45 0.00 -0.02 0.00 0.00 41.12 41.00 3m02 n ASP 27 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 3m02 h GLN 28 N 1.89 0.41 0.00 -1.24 4.20 -1.93 -1.78 115.11 116.66 3m02 h GLN 28 Ca 0.01 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3m02 h GLN 28 Cb 1.49 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.17 3m02 h GLN 28 CO 0.25 0.27 -1.52 1.19 -0.67 0.00 0.00 178.83 178.35 3m02 n PHE 29 N -4.92 0.12 -0.30 2.96 3.72 -1.26 -4.58 117.46 113.19 3m02 n PHE 29 Ca 0.29 0.03 0.30 0.00 -0.05 0.00 0.00 57.45 58.03 3m02 n PHE 29 Cb 0.90 -0.41 0.55 0.00 -0.94 0.00 0.00 39.48 39.59 3m02 n PHE 29 CO 0.00 0.00 0.00 -0.11 -0.05 0.00 0.00 176.76 176.60 3m02 n LEU 30 N -2.06 0.32 -3.72 4.37 7.94 -0.67 -3.94 117.00 119.25 3m02 n LEU 30 Ca -0.01 1.57 -0.15 0.00 -1.11 0.00 0.00 56.01 56.32 3m02 n LEU 30 Cb 0.49 -0.76 -0.15 0.00 0.53 0.00 0.00 43.42 43.53 3m02 n LEU 30 CO 0.44 -1.76 -0.23 -0.94 -1.11 0.00 0.00 177.39 173.79 3m02 s SER 31 N -4.55 0.19 -0.04 1.96 1.04 -1.26 -4.59 113.70 106.45 3m02 s SER 31 Ca -0.09 0.32 -0.00 0.00 0.48 0.00 0.00 55.95 56.66 3m02 s SER 31 Cb 0.32 0.22 0.03 0.00 0.10 0.00 0.00 66.02 66.69 3m02 s SER 31 CO 0.74 -0.18 0.01 0.12 0.98 0.00 0.00 173.24 174.91 3m02 s PHE 32 N 1.58 0.32 -0.28 5.02 5.36 -1.26 -5.06 117.98 123.65 3m02 s PHE 32 Ca -0.05 0.03 -0.04 0.00 -0.96 0.00 0.00 56.93 55.90 3m02 s PHE 32 Cb -0.12 -0.49 0.02 0.00 -0.34 0.00 0.00 43.02 42.09 3m02 s PHE 32 CO -0.06 -0.18 0.03 -1.54 -1.46 0.00 0.00 175.22 172.01 3m02 s SER 33 N 1.44 4.84 0.37 6.13 1.04 -1.26 -4.84 113.70 121.41 3m02 s SER 33 Ca -0.04 -0.86 -0.27 0.00 0.48 0.00 0.00 55.95 55.26 3m02 s SER 33 Cb -0.13 -1.79 -0.12 0.00 0.10 0.00 0.00 66.02 64.09 3m02 s SER 33 CO -0.03 -0.19 1.21 0.00 0.98 0.00 0.00 173.24 175.22 3m02 n ILE 34 N 4.77 2.21 -3.21 -1.02 0.13 -1.26 -4.92 119.36 116.07 3m02 n ILE 34 Ca -0.15 -0.50 -0.45 0.00 -1.10 0.00 0.00 62.75 60.55 3m02 n ILE 34 Cb 0.47 -1.45 -0.01 0.00 -0.84 0.00 0.00 39.64 37.81 3m02 n ILE 34 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 3m02 s LYS 35 N -1.95 3.92 0.41 9.51 1.02 -1.26 -4.90 119.74 126.49 3m02 s LYS 35 Ca 0.58 -2.68 0.23 0.00 0.02 0.00 0.00 55.97 54.12 3m02 s LYS 35 Cb -0.56 -4.66 1.23 0.00 -0.52 0.00 0.00 37.83 33.31 3m02 s LYS 35 CO 0.60 -1.43 1.70 -0.91 -0.92 0.00 0.00 175.35 174.40 3m02 h ASN 36 N 7.38 0.37 0.20 2.83 2.35 -1.99 0.50 115.58 127.23 3m02 h ASN 36 Ca 0.18 0.12 0.00 0.00 -0.55 0.00 0.00 56.30 56.05 3m02 h ASN 36 Cb 0.94 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.37 3m02 h ASN 36 CO 0.99 -0.04 -0.20 1.56 -1.65 0.00 0.00 177.43 178.09 3m02 h GLN 37 N 0.26 -0.41 -0.80 0.81 7.50 -2.00 -1.43 115.11 119.04 3m02 h GLN 37 Ca 0.70 0.03 -0.03 0.00 0.50 0.00 0.00 58.65 59.84 3m02 h GLN 37 Cb 1.94 0.09 -0.04 0.00 0.05 0.00 0.00 27.48 29.53 3m02 h GLN 37 CO -0.38 -0.28 0.37 0.28 -1.50 0.00 0.00 178.83 177.33 3m02 h VAL 38 N -0.43 1.25 0.05 -0.54 2.07 -1.38 -1.80 116.25 115.47 3m02 h VAL 38 Ca -0.00 -0.73 0.01 0.00 0.82 0.00 0.00 66.70 66.80 3m02 h VAL 38 Cb 0.40 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3m02 h VAL 38 CO -0.04 0.31 -0.09 0.00 0.02 0.00 0.00 177.57 177.76 3m02 h ALA 39 N 1.19 -0.14 -0.48 1.67 0.00 -0.95 -0.13 119.26 120.42 3m02 h ALA 39 Ca 0.27 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.09 3m02 h ALA 39 Cb 0.14 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3m02 h ALA 39 CO -0.03 -0.60 -0.04 0.93 0.00 0.00 0.00 179.25 179.51 3m02 h GLU 40 N -0.19 0.83 0.12 0.00 5.08 -1.19 0.20 114.58 119.43 3m02 h GLU 40 Ca 0.02 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.14 3m02 h GLU 40 Cb 0.21 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3m02 h GLU 40 CO -0.06 0.85 -0.10 -0.22 -1.00 0.00 0.00 179.01 178.48 3m02 h LYS 41 N 0.76 -0.22 0.09 2.33 3.64 -1.04 0.25 116.57 122.37 3m02 h LYS 41 Ca 0.14 0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3m02 h LYS 41 Cb 0.51 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.38 3m02 h LYS 41 CO 0.03 -0.15 -0.04 1.88 -2.27 0.00 0.00 179.45 178.90 3m02 h TYR 42 N -0.23 -0.11 -0.01 1.91 -1.99 -0.79 -1.83 116.97 113.92 3m02 h TYR 42 Ca -0.00 -0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.76 3m02 h TYR 42 Cb 0.21 0.04 -0.05 0.00 2.00 0.00 0.00 36.73 38.92 3m02 h TYR 42 CO -0.10 -0.00 -0.29 0.00 -0.00 0.00 0.00 178.16 177.77 3m02 h ALA 43 N 0.71 -0.39 -0.45 3.88 0.00 -0.47 0.41 119.26 122.95 3m02 h ALA 43 Ca -0.01 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.97 3m02 h ALA 43 Cb 0.16 0.51 -0.07 0.00 0.00 0.00 0.00 17.79 18.39 3m02 h ALA 43 CO 0.02 -0.79 0.02 -0.22 0.00 0.00 0.00 179.25 178.28 3m02 h LYS 44 N -0.43 0.13 -0.19 0.00 3.64 -0.42 0.21 116.57 119.52 3m02 h LYS 44 Ca 0.06 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.29 3m02 h LYS 44 Cb 0.52 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3m02 h LYS 44 CO -0.25 0.09 -0.50 1.49 -2.27 0.00 0.00 179.45 178.01 3m02 h GLU 45 N 0.14 0.52 -0.86 1.90 4.81 -0.94 -2.93 114.58 117.22 3m02 h GLU 45 Ca 0.23 -0.30 0.04 0.00 -0.13 0.00 0.00 59.36 59.19 3m02 h GLU 45 Cb 0.32 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 3m02 h GLU 45 CO -0.36 0.90 0.56 0.82 -0.73 0.00 0.00 179.01 180.20 3m02 h ILE 46 N 0.41 1.13 -0.89 2.32 2.04 0.76 0.48 117.51 123.75 3m02 h ILE 46 Ca 0.02 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.58 3m02 h ILE 46 Cb 1.02 -0.04 -0.07 0.00 -0.74 0.00 0.00 36.82 37.00 3m02 h ILE 46 CO 0.09 0.20 0.55 -0.08 0.00 0.00 0.00 178.15 178.91 3m02 h GLU 47 N 1.07 0.96 -0.07 2.37 4.57 -0.81 0.96 114.58 123.63 3m02 h GLU 47 Ca 0.35 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.45 3m02 h GLU 47 Cb 0.02 -0.22 -0.00 0.00 -0.16 0.00 0.00 28.75 28.39 3m02 h GLU 47 CO -0.12 0.63 -0.04 0.00 -1.18 0.00 0.00 179.01 178.31 3m02 h ALA 48 N 1.43 0.10 -0.00 2.92 0.00 -1.11 -2.62 119.26 119.98 3m02 h ALA 48 Ca 0.40 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3m02 h ALA 48 Cb 0.22 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3m02 h ALA 48 CO -0.19 -0.14 -0.14 -0.07 0.00 0.00 0.00 179.25 178.71 3m02 h LEU 49 N -0.22 0.00 -0.51 0.00 3.38 -0.32 -1.98 115.31 115.66 3m02 h LEU 49 Ca 0.02 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3m02 h LEU 49 Cb 0.48 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 3m02 h LEU 49 CO 0.01 0.14 0.24 0.50 0.09 0.00 0.00 178.44 179.42 3m02 h LYS 50 N 0.00 0.74 -0.08 1.13 3.64 0.12 -1.24 116.57 120.88 3m02 h LYS 50 Ca -0.00 -0.11 -0.17 0.00 -1.27 0.00 0.00 60.65 59.09 3m02 h LYS 50 Cb 0.25 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 3m02 h LYS 50 CO 0.02 0.62 -0.69 1.49 -2.27 0.00 0.00 179.45 178.62 3m02 h GLU 51 N 0.68 0.36 -0.40 1.90 4.57 -1.08 -1.77 114.58 118.83 3m02 h GLU 51 Ca 0.17 -0.28 -0.02 0.00 -1.18 0.00 0.00 59.36 58.05 3m02 h GLU 51 Cb 0.13 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 3m02 h GLU 51 CO -0.02 0.91 0.18 1.96 -1.18 0.00 0.00 179.01 180.86 3m02 h GLN 52 N 0.25 0.59 -0.50 1.92 4.20 -1.16 -1.83 115.11 118.58 3m02 h GLN 52 Ca -0.02 -0.10 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 3m02 h GLN 52 Cb 1.25 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.90 3m02 h GLN 52 CO 0.12 0.54 0.25 1.15 -0.67 0.00 0.00 178.83 180.21 3m02 h THR 53 N 0.51 1.19 -0.13 -0.54 2.02 -1.17 -2.22 112.91 112.57 3m02 h THR 53 Ca 0.14 -0.53 0.04 0.00 0.77 0.00 0.00 66.41 66.83 3m02 h THR 53 Cb 0.15 0.62 -0.05 0.00 -1.74 0.00 0.00 68.15 67.13 3m02 h THR 53 CO -0.01 0.21 -0.18 -0.09 0.37 0.00 0.00 175.52 175.82 3m02 h ARG 54 N 0.67 -0.21 -0.05 6.66 2.43 -1.05 0.13 114.38 122.95 3m02 h ARG 54 Ca 0.17 0.01 0.01 0.00 -0.81 0.00 0.00 59.98 59.37 3m02 h ARG 54 Cb 0.11 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3m02 h ARG 54 CO -0.02 -0.14 0.06 -0.91 -1.51 0.00 0.00 179.97 177.45 3m02 h ASN 55 N -0.22 0.00 -0.46 -3.80 2.35 -1.08 0.20 115.58 112.57 3m02 h ASN 55 Ca 0.10 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.74 3m02 h ASN 55 Cb 0.36 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.72 3m02 h ASN 55 CO -0.26 0.00 -0.13 0.24 -1.65 0.00 0.00 177.43 175.63 3m02 h MET 56 N 0.00 0.90 -0.16 0.81 2.86 -0.16 -2.51 114.93 116.67 3m02 h MET 56 Ca 0.02 -0.35 -0.08 0.00 -2.06 0.00 0.00 59.70 57.23 3m02 h MET 56 Cb 0.15 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.76 3m02 h MET 56 CO -0.00 1.00 -0.21 -0.07 1.06 0.00 0.00 176.91 178.69 3m02 h LEU 57 N 0.74 0.46 0.00 1.22 3.38 0.04 -3.12 115.31 118.03 3m02 h LEU 57 Ca 0.12 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.57 3m02 h LEU 57 Cb 0.68 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3m02 h LEU 57 CO 0.05 0.88 0.00 0.18 0.09 0.00 0.00 178.44 179.64 3m02 n LEU 58 N -4.47 0.00 -4.75 1.67 4.77 0.04 -4.85 117.00 109.40 3m02 n LEU 58 Ca -0.06 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.51 3m02 n LEU 58 Cb 0.41 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 3m02 n LEU 58 CO 0.41 0.00 0.88 0.00 -1.33 0.00 0.00 177.39 177.35 3m02 s ALA 59 N -2.00 3.45 0.57 -1.18 0.00 -0.95 -5.03 121.76 116.62 3m02 s ALA 59 Ca 0.12 1.03 -0.03 0.00 0.00 0.00 0.00 51.96 53.08 3m02 s ALA 59 Cb 0.06 -3.40 0.02 0.00 0.00 0.00 0.00 23.12 19.79 3m02 s ALA 59 CO 0.09 -0.37 0.84 0.95 0.00 0.00 0.00 175.76 177.27 3m02 s THR 60 N -0.74 3.25 -1.70 0.00 -4.23 -1.26 -4.42 115.64 106.54 3m02 s THR 60 Ca 0.49 -0.31 0.00 0.00 -1.18 0.00 0.00 61.69 60.69 3m02 s THR 60 Cb -0.35 -3.27 0.00 0.00 1.34 0.00 0.00 72.50 70.22 3m02 s THR 60 CO 0.43 -0.24 0.00 0.61 -0.54 0.00 0.00 174.62 174.87 3m02 n GLY 61 N -2.48 1.47 3.78 3.99 0.00 -1.26 -4.99 105.19 105.70 3m02 n GLY 61 Ca 0.05 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 3m02 n GLY 61 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3m02 s MET 62 N -3.50 4.49 0.90 1.61 1.00 -1.26 -5.05 119.30 117.49 3m02 s MET 62 Ca 0.00 1.07 -0.11 0.00 0.00 0.00 0.00 55.69 56.65 3m02 s MET 62 Cb 0.00 -3.23 0.13 0.00 0.00 0.00 0.00 34.83 31.74 3m02 s MET 62 CO 0.00 0.57 1.09 0.15 0.00 0.00 0.00 175.02 176.83 3m02 s LYS 63 N -1.21 1.19 0.07 2.03 1.02 -1.26 -4.83 119.74 116.76 3m02 s LYS 63 Ca 0.35 0.99 -0.25 0.00 0.02 0.00 0.00 55.97 57.08 3m02 s LYS 63 Cb -0.22 -1.79 -0.16 0.00 -0.52 0.00 0.00 37.83 35.14 3m02 s LYS 63 CO 0.25 -2.33 1.66 1.25 -0.92 0.00 0.00 175.35 175.26 3m02 h LEU 64 N -1.62 -0.14 -0.81 3.17 5.85 -1.99 -1.80 115.31 117.95 3m02 h LEU 64 Ca -0.49 -0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.28 3m02 h LEU 64 Cb 1.28 0.04 -0.07 0.00 0.37 0.00 0.00 40.66 42.28 3m02 h LEU 64 CO 0.52 -0.06 0.47 0.00 -0.34 0.00 0.00 178.44 179.04 3m02 h ALA 65 N 0.65 1.14 -0.25 1.25 0.00 -1.96 -1.34 119.26 118.75 3m02 h ALA 65 Ca -0.02 0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 3m02 h ALA 65 Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3m02 h ALA 65 CO 0.03 0.14 -0.35 -0.44 0.00 0.00 0.00 179.25 178.62 3m02 h ASP 66 N 0.82 0.58 -0.28 0.00 3.32 -1.89 -1.58 116.42 117.39 3m02 h ASP 66 Ca 0.38 -0.24 -0.09 0.00 0.02 0.00 0.00 57.03 57.10 3m02 h ASP 66 Cb 0.29 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3m02 h ASP 66 CO -0.22 0.88 -0.19 0.74 -1.72 0.00 0.00 179.24 178.74 3m02 h THR 67 N 0.47 1.30 -0.24 0.35 2.02 -0.74 -1.21 112.91 114.85 3m02 h THR 67 Ca 0.05 -1.31 -0.04 0.00 0.77 0.00 0.00 66.41 65.88 3m02 h THR 67 Cb 0.83 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.77 3m02 h THR 67 CO 0.07 0.42 0.00 -0.07 0.37 0.00 0.00 175.52 176.31 3m02 h LEU 68 N 0.37 0.42 -1.23 2.58 3.38 -1.22 -1.44 115.31 118.17 3m02 h LEU 68 Ca 0.06 -0.30 0.03 0.00 0.09 0.00 0.00 57.88 57.76 3m02 h LEU 68 Cb 0.72 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 3m02 h LEU 68 CO 0.05 0.62 0.54 0.78 0.09 0.00 0.00 178.44 180.52 3m02 h ASN 69 N 0.21 0.87 -0.19 -0.43 -0.26 -1.27 0.20 115.58 114.70 3m02 h ASN 69 Ca 0.07 -0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.79 3m02 h ASN 69 Cb 0.40 -0.20 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 3m02 h ASN 69 CO 0.01 0.60 0.06 0.25 -1.06 0.00 0.00 177.43 177.29 3m02 h LEU 70 N 1.00 0.27 -0.40 1.61 5.85 -0.95 0.81 115.31 123.50 3m02 h LEU 70 Ca 0.32 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 3m02 h LEU 70 Cb 0.04 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 3m02 h LEU 70 CO -0.09 0.39 0.14 0.40 -0.34 0.00 0.00 178.44 178.94 3m02 h ILE 71 N 0.13 1.21 -0.33 4.05 1.08 -0.46 -1.68 117.51 121.52 3m02 h ILE 71 Ca 0.06 -0.67 0.03 0.00 -0.39 0.00 0.00 64.86 63.88 3m02 h ILE 71 Cb 0.22 0.89 -0.03 0.00 -3.07 0.00 0.00 36.82 34.83 3m02 h ILE 71 CO -0.00 0.24 0.15 -0.78 -0.69 0.00 0.00 178.15 177.07 3m02 h ASP 72 N 0.51 0.21 -0.27 1.72 3.58 -0.48 -0.24 116.42 121.44 3m02 h ASP 72 Ca 0.13 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.59 3m02 h ASP 72 Cb 0.23 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 41.26 3m02 h ASP 72 CO -0.01 0.16 0.13 0.74 -2.88 0.00 0.00 179.24 177.39 3m02 h THR 73 N 0.31 1.15 -0.38 2.25 2.02 -0.72 0.02 112.91 117.56 3m02 h THR 73 Ca 0.14 -0.41 -0.02 0.00 0.77 0.00 0.00 66.41 66.89 3m02 h THR 73 Cb 0.07 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 3m02 h THR 73 CO -0.11 0.15 0.17 0.40 0.37 0.00 0.00 175.52 176.50 3m02 h ILE 74 N 0.31 1.14 -0.07 3.11 2.04 -1.01 0.09 117.51 123.13 3m02 h ILE 74 Ca 0.09 -0.42 -0.06 0.00 1.00 0.00 0.00 64.86 65.48 3m02 h ILE 74 Cb 0.11 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3m02 h ILE 74 CO -0.01 0.17 -0.19 -0.33 0.00 0.00 0.00 178.15 177.78 3m02 h GLU 75 N 0.54 0.25 0.00 2.37 5.08 -0.58 -2.74 114.58 119.49 3m02 h GLU 75 Ca 0.14 -0.18 -0.03 0.00 -1.00 0.00 0.00 59.36 58.29 3m02 h GLU 75 Cb 0.08 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3m02 h GLU 75 CO -0.02 0.79 -0.13 0.00 -1.00 0.00 0.00 179.01 178.65 3m02 h ARG 76 N -0.26 0.00 0.00 2.33 3.08 -0.74 -1.19 114.38 117.61 3m02 h ARG 76 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3m02 h ARG 76 Cb 0.80 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.85 3m02 h ARG 76 CO 0.04 0.13 0.00 1.28 -1.07 0.00 0.00 179.97 180.35 3m02 n LEU 77 N -3.98 0.00 -0.64 3.04 4.77 -0.00 -4.33 117.00 115.86 3m02 n LEU 77 Ca -0.02 0.12 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 3m02 n LEU 77 Cb 0.22 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.15 3m02 n LEU 77 CO 0.33 -0.02 -0.08 0.61 -1.33 0.00 0.00 177.39 176.89 3m02 n GLY 78 N 0.72 1.00 0.38 -0.72 0.00 -0.45 -4.81 105.19 101.30 3m02 n GLY 78 Ca 0.16 -0.46 0.03 0.00 0.00 0.00 0.00 46.02 45.76 3m02 n GLY 78 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3m02 n ILE 79 N -2.67 0.97 0.40 -0.61 -5.35 -1.05 -4.64 119.36 106.41 3m02 n ILE 79 Ca -0.08 -0.98 0.12 0.00 -0.27 0.00 0.00 62.75 61.53 3m02 n ILE 79 Cb 0.32 0.52 0.49 0.00 -1.74 0.00 0.00 39.64 39.23 3m02 n ILE 79 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3m02 n SER 80 N 0.12 0.68 0.00 7.28 3.41 -1.10 -2.76 113.62 121.25 3m02 n SER 80 Ca 0.07 0.67 0.08 0.00 -0.26 0.00 0.00 58.87 59.42 3m02 n SER 80 Cb 0.35 -0.81 0.43 0.00 -0.26 0.00 0.00 64.21 63.92 3m02 n SER 80 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3m02 n TYR 81 N -2.25 0.00 0.59 7.33 4.11 -1.26 -1.47 117.16 124.21 3m02 n TYR 81 Ca 0.02 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 58.03 3m02 n TYR 81 Cb 0.24 -0.14 0.04 0.00 -0.00 0.00 0.00 39.34 39.47 3m02 n TYR 81 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.86 177.58 3m02 n HIS 82 N -1.14 0.26 -2.41 -3.48 8.25 -1.11 -4.40 115.22 111.19 3m02 n HIS 82 Ca 0.10 0.08 -0.13 0.00 -0.26 0.00 0.00 57.72 57.50 3m02 n HIS 82 Cb 0.09 -0.43 0.03 0.00 1.12 0.00 0.00 29.99 30.80 3m02 n HIS 82 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3m02 n PHE 83 N -1.94 2.07 -0.31 4.41 3.72 -0.54 -4.88 117.46 119.98 3m02 n PHE 83 Ca 0.02 -2.22 0.05 0.00 -0.05 0.00 0.00 57.45 55.25 3m02 n PHE 83 Cb 0.43 -0.29 0.19 0.00 -0.94 0.00 0.00 39.48 38.88 3m02 n PHE 83 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3m02 h GLU 84 N 2.40 0.80 -0.01 -1.08 5.08 -1.76 -1.06 114.58 118.95 3m02 h GLU 84 Ca 0.13 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 3m02 h GLU 84 Cb 1.40 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3m02 h GLU 84 CO 0.50 0.53 -0.17 -0.22 -1.00 0.00 0.00 179.01 178.65 3m02 h LYS 85 N 0.82 0.13 -0.47 2.33 3.64 -1.92 -2.41 116.57 118.70 3m02 h LYS 85 Ca 0.43 -0.13 0.04 0.00 -1.27 0.00 0.00 60.65 59.72 3m02 h LYS 85 Cb 0.43 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.25 3m02 h LYS 85 CO -0.27 0.86 0.24 0.93 -2.27 0.00 0.00 179.45 178.94 3m02 h GLU 86 N -0.55 0.46 -0.62 1.90 3.07 -1.90 0.56 114.58 117.51 3m02 h GLU 86 Ca -0.02 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 3m02 h GLU 86 Cb 0.91 -0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.69 3m02 h GLU 86 CO 0.03 0.30 0.28 0.82 -1.40 0.00 0.00 179.01 179.05 3m02 h ILE 87 N 0.47 1.22 0.01 3.13 2.04 -1.30 -1.69 117.51 121.40 3m02 h ILE 87 Ca 0.20 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 3m02 h ILE 87 Cb 0.10 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.69 3m02 h ILE 87 CO -0.14 0.26 -0.01 -0.78 0.00 0.00 0.00 178.15 177.49 3m02 h ASP 88 N 0.85 -0.01 -0.63 1.72 3.58 -0.85 -0.70 116.42 120.38 3m02 h ASP 88 Ca 0.21 -0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.64 3m02 h ASP 88 Cb 0.15 0.00 -0.06 0.00 1.72 0.00 0.00 39.33 41.14 3m02 h ASP 88 CO -0.02 0.08 0.32 0.44 -2.88 0.00 0.00 179.24 177.17 3m02 h ASP 89 N -0.10 0.44 -0.15 2.28 3.32 -0.75 0.43 116.42 121.89 3m02 h ASP 89 Ca -0.00 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 3m02 h ASP 89 Cb 0.10 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.60 3m02 h ASP 89 CO 0.00 0.28 0.08 0.40 -1.72 0.00 0.00 179.24 178.29 3m02 h ILE 90 N 0.58 1.10 -0.47 0.35 1.08 -1.07 -1.32 117.51 117.76 3m02 h ILE 90 Ca 0.29 -0.28 -0.10 0.00 -0.39 0.00 0.00 64.86 64.38 3m02 h ILE 90 Cb 0.23 1.01 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 3m02 h ILE 90 CO -0.21 0.09 -0.11 -0.07 -0.69 0.00 0.00 178.15 177.17 3m02 h LEU 91 N 0.14 0.86 0.07 1.44 3.38 -0.54 -1.09 115.31 119.56 3m02 h LEU 91 Ca 0.05 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.77 3m02 h LEU 91 Cb 0.08 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 3m02 h LEU 91 CO -0.01 0.98 -0.15 -0.78 0.09 0.00 0.00 178.44 178.57 3m02 h ASP 92 N 0.78 -0.42 -0.83 -0.43 1.82 0.01 0.11 116.42 117.46 3m02 h ASP 92 Ca 0.13 0.05 0.06 0.00 -0.39 0.00 0.00 57.03 56.88 3m02 h ASP 92 Cb 0.62 0.16 -0.05 0.00 0.68 0.00 0.00 39.33 40.74 3m02 h ASP 92 CO 0.04 -0.22 0.54 -0.61 -1.61 0.00 0.00 179.24 177.39 3m02 h GLN 93 N -0.29 0.89 -0.53 0.28 4.15 -1.01 -1.40 115.11 117.22 3m02 h GLN 93 Ca 0.03 -0.05 -0.11 0.00 0.77 0.00 0.00 58.65 59.29 3m02 h GLN 93 Cb 0.31 -0.20 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 3m02 h GLN 93 CO -0.10 0.59 -0.08 0.82 -1.93 0.00 0.00 178.83 178.13 3m02 h ILE 94 N 0.92 1.27 -0.43 2.39 1.08 -0.33 -2.57 117.51 119.83 3m02 h ILE 94 Ca 0.36 -1.22 -0.00 0.00 -0.39 0.00 0.00 64.86 63.60 3m02 h ILE 94 Cb 0.22 0.99 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 3m02 h ILE 94 CO -0.13 0.43 0.27 0.22 -0.69 0.00 0.00 178.15 178.25 3m02 h TYR 95 N 0.85 0.57 -0.01 1.37 3.20 0.22 -2.50 116.97 120.67 3m02 h TYR 95 Ca 0.14 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 3m02 h TYR 95 Cb 0.64 -0.19 -0.00 0.00 1.54 0.00 0.00 36.73 38.72 3m02 h TYR 95 CO 0.05 0.39 -0.01 -0.91 -1.64 0.00 0.00 178.16 176.04 3m02 h ASN 96 N 0.58 0.02 0.31 -2.11 2.35 -1.29 -2.89 115.58 112.54 3m02 h ASN 96 Ca 0.16 -0.50 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 3m02 h ASN 96 Cb -0.02 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.34 3m02 h ASN 96 CO -0.03 0.51 0.00 0.00 -1.65 0.00 0.00 177.43 176.26 3m02 n GLN 97 N -4.84 0.04 -1.60 0.81 10.64 -0.97 -4.80 117.38 116.65 3m02 n GLN 97 Ca -0.08 0.29 0.00 0.00 -1.83 0.00 0.00 57.00 55.38 3m02 n GLN 97 Cb 0.26 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.14 3m02 n GLN 97 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 3m02 n ASN 98 N -1.45 0.00 -4.76 2.61 5.15 -0.94 -4.81 115.26 111.07 3m02 n ASN 98 Ca 0.03 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.69 3m02 n ASN 98 Cb 0.11 0.00 0.07 0.00 -0.53 0.00 0.00 39.78 39.43 3m02 n ASN 98 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3m02 s SER 99 N -1.62 4.66 -0.32 1.20 1.04 -1.26 -5.01 113.70 112.40 3m02 s SER 99 Ca 0.00 2.01 -0.03 0.00 0.48 0.00 0.00 55.95 58.41 3m02 s SER 99 Cb 0.00 -2.55 0.06 0.00 0.10 0.00 0.00 66.02 63.63 3m02 s SER 99 CO 0.00 -1.93 0.04 0.20 0.98 0.00 0.00 173.24 172.53 3m02 s ASN 100 N -2.75 4.99 0.41 7.02 -0.87 -1.26 -5.08 114.94 117.41 3m02 s ASN 100 Ca 0.66 -1.35 -0.22 0.00 -1.57 0.00 0.00 52.86 50.38 3m02 s ASN 100 Cb -0.21 -1.75 -0.10 0.00 -0.02 0.00 0.00 41.25 39.17 3m02 s ASN 100 CO 0.47 -0.30 0.96 0.00 -2.57 0.00 0.00 177.10 175.66 3m02 n ASN 102 N -0.42 4.26 -4.40 0.00 4.13 -1.26 -4.80 115.26 112.76 3m02 n ASN 102 Ca 0.06 -3.12 -0.31 0.00 1.68 0.00 0.00 54.58 52.89 3m02 n ASN 102 Cb 0.53 -0.62 -0.14 0.00 -1.54 0.00 0.00 39.78 38.01 3m02 n ASN 102 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 3m02 s ASP 103 N -1.63 3.54 0.15 6.41 -4.77 -1.26 -5.04 116.67 114.08 3m02 s ASP 103 Ca 0.47 -0.40 -0.22 0.00 -3.30 0.00 0.00 52.55 49.10 3m02 s ASP 103 Cb 0.38 -0.55 0.04 0.00 -1.09 0.00 0.00 42.92 41.70 3m02 s ASP 103 CO 0.10 0.30 1.63 0.25 0.70 0.00 0.00 175.17 178.15 3m02 h LEU 104 N 5.09 -0.80 -0.51 2.11 5.85 -1.93 -2.22 115.31 122.89 3m02 h LEU 104 Ca -0.46 0.15 0.10 0.00 0.84 0.00 0.00 57.88 58.51 3m02 h LEU 104 Cb 1.14 0.38 -0.10 0.00 0.37 0.00 0.00 40.66 42.45 3m02 h LEU 104 CO 0.48 -0.28 -0.24 0.00 -0.34 0.00 0.00 178.44 178.06 3m02 h THR 106 N -0.12 1.40 -0.20 0.00 2.02 -1.91 -2.56 112.91 111.54 3m02 h THR 106 Ca 0.23 -2.16 -0.09 0.00 0.77 0.00 0.00 66.41 65.16 3m02 h THR 106 Cb 0.49 2.13 -0.00 0.00 -1.74 0.00 0.00 68.15 69.02 3m02 h THR 106 CO -0.59 0.64 -0.24 0.28 0.37 0.00 0.00 175.52 175.98 3m02 h SER 107 N 0.21 0.57 -0.55 4.18 0.02 -0.87 -0.55 113.55 116.55 3m02 h SER 107 Ca -0.02 -0.50 -0.05 0.00 -0.84 0.00 0.00 61.79 60.38 3m02 h SER 107 Cb 1.26 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 3m02 h SER 107 CO 0.11 0.95 0.16 0.00 -1.14 0.00 0.00 176.83 176.91 3m02 h ALA 108 N 0.63 1.16 -0.10 3.77 0.00 -0.83 0.12 119.26 124.02 3m02 h ALA 108 Ca 0.03 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.69 3m02 h ALA 108 Cb 0.81 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 3m02 h ALA 108 CO 0.06 0.57 -0.07 1.25 0.00 0.00 0.00 179.25 181.06 3m02 h LEU 109 N 0.88 0.24 -0.92 0.00 5.85 -1.39 -1.51 115.31 118.46 3m02 h LEU 109 Ca 0.19 -0.45 0.07 0.00 0.84 0.00 0.00 57.88 58.54 3m02 h LEU 109 Cb 0.29 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.19 3m02 h LEU 109 CO -0.00 0.64 0.58 -0.61 -0.34 0.00 0.00 178.44 178.70 3m02 h GLN 110 N -0.15 1.00 -0.09 1.25 4.15 -0.91 -0.78 115.11 119.57 3m02 h GLN 110 Ca 0.02 -0.06 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 3m02 h GLN 110 Cb 0.56 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 28.02 3m02 h GLN 110 CO 0.02 0.66 0.03 0.35 -1.93 0.00 0.00 178.83 177.96 3m02 h PHE 111 N 1.03 0.15 0.19 3.99 3.57 -0.85 -2.53 116.94 122.48 3m02 h PHE 111 Ca 0.41 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.89 3m02 h PHE 111 Cb 0.23 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.93 3m02 h PHE 111 CO -0.02 0.27 -0.09 -0.09 -2.23 0.00 0.00 178.31 176.15 3m02 h ARG 112 N -0.02 -0.24 -0.74 1.11 2.43 -0.70 -1.78 114.38 114.44 3m02 h ARG 112 Ca 0.03 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.26 3m02 h ARG 112 Cb 0.19 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.74 3m02 h ARG 112 CO -0.00 -0.07 0.45 -0.07 -1.51 0.00 0.00 179.97 178.77 3m02 h LEU 113 N -0.36 0.71 0.18 3.80 3.38 -1.22 -0.48 115.31 121.32 3m02 h LEU 113 Ca -0.03 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3m02 h LEU 113 Cb 0.28 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3m02 h LEU 113 CO 0.04 0.47 -0.09 -0.07 0.09 0.00 0.00 178.44 178.89 3m02 h LEU 114 N 0.85 -0.21 -1.01 1.67 3.38 -1.41 -2.67 115.31 115.91 3m02 h LEU 114 Ca 0.31 -0.18 0.04 0.00 0.09 0.00 0.00 57.88 58.15 3m02 h LEU 114 Cb 0.11 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 3m02 h LEU 114 CO -0.15 0.06 0.66 0.03 0.09 0.00 0.00 178.44 179.13 3m02 h ARG 115 N -0.48 1.22 0.00 1.13 2.47 -1.10 0.15 114.38 117.76 3m02 h ARG 115 Ca -0.03 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.62 3m02 h ARG 115 Cb 0.37 -0.27 -0.00 0.00 -1.65 0.00 0.00 29.97 28.42 3m02 h ARG 115 CO 0.04 0.80 -0.00 1.96 0.56 0.00 0.00 179.97 183.33 3m02 h GLN 116 N 1.25 0.00 -0.68 0.04 4.20 -1.06 -1.91 115.11 116.96 3m02 h GLN 116 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 3m02 h GLN 116 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3m02 h GLN 116 CO -0.14 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.74 3m02 n HIS 117 N -3.09 0.90 -0.13 2.96 8.25 -0.07 -4.96 115.22 119.08 3m02 n HIS 117 Ca -0.00 -0.45 0.00 0.00 -0.26 0.00 0.00 57.72 57.01 3m02 n HIS 117 Cb 0.25 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.36 3m02 n HIS 117 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3m02 n GLY 118 N 1.64 1.18 3.61 -1.41 0.00 -0.72 -4.89 105.19 104.60 3m02 n GLY 118 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 3m02 n GLY 118 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3m02 s PHE 119 N -2.59 2.87 -0.99 1.61 0.08 -0.53 -1.18 117.98 117.26 3m02 s PHE 119 Ca 0.00 0.86 -0.12 0.00 0.12 0.00 0.00 56.93 57.80 3m02 s PHE 119 Cb 0.00 -4.18 -0.08 0.00 -0.57 0.00 0.00 43.02 38.19 3m02 s PHE 119 CO 0.00 -1.21 2.15 -1.71 -0.10 0.00 0.00 175.22 174.35 3m02 n ASN 120 N 7.62 4.51 -4.77 1.36 5.15 -1.26 -3.50 115.26 124.37 3m02 n ASN 120 Ca 0.13 -2.50 -0.40 0.00 -0.60 0.00 0.00 54.58 51.21 3m02 n ASN 120 Cb 0.48 -1.20 -0.01 0.00 -0.53 0.00 0.00 39.78 38.52 3m02 n ASN 120 CO 0.00 0.00 0.00 -0.51 1.40 0.00 0.00 177.26 178.15 3m02 s ILE 121 N 3.74 2.77 0.26 -1.44 2.07 -1.26 -4.95 121.20 122.39 3m02 s ILE 121 Ca 0.49 0.71 -0.30 0.00 -1.41 0.00 0.00 60.65 60.14 3m02 s ILE 121 Cb 0.13 -3.43 -0.09 0.00 0.13 0.00 0.00 42.46 39.19 3m02 s ILE 121 CO 0.00 0.13 1.28 -0.55 -1.91 0.00 0.00 174.94 173.89 3m02 s SER 122 N -0.72 6.90 0.00 4.50 0.15 -1.26 -4.88 113.70 118.38 3m02 s SER 122 Ca 0.54 2.49 0.03 0.00 0.70 0.00 0.00 55.95 59.71 3m02 s SER 122 Cb -0.37 -2.63 0.16 0.00 -1.71 0.00 0.00 66.02 61.48 3m02 s SER 122 CO 0.48 -0.48 1.00 -0.81 1.20 0.00 0.00 173.24 174.64 3m02 n PRO 123 N 1.76 0.89 0.14 5.44 -0.04 -1.26 -3.11 135.00 138.83 3m02 n PRO 123 Ca 0.03 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.62 3m02 n PRO 123 Cb 0.43 -1.05 0.47 0.00 -0.04 0.00 0.00 33.50 33.30 3m02 n PRO 123 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3m02 h GLU 124 N 0.00 0.00 0.00 0.54 4.57 -1.99 -2.85 114.58 114.84 3m02 h GLU 124 Ca 0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3m02 h GLU 124 Cb 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3m02 h GLU 124 CO 0.00 0.00 -0.00 0.97 -1.18 0.00 0.00 179.01 178.80 3m02 h ILE 125 N 0.00 0.04 -0.23 2.32 2.10 -1.95 -1.00 117.51 118.79 3m02 h ILE 125 Ca 0.00 -0.12 0.00 0.00 1.08 0.00 0.00 64.86 65.82 3m02 h ILE 125 Cb 0.52 1.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.37 3m02 h ILE 125 CO 0.00 0.00 0.00 0.49 -1.08 0.00 0.00 178.15 177.56 3m02 n PHE 126 N -3.14 0.29 -0.10 2.19 3.72 -1.08 -4.34 117.46 115.01 3m02 n PHE 126 Ca -0.02 -0.14 -0.11 0.00 -0.05 0.00 0.00 57.45 57.12 3m02 n PHE 126 Cb 0.12 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.63 3m02 n PHE 126 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3m02 h SER 127 N 2.50 0.52 0.08 4.37 0.02 -1.38 -2.91 113.55 116.76 3m02 h SER 127 Ca 0.00 -0.32 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 3m02 h SER 127 Cb 0.55 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.95 3m02 h SER 127 CO 0.00 0.72 0.00 2.29 -1.14 0.00 0.00 176.83 178.70 3m02 n LYS 128 N -4.55 0.02 -0.00 3.45 2.85 -1.26 -1.46 118.16 117.19 3m02 n LYS 128 Ca -0.03 0.37 0.10 0.00 -1.05 0.00 0.00 58.31 57.70 3m02 n LYS 128 Cb 0.27 -1.50 0.08 0.00 -0.65 0.00 0.00 35.03 33.24 3m02 n LYS 128 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 177.40 178.54 3m02 n PHE 129 N -1.42 0.01 -4.42 5.58 3.72 -1.10 -4.97 117.46 114.86 3m02 n PHE 129 Ca 0.01 -0.01 -0.24 0.00 -0.05 0.00 0.00 57.45 57.16 3m02 n PHE 129 Cb 0.03 -0.00 -0.09 0.00 -0.94 0.00 0.00 39.48 38.48 3m02 n PHE 129 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3m02 s GLN 130 N -1.63 1.87 0.67 -1.08 -0.21 -0.54 -1.07 119.66 117.68 3m02 s GLN 130 Ca 0.23 -1.70 -0.03 0.00 0.02 0.00 0.00 55.36 53.88 3m02 s GLN 130 Cb 0.16 -1.87 0.14 0.00 1.00 0.00 0.00 33.01 32.44 3m02 s GLN 130 CO 0.25 0.31 0.92 -0.40 -2.12 0.00 0.00 175.29 174.24 3m02 n ASP 131 N -0.73 0.97 -0.25 5.90 5.68 -0.07 -4.82 116.55 123.24 3m02 n ASP 131 Ca -0.05 -1.88 0.05 0.00 -0.50 0.00 0.00 54.79 52.40 3m02 n ASP 131 Cb 0.60 -0.62 0.17 0.00 -1.14 0.00 0.00 41.12 40.14 3m02 n ASP 131 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3m02 h GLU 132 N 0.00 0.40 0.00 0.11 4.11 -1.97 0.65 114.58 117.88 3m02 h GLU 132 Ca -0.30 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.10 3m02 h GLU 132 Cb 1.05 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.22 3m02 h GLU 132 CO 0.30 0.26 0.00 -0.97 0.07 0.00 0.00 179.01 178.67 3m02 h ASN 133 N 0.41 0.00 0.00 3.06 -1.24 -2.04 -3.46 115.58 112.32 3m02 h ASN 133 Ca 0.40 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.41 3m02 h ASN 133 Cb 0.61 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.66 3m02 h ASN 133 CO -0.41 0.00 0.00 0.61 -1.29 0.00 0.00 177.43 176.34 3m02 n GLY 134 N -0.98 0.75 3.85 1.57 0.00 0.22 -5.08 105.19 105.51 3m02 n GLY 134 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 3m02 n GLY 134 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m02 s LYS 135 N -0.86 3.13 0.31 1.61 3.01 -1.26 -4.82 119.74 120.86 3m02 s LYS 135 Ca 0.00 -0.66 -0.30 0.00 -1.01 0.00 0.00 55.97 54.00 3m02 s LYS 135 Cb 0.00 -2.83 -0.11 0.00 -1.01 0.00 0.00 37.83 33.88 3m02 s LYS 135 CO 0.00 0.54 1.55 -0.06 0.51 0.00 0.00 175.35 177.90 3m02 s PHE 136 N -1.59 2.75 -0.10 3.18 0.08 -1.26 -0.89 117.98 120.15 3m02 s PHE 136 Ca 0.32 0.90 -0.29 0.00 0.12 0.00 0.00 56.93 57.98 3m02 s PHE 136 Cb -0.12 -4.03 -0.07 0.00 -0.57 0.00 0.00 43.02 38.24 3m02 s PHE 136 CO 0.25 -3.35 2.06 0.15 -0.10 0.00 0.00 175.22 174.23 3m02 s LYS 137 N -0.85 3.66 0.65 0.44 1.02 -0.23 -4.81 119.74 119.62 3m02 s LYS 137 Ca 0.60 2.28 0.29 0.00 0.02 0.00 0.00 55.97 59.17 3m02 s LYS 137 Cb -0.47 -4.25 1.54 0.00 -0.52 0.00 0.00 37.83 34.14 3m02 s LYS 137 CO 0.51 -1.50 1.89 0.93 -0.92 0.00 0.00 175.35 176.25 3m02 h GLU 138 N 12.63 0.00 0.00 1.68 4.39 -1.90 -0.31 114.58 131.07 3m02 h GLU 138 Ca -0.45 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.25 3m02 h GLU 138 Cb 1.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.88 3m02 h GLU 138 CO 0.95 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 177.67 3m02 n SER 139 N -3.06 0.00 0.01 1.42 3.41 -1.26 -1.61 113.62 112.53 3m02 n SER 139 Ca 0.00 0.19 0.12 0.00 -0.26 0.00 0.00 58.87 58.92 3m02 n SER 139 Cb 0.46 -0.29 0.20 0.00 -0.26 0.00 0.00 64.21 64.31 3m02 n SER 139 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3m02 n LEU 140 N -1.29 0.57 0.16 1.04 4.77 -0.13 -4.28 117.00 117.83 3m02 n LEU 140 Ca 0.04 -0.01 0.08 0.00 -0.03 0.00 0.00 56.01 56.09 3m02 n LEU 140 Cb 0.06 -0.21 0.45 0.00 -2.33 0.00 0.00 43.42 41.39 3m02 n LEU 140 CO 0.06 0.10 0.81 0.00 -1.33 0.00 0.00 177.39 177.04 3m02 n ALA 141 N -1.57 0.78 -1.03 -1.18 0.00 -0.63 -1.06 120.51 115.83 3m02 n ALA 141 Ca 0.05 0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.70 3m02 n ALA 141 Cb 0.36 -0.99 0.29 0.00 0.00 0.00 0.00 19.45 19.10 3m02 n ALA 141 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3m02 n SER 142 N -2.13 4.23 -3.83 0.00 3.41 -1.26 -4.73 113.62 109.31 3m02 n SER 142 Ca -0.01 -3.09 -0.28 0.00 -0.26 0.00 0.00 58.87 55.23 3m02 n SER 142 Cb 0.21 -0.60 -0.11 0.00 -0.26 0.00 0.00 64.21 63.44 3m02 n SER 142 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3m02 n ASP 143 N -0.32 3.11 -0.14 4.04 2.03 -0.22 -4.99 116.55 120.07 3m02 n ASP 143 Ca 0.26 -3.24 -0.08 0.00 0.52 0.00 0.00 54.79 52.25 3m02 n ASP 143 Cb 1.02 -0.74 -0.02 0.00 -0.72 0.00 0.00 41.12 40.65 3m02 n ASP 143 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 3m02 h VAL 144 N 4.20 0.17 -0.69 5.18 2.07 -1.85 0.56 116.25 125.90 3m02 h VAL 144 Ca 0.16 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.75 3m02 h VAL 144 Cb 0.74 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 3m02 h VAL 144 CO 0.73 0.00 0.45 -0.07 0.02 0.00 0.00 177.57 178.71 3m02 h LEU 145 N -0.27 0.58 -0.25 2.57 3.38 -1.98 0.22 115.31 119.56 3m02 h LEU 145 Ca 0.17 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.02 3m02 h LEU 145 Cb 0.56 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 3m02 h LEU 145 CO -0.58 0.37 -0.31 1.23 0.09 0.00 0.00 178.44 179.24 3m02 h GLY 146 N 0.65 0.72 1.04 0.83 0.00 -1.60 -2.52 103.07 102.19 3m02 h GLY 146 Ca 0.30 -0.77 -0.05 0.00 0.00 0.00 0.00 47.33 46.82 3m02 h GLY 146 CO -0.10 0.69 0.27 1.41 0.00 0.00 0.00 176.54 178.81 3m02 h LEU 147 N 0.38 1.05 -0.20 3.11 3.38 0.11 -1.68 115.31 121.45 3m02 h LEU 147 Ca 0.03 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3m02 h LEU 147 Cb 0.89 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 3m02 h LEU 147 CO 0.07 0.96 0.11 0.25 0.09 0.00 0.00 178.44 179.92 3m02 h LEU 148 N 1.08 0.25 -1.07 1.67 5.85 -0.55 0.21 115.31 122.76 3m02 h LEU 148 Ca 0.24 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 3m02 h LEU 148 Cb 0.25 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3m02 h LEU 148 CO -0.01 0.27 -0.31 0.78 -0.34 0.00 0.00 178.44 178.82 3m02 h ASN 149 N 0.22 0.00 -0.13 1.25 4.21 -1.35 -1.64 115.58 118.14 3m02 h ASN 149 Ca 0.07 0.00 -0.19 0.00 1.21 0.00 0.00 56.30 57.39 3m02 h ASN 149 Cb 0.07 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 3m02 h ASN 149 CO -0.01 0.31 -0.62 0.25 -1.29 0.00 0.00 177.43 176.08 3m02 h LEU 150 N 0.00 0.84 0.30 1.61 5.85 -1.00 -1.53 115.31 121.39 3m02 h LEU 150 Ca -0.00 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.22 3m02 h LEU 150 Cb 0.80 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3m02 h LEU 150 CO 0.04 1.25 -0.15 0.22 -0.34 0.00 0.00 178.44 179.47 3m02 h TYR 151 N 0.55 -0.38 -0.56 1.25 5.03 -0.41 0.19 116.97 122.65 3m02 h TYR 151 Ca -0.01 -0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.29 3m02 h TYR 151 Cb 1.21 0.12 -0.03 0.00 1.55 0.00 0.00 36.73 39.59 3m02 h TYR 151 CO 0.07 -0.23 0.33 0.93 -1.32 0.00 0.00 178.16 177.94 3m02 h GLU 152 N -0.41 0.75 -0.25 1.82 4.39 -1.31 -2.57 114.58 116.99 3m02 h GLU 152 Ca -0.04 -0.06 -0.16 0.00 0.34 0.00 0.00 59.36 59.44 3m02 h GLU 152 Cb 0.32 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.80 3m02 h GLU 152 CO 0.07 0.53 -0.48 0.00 -1.16 0.00 0.00 179.01 177.96 3m02 h ALA 153 N 1.61 0.67 -0.06 3.43 0.00 -0.75 -2.97 119.26 121.19 3m02 h ALA 153 Ca 0.20 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.64 3m02 h ALA 153 Cb -0.03 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3m02 h ALA 153 CO -0.04 0.68 0.16 0.66 0.00 0.00 0.00 179.25 180.71 3m02 h SER 154 N 0.54 0.00 0.41 0.00 4.64 -0.20 -0.92 113.55 118.01 3m02 h SER 154 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3m02 h SER 154 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3m02 h SER 154 CO 0.10 0.00 -0.07 1.41 -0.87 0.00 0.00 176.83 177.40 3m02 n HIS 155 N -3.27 0.00 -0.49 4.77 -0.00 -1.12 -3.58 115.22 111.53 3m02 n HIS 155 Ca -0.01 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.77 3m02 n HIS 155 Cb 0.24 -0.20 0.19 0.00 -0.00 0.00 0.00 29.99 30.22 3m02 n HIS 155 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.34 177.67 3m02 n VAL 156 N -1.06 1.50 -1.28 1.59 0.24 -0.35 -4.95 118.33 114.02 3m02 n VAL 156 Ca 0.15 -1.34 -0.31 0.00 -2.04 0.00 0.00 64.34 60.79 3m02 n VAL 156 Cb 0.26 0.21 0.09 0.00 -1.47 0.00 0.00 33.84 32.93 3m02 n VAL 156 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3m02 s ARG 157 N -1.71 2.21 0.34 7.34 1.70 -1.23 -4.90 118.95 122.70 3m02 s ARG 157 Ca 0.30 1.26 0.01 0.00 -0.47 0.00 0.00 55.73 56.83 3m02 s ARG 157 Cb 0.20 -1.89 0.01 0.00 -0.57 0.00 0.00 34.95 32.71 3m02 s ARG 157 CO 0.13 -1.69 0.10 0.25 -1.08 0.00 0.00 175.30 173.00 3m02 n THR 158 N -3.40 0.00 0.35 4.99 -2.24 -1.26 -4.45 114.28 108.27 3m02 n THR 158 Ca 0.10 -1.53 0.08 0.00 -2.27 0.00 0.00 64.05 60.43 3m02 n THR 158 Cb 0.53 0.14 0.37 0.00 -2.10 0.00 0.00 70.33 69.26 3m02 n THR 158 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3m02 n HIS 159 N -1.02 0.38 -0.40 4.78 -0.00 -1.26 -2.09 115.22 115.62 3m02 n HIS 159 Ca -0.09 0.16 0.11 0.00 -0.00 0.00 0.00 57.72 57.90 3m02 n HIS 159 Cb 0.42 -0.76 0.31 0.00 -0.00 0.00 0.00 29.99 29.96 3m02 n HIS 159 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3m02 n ALA 160 N -1.63 2.47 -2.26 -1.41 0.00 -1.26 -4.54 120.51 111.88 3m02 n ALA 160 Ca 0.02 -1.34 -0.33 0.00 0.00 0.00 0.00 53.44 51.79 3m02 n ALA 160 Cb 0.15 -0.89 0.02 0.00 0.00 0.00 0.00 19.45 18.73 3m02 n ALA 160 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3m02 n ASP 161 N 1.44 5.94 0.15 0.00 8.00 -0.89 -4.73 116.55 126.46 3m02 n ASP 161 Ca 0.23 -3.77 0.12 0.00 0.71 0.00 0.00 54.79 52.09 3m02 n ASP 161 Cb 0.65 -0.73 0.54 0.00 -0.02 0.00 0.00 41.12 41.55 3m02 n ASP 161 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3m02 h ASP 162 N 2.79 0.00 0.19 -2.24 5.19 -1.82 -0.78 116.42 119.76 3m02 h ASP 162 Ca 0.41 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.79 3m02 h ASP 162 Cb 0.52 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.03 3m02 h ASP 162 CO 1.10 0.00 -0.17 -0.29 -3.12 0.00 0.00 179.24 176.77 3m02 h ILE 163 N 0.00 1.04 -0.56 0.35 2.10 -1.93 -1.16 117.51 117.35 3m02 h ILE 163 Ca 0.00 -0.58 -0.07 0.00 1.08 0.00 0.00 64.86 65.29 3m02 h ILE 163 Cb 0.26 1.32 -0.04 0.00 -1.09 0.00 0.00 36.82 37.27 3m02 h ILE 163 CO 0.00 0.16 0.09 0.18 -1.08 0.00 0.00 178.15 177.50 3m02 n LEU 164 N -4.22 5.35 0.21 2.19 4.77 -0.30 -4.55 117.00 120.45 3m02 n LEU 164 Ca -0.02 -2.74 0.07 0.00 -0.03 0.00 0.00 56.01 53.28 3m02 n LEU 164 Cb 0.24 -0.69 0.59 0.00 -2.33 0.00 0.00 43.42 41.22 3m02 n LEU 164 CO 0.35 0.64 1.06 -0.08 -1.33 0.00 0.00 177.39 178.04 3m02 h GLU 165 N 3.12 0.09 -0.03 3.23 4.57 -1.28 -2.85 114.58 121.43 3m02 h GLU 165 Ca 0.09 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.26 3m02 h GLU 165 Cb 1.94 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.51 3m02 h GLU 165 CO 0.52 0.09 0.00 -0.25 -1.18 0.00 0.00 179.01 178.18 3m02 n ASP 166 N -4.50 2.05 -0.30 1.04 8.00 -1.26 -4.64 116.55 116.94 3m02 n ASP 166 Ca -0.02 -1.53 0.04 0.00 0.71 0.00 0.00 54.79 54.00 3m02 n ASP 166 Cb 0.10 -0.01 0.19 0.00 -0.02 0.00 0.00 41.12 41.38 3m02 n ASP 166 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3m02 h ALA 167 N 2.39 1.23 0.10 2.24 0.00 -1.81 0.51 119.26 123.92 3m02 h ALA 167 Ca 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3m02 h ALA 167 Cb 0.52 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3m02 h ALA 167 CO 0.00 0.06 -0.05 1.25 0.00 0.00 0.00 179.25 180.51 3m02 h LEU 168 N 0.76 -0.11 -0.74 0.00 5.85 -1.82 -1.19 115.31 118.06 3m02 h LEU 168 Ca 0.42 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 3m02 h LEU 168 Cb 0.45 0.03 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 3m02 h LEU 168 CO -0.28 0.13 0.11 0.00 -0.34 0.00 0.00 178.44 178.06 3m02 h ALA 169 N 0.52 0.96 0.56 1.25 0.00 -1.81 -0.95 119.26 119.79 3m02 h ALA 169 Ca -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 3m02 h ALA 169 Cb 0.30 -0.25 0.01 0.00 0.00 0.00 0.00 17.79 17.84 3m02 h ALA 169 CO 0.02 0.66 -0.27 0.35 0.00 0.00 0.00 179.25 180.01 3m02 h PHE 170 N 1.01 -0.70 -0.86 0.00 3.57 -0.86 -1.79 116.94 117.31 3m02 h PHE 170 Ca 0.20 -0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.76 3m02 h PHE 170 Cb 0.42 0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.34 3m02 h PHE 170 CO 0.03 -0.44 0.56 0.66 -2.23 0.00 0.00 178.31 176.89 3m02 h SER 171 N -0.76 0.81 0.29 0.41 4.64 -1.26 -2.94 113.55 114.75 3m02 h SER 171 Ca -0.08 0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 3m02 h SER 171 Cb 0.58 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3m02 h SER 171 CO 0.13 0.51 -0.14 0.74 -0.87 0.00 0.00 176.83 177.20 3m02 h THR 172 N 0.91 0.74 -0.81 2.95 2.02 -1.11 -0.30 112.91 117.32 3m02 h THR 172 Ca 0.38 -0.16 0.08 0.00 0.77 0.00 0.00 66.41 67.47 3m02 h THR 172 Cb 0.28 0.83 -0.07 0.00 -1.74 0.00 0.00 68.15 67.46 3m02 h THR 172 CO -0.15 0.03 0.48 -0.29 0.37 0.00 0.00 175.52 175.97 3m02 h ILE 173 N -0.47 0.97 0.03 3.11 6.09 -1.15 -1.10 117.51 124.99 3m02 h ILE 173 Ca -0.04 -0.29 -0.22 0.00 -1.37 0.00 0.00 64.86 62.94 3m02 h ILE 173 Cb 0.36 0.06 -0.02 0.00 0.47 0.00 0.00 36.82 37.69 3m02 h ILE 173 CO 0.07 0.15 -1.02 0.45 -3.07 0.00 0.00 178.15 174.73 3m02 h HIS 174 N 0.84 0.20 -0.49 2.19 3.86 -1.49 -2.75 115.15 117.51 3m02 h HIS 174 Ca 0.37 -0.13 -0.10 0.00 -1.16 0.00 0.00 60.37 59.35 3m02 h HIS 174 Cb 0.26 -0.01 -0.02 0.00 1.06 0.00 0.00 27.41 28.70 3m02 h HIS 174 CO -0.05 1.05 -0.06 -0.07 0.86 0.00 0.00 177.93 179.65 3m02 h LEU 175 N 0.05 0.91 -0.72 2.43 3.38 -0.65 -0.72 115.31 119.98 3m02 h LEU 175 Ca -0.05 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.59 3m02 h LEU 175 Cb 1.73 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 42.19 3m02 h LEU 175 CO 0.15 1.04 0.47 -0.33 0.09 0.00 0.00 178.44 179.85 3m02 h GLU 176 N 0.77 0.95 -0.62 1.13 5.08 -1.24 -0.53 114.58 120.13 3m02 h GLU 176 Ca 0.13 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 3m02 h GLU 176 Cb 0.61 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 3m02 h GLU 176 CO 0.04 0.64 0.03 1.03 -1.00 0.00 0.00 179.01 179.74 3m02 h SER 177 N 0.98 1.04 0.85 1.42 0.87 -1.15 -3.27 113.55 114.29 3m02 h SER 177 Ca 0.26 -0.28 -0.17 0.00 -1.23 0.00 0.00 61.79 60.37 3m02 h SER 177 Cb -0.10 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.55 3m02 h SER 177 CO -0.06 1.07 -1.24 0.00 -0.53 0.00 0.00 176.83 176.08 3m02 h ALA 178 N 1.03 0.65 -0.78 6.23 0.00 -0.96 -3.41 119.26 122.02 3m02 h ALA 178 Ca 0.18 -0.84 0.14 0.00 0.00 0.00 0.00 54.91 54.39 3m02 h ALA 178 Cb 0.53 0.20 -0.14 0.00 0.00 0.00 0.00 17.79 18.38 3m02 h ALA 178 CO 0.03 0.96 -0.27 0.00 0.00 0.00 0.00 179.25 179.96 3m02 h ALA 179 N 1.36 0.31 -0.50 0.00 0.00 -1.14 -2.26 119.26 117.02 3m02 h ALA 179 Ca -0.13 0.27 0.15 0.00 0.00 0.00 0.00 54.91 55.19 3m02 h ALA 179 Cb 1.61 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 20.11 3m02 h ALA 179 CO 0.06 -0.52 0.55 -1.35 0.00 0.00 0.00 179.25 177.99 3m02 h PRO 180 N -0.05 0.00 -0.30 0.00 0.11 -1.79 -2.08 132.00 127.88 3m02 h PRO 180 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 3m02 h PRO 180 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 3m02 h PRO 180 CO -0.82 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 177.69 3m02 n HIS 181 N -3.64 0.63 -2.96 0.65 8.25 -0.85 -5.01 115.22 112.30 3m02 n HIS 181 Ca 0.10 -0.65 -0.30 0.00 -0.26 0.00 0.00 57.72 56.61 3m02 n HIS 181 Cb 0.75 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.68 3m02 n HIS 181 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3m02 s LEU 182 N -1.70 3.89 0.65 2.41 1.43 -0.79 -5.06 118.68 119.51 3m02 s LEU 182 Ca 0.30 1.10 -0.11 0.00 -1.03 0.00 0.00 54.13 54.39 3m02 s LEU 182 Cb 0.20 -3.96 -0.02 0.00 0.03 0.00 0.00 46.19 42.44 3m02 s LEU 182 CO 0.13 -0.35 1.04 -1.59 0.23 0.00 0.00 176.35 175.82 3m02 s LYS 183 N -3.68 3.32 0.21 1.70 -2.85 -1.26 -4.53 119.74 112.65 3m02 s LYS 183 Ca 0.51 0.80 -0.09 0.00 -1.00 0.00 0.00 55.97 56.19 3m02 s LYS 183 Cb -0.10 -2.04 -0.07 0.00 -2.06 0.00 0.00 37.83 33.55 3m02 s LYS 183 CO 0.29 -0.79 0.52 -1.12 0.10 0.00 0.00 175.35 174.35 3m02 s SER 184 N -4.06 6.60 0.00 0.03 0.01 -1.26 -1.08 113.70 113.94 3m02 s SER 184 Ca 0.56 0.86 0.29 0.00 1.31 0.00 0.00 55.95 58.97 3m02 s SER 184 Cb -0.12 -2.20 1.33 0.00 0.21 0.00 0.00 66.02 65.24 3m02 s SER 184 CO 0.54 -0.05 1.94 -0.81 0.41 0.00 0.00 173.24 175.27 3m02 n PRO 185 N -0.10 0.36 -0.28 12.44 -0.04 -1.26 -4.90 135.00 141.22 3m02 n PRO 185 Ca -0.00 -0.05 0.06 0.00 -0.04 0.00 0.00 63.50 63.47 3m02 n PRO 185 Cb 0.52 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.66 3m02 n PRO 185 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3m02 h LEU 186 N 0.13 -0.45 -0.52 1.53 5.85 -1.86 0.17 115.31 120.17 3m02 h LEU 186 Ca 0.00 0.22 0.09 0.00 0.84 0.00 0.00 57.88 59.03 3m02 h LEU 186 Cb 0.37 0.40 -0.07 0.00 0.37 0.00 0.00 40.66 41.72 3m02 h LEU 186 CO 0.00 -0.23 0.09 -0.09 -0.34 0.00 0.00 178.44 177.87 3m02 h ARG 187 N 0.07 0.21 -0.27 1.25 2.43 -1.34 0.16 114.38 116.88 3m02 h ARG 187 Ca 0.44 -0.01 -0.10 0.00 -0.81 0.00 0.00 59.98 59.50 3m02 h ARG 187 Cb 0.80 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 3m02 h ARG 187 CO -0.75 0.14 -0.25 0.93 -1.51 0.00 0.00 179.97 178.53 3m02 h GLU 188 N 0.22 0.53 -0.38 0.20 3.07 -1.04 -0.57 114.58 116.60 3m02 h GLU 188 Ca 0.26 -0.21 -0.05 0.00 -0.50 0.00 0.00 59.36 58.87 3m02 h GLU 188 Cb 0.37 -0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.24 3m02 h GLU 188 CO -0.36 0.74 0.05 0.37 -1.40 0.00 0.00 179.01 178.41 3m02 h GLN 189 N 0.47 0.63 -0.07 2.33 4.15 0.38 -0.04 115.11 122.96 3m02 h GLN 189 Ca 0.07 -0.18 -0.01 0.00 0.77 0.00 0.00 58.65 59.30 3m02 h GLN 189 Cb 0.69 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.31 3m02 h GLN 189 CO 0.05 0.70 -0.00 0.28 -1.93 0.00 0.00 178.83 177.93 3m02 h VAL 190 N 0.47 1.26 -0.80 2.39 2.07 -0.57 -1.09 116.25 119.98 3m02 h VAL 190 Ca 0.11 -0.81 0.06 0.00 0.82 0.00 0.00 66.70 66.88 3m02 h VAL 190 Cb 0.39 1.66 -0.06 0.00 -1.52 0.00 0.00 31.29 31.76 3m02 h VAL 190 CO 0.01 0.23 0.48 0.74 0.02 0.00 0.00 177.57 179.05 3m02 h THR 191 N -0.16 1.02 -0.44 2.57 2.02 -1.05 -1.06 112.91 115.80 3m02 h THR 191 Ca 0.02 -0.30 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 3m02 h THR 191 Cb 0.36 0.06 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 3m02 h THR 191 CO 0.00 0.16 0.15 -0.74 0.37 0.00 0.00 175.52 175.47 3m02 h HIS 192 N 0.88 0.70 -0.58 3.16 6.17 -0.89 -2.78 115.15 121.81 3m02 h HIS 192 Ca 0.35 -0.06 -0.01 0.00 0.71 0.00 0.00 60.37 61.36 3m02 h HIS 192 Cb 0.17 -0.20 -0.03 0.00 2.52 0.00 0.00 27.41 29.87 3m02 h HIS 192 CO -0.05 0.62 0.34 0.00 0.71 0.00 0.00 177.93 179.55 3m02 h ALA 193 N 1.00 1.51 0.00 5.26 0.00 -0.52 0.21 119.26 126.72 3m02 h ALA 193 Ca 0.14 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3m02 h ALA 193 Cb 0.23 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3m02 h ALA 193 CO -0.01 0.43 -0.09 -0.07 0.00 0.00 0.00 179.25 179.51 3m02 h LEU 194 N 0.80 0.00 0.00 0.00 3.38 -0.95 -2.71 115.31 115.83 3m02 h LEU 194 Ca 0.21 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.89 3m02 h LEU 194 Cb -0.02 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3m02 h LEU 194 CO -0.04 0.09 -1.97 -0.62 0.09 0.00 0.00 178.44 175.99 3m02 n GLU 195 N -3.36 0.66 -3.32 1.13 1.02 -0.47 -4.87 120.64 111.43 3m02 n GLU 195 Ca -0.01 0.13 -0.08 0.00 -0.02 0.00 0.00 57.16 57.18 3m02 n GLU 195 Cb 0.27 -1.66 -0.07 0.00 -0.02 0.00 0.00 31.44 29.96 3m02 n GLU 195 CO 0.00 0.00 0.00 -1.14 1.18 0.00 0.00 177.13 177.17 3m02 s GLN 196 N -2.65 0.39 0.78 3.49 2.00 0.62 -5.11 119.66 119.17 3m02 s GLN 196 Ca -0.07 0.50 -0.11 0.00 -2.00 0.00 0.00 55.36 53.68 3m02 s GLN 196 Cb 0.08 -0.33 0.06 0.00 0.80 0.00 0.00 33.01 33.61 3m02 s GLN 196 CO 0.83 -0.72 1.11 0.00 -0.50 0.00 0.00 175.29 176.00 3m02 h LEU 198 N -1.06 0.38 -1.41 0.00 5.85 -1.90 -3.23 115.31 113.94 3m02 h LEU 198 Ca -0.44 -0.49 0.10 0.00 0.84 0.00 0.00 57.88 57.89 3m02 h LEU 198 Cb 1.24 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.11 3m02 h LEU 198 CO 0.50 0.79 0.50 -0.74 -0.34 0.00 0.00 178.44 179.15 3m02 h HIS 199 N -0.03 0.70 -0.61 1.25 2.76 -1.93 -2.47 115.15 114.83 3m02 h HIS 199 Ca 0.02 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 3m02 h HIS 199 Cb 0.69 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.42 3m02 h HIS 199 CO 0.09 0.33 0.00 1.63 -1.30 0.00 0.00 177.93 178.67 3m02 n LYS 200 N -4.50 3.98 -4.01 5.26 5.02 -1.24 -4.97 118.16 117.70 3m02 n LYS 200 Ca 0.13 -2.95 -0.22 0.00 -2.02 0.00 0.00 58.31 53.25 3m02 n LYS 200 Cb 0.34 -1.97 -0.03 0.00 -0.02 0.00 0.00 35.03 33.35 3m02 n LYS 200 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3m02 s GLY 201 N -0.94 1.31 0.02 0.72 0.00 -0.93 -4.65 107.32 102.85 3m02 s GLY 201 Ca 0.51 -1.26 -0.30 0.00 0.00 0.00 0.00 44.72 43.67 3m02 s GLY 201 CO 0.22 -1.28 1.37 0.14 0.00 0.00 0.00 173.10 173.54 3m02 s VAL 202 N -1.99 3.71 0.20 1.40 1.01 -1.26 -4.92 120.40 118.55 3m02 s VAL 202 Ca 0.34 1.14 -0.15 0.00 0.00 0.00 0.00 61.98 63.30 3m02 s VAL 202 Cb -0.09 -3.73 0.21 0.00 0.00 0.00 0.00 36.38 32.77 3m02 s VAL 202 CO 0.28 0.02 1.62 -0.65 0.00 0.00 0.00 175.10 176.36 3m02 h PRO 203 N 7.54 -0.05 -0.69 2.72 0.11 -1.93 -0.49 132.00 139.21 3m02 h PRO 203 Ca -0.39 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.69 3m02 h PRO 203 Cb 1.19 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3m02 h PRO 203 CO 0.89 -0.03 0.27 0.00 -0.21 0.00 0.00 178.00 178.91 3m02 h ARG 204 N -0.05 1.04 -0.39 1.05 2.47 -1.92 -0.43 114.38 116.15 3m02 h ARG 204 Ca 0.28 -0.19 -0.02 0.00 -1.26 0.00 0.00 59.98 58.79 3m02 h ARG 204 Cb 0.49 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.63 3m02 h ARG 204 CO -0.65 0.87 0.16 0.28 0.56 0.00 0.00 179.97 181.19 3m02 h VAL 205 N 0.99 1.19 -0.01 2.04 2.07 -1.77 0.89 116.25 121.65 3m02 h VAL 205 Ca 0.23 -0.56 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 3m02 h VAL 205 Cb 0.22 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3m02 h VAL 205 CO -0.02 0.20 -0.52 -0.33 0.02 0.00 0.00 177.57 176.92 3m02 h GLU 206 N 0.48 0.03 -0.31 1.57 4.39 -0.99 -2.48 114.58 117.28 3m02 h GLU 206 Ca 0.13 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.65 3m02 h GLU 206 Cb 0.17 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.82 3m02 h GLU 206 CO -0.01 0.55 -0.45 1.15 -1.16 0.00 0.00 179.01 179.08 3m02 h THR 207 N 0.02 1.28 -0.15 1.13 2.02 -0.67 -0.96 112.91 115.58 3m02 h THR 207 Ca -0.00 -1.63 -0.00 0.00 0.77 0.00 0.00 66.41 65.54 3m02 h THR 207 Cb 0.93 1.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 3m02 h THR 207 CO 0.07 0.53 0.08 -0.09 0.37 0.00 0.00 175.52 176.48 3m02 h ARG 208 N 0.63 0.21 -0.40 6.66 9.65 -0.71 -0.90 114.38 129.52 3m02 h ARG 208 Ca 0.03 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 3m02 h ARG 208 Cb 1.05 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.57 3m02 h ARG 208 CO 0.10 0.22 0.22 0.35 2.80 0.00 0.00 179.97 183.67 3m02 h PHE 209 N 0.14 0.55 0.18 2.20 3.57 -1.42 -2.62 116.94 119.53 3m02 h PHE 209 Ca 0.05 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3m02 h PHE 209 Cb 0.07 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.64 3m02 h PHE 209 CO -0.04 0.42 -0.08 0.35 -2.23 0.00 0.00 178.31 176.72 3m02 h PHE 210 N 0.52 -0.22 0.29 0.41 3.57 -1.02 -0.37 116.94 120.12 3m02 h PHE 210 Ca 0.14 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 3m02 h PHE 210 Cb 0.05 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.83 3m02 h PHE 210 CO -0.03 -0.04 -0.47 0.82 -2.23 0.00 0.00 178.31 176.37 3m02 h ILE 211 N -0.36 0.00 0.00 1.41 2.04 -1.14 0.58 117.51 120.05 3m02 h ILE 211 Ca -0.02 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.76 3m02 h ILE 211 Cb 0.28 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.35 3m02 h ILE 211 CO 0.04 0.00 -0.83 0.77 0.00 0.00 0.00 178.15 178.13 3m02 h SER 212 N -0.80 0.00 0.17 1.72 4.64 -1.54 -1.57 113.55 116.17 3m02 h SER 212 Ca -0.03 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.15 3m02 h SER 212 Cb 0.74 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.81 3m02 h SER 212 CO -0.15 0.29 -1.96 -1.20 -0.87 0.00 0.00 176.83 172.93 3m02 n SER 213 N -2.95 0.18 0.00 4.97 7.64 -0.15 -4.63 113.62 118.68 3m02 n SER 213 Ca -0.02 0.08 -0.00 0.00 1.01 0.00 0.00 58.87 59.94 3m02 n SER 213 Cb 0.68 1.34 -0.00 0.00 -1.01 0.00 0.00 64.21 65.21 3m02 n SER 213 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3m02 n ILE 214 N -2.52 0.03 -0.11 0.44 2.08 -0.65 -4.67 119.36 113.96 3m02 n ILE 214 Ca -0.13 0.14 0.04 0.00 0.56 0.00 0.00 62.75 63.36 3m02 n ILE 214 Cb 0.78 -1.15 0.37 0.00 -0.75 0.00 0.00 39.64 38.89 3m02 n ILE 214 CO 0.00 0.00 0.00 0.22 0.56 0.00 0.00 176.55 177.33 3m02 h TYR 215 N -0.01 0.68 0.00 1.39 3.20 -1.01 -0.09 116.97 121.13 3m02 h TYR 215 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 3m02 h TYR 215 Cb 0.01 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.05 3m02 h TYR 215 CO -0.00 0.40 0.00 -3.47 -1.64 0.00 0.00 178.16 173.45 3m02 n ASP 216 N -4.46 0.14 -0.21 -2.11 2.03 -0.59 -2.16 116.55 109.19 3m02 n ASP 216 Ca 0.07 0.54 0.02 0.00 0.52 0.00 0.00 54.79 55.94 3m02 n ASP 216 Cb 0.12 -0.57 0.04 0.00 -0.72 0.00 0.00 41.12 39.99 3m02 n ASP 216 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3m02 n LYS 217 N -1.66 1.05 -2.39 -0.67 5.02 -0.11 -5.00 118.16 114.41 3m02 n LYS 217 Ca 0.03 -1.17 -0.42 0.00 -2.02 0.00 0.00 58.31 54.72 3m02 n LYS 217 Cb 0.15 -1.09 -0.03 0.00 -0.02 0.00 0.00 35.03 34.04 3m02 n LYS 217 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3m02 s GLU 218 N -0.64 4.42 0.24 1.97 0.41 -0.84 -4.41 118.70 119.85 3m02 s GLU 218 Ca 0.07 1.80 -0.05 0.00 -0.41 0.00 0.00 54.97 56.38 3m02 s GLU 218 Cb 0.04 -3.35 0.26 0.00 -1.78 0.00 0.00 34.13 29.30 3m02 s GLU 218 CO 0.06 -0.29 1.79 0.37 -0.49 0.00 0.00 175.26 176.71 3m02 h GLN 219 N 6.84 1.04 -0.34 1.61 4.15 -1.91 -2.65 115.11 123.85 3m02 h GLN 219 Ca -0.41 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 58.80 3m02 h GLN 219 Cb 1.21 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 28.74 3m02 h GLN 219 CO 0.82 0.88 0.00 -1.13 -1.93 0.00 0.00 178.83 177.47 3m02 n SER 220 N -4.27 2.01 -4.46 -0.69 3.41 -1.26 -4.98 113.62 103.38 3m02 n SER 220 Ca 0.06 -1.94 -0.40 0.00 -0.26 0.00 0.00 58.87 56.33 3m02 n SER 220 Cb 0.21 -0.23 0.02 0.00 -0.26 0.00 0.00 64.21 63.96 3m02 n SER 220 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3m02 n LYS 221 N 0.58 0.56 -3.42 4.33 2.85 -1.00 -4.92 118.16 117.14 3m02 n LYS 221 Ca 0.14 0.21 -0.40 0.00 -1.05 0.00 0.00 58.31 57.21 3m02 n LYS 221 Cb 0.33 -1.62 -0.09 0.00 -0.65 0.00 0.00 35.03 33.00 3m02 n LYS 221 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 3m02 s ASN 222 N -1.06 6.20 0.32 -5.58 3.84 -1.26 -4.97 114.94 112.43 3m02 s ASN 222 Ca 0.66 0.05 0.01 0.00 0.21 0.00 0.00 52.86 53.79 3m02 s ASN 222 Cb -0.51 -2.20 0.55 0.00 -0.55 0.00 0.00 41.25 38.55 3m02 s ASN 222 CO 0.56 -0.23 1.94 0.78 -2.79 0.00 0.00 177.10 177.36 3m02 h ASN 223 N 8.31 0.72 -0.03 -4.21 2.35 -1.99 -0.34 115.58 120.40 3m02 h ASN 223 Ca -0.31 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.37 3m02 h ASN 223 Cb 1.16 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 39.34 3m02 h ASN 223 CO 0.65 0.61 0.01 0.58 -1.65 0.00 0.00 177.43 177.64 3m02 h VAL 224 N 0.81 1.14 -0.72 2.81 2.07 -1.99 -0.51 116.25 119.86 3m02 h VAL 224 Ca 0.20 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 3m02 h VAL 224 Cb 0.07 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 3m02 h VAL 224 CO -0.03 0.11 0.27 -0.07 0.02 0.00 0.00 177.57 177.87 3m02 h LEU 225 N -0.11 1.01 -0.14 2.57 3.38 -1.88 -0.96 115.31 119.18 3m02 h LEU 225 Ca 0.01 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.79 3m02 h LEU 225 Cb 0.17 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3m02 h LEU 225 CO -0.00 0.92 0.05 0.25 0.09 0.00 0.00 178.44 179.75 3m02 h LEU 226 N 1.05 0.19 -0.05 1.67 5.85 -0.95 -0.67 115.31 122.40 3m02 h LEU 226 Ca 0.24 -0.18 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 3m02 h LEU 226 Cb 0.24 -0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 3m02 h LEU 226 CO -0.02 0.32 0.02 -0.09 -0.34 0.00 0.00 178.44 178.34 3m02 h ARG 227 N 0.05 0.06 -0.46 1.25 2.43 -0.97 -1.01 114.38 115.74 3m02 h ARG 227 Ca 0.04 -0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.30 3m02 h ARG 227 Cb 0.19 -0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 29.63 3m02 h ARG 227 CO -0.00 0.15 -0.22 0.35 -1.51 0.00 0.00 179.97 178.74 3m02 h PHE 228 N -0.03 -0.55 -0.54 2.20 3.57 -1.11 -0.33 116.94 120.14 3m02 h PHE 228 Ca 0.02 0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.58 3m02 h PHE 228 Cb 0.10 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 3m02 h PHE 228 CO -0.04 -0.30 0.36 0.00 -2.23 0.00 0.00 178.31 176.10 3m02 h ALA 229 N 1.18 0.69 -0.30 2.41 0.00 -0.77 0.00 119.26 122.47 3m02 h ALA 229 Ca 0.22 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 3m02 h ALA 229 Cb 0.46 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3m02 h ALA 229 CO -0.53 0.12 -0.03 0.87 0.00 0.00 0.00 179.25 179.68 3m02 h LYS 230 N 0.72 0.55 -0.35 0.00 1.57 -0.59 -1.55 116.57 116.92 3m02 h LYS 230 Ca 0.20 -0.19 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 3m02 h LYS 230 Cb -0.07 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 3m02 h LYS 230 CO -0.05 0.71 0.13 -0.07 -0.57 0.00 0.00 179.45 179.60 3m02 h LEU 231 N 0.33 0.49 -0.35 2.94 3.38 -0.91 -1.37 115.31 119.82 3m02 h LEU 231 Ca 0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3m02 h LEU 231 Cb 0.48 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 3m02 h LEU 231 CO 0.02 0.54 0.13 -0.78 0.09 0.00 0.00 178.44 178.44 3m02 h ASP 232 N 0.42 0.50 -0.67 -0.43 3.58 -0.98 0.53 116.42 119.37 3m02 h ASP 232 Ca 0.12 -0.18 0.00 0.00 0.42 0.00 0.00 57.03 57.39 3m02 h ASP 232 Cb 0.21 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 41.09 3m02 h ASP 232 CO -0.01 0.54 0.42 0.15 -2.88 0.00 0.00 179.24 177.47 3m02 h PHE 233 N 0.42 0.86 -0.31 0.28 3.04 -1.21 -0.11 116.94 119.92 3m02 h PHE 233 Ca 0.12 0.01 -0.12 0.00 3.98 0.00 0.00 57.97 61.96 3m02 h PHE 233 Cb 0.21 -0.29 -0.01 0.00 2.56 0.00 0.00 35.95 38.42 3m02 h PHE 233 CO 0.00 0.56 -0.31 -0.91 -2.02 0.00 0.00 178.31 175.63 3m02 h ASN 234 N 0.91 0.68 0.06 0.41 2.35 -0.99 -1.61 115.58 117.38 3m02 h ASN 234 Ca 0.24 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 3m02 h ASN 234 Cb -0.07 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.11 3m02 h ASN 234 CO -0.05 0.94 -0.03 0.25 -1.65 0.00 0.00 177.43 176.90 3m02 h LEU 235 N 0.56 -0.07 -1.28 1.61 5.85 -0.42 -2.66 115.31 118.90 3m02 h LEU 235 Ca 0.07 -0.25 0.04 0.00 0.84 0.00 0.00 57.88 58.57 3m02 h LEU 235 Cb 0.80 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.81 3m02 h LEU 235 CO 0.07 0.22 0.51 -0.07 -0.34 0.00 0.00 178.44 178.82 3m02 h LEU 236 N -0.35 0.80 -1.18 2.25 3.38 -1.00 -0.83 115.31 118.38 3m02 h LEU 236 Ca -0.01 -0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.05 3m02 h LEU 236 Cb 0.31 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 3m02 h LEU 236 CO 0.01 0.55 0.58 -0.61 0.09 0.00 0.00 178.44 179.06 3m02 h GLN 237 N 0.93 0.89 -0.78 1.13 4.15 -1.10 0.10 115.11 120.44 3m02 h GLN 237 Ca 0.31 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.68 3m02 h GLN 237 Cb 0.08 -0.20 -0.04 0.00 0.21 0.00 0.00 27.48 27.53 3m02 h GLN 237 CO -0.09 0.59 0.47 0.52 -1.93 0.00 0.00 178.83 178.39 3m02 h MET 238 N 0.92 1.05 -0.18 1.69 2.86 -0.80 0.19 114.93 120.66 3m02 h MET 238 Ca 0.41 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.95 3m02 h MET 238 Cb 0.37 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3m02 h MET 238 CO -0.17 0.74 0.07 1.25 1.06 0.00 0.00 176.91 179.86 3m02 h LEU 239 N 1.06 0.24 -0.63 1.22 5.85 -0.92 -1.97 115.31 120.16 3m02 h LEU 239 Ca 0.28 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 58.89 3m02 h LEU 239 Cb -0.04 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.88 3m02 h LEU 239 CO -0.05 0.32 0.37 0.45 -0.34 0.00 0.00 178.44 179.19 3m02 h HIS 240 N 0.14 0.69 -0.24 1.25 3.86 -0.49 -0.93 115.15 119.41 3m02 h HIS 240 Ca 0.06 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.24 3m02 h HIS 240 Cb 0.16 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.40 3m02 h HIS 240 CO -0.02 0.37 -0.08 0.87 0.86 0.00 0.00 177.93 179.93 3m02 h LYS 241 N 0.71 0.39 -0.07 2.45 1.57 -0.45 0.45 116.57 121.62 3m02 h LYS 241 Ca 0.26 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.94 3m02 h LYS 241 Cb 0.08 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.34 3m02 h LYS 241 CO -0.13 0.49 0.01 1.96 -0.57 0.00 0.00 179.45 181.20 3m02 h GLN 242 N 0.37 0.11 -0.00 3.15 4.20 -0.52 -0.61 115.11 121.80 3m02 h GLN 242 Ca 0.08 -0.03 0.02 0.00 0.06 0.00 0.00 58.65 58.77 3m02 h GLN 242 Cb 0.38 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.13 3m02 h GLN 242 CO 0.02 0.36 -0.12 0.93 -0.67 0.00 0.00 178.83 179.35 3m02 h GLU 243 N -0.15 -0.19 -0.19 1.46 5.08 -0.81 0.21 114.58 119.99 3m02 h GLU 243 Ca 0.02 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3m02 h GLU 243 Cb 0.31 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3m02 h GLU 243 CO 0.00 -0.13 0.09 1.25 -1.00 0.00 0.00 179.01 179.23 3m02 h LEU 244 N -0.20 0.23 0.13 1.33 5.85 -0.88 0.27 115.31 122.05 3m02 h LEU 244 Ca 0.04 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3m02 h LEU 244 Cb 0.25 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.22 3m02 h LEU 244 CO -0.12 0.19 -0.06 0.00 -0.34 0.00 0.00 178.44 178.12 3m02 h ALA 245 N 1.84 -0.17 -0.70 1.25 0.00 -0.26 0.85 119.26 122.07 3m02 h ALA 245 Ca 0.07 -0.21 0.09 0.00 0.00 0.00 0.00 54.91 54.86 3m02 h ALA 245 Cb 0.03 0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 3m02 h ALA 245 CO -0.01 -0.38 0.35 0.37 0.00 0.00 0.00 179.25 179.58 3m02 h GLN 246 N -0.60 0.58 0.00 0.00 4.15 0.02 -0.44 115.11 118.81 3m02 h GLN 246 Ca -0.02 -0.04 -0.09 0.00 0.77 0.00 0.00 58.65 59.28 3m02 h GLN 246 Cb 0.47 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.01 3m02 h GLN 246 CO 0.03 0.39 -0.41 0.28 -1.93 0.00 0.00 178.83 177.18 3m02 h VAL 247 N 0.60 0.97 -0.13 2.39 2.07 -0.45 -2.57 116.25 119.14 3m02 h VAL 247 Ca 0.34 -1.62 -0.20 0.00 0.82 0.00 0.00 66.70 66.05 3m02 h VAL 247 Cb 0.35 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 3m02 h VAL 247 CO -0.26 0.40 -0.72 0.28 0.02 0.00 0.00 177.57 177.29 3m02 h SER 248 N 0.00 0.68 -0.41 0.57 0.02 0.68 -1.89 113.55 113.20 3m02 h SER 248 Ca -0.00 -0.43 -0.06 0.00 -0.84 0.00 0.00 61.79 60.45 3m02 h SER 248 Cb 0.93 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 63.25 3m02 h SER 248 CO 0.05 1.19 0.03 0.03 -1.14 0.00 0.00 176.83 176.99 3m02 h ARG 249 N 0.40 0.70 -0.55 3.45 3.08 -1.03 -1.66 114.38 118.78 3m02 h ARG 249 Ca -0.03 -0.21 0.08 0.00 0.07 0.00 0.00 59.98 59.89 3m02 h ARG 249 Cb 1.31 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 31.23 3m02 h ARG 249 CO 0.14 0.77 0.19 2.35 -1.07 0.00 0.00 179.97 182.35 3m02 h TRP 250 N 0.54 0.33 -0.11 3.04 7.01 -1.37 -0.44 115.95 124.96 3m02 h TRP 250 Ca 0.12 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.06 3m02 h TRP 250 Cb 0.44 -0.07 -0.01 0.00 -2.10 0.00 0.00 29.16 27.42 3m02 h TRP 250 CO 0.03 0.09 -0.32 2.35 -2.79 0.00 0.00 178.44 177.81 3m02 h TRP 251 N 0.37 0.24 -0.21 2.65 2.91 -1.11 -2.94 115.95 117.85 3m02 h TRP 251 Ca 0.27 -0.05 -0.09 0.00 1.13 0.00 0.00 58.89 60.15 3m02 h TRP 251 Cb 0.31 -0.06 -0.00 0.00 -0.51 0.00 0.00 29.16 28.90 3m02 h TRP 251 CO -0.17 0.51 -0.22 -0.22 -1.03 0.00 0.00 178.44 177.31 3m02 h LYS 252 N 0.19 0.52 -0.81 2.65 3.64 -0.29 -2.92 116.57 119.55 3m02 h LYS 252 Ca 0.03 -0.28 0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3m02 h LYS 252 Cb 0.66 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.43 3m02 h LYS 252 CO 0.05 0.86 0.53 -0.44 -2.27 0.00 0.00 179.45 178.17 3m02 h ASP 253 N 0.20 0.67 -0.46 4.20 3.32 -0.96 -0.65 116.42 122.75 3m02 h ASP 253 Ca 0.03 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.01 3m02 h ASP 253 Cb 0.77 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 3m02 h ASP 253 CO 0.05 0.40 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.86 3m02 h LEU 254 N 0.75 0.87 0.36 1.55 3.38 -1.43 -3.47 115.31 117.33 3m02 h LEU 254 Ca 0.37 -0.24 -0.41 0.00 0.09 0.00 0.00 57.88 57.69 3m02 h LEU 254 Cb 0.45 -0.23 0.05 0.00 0.09 0.00 0.00 40.66 41.02 3m02 h LEU 254 CO -0.14 0.96 -0.63 -0.67 0.09 0.00 0.00 178.44 178.04 3m02 n ASP 255 N -4.18 -5.81 0.26 -0.43 2.03 -0.25 -4.86 116.55 103.31 3m02 n ASP 255 Ca 0.02 -0.40 0.18 0.00 0.52 0.00 0.00 54.79 55.11 3m02 n ASP 255 Cb 0.34 -4.67 0.82 0.00 -0.72 0.00 0.00 41.12 36.90 3m02 n ASP 255 CO 0.00 0.00 0.00 -0.26 -1.92 0.00 0.00 177.20 175.02 3m02 h PHE 256 N -1.71 0.00 -0.13 -0.67 0.04 -1.86 -2.03 116.94 110.58 3m02 h PHE 256 Ca -0.53 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.27 3m02 h PHE 256 Cb 1.36 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.50 3m02 h PHE 256 CO 0.54 0.00 0.12 0.28 -0.60 0.00 0.00 178.31 178.66 3m02 h VAL 257 N 0.00 0.62 0.00 -0.55 2.07 -1.89 0.25 116.25 116.75 3m02 h VAL 257 Ca 0.00 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.35 3m02 h VAL 257 Cb 0.27 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 3m02 h VAL 257 CO 0.00 0.00 -1.64 0.35 0.02 0.00 0.00 177.57 176.30 3m02 n THR 258 N -4.02 0.64 0.06 2.57 -2.24 -0.82 -4.21 114.28 106.26 3m02 n THR 258 Ca 0.00 -0.29 -0.19 0.00 -2.27 0.00 0.00 64.05 61.31 3m02 n THR 258 Cb 0.24 -0.86 -0.09 0.00 -2.10 0.00 0.00 70.33 67.52 3m02 n THR 258 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3m02 h THR 259 N 0.00 1.32 -2.27 4.28 1.35 -1.37 -3.35 112.91 112.87 3m02 h THR 259 Ca -0.25 -2.35 -0.60 0.00 -0.55 0.00 0.00 66.41 62.66 3m02 h THR 259 Cb 1.45 2.45 -0.42 0.00 -1.73 0.00 0.00 68.15 69.90 3m02 h THR 259 CO -0.02 0.72 -0.58 0.18 -0.25 0.00 0.00 175.52 175.57 3m02 n LEU 260 N -3.81 4.38 0.10 3.87 4.77 0.89 -4.93 117.00 122.28 3m02 n LEU 260 Ca -0.10 -5.61 0.19 0.00 -0.03 0.00 0.00 56.01 50.46 3m02 n LEU 260 Cb 0.89 -0.61 0.66 0.00 -2.33 0.00 0.00 43.42 42.02 3m02 n LEU 260 CO 0.55 2.27 1.17 1.55 -1.33 0.00 0.00 177.39 181.60 3m02 h PRO 261 N 3.35 0.00 0.00 3.23 0.13 -1.70 0.96 132.00 137.98 3m02 h PRO 261 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3m02 h PRO 261 Cb 0.54 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.67 3m02 h PRO 261 CO 0.84 0.00 0.00 0.10 -0.23 0.00 0.00 178.00 178.71 3m02 h TYR 262 N 0.00 0.00 -3.48 1.56 -0.00 -1.91 -3.45 116.97 109.69 3m02 h TYR 262 Ca 0.19 0.00 -0.53 0.00 -0.00 0.00 0.00 58.73 58.39 3m02 h TYR 262 Cb 1.40 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 38.09 3m02 h TYR 262 CO 0.00 0.00 0.15 0.00 -0.00 0.00 0.00 178.16 178.31 3m02 s ALA 263 N -3.43 3.46 0.54 0.10 0.00 0.33 -4.94 121.76 117.83 3m02 s ALA 263 Ca 0.04 0.32 -0.19 0.00 0.00 0.00 0.00 51.96 52.13 3m02 s ALA 263 Cb 0.07 -2.92 -0.06 0.00 0.00 0.00 0.00 23.12 20.21 3m02 s ALA 263 CO 0.59 0.29 1.11 1.03 0.00 0.00 0.00 175.76 178.78 3m02 s ARG 264 N -1.08 3.43 -0.43 0.00 0.52 -1.26 -4.86 118.95 115.28 3m02 s ARG 264 Ca 0.35 1.53 -0.05 0.00 -0.52 0.00 0.00 55.73 57.05 3m02 s ARG 264 Cb -0.23 -2.02 0.11 0.00 0.52 0.00 0.00 34.95 33.33 3m02 s ARG 264 CO 0.25 -0.77 0.25 0.34 0.02 0.00 0.00 175.30 175.39 3m02 s ASP 265 N -1.88 5.38 -0.12 0.23 -1.08 -1.26 -4.89 116.67 113.05 3m02 s ASP 265 Ca 0.71 -2.01 0.22 0.00 -0.52 0.00 0.00 52.55 50.95 3m02 s ASP 265 Cb -0.22 -1.88 0.45 0.00 -1.46 0.00 0.00 42.92 39.82 3m02 s ASP 265 CO 0.26 -0.58 1.16 0.54 0.52 0.00 0.00 175.17 177.07 3m02 n ARG 266 N 4.66 0.94 -0.14 4.34 5.12 -1.26 -4.40 116.66 125.92 3m02 n ARG 266 Ca -0.04 -2.74 0.11 0.00 -1.93 0.00 0.00 57.85 53.26 3m02 n ARG 266 Cb 0.41 -0.81 0.45 0.00 -1.16 0.00 0.00 32.46 31.34 3m02 n ARG 266 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 3m02 h VAL 267 N 5.48 0.90 -0.22 1.55 3.04 -1.98 0.82 116.25 125.84 3m02 h VAL 267 Ca -0.13 -0.18 -0.02 0.00 -1.01 0.00 0.00 66.70 65.36 3m02 h VAL 267 Cb 1.58 0.33 -0.01 0.00 -2.01 0.00 0.00 31.29 31.18 3m02 h VAL 267 CO 0.15 0.10 0.07 0.58 -1.01 0.00 0.00 177.57 177.46 3m02 h VAL 268 N 0.53 1.19 -0.35 1.51 2.07 -1.97 0.10 116.25 119.33 3m02 h VAL 268 Ca 0.32 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 3m02 h VAL 268 Cb 0.54 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 3m02 h VAL 268 CO -0.11 0.19 0.07 -0.33 0.02 0.00 0.00 177.57 177.42 3m02 h GLU 269 N 0.19 0.52 -0.41 1.57 3.07 -1.62 -1.60 114.58 116.31 3m02 h GLU 269 Ca 0.07 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.36 58.72 3m02 h GLU 269 Cb 0.23 -0.09 -0.01 0.00 -0.84 0.00 0.00 28.75 28.04 3m02 h GLU 269 CO -0.00 0.49 -0.26 0.00 -1.40 0.00 0.00 179.01 177.84 3m02 h TYR 271 N 0.74 1.11 -0.49 0.00 3.20 0.00 -1.80 116.97 119.72 3m02 h TYR 271 Ca 0.09 -0.12 0.06 0.00 3.14 0.00 0.00 58.73 61.90 3m02 h TYR 271 Cb 0.80 -0.32 -0.05 0.00 1.54 0.00 0.00 36.73 38.71 3m02 h TYR 271 CO 0.05 0.90 0.21 0.35 -1.64 0.00 0.00 178.16 178.03 3m02 h PHE 272 N 1.02 0.39 -0.32 -3.82 3.57 -1.03 0.17 116.94 116.91 3m02 h PHE 272 Ca 0.22 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.78 3m02 h PHE 272 Cb 0.33 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.93 3m02 h PHE 272 CO 0.02 0.16 0.09 2.35 -2.23 0.00 0.00 178.31 178.71 3m02 h TRP 273 N 0.42 0.16 -0.82 0.41 2.91 -0.93 0.22 115.95 118.31 3m02 h TRP 273 Ca 0.23 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 60.23 3m02 h TRP 273 Cb 0.19 -0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 28.78 3m02 h TRP 273 CO -0.13 0.05 0.37 0.00 -1.03 0.00 0.00 178.44 177.70 3m02 h ALA 274 N 1.22 1.05 0.00 2.65 0.00 -0.55 -2.12 119.26 121.51 3m02 h ALA 274 Ca 0.15 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3m02 h ALA 274 Cb 0.14 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3m02 h ALA 274 CO -0.17 0.64 -0.20 1.25 0.00 0.00 0.00 179.25 180.77 3m02 h LEU 275 N 1.17 0.00 -0.77 0.00 5.85 0.24 -1.67 115.31 120.13 3m02 h LEU 275 Ca 0.28 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.90 3m02 h LEU 275 Cb 0.16 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.17 3m02 h LEU 275 CO -0.03 0.20 -0.47 1.23 -0.34 0.00 0.00 178.44 179.03 3m02 h GLY 276 N 0.60 0.00 0.86 3.75 0.00 -0.33 -3.22 103.07 104.74 3m02 h GLY 276 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 3m02 h GLY 276 CO 0.03 0.00 -0.22 -2.08 0.00 0.00 0.00 176.54 174.26 3m02 h VAL 277 N 0.00 1.32 -1.93 4.60 2.07 -0.95 -3.44 116.25 117.92 3m02 h VAL 277 Ca -0.00 -1.39 -0.01 0.00 0.82 0.00 0.00 66.70 66.11 3m02 h VAL 277 Cb 1.02 1.73 -0.22 0.00 -1.52 0.00 0.00 31.29 32.30 3m02 h VAL 277 CO 0.06 0.43 0.16 -0.72 0.02 0.00 0.00 177.57 177.52 3m02 s TYR 278 N -4.33 -0.79 -0.08 1.57 -0.85 -1.10 -4.56 117.35 107.21 3m02 s TYR 278 Ca -0.13 1.84 0.05 0.00 -0.52 0.00 0.00 57.07 58.30 3m02 s TYR 278 Cb 0.07 0.35 -0.07 0.00 0.38 0.00 0.00 41.96 42.69 3m02 s TYR 278 CO 0.79 -0.38 0.14 1.97 -1.52 0.00 0.00 175.55 176.56 3m02 n PHE 279 N 2.92 0.00 -1.66 -3.49 1.16 -1.23 -4.37 117.46 110.79 3m02 n PHE 279 Ca -0.15 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.05 3m02 n PHE 279 Cb 0.56 -0.08 0.05 0.00 -1.61 0.00 0.00 39.48 38.40 3m02 n PHE 279 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 3m02 n GLU 280 N -1.49 1.18 0.25 3.97 4.71 -1.26 -4.90 120.64 123.10 3m02 n GLU 280 Ca -0.00 0.45 0.08 0.00 -0.01 0.00 0.00 57.16 57.68 3m02 n GLU 280 Cb 0.11 -2.29 0.62 0.00 -1.01 0.00 0.00 31.44 28.87 3m02 n GLU 280 CO 0.00 0.00 0.00 -1.00 0.09 0.00 0.00 177.13 176.22 3m02 h PRO 281 N 0.87 0.00 0.00 3.49 0.13 -1.97 -2.42 132.00 132.10 3m02 h PRO 281 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3m02 h PRO 281 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 3m02 h PRO 281 CO 0.53 0.12 0.00 0.00 -0.23 0.00 0.00 178.00 178.42 3m02 n GLN 282 N -4.16 0.11 -0.65 0.86 10.64 -1.26 -2.13 117.38 120.79 3m02 n GLN 282 Ca -0.02 0.36 0.08 0.00 -1.83 0.00 0.00 57.00 55.58 3m02 n GLN 282 Cb 0.20 -1.72 0.33 0.00 -0.86 0.00 0.00 30.24 28.19 3m02 n GLN 282 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3m02 n TYR 283 N -1.93 1.49 -0.14 2.61 4.01 -0.91 -4.63 117.16 117.67 3m02 n TYR 283 Ca 0.03 -0.76 -0.03 0.00 -0.16 0.00 0.00 57.90 56.97 3m02 n TYR 283 Cb 0.20 -0.38 0.05 0.00 -0.31 0.00 0.00 39.34 38.90 3m02 n TYR 283 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3m02 h SER 284 N 3.09 -0.01 -0.28 7.72 0.87 -1.55 0.10 113.55 123.50 3m02 h SER 284 Ca 0.00 0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.61 3m02 h SER 284 Cb 1.64 0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 63.71 3m02 h SER 284 CO 0.33 0.03 0.06 -0.61 -0.53 0.00 0.00 176.83 176.10 3m02 h GLN 285 N 0.22 0.45 -0.48 2.24 4.15 -1.85 -2.50 115.11 117.32 3m02 h GLN 285 Ca 0.22 -0.12 0.07 0.00 0.77 0.00 0.00 58.65 59.59 3m02 h GLN 285 Cb 0.29 -0.06 -0.06 0.00 0.21 0.00 0.00 27.48 27.87 3m02 h GLN 285 CO -0.30 0.55 0.17 0.00 -1.93 0.00 0.00 178.83 177.33 3m02 h ALA 286 N 0.88 0.59 -0.16 3.38 0.00 -1.55 -1.60 119.26 120.79 3m02 h ALA 286 Ca 0.09 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3m02 h ALA 286 Cb 0.31 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3m02 h ALA 286 CO 0.00 -0.22 -0.05 0.00 0.00 0.00 0.00 179.25 178.98 3m02 h ARG 287 N 0.35 -0.02 -0.57 0.00 3.08 -0.65 0.17 114.38 116.73 3m02 h ARG 287 Ca 0.23 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.30 3m02 h ARG 287 Cb 0.24 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 3m02 h ARG 287 CO -0.24 -0.02 0.35 0.28 -1.07 0.00 0.00 179.97 179.28 3m02 h VAL 288 N -0.02 1.08 -0.40 2.04 2.07 -1.10 0.11 116.25 120.03 3m02 h VAL 288 Ca 0.08 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 3m02 h VAL 288 Cb 0.15 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 3m02 h VAL 288 CO -0.18 0.13 0.18 0.24 0.02 0.00 0.00 177.57 177.96 3m02 h MET 289 N 0.70 0.59 -0.44 1.57 2.86 -0.95 -2.46 114.93 116.79 3m02 h MET 289 Ca 0.22 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 3m02 h MET 289 Cb -0.00 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 3m02 h MET 289 CO -0.09 0.53 0.25 1.25 1.06 0.00 0.00 176.91 179.91 3m02 h LEU 290 N 0.51 0.55 -0.77 1.22 5.85 -0.11 -2.44 115.31 120.12 3m02 h LEU 290 Ca 0.14 -0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 3m02 h LEU 290 Cb 0.15 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 3m02 h LEU 290 CO -0.02 0.47 0.03 1.62 -0.34 0.00 0.00 178.44 180.21 3m02 h VAL 291 N 0.58 1.26 -0.91 1.05 3.04 -0.96 -1.20 116.25 119.11 3m02 h VAL 291 Ca 0.16 -1.06 0.03 0.00 -1.01 0.00 0.00 66.70 64.82 3m02 h VAL 291 Cb 0.04 0.78 -0.05 0.00 -2.01 0.00 0.00 31.29 30.05 3m02 h VAL 291 CO -0.03 0.39 0.59 0.11 -1.01 0.00 0.00 177.57 177.62 3m02 h LYS 292 N 0.90 1.11 -0.29 4.17 1.57 -1.23 -0.05 116.57 122.75 3m02 h LYS 292 Ca 0.17 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.82 3m02 h LYS 292 Cb 0.48 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3m02 h LYS 292 CO 0.02 0.74 -0.07 1.15 -0.57 0.00 0.00 179.45 180.71 3m02 h THR 293 N 1.15 1.28 -0.74 -0.16 2.02 -1.01 -1.13 112.91 114.32 3m02 h THR 293 Ca 0.36 -1.11 -0.01 0.00 0.77 0.00 0.00 66.41 66.43 3m02 h THR 293 Cb -0.00 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 3m02 h THR 293 CO -0.12 0.35 0.44 0.40 0.37 0.00 0.00 175.52 176.96 3m02 h ILE 294 N 0.31 1.21 0.04 3.11 2.04 -0.84 0.09 117.51 123.48 3m02 h ILE 294 Ca 0.07 -0.49 -0.00 0.00 1.00 0.00 0.00 64.86 65.44 3m02 h ILE 294 Cb 0.56 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.84 3m02 h ILE 294 CO 0.03 0.23 -0.02 0.28 0.00 0.00 0.00 178.15 178.67 3m02 h SER 295 N 1.01 -0.05 -0.38 1.72 0.02 -0.93 -2.17 113.55 112.78 3m02 h SER 295 Ca 0.26 -0.07 0.03 0.00 -0.84 0.00 0.00 61.79 61.17 3m02 h SER 295 Cb -0.02 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.50 3m02 h SER 295 CO -0.05 0.04 0.18 -0.03 -1.14 0.00 0.00 176.83 175.83 3m02 h MET 296 N -0.13 0.35 0.00 3.45 -1.53 -0.90 -1.30 114.93 114.87 3m02 h MET 296 Ca -0.01 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.23 3m02 h MET 296 Cb 0.12 -0.08 0.00 0.00 -0.55 0.00 0.00 31.60 31.09 3m02 h MET 296 CO 0.01 0.23 0.00 1.51 0.14 0.00 0.00 176.91 178.80 3m02 n ILE 297 N -4.95 0.86 0.01 1.77 0.13 -0.01 -1.85 119.36 115.33 3m02 n ILE 297 Ca 0.01 0.21 -0.18 0.00 -1.10 0.00 0.00 62.75 61.69 3m02 n ILE 297 Cb 0.10 -0.95 -0.10 0.00 -0.84 0.00 0.00 39.64 37.85 3m02 n ILE 297 CO 0.00 0.00 0.00 -1.28 2.80 0.00 0.00 176.55 178.07 3m02 h SER 298 N 0.00 0.72 -0.24 9.51 0.87 -0.57 -2.51 113.55 121.34 3m02 h SER 298 Ca 0.00 -0.73 0.00 0.00 -1.23 0.00 0.00 61.79 59.83 3m02 h SER 298 Cb 0.29 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3m02 h SER 298 CO 0.00 1.35 0.15 0.40 -0.53 0.00 0.00 176.83 178.21 3m02 h ILE 299 N 0.16 1.07 -0.76 2.23 1.08 -1.15 -1.75 117.51 118.39 3m02 h ILE 299 Ca -0.09 -0.13 0.05 0.00 -0.39 0.00 0.00 64.86 64.29 3m02 h ILE 299 Cb 1.46 0.73 -0.05 0.00 -3.07 0.00 0.00 36.82 35.89 3m02 h ILE 299 CO 0.15 0.07 0.47 0.58 -0.69 0.00 0.00 178.15 178.73 3m02 h VAL 300 N 0.32 1.06 0.15 1.67 2.07 -1.54 0.12 116.25 120.09 3m02 h VAL 300 Ca 0.09 -0.30 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3m02 h VAL 300 Cb -0.03 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.85 3m02 h VAL 300 CO -0.02 0.16 -0.07 -0.78 0.02 0.00 0.00 177.57 176.88 3m02 h ASP 301 N 0.88 -0.17 -0.67 0.57 3.58 -1.03 -0.94 116.42 118.63 3m02 h ASP 301 Ca 0.32 -0.06 0.07 0.00 0.42 0.00 0.00 57.03 57.78 3m02 h ASP 301 Cb 0.10 0.04 -0.06 0.00 1.72 0.00 0.00 39.33 41.13 3m02 h ASP 301 CO -0.14 -0.05 0.35 0.44 -2.88 0.00 0.00 179.24 176.96 3m02 h ASP 302 N -0.28 0.50 -0.94 2.28 3.32 -0.98 -1.25 116.42 119.07 3m02 h ASP 302 Ca -0.02 0.04 0.08 0.00 0.02 0.00 0.00 57.03 57.15 3m02 h ASP 302 Cb 0.22 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 39.65 3m02 h ASP 302 CO 0.03 0.31 0.59 0.74 -1.72 0.00 0.00 179.24 179.19 3m02 h THR 303 N 0.63 1.01 -0.10 0.35 2.02 -0.38 0.24 112.91 116.69 3m02 h THR 303 Ca 0.31 -0.35 -0.18 0.00 0.77 0.00 0.00 66.41 66.96 3m02 h THR 303 Cb 0.26 -0.10 0.01 0.00 -1.74 0.00 0.00 68.15 66.57 3m02 h THR 303 CO -0.22 0.19 -0.65 -0.26 0.37 0.00 0.00 175.52 174.95 3m02 h PHE 304 N 1.02 0.84 -0.19 3.16 -1.00 -0.07 -0.51 116.94 120.20 3m02 h PHE 304 Ca 0.43 -0.39 0.00 0.00 2.81 0.00 0.00 57.97 60.82 3m02 h PHE 304 Cb 0.28 -0.12 0.00 0.00 3.61 0.00 0.00 35.95 39.71 3m02 h PHE 304 CO -0.02 1.19 0.00 -0.40 -1.61 0.00 0.00 178.31 177.47 3m02 n ASP 305 N -4.11 3.01 -0.90 2.17 5.68 -0.67 -4.67 116.55 117.06 3m02 n ASP 305 Ca -0.08 -2.58 -0.00 0.00 -0.50 0.00 0.00 54.79 51.62 3m02 n ASP 305 Cb 0.68 -0.35 -0.01 0.00 -1.14 0.00 0.00 41.12 40.30 3m02 n ASP 305 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3m02 n ALA 306 N -0.41 2.51 0.03 2.12 0.00 0.85 -5.03 120.51 120.58 3m02 n ALA 306 Ca 0.14 -1.09 0.00 0.00 0.00 0.00 0.00 53.44 52.49 3m02 n ALA 306 Cb 0.61 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.64 3m02 n ALA 306 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3m02 n TYR 307 N 0.14 -1.63 -1.43 0.00 9.36 -1.23 -4.76 117.16 117.63 3m02 n TYR 307 Ca -0.05 0.18 -0.36 0.00 3.32 0.00 0.00 57.90 60.99 3m02 n TYR 307 Cb 0.78 0.68 0.07 0.00 -0.63 0.00 0.00 39.34 40.24 3m02 n TYR 307 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3m02 n GLY 308 N -1.38 -0.68 3.94 2.98 0.00 -0.20 -4.68 105.19 105.17 3m02 n GLY 308 Ca 0.00 -0.28 -0.25 0.00 0.00 0.00 0.00 46.02 45.50 3m02 n GLY 308 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m02 s THR 309 N -1.74 5.15 0.36 2.61 -4.23 -1.26 -4.87 115.64 111.66 3m02 s THR 309 Ca 0.73 -0.48 0.17 0.00 -1.18 0.00 0.00 61.69 60.93 3m02 s THR 309 Cb -0.37 -3.82 0.36 0.00 1.34 0.00 0.00 72.50 70.01 3m02 s THR 309 CO 0.51 -0.39 1.67 0.58 -0.54 0.00 0.00 174.62 176.44 3m02 h VAL 310 N 1.09 0.29 -0.07 2.29 2.07 -1.96 0.63 116.25 120.58 3m02 h VAL 310 Ca -0.49 -0.10 -0.14 0.00 0.82 0.00 0.00 66.70 66.79 3m02 h VAL 310 Cb 1.21 -0.03 0.01 0.00 -1.52 0.00 0.00 31.29 30.96 3m02 h VAL 310 CO 0.63 0.05 -0.51 0.50 0.02 0.00 0.00 177.57 178.27 3m02 h LYS 311 N 0.29 0.47 -0.46 1.57 3.64 -1.99 -2.58 116.57 117.49 3m02 h LYS 311 Ca 0.74 -0.41 -0.06 0.00 -1.27 0.00 0.00 60.65 59.65 3m02 h LYS 311 Cb 1.81 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.71 3m02 h LYS 311 CO -0.55 1.05 0.06 0.93 -2.27 0.00 0.00 179.45 178.66 3m02 h GLU 312 N 0.02 0.78 -0.87 1.90 5.08 -1.44 -2.44 114.58 117.61 3m02 h GLU 312 Ca -0.04 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 3m02 h GLU 312 Cb 1.18 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 30.30 3m02 h GLU 312 CO 0.10 0.81 0.49 -0.07 -1.00 0.00 0.00 179.01 179.34 3m02 h LEU 313 N 0.64 1.08 -1.29 1.33 3.38 -1.04 0.28 115.31 119.69 3m02 h LEU 313 Ca 0.14 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.03 3m02 h LEU 313 Cb 0.42 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 3m02 h LEU 313 CO 0.01 0.86 0.48 -0.08 0.09 0.00 0.00 178.44 179.80 3m02 h GLU 314 N 1.21 0.95 0.06 1.13 4.57 -1.21 0.16 114.58 121.46 3m02 h GLU 314 Ca 0.31 -0.06 -0.25 0.00 -1.18 0.00 0.00 59.36 58.18 3m02 h GLU 314 Cb 0.01 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.39 3m02 h GLU 314 CO -0.05 0.63 -1.08 0.00 -1.18 0.00 0.00 179.01 177.33 3m02 h ALA 315 N 1.55 0.25 -0.20 2.92 0.00 -0.85 -2.86 119.26 120.05 3m02 h ALA 315 Ca 0.27 -0.79 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 3m02 h ALA 315 Cb -0.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3m02 h ALA 315 CO -0.06 0.88 0.08 -0.92 0.00 0.00 0.00 179.25 179.23 3m02 h TYR 316 N 0.15 0.32 -0.47 0.00 3.20 0.19 -0.01 116.97 120.35 3m02 h TYR 316 Ca -0.10 -0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.79 3m02 h TYR 316 Cb 1.75 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.88 3m02 h TYR 316 CO 0.06 0.37 0.22 1.15 -1.64 0.00 0.00 178.16 178.32 3m02 h THR 317 N 0.17 0.93 -0.60 1.81 2.02 -0.75 -0.77 112.91 115.72 3m02 h THR 317 Ca 0.07 -0.15 -0.10 0.00 0.77 0.00 0.00 66.41 67.00 3m02 h THR 317 Cb 0.19 0.46 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 3m02 h THR 317 CO -0.00 0.08 -0.00 -0.78 0.37 0.00 0.00 175.52 175.18 3m02 h ASP 318 N 0.43 1.03 -0.98 4.18 3.58 -1.31 -1.75 116.42 121.60 3m02 h ASP 318 Ca 0.21 -0.29 0.02 0.00 0.42 0.00 0.00 57.03 57.39 3m02 h ASP 318 Cb 0.15 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 40.87 3m02 h ASP 318 CO -0.17 1.08 0.65 0.00 -2.88 0.00 0.00 179.24 177.92 3m02 h ALA 319 N 1.02 1.26 -0.56 -0.78 0.00 -0.31 -1.37 119.26 118.52 3m02 h ALA 319 Ca 0.17 -0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3m02 h ALA 319 Cb 0.56 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3m02 h ALA 319 CO 0.03 0.60 -0.07 0.82 0.00 0.00 0.00 179.25 180.63 3m02 h ILE 320 N 1.30 1.27 -0.47 0.00 5.03 -0.83 -0.26 117.51 123.54 3m02 h ILE 320 Ca 0.37 -1.23 -0.04 0.00 -0.12 0.00 0.00 64.86 63.84 3m02 h ILE 320 Cb -0.10 0.92 -0.02 0.00 -3.03 0.00 0.00 36.82 34.59 3m02 h ILE 320 CO -0.09 0.44 0.13 1.56 -0.68 0.00 0.00 178.15 179.51 3m02 h GLN 321 N 0.92 0.75 -0.22 2.37 1.08 -0.76 -2.82 115.11 116.43 3m02 h GLN 321 Ca 0.15 -0.17 -0.14 0.00 -1.45 0.00 0.00 58.65 57.04 3m02 h GLN 321 Cb 0.64 -0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 3m02 h GLN 321 CO 0.04 0.72 -0.44 0.00 -0.95 0.00 0.00 178.83 178.21 3m02 h ARG 322 N 0.63 0.53 -6.05 1.46 3.08 -1.22 -3.48 114.38 109.33 3m02 h ARG 322 Ca 0.15 -0.28 -0.24 0.00 0.07 0.00 0.00 59.98 59.68 3m02 h ARG 322 Cb 0.30 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3m02 h ARG 322 CO -0.00 0.87 -0.72 1.87 -1.07 0.00 0.00 179.97 180.92 3m02 n TRP 323 N -4.01 -2.74 -3.63 3.04 -0.00 -0.12 -5.03 117.44 104.96 3m02 n TRP 323 Ca -0.02 1.10 -0.04 0.00 -0.00 0.00 0.00 57.50 58.54 3m02 n TRP 323 Cb 0.53 -3.16 -0.06 0.00 -0.00 0.00 0.00 31.31 28.62 3m02 n TRP 323 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 177.69 178.03 3m02 s ASP 324 N -2.56 -0.76 0.45 5.87 -1.08 -1.26 -5.04 116.67 112.28 3m02 s ASP 324 Ca 0.14 1.19 0.30 0.00 -0.52 0.00 0.00 52.55 53.66 3m02 s ASP 324 Cb -0.02 1.41 1.40 0.00 -1.46 0.00 0.00 42.92 44.25 3m02 s ASP 324 CO 0.83 -0.18 1.66 -0.29 0.52 0.00 0.00 175.17 177.70 3m02 h ILE 325 N 5.12 0.21 -0.05 4.11 6.09 -1.96 0.18 117.51 131.21 3m02 h ILE 325 Ca -0.27 -0.04 0.01 0.00 -1.37 0.00 0.00 64.86 63.19 3m02 h ILE 325 Cb 1.20 0.07 -0.00 0.00 0.47 0.00 0.00 36.82 38.55 3m02 h ILE 325 CO 0.16 0.02 0.39 0.78 -3.07 0.00 0.00 178.15 176.44 3m02 h ASN 326 N 0.13 0.00 1.50 2.19 2.35 -2.01 0.17 115.58 119.92 3m02 h ASN 326 Ca 0.77 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.52 3m02 h ASN 326 Cb 2.44 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.81 3m02 h ASN 326 CO -0.34 0.00 -0.22 -0.33 -1.65 0.00 0.00 177.43 174.90 3m02 h GLU 327 N 0.00 0.00 -0.99 0.81 4.39 -1.01 -3.36 114.58 114.42 3m02 h GLU 327 Ca 0.02 0.00 0.21 0.00 0.34 0.00 0.00 59.36 59.93 3m02 h GLU 327 Cb 0.81 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.36 3m02 h GLU 327 CO -0.00 0.00 0.62 0.97 -1.16 0.00 0.00 179.01 179.44 3m02 h ILE 328 N 0.00 0.66 0.00 3.13 2.10 -0.82 0.29 117.51 122.87 3m02 h ILE 328 Ca 0.00 -0.22 0.00 0.00 1.08 0.00 0.00 64.86 65.72 3m02 h ILE 328 Cb 0.86 -0.03 0.00 0.00 -1.09 0.00 0.00 36.82 36.56 3m02 h ILE 328 CO 0.00 0.12 0.00 0.44 -1.08 0.00 0.00 178.15 177.63 3m02 h ASP 329 N 0.63 0.00 0.41 2.19 3.32 -1.78 -1.88 116.42 119.32 3m02 h ASP 329 Ca 0.57 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.62 3m02 h ASP 329 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.62 3m02 h ASP 329 CO -0.34 0.00 0.00 -1.14 -1.72 0.00 0.00 179.24 176.04 3m02 n ARG 330 N -2.90 0.55 -4.30 3.56 0.63 0.10 -4.83 116.66 109.48 3m02 n ARG 330 Ca 0.00 0.01 -0.27 0.00 -0.92 0.00 0.00 57.85 56.67 3m02 n ARG 330 Cb 0.25 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 31.57 3m02 n ARG 330 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3m02 s LEU 331 N -2.43 2.96 0.79 6.15 1.43 -0.71 -4.97 118.68 121.90 3m02 s LEU 331 Ca 0.32 -0.59 -0.13 0.00 -1.03 0.00 0.00 54.13 52.70 3m02 s LEU 331 Cb 0.20 -1.64 0.07 0.00 0.03 0.00 0.00 46.19 44.85 3m02 s LEU 331 CO 0.42 0.10 1.16 -2.16 0.23 0.00 0.00 176.35 176.11 3m02 s PRO 332 N -2.85 1.85 0.27 1.29 0.04 -1.26 -4.74 135.00 129.60 3m02 s PRO 332 Ca 0.25 1.57 -0.04 0.00 0.04 0.00 0.00 61.00 62.81 3m02 s PRO 332 Cb -0.09 -1.82 0.53 0.00 0.04 0.00 0.00 34.50 33.17 3m02 s PRO 332 CO 0.15 -2.01 1.61 -0.44 0.04 0.00 0.00 177.00 176.34 3m02 h ASP 333 N -0.91 -0.45 -0.35 6.66 3.32 -1.97 -1.87 116.42 120.85 3m02 h ASP 333 Ca -0.45 0.23 -0.13 0.00 0.02 0.00 0.00 57.03 56.70 3m02 h ASP 333 Cb 1.27 0.42 -0.01 0.00 0.22 0.00 0.00 39.33 41.23 3m02 h ASP 333 CO 0.48 -0.25 -0.30 0.10 -1.72 0.00 0.00 179.24 177.55 3m02 h TYR 334 N 0.06 0.97 0.00 4.55 -0.00 -1.95 -2.35 116.97 118.26 3m02 h TYR 334 Ca 0.48 -0.28 0.00 0.00 -0.00 0.00 0.00 58.73 58.93 3m02 h TYR 334 Cb 0.88 -0.21 0.00 0.00 -0.00 0.00 0.00 36.73 37.40 3m02 h TYR 334 CO -0.48 1.06 0.00 -1.33 -0.00 0.00 0.00 178.16 177.41 3m02 n MET 335 N -4.19 0.08 0.09 0.10 2.81 -0.76 -1.29 117.12 113.96 3m02 n MET 335 Ca -0.03 0.45 -0.18 0.00 -1.81 0.00 0.00 57.70 56.14 3m02 n MET 335 Cb 0.49 -1.70 -0.10 0.00 -0.71 0.00 0.00 33.22 31.19 3m02 n MET 335 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 3m02 h LYS 336 N 0.00 0.46 0.08 0.03 1.57 -0.84 -1.51 116.57 116.35 3m02 h LYS 336 Ca 0.00 -0.61 -0.00 0.00 -1.87 0.00 0.00 60.65 58.17 3m02 h LYS 336 Cb 0.15 0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3m02 h LYS 336 CO 0.00 1.25 -0.04 0.82 -0.57 0.00 0.00 179.45 180.91 3m02 h ILE 337 N 0.20 0.99 0.48 1.86 2.04 -1.15 -0.82 117.51 121.11 3m02 h ILE 337 Ca -0.14 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.48 3m02 h ILE 337 Cb 1.83 1.13 -0.01 0.00 -0.74 0.00 0.00 36.82 39.03 3m02 h ILE 337 CO 0.21 0.05 -0.35 0.28 0.00 0.00 0.00 178.15 178.34 3m02 h SER 338 N -0.20 -0.91 -0.50 1.72 0.02 -1.57 -2.08 113.55 110.03 3m02 h SER 338 Ca -0.01 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.09 3m02 h SER 338 Cb 0.17 0.28 -0.10 0.00 0.14 0.00 0.00 62.40 62.88 3m02 h SER 338 CO 0.02 -0.50 -0.31 0.22 -1.14 0.00 0.00 176.83 175.12 3m02 h TYR 339 N -0.79 -0.83 -0.77 3.45 3.20 -1.29 -0.43 116.97 119.51 3m02 h TYR 339 Ca -0.06 0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.91 3m02 h TYR 339 Cb 0.65 0.44 -0.05 0.00 1.54 0.00 0.00 36.73 39.31 3m02 h TYR 339 CO -0.10 -0.37 0.48 -0.22 -1.64 0.00 0.00 178.16 176.32 3m02 h LYS 340 N -0.18 0.90 -0.60 1.82 3.11 -1.14 -2.09 116.57 118.39 3m02 h LYS 340 Ca 0.21 -0.05 -0.02 0.00 -2.81 0.00 0.00 60.65 57.98 3m02 h LYS 340 Cb 0.53 -0.20 -0.03 0.00 -1.00 0.00 0.00 32.23 31.53 3m02 h LYS 340 CO -0.61 0.60 0.30 0.00 -2.81 0.00 0.00 179.45 176.93 3m02 h ALA 341 N 1.34 0.78 -0.05 5.00 0.00 -0.52 -2.05 119.26 123.76 3m02 h ALA 341 Ca 0.32 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 55.12 3m02 h ALA 341 Cb 0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3m02 h ALA 341 CO -0.13 0.33 -0.06 0.82 0.00 0.00 0.00 179.25 180.21 3m02 h ILE 342 N 0.82 0.83 -0.57 0.00 2.04 -0.50 -1.36 117.51 118.78 3m02 h ILE 342 Ca 0.21 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.07 3m02 h ILE 342 Cb 0.10 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 3m02 h ILE 342 CO -0.03 0.00 0.36 -0.07 0.00 0.00 0.00 178.15 178.42 3m02 h LEU 343 N -0.08 0.67 -0.93 1.44 3.38 -1.23 -2.58 115.31 115.98 3m02 h LEU 343 Ca 0.04 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3m02 h LEU 343 Cb 0.14 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3m02 h LEU 343 CO -0.10 0.51 0.33 0.44 0.09 0.00 0.00 178.44 179.71 3m02 h ASP 344 N 0.78 1.01 0.00 -0.43 3.32 -1.18 -1.59 116.42 118.33 3m02 h ASP 344 Ca 0.21 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.15 3m02 h ASP 344 Cb -0.06 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.19 3m02 h ASP 344 CO -0.04 0.88 -0.22 0.25 -1.72 0.00 0.00 179.24 178.39 3m02 h LEU 345 N 1.09 -0.64 -1.83 1.55 5.85 -0.86 0.24 115.31 120.71 3m02 h LEU 345 Ca 0.26 0.09 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 3m02 h LEU 345 Cb 0.16 0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 3m02 h LEU 345 CO -0.03 -0.29 -0.11 1.88 -0.34 0.00 0.00 178.44 179.55 3m02 h TYR 346 N -0.35 0.00 -0.06 1.25 0.05 -1.22 0.10 116.97 116.74 3m02 h TYR 346 Ca 0.06 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.72 3m02 h TYR 346 Cb 0.42 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.15 3m02 h TYR 346 CO -0.26 0.11 -0.49 0.87 -1.05 0.00 0.00 178.16 177.35 3m02 h LYS 347 N 0.00 0.15 -0.26 4.88 1.79 -0.17 -1.89 116.57 121.07 3m02 h LYS 347 Ca -0.00 -0.08 -0.17 0.00 -2.18 0.00 0.00 60.65 58.22 3m02 h LYS 347 Cb 0.21 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 3m02 h LYS 347 CO 0.01 0.61 -0.49 -0.44 -1.08 0.00 0.00 179.45 178.07 3m02 h ASP 348 N 0.12 0.88 -0.34 0.86 3.32 0.18 -2.44 116.42 119.01 3m02 h ASP 348 Ca 0.00 -0.53 0.03 0.00 0.02 0.00 0.00 57.03 56.56 3m02 h ASP 348 Cb 0.91 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.17 3m02 h ASP 348 CO 0.07 1.25 0.13 1.88 -1.72 0.00 0.00 179.24 180.85 3m02 h TYR 349 N 0.55 0.24 -0.86 4.55 0.05 -0.93 0.60 116.97 121.17 3m02 h TYR 349 Ca 0.01 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.86 3m02 h TYR 349 Cb 1.09 -0.06 -0.05 0.00 1.01 0.00 0.00 36.73 38.72 3m02 h TYR 349 CO 0.08 0.11 0.56 0.93 -1.05 0.00 0.00 178.16 178.79 3m02 h GLU 350 N 0.29 0.98 -0.23 4.88 5.08 -1.31 -1.02 114.58 123.25 3m02 h GLU 350 Ca 0.15 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.29 3m02 h GLU 350 Cb 0.11 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 3m02 h GLU 350 CO -0.14 0.65 -0.52 -0.22 -1.00 0.00 0.00 179.01 177.78 3m02 h LYS 351 N 1.01 0.65 -0.19 2.33 1.63 -0.81 -2.63 116.57 118.57 3m02 h LYS 351 Ca 0.35 -0.39 -0.10 0.00 -0.85 0.00 0.00 60.65 59.66 3m02 h LYS 351 Cb 0.12 0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.78 3m02 h LYS 351 CO -0.12 1.01 -0.32 0.93 -3.45 0.00 0.00 179.45 177.50 3m02 h GLU 352 N 0.51 0.38 -0.00 1.90 5.08 0.01 -3.00 114.58 119.46 3m02 h GLU 352 Ca 0.02 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3m02 h GLU 352 Cb 1.07 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3m02 h GLU 352 CO 0.10 0.66 -0.35 1.28 -1.00 0.00 0.00 179.01 179.70 3m02 n LEU 353 N -4.08 0.71 -0.13 1.33 4.77 -0.48 -4.15 117.00 114.97 3m02 n LEU 353 Ca -0.01 -0.10 -0.05 0.00 -0.03 0.00 0.00 56.01 55.82 3m02 n LEU 353 Cb 0.44 -0.20 0.03 0.00 -2.33 0.00 0.00 43.42 41.36 3m02 n LEU 353 CO 0.42 0.15 0.97 0.28 -1.33 0.00 0.00 177.39 177.87 3m02 h SER 354 N 0.57 0.21 -0.85 -1.43 0.02 -1.32 0.51 113.55 111.26 3m02 h SER 354 Ca 0.00 0.04 0.21 0.00 -0.84 0.00 0.00 61.79 61.20 3m02 h SER 354 Cb 0.49 0.01 -0.15 0.00 0.14 0.00 0.00 62.40 62.89 3m02 h SER 354 CO 0.00 0.16 0.04 -1.28 -1.14 0.00 0.00 176.83 174.61 3m02 h SER 355 N 0.35 -0.34 -0.72 3.07 0.87 -1.75 0.41 113.55 115.44 3m02 h SER 355 Ca 0.19 0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.98 3m02 h SER 355 Cb 0.16 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 62.50 3m02 h SER 355 CO -0.18 -0.23 0.00 0.00 -0.53 0.00 0.00 176.83 175.89 3m02 n ALA 356 N -2.98 2.42 -3.66 6.23 0.00 -0.86 -4.97 120.51 116.69 3m02 n ALA 356 Ca 0.18 -1.27 -0.22 0.00 0.00 0.00 0.00 53.44 52.13 3m02 n ALA 356 Cb 0.59 -0.95 0.04 0.00 0.00 0.00 0.00 19.45 19.13 3m02 n ALA 356 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m02 n GLY 357 N 1.62 -0.41 0.31 0.00 0.00 0.14 -4.91 105.19 101.93 3m02 n GLY 357 Ca 0.24 0.19 0.06 0.00 0.00 0.00 0.00 46.02 46.51 3m02 n GLY 357 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3m02 n ARG 358 N -4.19 0.85 0.22 1.61 1.74 -0.30 -4.77 116.66 111.83 3m02 n ARG 358 Ca -0.27 -2.12 0.15 0.00 -0.77 0.00 0.00 57.85 54.84 3m02 n ARG 358 Cb 0.67 -1.14 0.66 0.00 -1.02 0.00 0.00 32.46 31.63 3m02 n ARG 358 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 3m02 h SER 359 N 0.12 0.00 0.64 0.55 0.02 -1.83 -2.93 113.55 110.13 3m02 h SER 359 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 3m02 h SER 359 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 3m02 h SER 359 CO 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 3m02 n HIS 360 N -2.68 0.00 0.08 3.45 1.44 -1.26 -2.65 115.22 113.60 3m02 n HIS 360 Ca 0.01 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.82 3m02 n HIS 360 Cb 0.23 -0.50 -0.03 0.00 0.12 0.00 0.00 29.99 29.81 3m02 n HIS 360 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 3m02 n ILE 361 N -1.50 0.58 -0.20 0.61 -5.35 -1.11 -4.13 119.36 108.26 3m02 n ILE 361 Ca 0.05 -0.55 0.27 0.00 -0.27 0.00 0.00 62.75 62.24 3m02 n ILE 361 Cb 0.22 -0.32 0.68 0.00 -1.74 0.00 0.00 39.64 38.48 3m02 n ILE 361 CO 0.00 0.00 0.00 0.58 -1.76 0.00 0.00 176.55 175.37 3m02 h VAL 362 N 0.00 0.57 -0.20 7.28 2.07 -1.69 -0.70 116.25 123.58 3m02 h VAL 362 Ca -0.01 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 3m02 h VAL 362 Cb 1.04 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 3m02 h VAL 362 CO 0.00 0.02 0.04 0.00 0.02 0.00 0.00 177.57 177.64 3m02 h HIS 364 N 0.28 0.55 -0.80 0.00 3.86 -1.40 0.44 115.15 118.07 3m02 h HIS 364 Ca 0.07 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.27 3m02 h HIS 364 Cb 0.14 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 28.38 3m02 h HIS 364 CO 0.00 0.36 0.41 0.00 0.86 0.00 0.00 177.93 179.56 3m02 h ALA 365 N 1.15 1.21 -0.18 2.45 0.00 -1.58 -2.49 119.26 119.83 3m02 h ALA 365 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3m02 h ALA 365 Cb -0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 3m02 h ALA 365 CO -0.03 0.62 0.06 0.82 0.00 0.00 0.00 179.25 180.71 3m02 h ILE 366 N 1.13 1.19 0.00 0.00 2.04 -0.95 -1.73 117.51 119.19 3m02 h ILE 366 Ca 0.28 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 3m02 h ILE 366 Cb 0.07 1.23 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 3m02 h ILE 366 CO -0.04 0.18 -0.06 -0.33 0.00 0.00 0.00 178.15 177.90 3m02 h GLU 367 N 0.12 0.00 -0.05 2.37 4.39 -0.78 -0.95 114.58 119.67 3m02 h GLU 367 Ca 0.06 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.60 3m02 h GLU 367 Cb 0.23 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 3m02 h GLU 367 CO -0.00 0.06 -0.67 0.00 -1.16 0.00 0.00 179.01 177.24 3m02 h ARG 368 N 0.00 0.24 -0.30 2.33 2.47 -1.10 -2.40 114.38 115.62 3m02 h ARG 368 Ca -0.00 -0.18 -0.17 0.00 -1.26 0.00 0.00 59.98 58.37 3m02 h ARG 368 Cb 0.11 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.46 3m02 h ARG 368 CO 0.01 0.82 -0.49 1.98 0.56 0.00 0.00 179.97 182.84 3m02 h MET 369 N 0.17 0.83 -0.92 0.04 4.05 -0.30 -1.94 114.93 116.86 3m02 h MET 369 Ca -0.01 -0.49 0.01 0.00 -0.28 0.00 0.00 59.70 58.93 3m02 h MET 369 Cb 1.20 0.04 -0.05 0.00 -0.80 0.00 0.00 31.60 32.00 3m02 h MET 369 CO 0.10 1.13 0.61 0.87 0.23 0.00 0.00 176.91 179.85 3m02 h LYS 370 N 0.65 1.20 -0.54 0.39 1.57 -1.19 -0.76 116.57 117.89 3m02 h LYS 370 Ca 0.03 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.71 3m02 h LYS 370 Cb 1.08 -0.27 -0.02 0.00 0.08 0.00 0.00 32.23 33.10 3m02 h LYS 370 CO 0.11 0.79 0.24 1.49 -0.57 0.00 0.00 179.45 181.52 3m02 h GLU 371 N 1.24 0.80 -0.54 3.15 4.81 -1.17 -0.62 114.58 122.23 3m02 h GLU 371 Ca 0.34 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.44 3m02 h GLU 371 Cb -0.12 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.10 3m02 h GLU 371 CO -0.08 0.67 0.30 0.28 -0.73 0.00 0.00 179.01 179.46 3m02 h VAL 372 N 0.74 1.18 -0.61 0.32 2.07 -0.54 -2.06 116.25 117.35 3m02 h VAL 372 Ca 0.18 -0.45 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 3m02 h VAL 372 Cb 0.15 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3m02 h VAL 372 CO -0.02 0.19 0.04 0.58 0.02 0.00 0.00 177.57 178.38 3m02 h VAL 373 N 0.73 1.26 -0.19 2.57 2.07 -0.87 -0.34 116.25 121.48 3m02 h VAL 373 Ca 0.19 -1.09 0.01 0.00 0.82 0.00 0.00 66.70 66.63 3m02 h VAL 373 Cb 0.04 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.55 3m02 h VAL 373 CO -0.03 0.40 0.10 0.03 0.02 0.00 0.00 177.57 178.09 3m02 h ARG 374 N 0.95 0.21 0.00 1.57 3.08 -0.90 -1.43 114.38 117.87 3m02 h ARG 374 Ca 0.18 -0.01 -0.07 0.00 0.07 0.00 0.00 59.98 60.15 3m02 h ARG 374 Cb 0.50 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3m02 h ARG 374 CO 0.02 0.14 -0.32 -0.91 -1.07 0.00 0.00 179.97 177.83 3m02 h ASN 375 N 0.22 0.00 -0.10 7.04 4.21 -1.16 -0.92 115.58 124.87 3m02 h ASN 375 Ca 0.07 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.56 3m02 h ASN 375 Cb 0.00 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.20 3m02 h ASN 375 CO -0.04 0.32 -0.02 1.88 -1.29 0.00 0.00 177.43 178.29 3m02 h TYR 376 N 0.00 0.21 -0.54 1.19 0.05 -0.68 0.13 116.97 117.33 3m02 h TYR 376 Ca -0.00 -0.04 0.06 0.00 0.05 0.00 0.00 58.73 58.79 3m02 h TYR 376 Cb 0.70 -0.05 -0.05 0.00 1.01 0.00 0.00 36.73 38.34 3m02 h TYR 376 CO 0.00 0.49 0.24 -0.97 -1.05 0.00 0.00 178.16 176.87 3m02 h ASN 377 N -0.13 0.31 -0.46 3.88 -0.73 -0.90 -0.06 115.58 117.48 3m02 h ASN 377 Ca 0.03 0.05 0.02 0.00 1.87 0.00 0.00 56.30 58.26 3m02 h ASN 377 Cb 0.42 -0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.97 3m02 h ASN 377 CO 0.01 0.21 0.28 0.58 -0.37 0.00 0.00 177.43 178.14 3m02 h VAL 378 N 0.46 1.06 -0.63 2.57 2.07 -1.06 -0.54 116.25 120.18 3m02 h VAL 378 Ca 0.25 -0.19 0.11 0.00 0.82 0.00 0.00 66.70 67.69 3m02 h VAL 378 Cb 0.22 0.45 -0.08 0.00 -1.52 0.00 0.00 31.29 30.35 3m02 h VAL 378 CO -0.21 0.10 0.18 -0.08 0.02 0.00 0.00 177.57 177.59 3m02 h GLU 379 N 0.56 0.32 -0.35 1.57 4.81 0.75 0.98 114.58 123.23 3m02 h GLU 379 Ca 0.18 -0.02 -0.14 0.00 -0.13 0.00 0.00 59.36 59.25 3m02 h GLU 379 Cb -0.00 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.30 3m02 h GLU 379 CO -0.07 0.21 -0.32 0.66 -0.73 0.00 0.00 179.01 178.76 3m02 h SER 380 N 0.33 0.88 -0.98 1.04 4.64 -0.69 -1.98 113.55 116.79 3m02 h SER 380 Ca 0.33 -0.46 0.09 0.00 -0.47 0.00 0.00 61.79 61.29 3m02 h SER 380 Cb 0.48 -0.25 -0.07 0.00 -0.31 0.00 0.00 62.40 62.25 3m02 h SER 380 CO -0.38 1.16 0.63 0.74 -0.87 0.00 0.00 176.83 178.11 3m02 h THR 381 N 0.62 1.00 -0.26 2.95 2.02 0.27 0.24 112.91 119.75 3m02 h THR 381 Ca 0.06 -0.36 -0.10 0.00 0.77 0.00 0.00 66.41 66.78 3m02 h THR 381 Cb 0.90 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 3m02 h THR 381 CO 0.08 0.19 -0.28 -0.50 0.37 0.00 0.00 175.52 175.38 3m02 h TRP 382 N 1.05 0.58 0.10 3.16 6.55 -0.68 -2.15 115.95 124.56 3m02 h TRP 382 Ca 0.45 -0.13 -0.00 0.00 0.95 0.00 0.00 58.89 60.16 3m02 h TRP 382 Cb 0.34 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 28.50 3m02 h TRP 382 CO -0.00 0.74 -0.05 0.35 -1.05 0.00 0.00 178.44 178.43 3m02 h PHE 383 N 0.45 -0.13 -0.50 0.49 3.57 -0.06 0.67 116.94 121.43 3m02 h PHE 383 Ca 0.06 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.60 3m02 h PHE 383 Cb 0.72 0.04 -0.05 0.00 2.79 0.00 0.00 35.95 39.46 3m02 h PHE 383 CO 0.03 0.12 0.25 0.82 -2.23 0.00 0.00 178.31 177.29 3m02 h ILE 384 N -0.36 0.94 0.00 1.41 1.08 -0.56 -2.05 117.51 117.97 3m02 h ILE 384 Ca -0.01 -0.17 0.00 0.00 -0.39 0.00 0.00 64.86 64.29 3m02 h ILE 384 Cb 0.30 0.42 0.00 0.00 -3.07 0.00 0.00 36.82 34.47 3m02 h ILE 384 CO 0.02 0.09 0.00 -0.62 -0.69 0.00 0.00 178.15 176.95 3m02 n GLU 385 N -4.90 0.12 -2.49 2.37 1.02 -0.82 -4.89 120.64 111.05 3m02 n GLU 385 Ca 0.04 0.16 -0.10 0.00 -0.02 0.00 0.00 57.16 57.25 3m02 n GLU 385 Cb 0.14 -1.66 0.01 0.00 -0.02 0.00 0.00 31.44 29.91 3m02 n GLU 385 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m02 n GLY 386 N 1.07 0.09 3.72 0.62 0.00 -0.52 -4.98 105.19 105.19 3m02 n GLY 386 Ca 0.05 -0.40 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 3m02 n GLY 386 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3m02 s TYR 387 N -2.73 3.72 -0.57 1.61 5.04 0.12 -4.98 117.35 119.55 3m02 s TYR 387 Ca 0.10 1.66 0.04 0.00 -2.44 0.00 0.00 57.07 56.44 3m02 s TYR 387 Cb -0.05 -3.02 0.14 0.00 0.35 0.00 0.00 41.96 39.39 3m02 s TYR 387 CO 0.13 0.13 0.33 0.99 -1.34 0.00 0.00 175.55 175.79 3m02 s THR 388 N 0.42 2.61 1.01 4.34 2.01 -1.26 -3.98 115.64 120.79 3m02 s THR 388 Ca 0.46 -3.58 -0.12 0.00 0.31 0.00 0.00 61.69 58.76 3m02 s THR 388 Cb -0.22 -2.78 0.20 0.00 0.01 0.00 0.00 72.50 69.71 3m02 s THR 388 CO 0.27 -0.87 1.08 -2.16 -0.69 0.00 0.00 174.62 172.25 3m02 s PRO 389 N -0.62 0.32 0.61 4.92 0.04 -1.26 -4.97 135.00 134.04 3m02 s PRO 389 Ca 0.20 0.67 -0.14 0.00 0.04 0.00 0.00 61.00 61.76 3m02 s PRO 389 Cb -0.19 -1.71 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 3m02 s PRO 389 CO -0.05 -2.84 1.04 -2.14 0.04 0.00 0.00 177.00 173.05 3m02 s PRO 390 N -4.85 3.34 0.23 0.56 0.02 -1.26 -4.61 135.00 128.43 3m02 s PRO 390 Ca 0.66 1.08 -0.08 0.00 0.02 0.00 0.00 61.00 62.68 3m02 s PRO 390 Cb -0.20 -2.04 0.38 0.00 0.02 0.00 0.00 34.50 32.66 3m02 s PRO 390 CO 0.59 -0.78 1.69 0.28 -0.33 0.00 0.00 177.00 178.44 3m02 h VAL 391 N 0.20 0.54 -0.26 3.83 2.07 -1.95 0.07 116.25 120.75 3m02 h VAL 391 Ca -0.46 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.03 3m02 h VAL 391 Cb 1.21 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 31.22 3m02 h VAL 391 CO 0.58 0.04 -0.04 0.77 0.02 0.00 0.00 177.57 178.95 3m02 h SER 392 N 0.23 -0.18 -0.38 0.57 4.64 -1.98 -0.12 113.55 116.33 3m02 h SER 392 Ca 0.37 0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.67 3m02 h SER 392 Cb 0.60 0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.81 3m02 h SER 392 CO -0.49 -0.06 -0.08 -0.08 -0.87 0.00 0.00 176.83 175.25 3m02 h GLU 393 N 0.03 0.81 0.09 4.77 4.81 -1.71 -1.81 114.58 121.57 3m02 h GLU 393 Ca 0.13 -0.26 0.01 0.00 -0.13 0.00 0.00 59.36 59.11 3m02 h GLU 393 Cb 0.18 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 3m02 h GLU 393 CO -0.25 0.86 -0.13 -0.92 -0.73 0.00 0.00 179.01 177.85 3m02 h TYR 394 N 0.73 -0.34 -0.20 0.92 3.20 -0.27 -2.86 116.97 118.16 3m02 h TYR 394 Ca 0.13 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 3m02 h TYR 394 Cb 0.56 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.95 3m02 h TYR 394 CO 0.03 -0.20 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.13 3m02 h LEU 395 N -0.27 0.32 -2.51 2.82 3.38 -0.92 0.56 115.31 118.70 3m02 h LEU 395 Ca 0.02 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3m02 h LEU 395 Cb 0.28 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.94 3m02 h LEU 395 CO -0.06 0.50 -0.01 0.77 0.09 0.00 0.00 178.44 179.74 3m02 h SER 396 N 0.31 0.00 0.00 -0.43 4.64 -1.10 -2.16 113.55 114.82 3m02 h SER 396 Ca 0.06 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.06 3m02 h SER 396 Cb 0.46 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.51 3m02 h SER 396 CO 0.03 0.01 -2.03 -3.20 -0.87 0.00 0.00 176.83 170.76 3m02 n ASN 397 N -3.74 1.55 0.31 4.97 5.15 -0.80 -4.68 115.26 118.01 3m02 n ASN 397 Ca -0.03 0.27 0.18 0.00 -0.60 0.00 0.00 54.58 54.40 3m02 n ASN 397 Cb 0.09 -0.64 0.99 0.00 -0.53 0.00 0.00 39.78 39.69 3m02 n ASN 397 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3m02 h ALA 398 N -0.77 1.22 -0.14 5.20 0.00 0.10 -3.01 119.26 121.85 3m02 h ALA 398 Ca -0.48 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.39 3m02 h ALA 398 Cb 1.39 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 3m02 h ALA 398 CO -0.29 0.03 0.02 -0.07 0.00 0.00 0.00 179.25 178.93 3m02 h LEU 399 N 0.00 0.23 -1.33 0.00 3.38 -1.60 -3.03 115.31 112.96 3m02 h LEU 399 Ca -0.00 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 3m02 h LEU 399 Cb 0.11 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3m02 h LEU 399 CO 0.00 0.44 -0.32 0.00 0.09 0.00 0.00 178.44 178.66 3m02 h ALA 400 N 0.79 1.27 0.00 1.53 0.00 -1.78 -2.71 119.26 118.37 3m02 h ALA 400 Ca 0.04 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.66 3m02 h ALA 400 Cb 0.32 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3m02 h ALA 400 CO 0.00 0.40 0.00 0.25 0.00 0.00 0.00 179.25 179.90 3m02 n THR 401 N -3.87 0.00 0.22 0.00 -2.24 -1.14 -0.66 114.28 106.58 3m02 n THR 401 Ca -0.01 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 61.88 3m02 n THR 401 Cb 0.39 -0.70 0.20 0.00 -2.10 0.00 0.00 70.33 68.12 3m02 n THR 401 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3m02 h THR 402 N 0.00 0.11 0.00 4.28 1.35 -1.54 -3.47 112.91 113.64 3m02 h THR 402 Ca 0.00 -1.10 0.00 0.00 -0.55 0.00 0.00 66.41 64.76 3m02 h THR 402 Cb 0.00 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 3m02 h THR 402 CO 0.00 0.06 0.00 0.35 -0.25 0.00 0.00 175.52 175.68 3m02 n THR 403 N -3.12 0.00 -0.22 6.82 -2.24 0.17 -4.93 114.28 110.75 3m02 n THR 403 Ca 0.03 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.74 3m02 n THR 403 Cb 0.53 -0.17 0.03 0.00 -2.10 0.00 0.00 70.33 68.62 3m02 n THR 403 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 3m02 h TYR 404 N 0.00 1.06 -0.75 4.78 -1.99 -1.82 0.35 116.97 118.59 3m02 h TYR 404 Ca 0.00 -0.13 0.04 0.00 2.00 0.00 0.00 58.73 60.64 3m02 h TYR 404 Cb 0.13 -0.30 -0.05 0.00 2.00 0.00 0.00 36.73 38.51 3m02 h TYR 404 CO 0.08 0.88 0.47 1.88 -0.00 0.00 0.00 178.16 181.47 3m02 h TYR 405 N 0.93 0.87 -0.22 4.88 0.05 -1.88 0.52 116.97 122.13 3m02 h TYR 405 Ca 0.20 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.99 3m02 h TYR 405 Cb 0.36 -0.28 -0.01 0.00 1.01 0.00 0.00 36.73 37.80 3m02 h TYR 405 CO 0.03 0.48 0.09 -0.92 -1.05 0.00 0.00 178.16 176.79 3m02 h TYR 406 N 0.90 0.32 -0.35 4.88 3.20 -1.72 -1.25 116.97 122.95 3m02 h TYR 406 Ca 0.31 -0.02 -0.13 0.00 3.14 0.00 0.00 58.73 62.03 3m02 h TYR 406 Cb 0.06 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 3m02 h TYR 406 CO -0.04 0.35 -0.30 -0.07 -1.64 0.00 0.00 178.16 176.46 3m02 h LEU 407 N 0.20 0.78 -0.21 2.82 3.38 0.05 0.29 115.31 122.61 3m02 h LEU 407 Ca 0.07 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.73 3m02 h LEU 407 Cb 0.16 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 3m02 h LEU 407 CO -0.01 1.03 0.11 0.00 0.09 0.00 0.00 178.44 179.66 3m02 h ALA 408 N 1.02 0.27 -0.50 1.53 0.00 -0.82 0.17 119.26 120.93 3m02 h ALA 408 Ca 0.07 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.92 3m02 h ALA 408 Cb 0.83 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3m02 h ALA 408 CO 0.07 -0.19 0.33 1.15 0.00 0.00 0.00 179.25 180.62 3m02 h THR 409 N 0.23 1.13 -1.01 0.00 2.02 -1.07 -2.65 112.91 111.57 3m02 h THR 409 Ca 0.07 -0.23 0.02 0.00 0.77 0.00 0.00 66.41 67.04 3m02 h THR 409 Cb 0.08 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 66.83 3m02 h THR 409 CO -0.01 0.12 0.66 0.74 0.37 0.00 0.00 175.52 177.41 3m02 h THR 410 N 0.68 1.23 0.00 3.16 2.02 -0.40 -2.57 112.91 117.03 3m02 h THR 410 Ca 0.18 -0.46 -0.00 0.00 0.77 0.00 0.00 66.41 66.91 3m02 h THR 410 Cb -0.08 -0.22 -0.00 0.00 -1.74 0.00 0.00 68.15 66.11 3m02 h THR 410 CO -0.04 0.24 -0.00 0.77 0.37 0.00 0.00 175.52 176.86 3m02 h SER 411 N 1.34 0.00 0.86 4.18 4.64 -0.30 -2.01 113.55 122.26 3m02 h SER 411 Ca 0.38 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 61.48 3m02 h SER 411 Cb -0.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 61.96 3m02 h SER 411 CO -0.09 0.00 -1.00 1.88 -0.87 0.00 0.00 176.83 176.75 3m02 h TYR 412 N 0.00 0.12 -0.84 4.77 -1.99 -1.47 -3.38 116.97 114.18 3m02 h TYR 412 Ca -0.00 -0.08 0.15 0.00 2.00 0.00 0.00 58.73 60.79 3m02 h TYR 412 Cb 0.06 -0.01 -0.15 0.00 2.00 0.00 0.00 36.73 38.63 3m02 h TYR 412 CO 0.00 1.02 -0.31 -0.07 -0.00 0.00 0.00 178.16 178.80 3m02 h LEU 413 N 0.03 -1.14 -0.24 3.88 3.38 -1.45 0.48 115.31 120.25 3m02 h LEU 413 Ca -0.04 0.27 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3m02 h LEU 413 Cb 1.73 0.63 0.00 0.00 0.09 0.00 0.00 40.66 43.11 3m02 h LEU 413 CO 0.14 -0.29 -0.07 0.61 0.09 0.00 0.00 178.44 178.92 3m02 n GLY 414 N -1.49 -0.89 3.56 0.83 0.00 -1.26 -4.75 105.19 101.19 3m02 n GLY 414 Ca 0.09 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3m02 n GLY 414 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3m02 s MET 415 N -2.35 3.43 0.35 1.61 -1.94 0.16 -3.88 119.30 116.67 3m02 s MET 415 Ca 0.33 0.08 0.16 0.00 -1.71 0.00 0.00 55.69 54.55 3m02 s MET 415 Cb 0.20 -4.05 1.18 0.00 2.01 0.00 0.00 34.83 34.17 3m02 s MET 415 CO 0.44 -1.73 1.54 1.63 -0.01 0.00 0.00 175.02 176.89 3m02 n LYS 416 N 8.44 -0.06 0.00 2.03 4.01 -1.26 -0.45 118.16 130.86 3m02 n LYS 416 Ca 0.06 1.37 0.14 0.00 -0.51 0.00 0.00 58.31 59.38 3m02 n LYS 416 Cb 0.49 -2.40 0.69 0.00 -0.51 0.00 0.00 35.03 33.30 3m02 n LYS 416 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 3m02 n SER 417 N -5.27 0.11 -4.71 4.39 7.64 -1.26 -4.88 113.62 109.63 3m02 n SER 417 Ca 0.34 -0.10 -0.42 0.00 1.01 0.00 0.00 58.87 59.70 3m02 n SER 417 Cb 1.13 -0.27 -0.03 0.00 -1.01 0.00 0.00 64.21 64.04 3m02 n SER 417 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3m02 s ALA 418 N -2.66 3.73 0.40 -0.43 0.00 0.41 -5.01 121.76 118.20 3m02 s ALA 418 Ca 0.25 1.29 0.08 0.00 0.00 0.00 0.00 51.96 53.57 3m02 s ALA 418 Cb 0.20 -3.63 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 3m02 s ALA 418 CO 0.49 -0.84 0.16 0.95 0.00 0.00 0.00 175.76 176.51 3m02 s THR 419 N 1.55 2.43 0.38 0.00 -4.23 -1.26 -5.01 115.64 109.49 3m02 s THR 419 Ca 0.70 -1.73 0.08 0.00 -1.18 0.00 0.00 61.69 59.56 3m02 s THR 419 Cb -0.42 -2.97 0.30 0.00 1.34 0.00 0.00 72.50 70.75 3m02 s THR 419 CO 0.31 -0.05 1.95 -0.33 -0.54 0.00 0.00 174.62 175.97 3m02 h GLU 420 N 1.49 0.65 -0.55 3.99 4.39 -1.99 -1.52 114.58 121.02 3m02 h GLU 420 Ca -0.43 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.22 3m02 h GLU 420 Cb 1.25 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.73 3m02 h GLU 420 CO 0.69 0.43 0.30 1.96 -1.16 0.00 0.00 179.01 181.23 3m02 h GLN 421 N 0.67 0.77 -0.53 2.33 7.50 -1.98 0.12 115.11 123.99 3m02 h GLN 421 Ca 0.32 -0.09 0.01 0.00 0.50 0.00 0.00 58.65 59.39 3m02 h GLN 421 Cb 0.37 -0.15 -0.03 0.00 0.05 0.00 0.00 27.48 27.72 3m02 h GLN 421 CO -0.11 0.59 0.34 -0.44 -1.50 0.00 0.00 178.83 177.72 3m02 h ASP 422 N 0.74 0.57 0.09 1.46 3.32 -1.69 0.26 116.42 121.18 3m02 h ASP 422 Ca 0.19 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.15 3m02 h ASP 422 Cb 0.05 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3m02 h ASP 422 CO -0.03 0.41 -0.29 -0.26 -1.72 0.00 0.00 179.24 177.35 3m02 h PHE 423 N 0.68 0.35 -0.32 4.55 0.04 -1.01 -1.76 116.94 119.47 3m02 h PHE 423 Ca 0.20 -0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.82 3m02 h PHE 423 Cb -0.04 -0.09 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 3m02 h PHE 423 CO -0.05 0.58 -0.09 1.49 -0.60 0.00 0.00 178.31 179.64 3m02 h GLU 424 N 0.28 0.63 -0.74 1.51 4.57 -0.08 0.12 114.58 120.86 3m02 h GLU 424 Ca 0.04 -0.25 0.00 0.00 -1.18 0.00 0.00 59.36 57.97 3m02 h GLU 424 Cb 0.66 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.18 3m02 h GLU 424 CO 0.05 0.81 0.46 2.35 -1.18 0.00 0.00 179.01 181.51 3m02 h TRP 425 N 0.40 0.96 -0.23 0.92 7.01 -0.73 -2.42 115.95 121.86 3m02 h TRP 425 Ca 0.08 0.01 -0.10 0.00 2.11 0.00 0.00 58.89 60.98 3m02 h TRP 425 Cb 0.59 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.32 3m02 h TRP 425 CO 0.05 0.63 -0.29 1.25 -2.79 0.00 0.00 178.44 177.29 3m02 h LEU 426 N 1.01 0.47 -2.20 0.65 5.85 -1.07 -2.81 115.31 117.20 3m02 h LEU 426 Ca 0.27 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3m02 h LEU 426 Cb -0.07 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.84 3m02 h LEU 426 CO -0.05 0.75 0.00 0.77 -0.34 0.00 0.00 178.44 179.56 3m02 h SER 427 N 0.40 0.00 -0.15 1.25 4.64 -0.25 -2.05 113.55 117.39 3m02 h SER 427 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3m02 h SER 427 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 3m02 h SER 427 CO 0.06 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.31 3m02 n LYS 428 N -3.05 1.53 -3.33 4.77 5.02 -1.06 -4.94 118.16 117.10 3m02 n LYS 428 Ca -0.01 -0.80 -0.17 0.00 -2.02 0.00 0.00 58.31 55.30 3m02 n LYS 428 Cb 0.18 -1.32 0.06 0.00 -0.02 0.00 0.00 35.03 33.93 3m02 n LYS 428 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3m02 n ASN 429 N 0.05 -6.47 -4.64 4.39 4.13 -0.77 -4.93 115.26 107.02 3m02 n ASN 429 Ca 0.13 -0.72 -0.35 0.00 1.68 0.00 0.00 54.58 55.32 3m02 n ASN 429 Cb 0.24 -4.81 0.10 0.00 -1.54 0.00 0.00 39.78 33.77 3m02 n ASN 429 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 3m02 n PRO 430 N -3.29 0.45 -0.35 3.52 -0.04 -1.26 -4.65 135.00 129.37 3m02 n PRO 430 Ca -0.07 0.21 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 3m02 n PRO 430 Cb 0.60 -2.30 0.31 0.00 -0.04 0.00 0.00 33.50 32.08 3m02 n PRO 430 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3m02 h LYS 431 N -0.41 0.77 -0.72 0.54 3.64 -1.97 -1.13 116.57 117.30 3m02 h LYS 431 Ca -0.47 -0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 58.83 3m02 h LYS 431 Cb 1.32 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.94 3m02 h LYS 431 CO 0.47 0.51 0.32 0.97 -2.27 0.00 0.00 179.45 179.44 3m02 h ILE 432 N 0.79 1.24 -0.12 2.00 2.10 -1.90 -1.19 117.51 120.44 3m02 h ILE 432 Ca 0.57 -0.70 -0.21 0.00 1.08 0.00 0.00 64.86 65.61 3m02 h ILE 432 Cb 0.86 0.35 0.00 0.00 -1.09 0.00 0.00 36.82 36.94 3m02 h ILE 432 CO -0.37 0.29 -0.76 0.25 -1.08 0.00 0.00 178.15 176.48 3m02 h LEU 433 N 1.03 0.73 -0.33 2.19 5.85 -1.59 -2.69 115.31 120.50 3m02 h LEU 433 Ca 0.25 -0.48 -0.01 0.00 0.84 0.00 0.00 57.88 58.47 3m02 h LEU 433 Cb 0.15 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.95 3m02 h LEU 433 CO -0.03 1.26 0.17 -0.08 -0.34 0.00 0.00 178.44 179.42 3m02 h GLU 434 N 0.42 0.47 -0.51 1.25 4.57 -1.04 -1.21 114.58 118.53 3m02 h GLU 434 Ca -0.04 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.11 3m02 h GLU 434 Cb 1.37 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.83 3m02 h GLU 434 CO 0.15 0.42 0.27 0.00 -1.18 0.00 0.00 179.01 178.66 3m02 h ALA 435 N 1.03 0.65 -0.79 2.92 0.00 -1.20 0.44 119.26 122.30 3m02 h ALA 435 Ca 0.11 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3m02 h ALA 435 Cb 0.10 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3m02 h ALA 435 CO -0.02 -0.07 0.52 1.03 0.00 0.00 0.00 179.25 180.71 3m02 h SER 436 N 0.52 0.90 -0.40 0.00 0.87 -1.16 -1.35 113.55 112.94 3m02 h SER 436 Ca 0.22 -0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.73 3m02 h SER 436 Cb 0.12 -0.22 -0.02 0.00 -0.44 0.00 0.00 62.40 61.84 3m02 h SER 436 CO -0.15 0.65 0.14 0.58 -0.53 0.00 0.00 176.83 177.52 3m02 h VAL 437 N 1.06 1.21 -0.50 2.23 2.07 -0.40 -2.62 116.25 119.31 3m02 h VAL 437 Ca 0.29 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 67.16 3m02 h VAL 437 Cb -0.11 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 3m02 h VAL 437 CO -0.07 0.24 0.32 0.40 0.02 0.00 0.00 177.57 178.48 3m02 h ILE 438 N 0.50 1.10 -0.49 4.57 2.04 -0.59 -0.97 117.51 123.67 3m02 h ILE 438 Ca 0.13 -0.22 0.04 0.00 1.00 0.00 0.00 64.86 65.81 3m02 h ILE 438 Cb 0.23 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.67 3m02 h ILE 438 CO -0.01 0.12 0.25 0.40 0.00 0.00 0.00 178.15 178.91 3m02 h ILE 439 N 0.65 0.97 0.17 -0.67 2.04 -1.13 0.33 117.51 119.88 3m02 h ILE 439 Ca 0.19 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 3m02 h ILE 439 Cb -0.05 0.43 0.00 0.00 -0.74 0.00 0.00 36.82 36.47 3m02 h ILE 439 CO -0.06 0.09 -0.08 0.00 0.00 0.00 0.00 178.15 178.10 3m02 h ARG 441 N -0.36 -0.88 -0.75 0.00 9.65 -0.84 -0.80 114.38 120.40 3m02 h ARG 441 Ca -0.02 0.06 0.01 0.00 -1.10 0.00 0.00 59.98 58.92 3m02 h ARG 441 Cb 0.28 0.20 -0.04 0.00 -1.39 0.00 0.00 29.97 29.02 3m02 h ARG 441 CO 0.04 -0.59 0.50 0.28 2.80 0.00 0.00 179.97 183.00 3m02 h VAL 442 N -0.91 1.20 -0.46 0.20 2.07 -0.38 -0.57 116.25 117.40 3m02 h VAL 442 Ca -0.05 -0.36 -0.13 0.00 0.82 0.00 0.00 66.70 66.97 3m02 h VAL 442 Cb 0.79 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3m02 h VAL 442 CO -0.03 0.19 -0.24 0.40 0.02 0.00 0.00 177.57 177.91 3m02 h ILE 443 N 1.02 1.27 -0.08 4.57 5.03 -1.05 -2.37 117.51 125.90 3m02 h ILE 443 Ca 0.28 -1.40 -0.00 0.00 -0.12 0.00 0.00 64.86 63.61 3m02 h ILE 443 Cb -0.11 1.16 -0.00 0.00 -3.03 0.00 0.00 36.82 34.83 3m02 h ILE 443 CO -0.06 0.48 0.03 -0.78 -0.68 0.00 0.00 178.15 177.15 3m02 h ASP 444 N 0.83 0.11 -0.57 1.72 1.82 -0.87 -1.83 116.42 117.63 3m02 h ASP 444 Ca 0.10 -0.15 0.08 0.00 -0.39 0.00 0.00 57.03 56.68 3m02 h ASP 444 Cb 0.81 -0.03 -0.03 0.00 0.68 0.00 0.00 39.33 40.76 3m02 h ASP 444 CO 0.07 0.23 0.38 0.44 -1.61 0.00 0.00 179.24 178.75 3m02 h ASP 445 N -0.02 0.39 -0.19 2.28 5.19 -1.04 0.65 116.42 123.68 3m02 h ASP 445 Ca 0.03 0.01 -0.21 0.00 -0.62 0.00 0.00 57.03 56.24 3m02 h ASP 445 Cb 0.15 -0.08 0.01 0.00 0.18 0.00 0.00 39.33 39.59 3m02 h ASP 445 CO -0.00 0.24 -0.67 0.74 -3.12 0.00 0.00 179.24 176.43 3m02 h THR 446 N 0.44 1.28 0.09 0.35 2.02 -1.15 -2.51 112.91 113.43 3m02 h THR 446 Ca 0.26 -1.87 -0.27 0.00 0.77 0.00 0.00 66.41 65.30 3m02 h THR 446 Cb 0.44 1.83 0.01 0.00 -1.74 0.00 0.00 68.15 68.69 3m02 h THR 446 CO -0.07 0.60 -1.16 0.00 0.37 0.00 0.00 175.52 175.26 3m02 h ALA 447 N 0.64 0.14 -0.65 6.16 0.00 -0.37 -3.34 119.26 121.84 3m02 h ALA 447 Ca -0.02 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.10 3m02 h ALA 447 Cb 1.29 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3m02 h ALA 447 CO 0.14 0.82 0.00 0.25 0.00 0.00 0.00 179.25 180.46 3m02 n THR 448 N -3.69 1.59 0.47 0.00 -2.24 0.21 -4.49 114.28 106.14 3m02 n THR 448 Ca -0.10 -1.16 -0.20 0.00 -2.27 0.00 0.00 64.05 60.33 3m02 n THR 448 Cb 0.96 0.24 -0.10 0.00 -2.10 0.00 0.00 70.33 69.32 3m02 n THR 448 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 3m02 h TYR 449 N 4.01 -1.26 -0.43 4.78 3.20 -1.57 -2.43 116.97 123.28 3m02 h TYR 449 Ca 0.00 -0.02 0.06 0.00 3.14 0.00 0.00 58.73 61.91 3m02 h TYR 449 Cb 1.30 0.43 -0.09 0.00 1.54 0.00 0.00 36.73 39.92 3m02 h TYR 449 CO 0.67 -0.74 -0.53 0.93 -1.64 0.00 0.00 178.16 176.85 3m02 h GLU 450 N -1.25 -0.36 0.38 1.82 4.39 -1.86 0.19 114.58 117.89 3m02 h GLU 450 Ca -0.12 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 3m02 h GLU 450 Cb 0.98 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 3m02 h GLU 450 CO 0.16 -0.24 -0.42 0.28 -1.16 0.00 0.00 179.01 177.63 3m02 h VAL 451 N -0.37 0.00 -0.92 3.13 2.07 -1.88 -1.12 116.25 117.16 3m02 h VAL 451 Ca 0.09 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.77 3m02 h VAL 451 Cb 0.59 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.29 3m02 h VAL 451 CO -0.60 0.00 0.59 -0.33 0.02 0.00 0.00 177.57 177.25 3m02 h GLU 452 N -0.81 0.68 -0.50 1.57 5.08 -1.28 0.55 114.58 119.87 3m02 h GLU 452 Ca -0.05 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.24 3m02 h GLU 452 Cb 0.72 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 3m02 h GLU 452 CO -0.07 0.45 0.18 -0.22 -1.00 0.00 0.00 179.01 178.35 3m02 h LYS 453 N 0.71 0.73 -0.24 2.33 1.63 -0.16 -1.48 116.57 120.08 3m02 h LYS 453 Ca 0.47 -0.11 0.00 0.00 -0.85 0.00 0.00 60.65 60.16 3m02 h LYS 453 Cb 0.77 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.27 3m02 h LYS 453 CO -0.23 0.61 0.00 0.43 -3.45 0.00 0.00 179.45 176.81 3m02 n SER 454 N -4.33 1.14 0.00 4.20 7.64 0.16 -3.04 113.62 119.39 3m02 n SER 454 Ca 0.04 -2.02 0.00 0.00 1.01 0.00 0.00 58.87 57.90 3m02 n SER 454 Cb 0.17 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 3m02 n SER 454 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3m02 n ARG 455 N 0.09 2.18 -0.86 1.43 1.74 -0.73 -4.98 116.66 115.54 3m02 n ARG 455 Ca 0.07 -1.26 0.00 0.00 -0.77 0.00 0.00 57.85 55.89 3m02 n ARG 455 Cb 0.19 -0.94 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 3m02 n ARG 455 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m02 n GLY 456 N -0.38 0.82 2.89 -0.13 0.00 -1.17 -4.94 105.19 102.28 3m02 n GLY 456 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3m02 n GLY 456 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m02 n GLN 457 N -2.25 2.49 0.00 1.61 6.02 -0.64 -4.63 117.38 119.98 3m02 n GLN 457 Ca 0.00 -2.43 0.09 0.00 -0.01 0.00 0.00 57.00 54.65 3m02 n GLN 457 Cb 0.00 -3.21 0.49 0.00 1.02 0.00 0.00 30.24 28.54 3m02 n GLN 457 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 3m02 n ILE 458 N 5.46 0.34 -0.26 5.09 -0.00 -1.26 -2.28 119.36 126.45 3m02 n ILE 458 Ca 0.51 0.09 -0.00 0.00 -0.00 0.00 0.00 62.75 63.35 3m02 n ILE 458 Cb 0.40 -0.78 0.23 0.00 -0.00 0.00 0.00 39.64 39.48 3m02 n ILE 458 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3m02 n ALA 459 N -1.22 3.65 -1.98 -1.28 0.00 -1.26 -4.48 120.51 113.94 3m02 n ALA 459 Ca 0.10 -1.37 -0.36 0.00 0.00 0.00 0.00 53.44 51.81 3m02 n ALA 459 Cb 0.13 -1.13 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 3m02 n ALA 459 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3m02 s THR 460 N -2.13 4.45 0.10 0.00 -1.32 -0.97 -4.89 115.64 110.88 3m02 s THR 460 Ca 0.35 1.45 -0.20 0.00 -1.21 0.00 0.00 61.69 62.09 3m02 s THR 460 Cb 0.28 -3.88 -0.05 0.00 -1.51 0.00 0.00 72.50 67.34 3m02 s THR 460 CO 0.09 0.13 1.20 0.61 -2.21 0.00 0.00 174.62 174.44 3m02 n GLY 461 N 0.51 -2.30 0.36 6.08 0.00 -1.26 -1.20 105.19 107.38 3m02 n GLY 461 Ca 0.00 0.89 0.04 0.00 0.00 0.00 0.00 46.02 46.95 3m02 n GLY 461 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3m02 h ILE 462 N 0.00 1.06 0.79 -0.61 1.08 -1.95 -1.51 117.51 116.37 3m02 h ILE 462 Ca 0.10 -0.33 -0.03 0.00 -0.39 0.00 0.00 64.86 64.21 3m02 h ILE 462 Cb 0.27 -0.00 -0.00 0.00 -3.07 0.00 0.00 36.82 34.01 3m02 h ILE 462 CO -0.61 0.18 -0.50 -0.08 -0.69 0.00 0.00 178.15 176.45 3m02 h GLU 463 N 0.98 -1.17 -0.94 2.37 4.57 -1.47 -0.26 114.58 118.66 3m02 h GLU 463 Ca 0.37 0.08 0.19 0.00 -1.18 0.00 0.00 59.36 58.82 3m02 h GLU 463 Cb 0.20 0.26 -0.11 0.00 -0.16 0.00 0.00 28.75 28.95 3m02 h GLU 463 CO -0.14 -0.78 0.52 0.00 -1.18 0.00 0.00 179.01 177.43 3m02 h MET 466 N 0.57 -0.70 -0.15 0.00 2.07 0.51 -0.89 114.93 116.35 3m02 h MET 466 Ca 0.15 0.05 0.02 0.00 -2.07 0.00 0.00 59.70 57.84 3m02 h MET 466 Cb 0.21 0.16 -0.02 0.00 -1.87 0.00 0.00 31.60 30.08 3m02 h MET 466 CO -0.01 -0.41 0.02 -0.09 1.07 0.00 0.00 176.91 177.49 3m02 h ARG 467 N -0.88 0.08 0.27 1.72 2.43 -1.27 1.48 114.38 118.21 3m02 h ARG 467 Ca -0.07 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 3m02 h ARG 467 Cb 0.61 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.11 3m02 h ARG 467 CO 0.12 0.05 -0.52 0.22 -1.51 0.00 0.00 179.97 178.34 3m02 h ASP 468 N 0.08 -1.51 1.19 -3.80 1.82 -0.64 -3.02 116.42 110.54 3m02 h ASP 468 Ca 0.07 0.14 0.00 0.00 -0.39 0.00 0.00 57.03 56.85 3m02 h ASP 468 Cb 0.07 0.54 0.00 0.00 0.68 0.00 0.00 39.33 40.61 3m02 h ASP 468 CO -0.10 -0.60 -0.31 -1.22 -1.61 0.00 0.00 179.24 175.40 3m02 n TYR 469 N -5.47 0.77 -2.80 0.28 4.02 -0.34 -4.97 117.16 108.65 3m02 n TYR 469 Ca -0.10 0.22 -0.10 0.00 -0.01 0.00 0.00 57.90 57.92 3m02 n TYR 469 Cb 0.43 -0.81 0.05 0.00 -0.02 0.00 0.00 39.34 38.99 3m02 n TYR 469 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3m02 n GLY 470 N 1.32 -0.10 3.17 2.72 0.00 0.50 -5.05 105.19 107.75 3m02 n GLY 470 Ca 0.04 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 3m02 n GLY 470 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3m02 s ILE 471 N -3.22 0.77 0.97 -0.61 -5.25 -0.92 -5.04 121.20 107.90 3m02 s ILE 471 Ca 0.06 -1.85 -0.11 0.00 -0.99 0.00 0.00 60.65 57.76 3m02 s ILE 471 Cb -0.01 -1.58 0.17 0.00 2.95 0.00 0.00 42.46 44.00 3m02 s ILE 471 CO 0.44 -0.78 1.10 -0.94 -1.79 0.00 0.00 174.94 172.97 3m02 s SER 472 N -2.88 2.57 0.48 4.36 1.04 -1.26 -4.49 113.70 113.53 3m02 s SER 472 Ca 0.10 1.90 0.16 0.00 0.48 0.00 0.00 55.95 58.59 3m02 s SER 472 Cb 0.03 -2.45 1.17 0.00 0.10 0.00 0.00 66.02 64.87 3m02 s SER 472 CO -0.03 -3.27 2.04 0.74 0.98 0.00 0.00 173.24 173.70 3m02 h THR 473 N -1.98 0.91 -0.01 2.02 2.02 -1.98 -0.30 112.91 113.57 3m02 h THR 473 Ca -0.49 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 3m02 h THR 473 Cb 1.28 0.68 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 3m02 h THR 473 CO 0.46 0.04 -0.01 0.50 0.37 0.00 0.00 175.52 176.88 3m02 h LYS 474 N 0.21 0.03 -0.21 6.66 3.64 -1.99 -1.22 116.57 123.70 3m02 h LYS 474 Ca 0.18 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.50 3m02 h LYS 474 Cb 0.43 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.24 3m02 h LYS 474 CO -0.03 0.46 -0.04 0.93 -2.27 0.00 0.00 179.45 178.50 3m02 h GLU 475 N -0.40 0.31 -0.35 1.90 5.08 -1.72 -0.55 114.58 118.85 3m02 h GLU 475 Ca 0.00 -0.06 -0.11 0.00 -1.00 0.00 0.00 59.36 58.20 3m02 h GLU 475 Cb 0.46 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 3m02 h GLU 475 CO 0.00 0.38 -0.21 0.00 -1.00 0.00 0.00 179.01 178.18 3m02 h ALA 476 N 1.66 0.49 -0.05 3.43 0.00 -0.95 -0.11 119.26 123.73 3m02 h ALA 476 Ca 0.07 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.47 3m02 h ALA 476 Cb 0.28 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 3m02 h ALA 476 CO 0.01 0.45 -0.59 0.52 0.00 0.00 0.00 179.25 179.64 3m02 h MET 477 N 0.53 0.18 -0.33 0.00 2.86 -0.86 -1.60 114.93 115.71 3m02 h MET 477 Ca 0.07 -0.12 -0.11 0.00 -2.06 0.00 0.00 59.70 57.48 3m02 h MET 477 Cb 0.76 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 3m02 h MET 477 CO 0.06 0.72 -0.23 0.00 1.06 0.00 0.00 176.91 178.52 3m02 h ALA 478 N 1.25 0.98 -0.58 6.32 0.00 -0.92 -0.74 119.26 125.56 3m02 h ALA 478 Ca -0.01 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.47 3m02 h ALA 478 Cb 1.08 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.71 3m02 h ALA 478 CO 0.09 0.60 0.07 -0.22 0.00 0.00 0.00 179.25 179.78 3m02 h LYS 479 N 0.56 0.99 0.00 0.00 3.64 -0.67 -2.45 116.57 118.64 3m02 h LYS 479 Ca 0.08 -0.28 -0.07 0.00 -1.27 0.00 0.00 60.65 59.11 3m02 h LYS 479 Cb 0.70 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3m02 h LYS 479 CO 0.05 0.95 -0.34 0.74 -2.27 0.00 0.00 179.45 178.58 3m02 h PHE 480 N 0.88 0.00 -0.43 1.91 -1.00 -0.81 -2.82 116.94 114.67 3m02 h PHE 480 Ca 0.17 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.84 3m02 h PHE 480 Cb 0.46 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.01 3m02 h PHE 480 CO 0.03 0.34 -0.19 1.96 -1.61 0.00 0.00 178.31 178.84 3m02 h GLN 481 N 0.00 0.88 0.00 1.51 1.08 -0.68 -1.95 115.11 115.95 3m02 h GLN 481 Ca -0.00 -0.38 -0.04 0.00 -1.45 0.00 0.00 58.65 56.78 3m02 h GLN 481 Cb 0.66 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 28.06 3m02 h GLN 481 CO 0.04 1.03 -0.19 -0.91 -0.95 0.00 0.00 178.83 177.85 3m02 h ASN 482 N 0.71 0.00 -0.12 1.46 2.35 -1.31 0.11 115.58 118.78 3m02 h ASN 482 Ca 0.10 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.76 3m02 h ASN 482 Cb 0.75 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.12 3m02 h ASN 482 CO 0.06 0.19 -0.26 0.24 -1.65 0.00 0.00 177.43 176.00 3m02 h MET 483 N 0.00 0.39 -0.85 0.81 2.86 -1.23 0.12 114.93 117.03 3m02 h MET 483 Ca -0.00 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.37 3m02 h MET 483 Cb 0.55 0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.21 3m02 h MET 483 CO 0.02 0.87 0.48 0.00 1.06 0.00 0.00 176.91 179.34 3m02 h ALA 484 N 0.52 1.24 -0.13 6.32 0.00 -0.73 0.15 119.26 126.63 3m02 h ALA 484 Ca 0.00 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3m02 h ALA 484 Cb 0.86 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3m02 h ALA 484 CO 0.06 0.62 0.01 1.49 0.00 0.00 0.00 179.25 181.43 3m02 h GLU 485 N 1.18 0.23 -0.68 0.00 4.81 -0.65 -0.66 114.58 118.80 3m02 h GLU 485 Ca 0.30 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 3m02 h GLU 485 Cb 0.00 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 3m02 h GLU 485 CO -0.05 0.45 0.43 1.15 -0.73 0.00 0.00 179.01 180.26 3m02 h THR 486 N -0.02 1.19 -0.76 0.32 2.02 -0.48 -1.89 112.91 113.29 3m02 h THR 486 Ca 0.04 -0.39 0.02 0.00 0.77 0.00 0.00 66.41 66.85 3m02 h THR 486 Cb 0.34 0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.93 3m02 h THR 486 CO 0.01 0.19 0.50 0.00 0.37 0.00 0.00 175.52 176.58 3m02 h ALA 487 N 1.23 0.97 -0.77 6.16 0.00 -0.49 -0.67 119.26 125.70 3m02 h ALA 487 Ca 0.25 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 3m02 h ALA 487 Cb -0.06 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 3m02 h ALA 487 CO -0.05 0.35 0.32 -1.49 0.00 0.00 0.00 179.25 178.38 3m02 h TRP 488 N 1.00 1.16 -0.87 0.00 4.06 -0.58 -0.27 115.95 120.44 3m02 h TRP 488 Ca 0.29 -0.08 -0.02 0.00 2.06 0.00 0.00 58.89 61.14 3m02 h TRP 488 Cb -0.08 -0.35 -0.04 0.00 -1.00 0.00 0.00 29.16 27.69 3m02 h TRP 488 CO -0.02 0.87 0.47 0.87 -3.56 0.00 0.00 178.44 177.07 3m02 h LYS 489 N 1.12 1.22 -0.48 0.49 1.57 -0.58 -1.20 116.57 118.72 3m02 h LYS 489 Ca 0.26 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 3m02 h LYS 489 Cb 0.19 -0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3m02 h LYS 489 CO -0.02 0.90 0.19 -0.44 -0.57 0.00 0.00 179.45 179.51 3m02 h ASP 490 N 1.22 0.66 -0.65 0.86 3.32 -0.27 -0.75 116.42 120.81 3m02 h ASP 490 Ca 0.31 -0.17 0.04 0.00 0.02 0.00 0.00 57.03 57.23 3m02 h ASP 490 Cb 0.03 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 3m02 h ASP 490 CO -0.05 0.64 0.39 0.40 -1.72 0.00 0.00 179.24 178.91 3m02 h ILE 491 N 0.63 1.06 -0.38 0.35 2.04 -0.68 0.21 117.51 120.73 3m02 h ILE 491 Ca 0.16 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 3m02 h ILE 491 Cb 0.19 0.23 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 3m02 h ILE 491 CO -0.01 0.14 0.03 0.78 0.00 0.00 0.00 178.15 179.08 3m02 h ASN 492 N 0.76 0.54 -0.27 1.72 2.35 -0.81 -2.42 115.58 117.45 3m02 h ASN 492 Ca 0.27 -0.10 -0.19 0.00 -0.55 0.00 0.00 56.30 55.73 3m02 h ASN 492 Cb 0.06 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.29 3m02 h ASN 492 CO -0.12 0.60 -0.57 -0.33 -1.65 0.00 0.00 177.43 175.35 3m02 h GLU 493 N 0.56 0.87 0.00 0.81 5.08 -0.22 -3.07 114.58 118.61 3m02 h GLU 493 Ca 0.12 -0.57 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3m02 h GLU 493 Cb 0.31 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.64 3m02 h GLU 493 CO 0.01 1.20 0.00 0.78 -1.00 0.00 0.00 179.01 180.00 3m02 h GLY 494 N 0.66 0.00 0.36 -3.84 0.00 -0.15 -2.07 103.07 98.03 3m02 h GLY 494 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3m02 h GLY 494 CO 0.13 0.00 -0.42 1.04 0.00 0.00 0.00 176.54 177.29 3m02 n LEU 495 N -2.33 0.94 -4.75 3.11 4.77 -1.03 -4.85 117.00 112.87 3m02 n LEU 495 Ca 0.00 -0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.34 3m02 n LEU 495 Cb 0.15 -0.14 -0.05 0.00 -2.33 0.00 0.00 43.42 41.05 3m02 n LEU 495 CO 0.16 0.19 0.71 -0.76 -1.33 0.00 0.00 177.39 176.37 3m02 s LEU 496 N -2.71 4.57 0.48 2.23 1.43 -0.78 -3.89 118.68 120.01 3m02 s LEU 496 Ca 0.18 2.03 -0.21 0.00 -1.03 0.00 0.00 54.13 55.09 3m02 s LEU 496 Cb 0.18 -3.61 -0.08 0.00 0.03 0.00 0.00 46.19 42.72 3m02 s LEU 496 CO 0.61 -0.02 1.08 -0.13 0.23 0.00 0.00 176.35 178.13 3m02 s ARG 497 N -0.89 3.75 0.12 1.70 0.52 -0.32 -3.83 118.95 120.00 3m02 s ARG 497 Ca 0.44 1.52 -0.30 0.00 -0.52 0.00 0.00 55.73 56.88 3m02 s ARG 497 Cb -0.28 -2.21 -0.06 0.00 0.52 0.00 0.00 34.95 32.92 3m02 s ARG 497 CO 0.34 -0.50 1.00 -1.25 0.02 0.00 0.00 175.30 174.91 3m02 s PRO 498 N -3.01 4.66 0.17 3.54 0.04 -1.26 -4.86 135.00 134.29 3m02 s PRO 498 Ca 0.66 1.51 -0.14 0.00 0.04 0.00 0.00 61.00 63.07 3m02 s PRO 498 Cb -0.21 -3.36 -0.07 0.00 0.04 0.00 0.00 34.50 30.90 3m02 s PRO 498 CO 0.26 0.16 0.58 0.95 0.04 0.00 0.00 177.00 178.99 3m02 s THR 499 N 0.02 4.82 0.54 1.26 -4.23 -1.25 -4.98 115.64 111.82 3m02 s THR 499 Ca 0.48 0.84 0.30 0.00 -1.18 0.00 0.00 61.69 62.13 3m02 s THR 499 Cb -0.25 -3.73 0.34 0.00 1.34 0.00 0.00 72.50 70.21 3m02 s THR 499 CO 0.31 0.18 2.21 1.55 -0.54 0.00 0.00 174.62 178.32 3m02 h PRO 500 N 3.34 0.00 -4.27 3.99 0.13 -1.91 -3.43 132.00 129.85 3m02 h PRO 500 Ca -0.48 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.49 3m02 h PRO 500 Cb 1.19 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 3m02 h PRO 500 CO 0.66 0.04 -0.55 0.14 -0.23 0.00 0.00 178.00 178.06 3m02 s VAL 501 N -4.45 0.09 0.51 1.56 -7.23 -1.26 -5.07 120.40 104.54 3m02 s VAL 501 Ca -0.04 -1.76 -0.22 0.00 -1.81 0.00 0.00 61.98 58.15 3m02 s VAL 501 Cb 0.14 -1.99 -0.06 0.00 0.56 0.00 0.00 36.38 35.03 3m02 s VAL 501 CO 0.55 -0.41 1.26 -0.94 -0.31 0.00 0.00 175.10 175.25 3m02 s SER 502 N -3.03 5.68 0.51 4.85 1.04 -1.26 -4.86 113.70 116.63 3m02 s SER 502 Ca 0.22 2.53 0.32 0.00 0.48 0.00 0.00 55.95 59.50 3m02 s SER 502 Cb 0.06 -2.62 1.45 0.00 0.10 0.00 0.00 66.02 65.01 3m02 s SER 502 CO 0.01 -1.27 1.81 0.74 0.98 0.00 0.00 173.24 175.52 3m02 h THR 503 N 1.61 0.46 -0.53 2.02 2.02 -1.98 -0.04 112.91 116.46 3m02 h THR 503 Ca -0.50 -0.03 0.15 0.00 0.77 0.00 0.00 66.41 66.81 3m02 h THR 503 Cb 1.28 0.37 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 3m02 h THR 503 CO 0.58 0.01 0.43 -0.08 0.37 0.00 0.00 175.52 176.84 3m02 h GLU 504 N 0.08 0.00 -0.02 6.66 4.81 -2.02 0.86 114.58 124.94 3m02 h GLU 504 Ca 0.54 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.77 3m02 h GLU 504 Cb 2.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.39 3m02 h GLU 504 CO -0.07 0.00 -0.15 1.19 -0.73 0.00 0.00 179.01 179.25 3m02 n PHE 505 N -4.13 0.00 -0.08 0.92 3.72 -0.03 -4.18 117.46 113.68 3m02 n PHE 505 Ca 0.10 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.33 3m02 n PHE 505 Cb 0.65 -0.01 -0.13 0.00 -0.94 0.00 0.00 39.48 39.05 3m02 n PHE 505 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3m02 n LEU 506 N 0.76 2.29 -0.31 4.37 4.77 0.20 -4.41 117.00 124.68 3m02 n LEU 506 Ca 0.13 0.03 0.17 0.00 -0.03 0.00 0.00 56.01 56.31 3m02 n LEU 506 Cb 0.53 -0.69 0.42 0.00 -2.33 0.00 0.00 43.42 41.35 3m02 n LEU 506 CO 0.19 0.81 1.21 0.74 -1.33 0.00 0.00 177.39 179.01 3m02 h THR 507 N 0.02 0.67 -0.15 -5.08 2.02 -1.46 0.14 112.91 109.07 3m02 h THR 507 Ca -0.50 -0.20 -0.09 0.00 0.77 0.00 0.00 66.41 66.39 3m02 h THR 507 Cb 2.00 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.43 3m02 h THR 507 CO -0.01 0.11 -0.31 -0.65 0.37 0.00 0.00 175.52 175.03 3m02 h PRO 508 N 0.58 0.29 -0.26 6.66 0.11 -1.77 0.18 132.00 137.79 3m02 h PRO 508 Ca 0.54 -0.11 -0.04 0.00 0.11 0.00 0.00 66.00 66.50 3m02 h PRO 508 Cb 1.09 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 3m02 h PRO 508 CO -0.29 0.57 0.00 0.82 -0.21 0.00 0.00 178.00 178.90 3m02 h ILE 509 N 0.25 1.25 -0.10 4.15 5.03 -1.23 -1.08 117.51 125.79 3m02 h ILE 509 Ca 0.03 -0.90 0.04 0.00 -0.12 0.00 0.00 64.86 63.91 3m02 h ILE 509 Cb 0.68 1.34 -0.04 0.00 -3.03 0.00 0.00 36.82 35.77 3m02 h ILE 509 CO 0.05 0.29 -0.14 0.25 -0.68 0.00 0.00 178.15 177.92 3m02 h LEU 510 N 0.24 -0.43 -1.76 1.44 5.85 -0.95 -2.13 115.31 117.56 3m02 h LEU 510 Ca 0.07 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.87 3m02 h LEU 510 Cb 0.41 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.64 3m02 h LEU 510 CO 0.01 -0.19 0.09 0.78 -0.34 0.00 0.00 178.44 178.79 3m02 h ASN 511 N -0.18 0.21 -0.63 1.25 2.35 -0.49 -1.19 115.58 116.89 3m02 h ASN 511 Ca 0.08 -0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.75 3m02 h ASN 511 Cb 0.30 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.59 3m02 h ASN 511 CO -0.21 0.18 0.11 -0.07 -1.65 0.00 0.00 177.43 175.79 3m02 h LEU 512 N 0.24 1.02 -0.73 1.61 3.38 -0.54 -0.16 115.31 120.13 3m02 h LEU 512 Ca 0.06 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.68 3m02 h LEU 512 Cb 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3m02 h LEU 512 CO -0.01 1.01 -0.30 0.00 0.09 0.00 0.00 178.44 179.23 3m02 h ALA 513 N 1.11 0.90 -0.69 1.53 0.00 -0.87 -2.72 119.26 118.51 3m02 h ALA 513 Ca 0.20 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 3m02 h ALA 513 Cb 0.43 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 3m02 h ALA 513 CO 0.01 0.62 0.22 0.00 0.00 0.00 0.00 179.25 180.10 3m02 h ARG 514 N 0.55 1.07 -0.98 0.00 3.08 -0.67 -2.21 114.38 115.22 3m02 h ARG 514 Ca 0.07 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 59.94 3m02 h ARG 514 Cb 0.79 -0.16 -0.06 0.00 0.08 0.00 0.00 29.97 30.62 3m02 h ARG 514 CO 0.06 0.91 0.64 0.82 -1.07 0.00 0.00 179.97 181.33 3m02 h ILE 515 N 1.03 1.17 0.55 2.04 1.08 -0.74 -2.09 117.51 120.54 3m02 h ILE 515 Ca 0.23 -0.42 -0.02 0.00 -0.39 0.00 0.00 64.86 64.25 3m02 h ILE 515 Cb 0.29 -0.18 -0.01 0.00 -3.07 0.00 0.00 36.82 33.86 3m02 h ILE 515 CO -0.01 0.23 -0.34 0.58 -0.69 0.00 0.00 178.15 177.91 3m02 h VAL 516 N 1.23 0.30 -0.87 1.67 2.07 -1.18 -0.18 116.25 119.29 3m02 h VAL 516 Ca 0.39 0.00 0.16 0.00 0.82 0.00 0.00 66.70 68.07 3m02 h VAL 516 Cb 0.01 0.30 -0.07 0.00 -1.52 0.00 0.00 31.29 30.01 3m02 h VAL 516 CO -0.13 0.00 0.56 -0.33 0.02 0.00 0.00 177.57 177.70 3m02 h GLU 517 N -0.85 0.57 0.08 1.57 4.39 -1.22 -2.22 114.58 116.89 3m02 h GLU 517 Ca -0.07 -0.03 -0.25 0.00 0.34 0.00 0.00 59.36 59.35 3m02 h GLU 517 Cb 0.69 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.21 3m02 h GLU 517 CO 0.06 0.37 -1.18 0.28 -1.16 0.00 0.00 179.01 177.39 3m02 h VAL 518 N 0.58 1.55 0.00 3.13 2.07 -1.07 -2.65 116.25 119.87 3m02 h VAL 518 Ca 0.44 -3.18 -0.08 0.00 0.82 0.00 0.00 66.70 64.70 3m02 h VAL 518 Cb 0.83 2.89 -0.01 0.00 -1.52 0.00 0.00 31.29 33.49 3m02 h VAL 518 CO -0.19 0.92 -0.38 0.74 0.02 0.00 0.00 177.57 178.67 3m02 h THR 519 N 0.05 0.67 -0.03 2.57 2.02 -0.58 -3.29 112.91 114.31 3m02 h THR 519 Ca -0.10 -1.91 -0.01 0.00 0.77 0.00 0.00 66.41 65.16 3m02 h THR 519 Cb 1.90 2.31 -0.01 0.00 -1.74 0.00 0.00 68.15 70.61 3m02 h THR 519 CO 0.17 0.38 -0.30 -1.22 0.37 0.00 0.00 175.52 174.92 3m02 n TYR 520 N -3.21 0.11 -0.11 3.16 4.02 -0.88 -4.70 117.16 115.55 3m02 n TYR 520 Ca 0.02 -1.34 0.27 0.00 -0.01 0.00 0.00 57.90 56.84 3m02 n TYR 520 Cb 0.68 -0.24 0.70 0.00 -0.02 0.00 0.00 39.34 40.46 3m02 n TYR 520 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 176.86 176.82 3m02 h ILE 521 N 0.72 0.37 -3.53 -0.72 -0.00 -1.54 -3.20 117.51 109.60 3m02 h ILE 521 Ca 0.02 0.00 -0.78 0.00 -0.00 0.00 0.00 64.86 64.10 3m02 h ILE 521 Cb 1.06 0.49 -0.25 0.00 -0.00 0.00 0.00 36.82 38.12 3m02 h ILE 521 CO 0.04 0.00 0.00 -1.00 -0.00 0.00 0.00 178.15 177.19 3m02 s HIS 522 N -4.75 3.57 -0.80 2.19 3.76 -1.26 -4.83 115.29 113.16 3m02 s HIS 522 Ca -0.04 -1.73 0.26 0.00 -0.15 0.00 0.00 55.06 53.40 3m02 s HIS 522 Cb 0.18 -3.83 0.74 0.00 1.11 0.00 0.00 32.58 30.78 3m02 s HIS 522 CO 0.65 -1.02 1.64 0.09 -0.85 0.00 0.00 174.74 175.25 3m02 n ASN 523 N 4.49 0.56 -0.22 1.40 3.02 -1.21 0.76 115.26 124.06 3m02 n ASN 523 Ca 0.04 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.91 3m02 n ASN 523 Cb 0.45 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 3m02 n ASN 523 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3m02 n LEU 524 N -1.95 0.22 0.00 3.41 4.32 -1.26 -3.94 117.00 117.80 3m02 n LEU 524 Ca 0.05 -0.11 0.00 0.00 -0.02 0.00 0.00 56.01 55.93 3m02 n LEU 524 Cb 0.40 -0.11 0.00 0.00 -1.62 0.00 0.00 43.42 42.09 3m02 n LEU 524 CO 0.32 0.06 0.00 -0.90 -1.22 0.00 0.00 177.39 175.64 3m02 n ASP 525 N -0.18 0.00 0.00 -1.43 5.68 -1.24 -4.88 116.55 114.49 3m02 n ASP 525 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 3m02 n ASP 525 Cb 0.06 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.04 3m02 n ASP 525 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3m02 n GLY 526 N 0.00 2.05 2.32 6.12 0.00 0.23 -4.51 105.19 111.40 3m02 n GLY 526 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 3m02 n GLY 526 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3m02 n TYR 527 N -1.41 -2.05 0.00 1.61 0.18 -1.26 -4.17 117.16 110.06 3m02 n TYR 527 Ca 0.00 1.22 0.00 0.00 1.88 0.00 0.00 57.90 61.00 3m02 n TYR 527 Cb 0.00 -2.23 0.00 0.00 -0.38 0.00 0.00 39.34 36.73 3m02 n TYR 527 CO 0.00 0.00 0.00 -2.37 -2.08 0.00 0.00 176.86 172.41 3m02 n THR 528 N 2.00 0.00 -0.32 -3.48 5.66 -1.26 -4.64 114.28 112.24 3m02 n THR 528 Ca -0.04 0.00 0.05 0.00 -3.05 0.00 0.00 64.05 61.01 3m02 n THR 528 Cb 0.06 0.00 0.12 0.00 -1.55 0.00 0.00 70.33 68.96 3m02 n THR 528 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 3m02 n HIS 529 N 0.00 0.29 0.00 1.09 -0.00 -1.26 -3.08 115.22 112.27 3m02 n HIS 529 Ca 0.00 1.06 0.00 0.00 -0.00 0.00 0.00 57.72 58.78 3m02 n HIS 529 Cb 0.00 -0.99 0.00 0.00 -0.00 0.00 0.00 29.99 29.00 3m02 n HIS 529 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 3m02 n PRO 530 N -5.41 0.00 0.00 -0.41 -0.02 -1.26 -3.96 135.00 123.94 3m02 n PRO 530 Ca 0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.62 3m02 n PRO 530 Cb 0.43 -0.01 0.00 0.00 -0.02 0.00 0.00 33.50 33.90 3m02 n PRO 530 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3m02 n GLU 531 N 0.00 0.00 -0.94 -0.52 -0.00 -1.23 -3.95 120.64 114.00 3m02 n GLU 531 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.16 56.80 3m02 n GLU 531 Cb 0.00 -0.33 0.06 0.00 -0.00 0.00 0.00 31.44 31.17 3m02 n GLU 531 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 3m02 n LYS 532 N 0.00 -0.14 0.00 3.44 2.85 -1.18 -1.10 118.16 122.03 3m02 n LYS 532 Ca 0.00 -0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.23 3m02 n LYS 532 Cb 0.00 -1.20 0.00 0.00 -0.65 0.00 0.00 35.03 33.18 3m02 n LYS 532 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 3m02 n VAL 533 N -2.97 0.00 0.12 0.58 0.31 -1.26 -4.22 118.33 110.88 3m02 n VAL 533 Ca -0.00 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.10 3m02 n VAL 533 Cb 0.59 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 33.38 3m02 n VAL 533 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3m02 h LEU 534 N 0.00 0.79 -0.99 7.52 3.38 -1.67 -3.38 115.31 120.97 3m02 h LEU 534 Ca 0.00 -0.80 0.13 0.00 0.09 0.00 0.00 57.88 57.31 3m02 h LEU 534 Cb 0.00 -0.25 -0.15 0.00 0.09 0.00 0.00 40.66 40.35 3m02 h LEU 534 CO 0.00 1.61 -0.44 1.17 0.09 0.00 0.00 178.44 180.87 3m02 n LYS 535 N -3.72 -0.29 -0.17 1.13 4.81 -0.26 -0.93 118.16 118.73 3m02 n LYS 535 Ca -0.14 1.51 -0.01 0.00 -0.87 0.00 0.00 58.31 58.80 3m02 n LYS 535 Cb 1.05 -2.24 0.08 0.00 0.02 0.00 0.00 35.03 33.94 3m02 n LYS 535 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 3m02 h PRO 536 N 0.00 0.20 -0.55 1.64 0.11 -1.84 -0.48 132.00 131.08 3m02 h PRO 536 Ca 0.29 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.33 3m02 h PRO 536 Cb 0.54 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.58 3m02 h PRO 536 CO -0.96 0.13 0.11 0.45 -0.21 0.00 0.00 178.00 177.52 3m02 h HIS 537 N 0.21 0.95 -0.72 0.65 3.86 -1.25 -0.74 115.15 118.10 3m02 h HIS 537 Ca 0.27 -0.12 -0.01 0.00 -1.16 0.00 0.00 60.37 59.35 3m02 h HIS 537 Cb 0.39 -0.26 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 3m02 h HIS 537 CO -0.26 0.83 0.41 0.82 0.86 0.00 0.00 177.93 180.59 3m02 h ILE 538 N 0.79 1.22 -0.57 2.45 2.04 -0.41 0.14 117.51 123.17 3m02 h ILE 538 Ca 0.17 -0.51 -0.08 0.00 1.00 0.00 0.00 64.86 65.43 3m02 h ILE 538 Cb 0.37 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 3m02 h ILE 538 CO 0.01 0.23 0.03 0.40 0.00 0.00 0.00 178.15 178.82 3m02 h ILE 539 N 0.99 1.26 0.00 -0.67 2.04 -0.86 0.22 117.51 120.50 3m02 h ILE 539 Ca 0.26 -1.08 -0.10 0.00 1.00 0.00 0.00 64.86 64.93 3m02 h ILE 539 Cb 0.01 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3m02 h ILE 539 CO -0.04 0.39 -0.49 0.78 0.00 0.00 0.00 178.15 178.79 3m02 h ASN 540 N 0.87 0.00 0.00 1.72 -0.26 -0.67 0.65 115.58 117.90 3m02 h ASN 540 Ca 0.17 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.72 3m02 h ASN 540 Cb 0.50 0.00 -0.03 0.00 -1.06 0.00 0.00 38.32 37.73 3m02 h ASN 540 CO 0.02 0.49 -2.06 0.18 -1.06 0.00 0.00 177.43 175.00 3m02 n LEU 541 N -3.72 0.00 0.00 1.61 4.77 0.46 -4.64 117.00 115.48 3m02 n LEU 541 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3m02 n LEU 541 Cb 0.55 0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.88 3m02 n LEU 541 CO 0.39 0.25 0.02 0.18 -1.33 0.00 0.00 177.39 176.90 3m02 n LEU 542 N -2.44 0.08 -0.01 2.23 4.77 0.78 -4.87 117.00 117.53 3m02 n LEU 542 Ca -0.18 -0.51 -0.01 0.00 -0.03 0.00 0.00 56.01 55.29 3m02 n LEU 542 Cb 0.83 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.91 3m02 n LEU 542 CO 0.39 0.02 -0.08 0.52 -1.33 0.00 0.00 177.39 176.90 3m02 n VAL 543 N -0.86 0.32 -2.97 4.08 0.31 -0.79 -4.91 118.33 113.51 3m02 n VAL 543 Ca 0.00 0.26 -0.40 0.00 -0.01 0.00 0.00 64.34 64.19 3m02 n VAL 543 Cb 0.00 -1.42 -0.05 0.00 -0.91 0.00 0.00 33.84 31.46 3m02 n VAL 543 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 3m02 s ASP 544 N -4.82 7.15 0.47 4.52 1.01 0.16 -5.04 116.67 120.11 3m02 s ASP 544 Ca -0.03 1.38 -0.07 0.00 0.71 0.00 0.00 52.55 54.54 3m02 s ASP 544 Cb 0.00 -2.46 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 3m02 s ASP 544 CO 0.05 -0.07 0.80 -0.94 0.21 0.00 0.00 175.17 175.22 3m02 s SER 545 N 0.39 6.33 -0.04 0.27 1.04 -1.26 -4.64 113.70 115.80 3m02 s SER 545 Ca 0.40 1.02 -0.30 0.00 0.48 0.00 0.00 55.95 57.55 3m02 s SER 545 Cb -0.20 -2.28 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 3m02 s SER 545 CO 0.22 -0.55 1.26 -0.63 0.98 0.00 0.00 173.24 174.52 3m02 s ILE 546 N -2.67 4.09 -0.05 -1.02 1.01 -1.26 -4.95 121.20 116.36 3m02 s ILE 546 Ca 0.49 1.43 -0.30 0.00 0.00 0.00 0.00 60.65 62.28 3m02 s ILE 546 Cb -0.10 -3.92 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 3m02 s ILE 546 CO 0.42 -0.00 1.43 -1.59 0.00 0.00 0.00 174.94 175.19 3m02 s LYS 547 N 2.27 4.25 0.00 2.79 -2.85 -1.26 -4.98 119.74 119.96 3m02 s LYS 547 Ca 0.58 1.95 0.32 0.00 -1.00 0.00 0.00 55.97 57.82 3m02 s LYS 547 Cb -0.27 -3.71 1.82 0.00 -2.06 0.00 0.00 37.83 33.61 3m02 s LYS 547 CO 0.23 -0.67 2.18 -0.89 0.10 0.00 0.00 175.35 176.30