#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3jyi h PRO 27 N 0.00 0.26 0.00 1.57 0.11 -1.97 -0.16 132.00 131.81 3jyi h PRO 27 Ca 0.00 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.96 3jyi h PRO 27 Cb 0.00 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 3jyi h PRO 27 CO 0.00 0.17 -0.64 0.93 -0.21 0.00 0.00 178.00 178.25 3jyi h GLU 28 N 0.27 0.00 -0.28 1.05 4.39 -1.99 -1.85 114.58 116.17 3jyi h GLU 28 Ca 0.74 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 60.34 3jyi h GLU 28 Cb 1.90 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.54 3jyi h GLU 28 CO -0.50 0.64 -0.18 1.15 -1.16 0.00 0.00 179.01 178.95 3jyi h THR 29 N 0.00 1.30 -0.78 1.13 2.02 -1.34 -2.52 112.91 112.73 3jyi h THR 29 Ca -0.01 -1.31 0.06 0.00 0.77 0.00 0.00 66.41 65.92 3jyi h THR 29 Cb 1.36 1.54 -0.06 0.00 -1.74 0.00 0.00 68.15 69.26 3jyi h THR 29 CO 0.08 0.42 0.46 0.25 0.37 0.00 0.00 175.52 177.10 3jyi h LEU 30 N 0.36 0.72 -0.57 2.58 5.85 -1.32 0.00 115.31 122.92 3jyi h LEU 30 Ca 0.06 0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.84 3jyi h LEU 30 Cb 0.72 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 3jyi h LEU 30 CO 0.05 0.46 0.32 0.58 -0.34 0.00 0.00 178.44 179.50 3jyi h VAL 31 N 0.85 1.00 -0.54 1.05 2.07 -1.27 -1.56 116.25 117.84 3jyi h VAL 31 Ca 0.34 -0.21 -0.07 0.00 0.82 0.00 0.00 66.70 67.58 3jyi h VAL 31 Cb 0.18 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 3jyi h VAL 31 CO -0.18 0.11 0.05 0.50 0.02 0.00 0.00 177.57 178.07 3jyi h LYS 32 N 0.61 0.89 0.14 1.57 1.63 -0.84 -0.80 116.57 119.76 3jyi h LYS 32 Ca 0.24 -0.23 0.01 0.00 -0.85 0.00 0.00 60.65 59.82 3jyi h LYS 32 Cb 0.11 -0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.61 3jyi h LYS 32 CO -0.14 0.85 -0.16 0.28 -3.45 0.00 0.00 179.45 176.83 3jyi h VAL 33 N 0.83 0.65 -0.77 2.00 2.07 -0.67 -0.36 116.25 120.01 3jyi h VAL 33 Ca 0.17 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.78 3jyi h VAL 33 Cb 0.43 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.78 3jyi h VAL 33 CO 0.01 0.00 0.41 0.11 0.02 0.00 0.00 177.57 178.13 3jyi h LYS 34 N -0.33 0.67 -0.09 1.57 1.57 -1.03 0.61 116.57 119.53 3jyi h LYS 34 Ca 0.01 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 58.73 3jyi h LYS 34 Cb 0.32 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 3jyi h LYS 34 CO -0.05 0.44 -0.04 0.22 -0.57 0.00 0.00 179.45 179.46 3jyi h ASP 35 N 0.69 0.11 0.06 0.86 3.58 -0.72 -2.26 116.42 118.73 3jyi h ASP 35 Ca 0.38 -0.01 -0.14 0.00 0.42 0.00 0.00 57.03 57.68 3jyi h ASP 35 Cb 0.38 -0.03 -0.01 0.00 1.72 0.00 0.00 39.33 41.39 3jyi h ASP 35 CO -0.26 0.17 -0.46 0.00 -2.88 0.00 0.00 179.24 175.81 3jyi h ALA 36 N 1.85 0.85 -0.29 -0.78 0.00 0.86 -1.47 119.26 120.28 3jyi h ALA 36 Ca 0.03 -0.46 0.01 0.00 0.00 0.00 0.00 54.91 54.49 3jyi h ALA 36 Cb 0.15 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 3jyi h ALA 36 CO 0.01 0.65 0.16 0.93 0.00 0.00 0.00 179.25 181.00 3jyi h GLU 37 N 0.39 0.33 -0.48 0.00 5.08 -0.90 -2.14 114.58 116.85 3jyi h GLU 37 Ca 0.02 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3jyi h GLU 37 Cb 0.95 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 3jyi h GLU 37 CO 0.08 0.22 0.31 -0.44 -1.00 0.00 0.00 179.01 178.18 3jyi h ASP 38 N 0.34 0.56 0.42 1.42 3.45 -1.15 0.38 116.42 121.83 3jyi h ASP 38 Ca 0.12 -0.02 -0.06 0.00 0.43 0.00 0.00 57.03 57.50 3jyi h ASP 38 Cb 0.01 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 38.63 3jyi h ASP 38 CO -0.06 0.41 -0.29 1.56 -1.57 0.00 0.00 179.24 179.28 3jyi h GLN 39 N 0.65 0.00 0.00 3.56 1.08 -1.13 -3.10 115.11 116.16 3jyi h GLN 39 Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 3jyi h GLN 39 Cb -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 3jyi h GLN 39 CO -0.04 0.29 -1.79 1.28 -0.95 0.00 0.00 178.83 177.62 3jyi n LEU 40 N -3.94 0.11 -3.37 1.46 4.77 -0.82 -4.99 117.00 110.22 3jyi n LEU 40 Ca -0.02 -0.06 -0.17 0.00 -0.03 0.00 0.00 56.01 55.74 3jyi n LEU 40 Cb 0.36 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.54 3jyi n LEU 40 CO 0.36 0.03 0.11 0.61 -1.33 0.00 0.00 177.39 177.17 3jyi n GLY 41 N 1.38 -0.34 3.43 -0.72 0.00 0.13 -4.15 105.19 104.92 3jyi n GLY 41 Ca -0.03 0.09 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 3jyi n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3jyi s ALA 42 N -3.35 -1.54 0.63 4.61 0.00 -1.14 -4.45 121.76 116.52 3jyi s ALA 42 Ca 0.00 0.72 -0.18 0.00 0.00 0.00 0.00 51.96 52.50 3jyi s ALA 42 Cb -0.00 0.50 -0.02 0.00 0.00 0.00 0.00 23.12 23.61 3jyi s ALA 42 CO 0.71 -0.58 1.26 1.03 0.00 0.00 0.00 175.76 178.18 3jyi s ARG 43 N -2.71 2.67 -0.05 0.00 0.52 -1.25 -4.46 118.95 113.68 3jyi s ARG 43 Ca -0.04 1.97 0.01 0.00 -0.52 0.00 0.00 55.73 57.15 3jyi s ARG 43 Cb -0.01 -1.87 0.02 0.00 0.52 0.00 0.00 34.95 33.62 3jyi s ARG 43 CO -0.04 -1.48 -0.03 0.08 0.02 0.00 0.00 175.30 173.85 3jyi s VAL 44 N -1.49 0.49 -0.03 3.52 1.01 -1.26 -3.65 120.40 118.99 3jyi s VAL 44 Ca 0.81 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.69 3jyi s VAL 44 Cb -0.35 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.45 3jyi s VAL 44 CO 0.38 0.22 0.12 -0.83 0.00 0.00 0.00 175.10 174.99 3jyi s GLY 45 N 1.09 2.08 -0.23 4.51 0.00 0.12 -4.58 107.32 110.32 3jyi s GLY 45 Ca -0.08 -0.80 -0.12 0.00 0.00 0.00 0.00 44.72 43.72 3jyi s GLY 45 CO -0.01 -0.65 0.55 -0.47 0.00 0.00 0.00 173.10 172.52 3jyi s TYR 46 N -1.19 -0.89 0.03 1.90 5.04 -0.17 -1.93 117.35 120.14 3jyi s TYR 46 Ca 0.23 1.77 -0.03 0.00 -2.44 0.00 0.00 57.07 56.59 3jyi s TYR 46 Cb -0.12 0.48 -0.02 0.00 0.35 0.00 0.00 41.96 42.65 3jyi s TYR 46 CO 0.13 -0.47 0.04 -1.50 -1.34 0.00 0.00 175.55 172.42 3jyi s ILE 47 N 1.77 0.14 -0.11 3.14 2.07 -0.83 -0.68 121.20 126.70 3jyi s ILE 47 Ca -0.09 -1.15 -0.02 0.00 -1.41 0.00 0.00 60.65 57.98 3jyi s ILE 47 Cb -0.08 -0.82 0.04 0.00 0.13 0.00 0.00 42.46 41.74 3jyi s ILE 47 CO -0.16 -0.64 0.04 -0.70 -1.91 0.00 0.00 174.94 171.57 3jyi s GLU 48 N -2.48 0.37 0.03 3.50 2.12 -0.47 -1.58 118.70 120.19 3jyi s GLU 48 Ca -0.06 0.01 0.06 0.00 0.36 0.00 0.00 54.97 55.34 3jyi s GLU 48 Cb -0.02 -1.29 -0.03 0.00 0.26 0.00 0.00 34.13 33.05 3jyi s GLU 48 CO -0.04 -0.45 -0.16 -0.51 -0.54 0.00 0.00 175.26 173.55 3jyi s LEU 49 N 2.02 2.69 -0.15 2.70 1.43 0.72 -0.35 118.68 127.74 3jyi s LEU 49 Ca 0.03 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.47 3jyi s LEU 49 Cb -0.14 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.50 3jyi s LEU 49 CO -0.06 0.27 1.21 -0.62 0.23 0.00 0.00 176.35 177.37 3jyi s ASP 50 N -1.36 7.00 0.37 2.29 2.15 -0.33 -0.79 116.67 126.00 3jyi s ASP 50 Ca 0.15 1.66 0.07 0.00 0.43 0.00 0.00 52.55 54.85 3jyi s ASP 50 Cb -0.11 -2.54 0.79 0.00 -0.30 0.00 0.00 42.92 40.76 3jyi s ASP 50 CO 0.05 -0.70 1.96 0.25 -0.17 0.00 0.00 175.17 176.56 3jyi h LEU 51 N 9.34 0.62 0.00 -1.34 5.85 -1.51 0.63 115.31 128.90 3jyi h LEU 51 Ca -0.27 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.46 3jyi h LEU 51 Cb 1.11 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.01 3jyi h LEU 51 CO 0.95 0.39 -0.03 0.78 -0.34 0.00 0.00 178.44 180.19 3jyi h ASN 52 N 0.70 0.00 0.59 1.25 2.35 -1.91 -3.38 115.58 115.17 3jyi h ASN 52 Ca 0.31 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.97 3jyi h ASN 52 Cb 0.32 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.68 3jyi h ASN 52 CO -0.10 0.21 -0.44 0.77 -1.65 0.00 0.00 177.43 176.21 3jyi h SER 53 N -0.39 0.00 0.00 5.81 4.64 -1.96 -3.46 113.55 118.19 3jyi h SER 53 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3jyi h SER 53 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 3jyi h SER 53 CO 0.00 0.44 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 3jyi n GLY 54 N -0.03 0.92 3.76 -0.77 0.00 0.22 -5.00 105.19 104.29 3jyi n GLY 54 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 3jyi n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3jyi s LYS 55 N -0.02 3.67 -0.16 1.61 2.20 -1.25 -4.54 119.74 121.24 3jyi s LYS 55 Ca 0.00 2.30 -0.28 0.00 -0.36 0.00 0.00 55.97 57.64 3jyi s LYS 55 Cb 0.00 -2.61 -0.01 0.00 -1.51 0.00 0.00 37.83 33.71 3jyi s LYS 55 CO 0.00 -0.79 0.94 0.42 -0.36 0.00 0.00 175.35 175.56 3jyi s ILE 56 N -1.25 4.80 -0.11 5.43 1.01 -1.26 -1.19 121.20 128.64 3jyi s ILE 56 Ca 0.62 1.86 0.20 0.00 0.00 0.00 0.00 60.65 63.33 3jyi s ILE 56 Cb -0.41 -4.24 -0.28 0.00 0.01 0.00 0.00 42.46 37.54 3jyi s ILE 56 CO 0.52 -0.03 0.34 0.18 0.00 0.00 0.00 174.94 175.95 3jyi n LEU 57 N 5.43 0.07 -3.60 2.97 4.77 0.53 -4.98 117.00 122.18 3jyi n LEU 57 Ca 0.08 0.03 -0.12 0.00 -0.03 0.00 0.00 56.01 55.96 3jyi n LEU 57 Cb 0.48 0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.72 3jyi n LEU 57 CO 0.50 0.22 0.62 -0.70 -1.33 0.00 0.00 177.39 176.70 3jyi s GLU 58 N -3.05 0.71 0.01 3.23 2.56 -1.22 -4.31 118.70 116.64 3jyi s GLU 58 Ca -0.08 0.51 -0.27 0.00 0.00 0.00 0.00 54.97 55.12 3jyi s GLU 58 Cb 0.10 0.34 0.06 0.00 2.00 0.00 0.00 34.13 36.64 3jyi s GLU 58 CO 0.87 -0.15 0.62 -1.54 -0.56 0.00 0.00 175.26 174.49 3jyi s SER 59 N -0.35 -0.58 -0.24 -1.70 1.04 -1.26 -1.37 113.70 109.24 3jyi s SER 59 Ca -0.02 0.46 -0.05 0.00 0.48 0.00 0.00 55.95 56.82 3jyi s SER 59 Cb -0.03 0.53 0.12 0.00 0.10 0.00 0.00 66.02 66.75 3jyi s SER 59 CO 0.01 -0.69 0.47 0.12 0.98 0.00 0.00 173.24 174.13 3jyi s PHE 60 N -1.89 -1.01 -1.31 5.02 5.36 0.14 -4.88 117.98 119.40 3jyi s PHE 60 Ca -0.08 1.48 -0.02 0.00 -0.96 0.00 0.00 56.93 57.35 3jyi s PHE 60 Cb -0.01 0.34 0.01 0.00 -0.34 0.00 0.00 43.02 43.02 3jyi s PHE 60 CO 0.03 -0.64 0.82 0.54 -1.46 0.00 0.00 175.22 174.51 3jyi n ARG 61 N 5.40 -5.51 0.15 10.12 1.74 -1.26 -1.00 116.66 126.30 3jyi n ARG 61 Ca -0.06 0.68 0.14 0.00 -0.77 0.00 0.00 57.85 57.83 3jyi n ARG 61 Cb 0.50 -5.40 0.68 0.00 -1.02 0.00 0.00 32.46 27.22 3jyi n ARG 61 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3jyi h PRO 62 N -1.94 0.00 0.00 5.56 0.11 -1.90 -3.09 132.00 130.74 3jyi h PRO 62 Ca -0.60 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.51 3jyi h PRO 62 Cb 1.36 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.46 3jyi h PRO 62 CO 0.56 0.00 -0.16 0.39 -0.21 0.00 0.00 178.00 178.58 3jyi n GLU 63 N -4.41 1.34 -3.26 1.05 1.02 -1.26 -0.97 120.64 114.15 3jyi n GLU 63 Ca 0.02 -2.77 -0.25 0.00 -0.02 0.00 0.00 57.16 54.15 3jyi n GLU 63 Cb 0.31 -1.51 -0.01 0.00 -0.02 0.00 0.00 31.44 30.21 3jyi n GLU 63 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3jyi s GLU 64 N -2.92 3.50 -0.10 3.49 2.02 -1.17 -4.99 118.70 118.52 3jyi s GLU 64 Ca 0.33 -0.23 -0.11 0.00 0.02 0.00 0.00 54.97 54.99 3jyi s GLU 64 Cb 0.30 -2.62 -0.05 0.00 0.10 0.00 0.00 34.13 31.87 3jyi s GLU 64 CO -0.00 0.10 0.24 1.03 0.02 0.00 0.00 175.26 176.65 3jyi s ARG 65 N -4.32 3.80 0.10 1.61 0.52 -1.26 -4.14 118.95 115.26 3jyi s ARG 65 Ca 0.41 0.05 0.04 0.00 -0.52 0.00 0.00 55.73 55.71 3jyi s ARG 65 Cb -0.10 -3.27 -0.04 0.00 0.52 0.00 0.00 34.95 32.07 3jyi s ARG 65 CO 0.37 0.60 -0.11 -0.06 0.02 0.00 0.00 175.30 176.12 3jyi s PHE 66 N -0.61 1.17 0.14 -0.53 0.08 -0.29 -4.96 117.98 112.98 3jyi s PHE 66 Ca 0.17 -0.62 -0.31 0.00 0.12 0.00 0.00 56.93 56.29 3jyi s PHE 66 Cb -0.13 -0.63 -0.11 0.00 -0.57 0.00 0.00 43.02 41.58 3jyi s PHE 66 CO 0.06 0.05 1.79 -2.14 -0.10 0.00 0.00 175.22 174.88 3jyi s PRO 67 N -2.73 4.14 0.25 0.24 0.02 -1.26 -1.40 135.00 134.26 3jyi s PRO 67 Ca 0.06 2.58 -0.04 0.00 0.02 0.00 0.00 61.00 63.62 3jyi s PRO 67 Cb -0.04 -3.48 0.30 0.00 0.02 0.00 0.00 34.50 31.31 3jyi s PRO 67 CO 0.01 -0.81 1.80 0.52 -0.33 0.00 0.00 177.00 178.19 3jyi h MET 68 N 8.18 0.97 0.00 5.54 2.86 -1.51 -3.47 114.93 127.51 3jyi h MET 68 Ca -0.45 -0.19 0.00 0.00 -2.06 0.00 0.00 59.70 56.99 3jyi h MET 68 Cb 1.21 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 32.72 3jyi h MET 68 CO 0.95 0.84 0.00 -1.33 1.06 0.00 0.00 176.91 178.43 3jyi n MET 69 N -4.27 0.00 0.00 1.72 2.81 -1.26 -2.62 117.12 113.50 3jyi n MET 69 Ca 0.05 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 3jyi n MET 69 Cb 0.22 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 32.73 3jyi n MET 69 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 3jyi n SER 70 N -3.18 0.00 0.32 7.83 7.64 -1.26 -2.13 113.62 122.84 3jyi n SER 70 Ca 0.00 0.40 0.20 0.00 1.01 0.00 0.00 58.87 60.48 3jyi n SER 70 Cb 0.00 -0.40 1.06 0.00 -1.01 0.00 0.00 64.21 63.86 3jyi n SER 70 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 3jyi h THR 71 N 0.00 0.14 0.00 0.44 2.02 -1.61 -1.29 112.91 112.61 3jyi h THR 71 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3jyi h THR 71 Cb 0.08 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 3jyi h THR 71 CO 0.00 0.00 -0.19 2.19 0.37 0.00 0.00 175.52 177.89 3jyi h PHE 72 N 0.00 0.00 0.00 3.16 -5.15 -1.63 -3.23 116.94 110.10 3jyi h PHE 72 Ca 0.01 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.78 3jyi h PHE 72 Cb 0.19 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.36 3jyi h PHE 72 CO 0.00 0.19 -0.02 0.87 -2.00 0.00 0.00 178.31 177.35 3jyi h LYS 73 N 0.00 0.00 -0.09 6.09 1.57 -1.49 0.34 116.57 122.99 3jyi h LYS 73 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3jyi h LYS 73 Cb 0.72 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 3jyi h LYS 73 CO 0.02 0.02 -0.11 0.28 -0.57 0.00 0.00 179.45 179.09 3jyi h VAL 74 N 0.00 1.38 -0.99 0.50 2.07 -1.77 -2.33 116.25 115.11 3jyi h VAL 74 Ca -0.00 -1.32 0.06 0.00 0.82 0.00 0.00 66.70 66.26 3jyi h VAL 74 Cb 0.06 2.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.83 3jyi h VAL 74 CO 0.00 0.37 0.64 -0.07 0.02 0.00 0.00 177.57 178.54 3jyi h LEU 75 N -0.21 1.03 0.64 2.57 4.07 -0.65 -1.78 115.31 120.97 3jyi h LEU 75 Ca 0.01 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.95 3jyi h LEU 75 Cb 0.65 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 3jyi h LEU 75 CO 0.03 0.66 -0.43 0.25 -1.08 0.00 0.00 178.44 177.87 3jyi h LEU 76 N 1.17 -1.11 -2.23 1.67 5.85 -0.75 -1.63 115.31 118.29 3jyi h LEU 76 Ca 0.42 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.21 3jyi h LEU 76 Cb 0.15 0.33 0.00 0.00 0.37 0.00 0.00 40.66 41.52 3jyi h LEU 76 CO -0.16 -0.65 0.00 0.00 -0.34 0.00 0.00 178.44 177.29 3jyi h GLY 78 N 0.49 0.93 0.92 0.00 0.00 -0.59 -1.62 103.07 103.20 3jyi h GLY 78 Ca 0.00 -1.12 -0.07 0.00 0.00 0.00 0.00 47.33 46.14 3jyi h GLY 78 CO 0.00 1.00 -0.08 0.00 0.00 0.00 0.00 176.54 177.47 3jyi h ALA 79 N 0.65 0.45 -0.51 3.60 0.00 -0.01 -1.23 119.26 122.21 3jyi h ALA 79 Ca 0.00 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.69 3jyi h ALA 79 Cb 1.18 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.80 3jyi h ALA 79 CO 0.13 0.29 0.19 0.28 0.00 0.00 0.00 179.25 180.13 3jyi h VAL 80 N 0.41 0.83 -0.39 0.00 2.07 -1.22 -1.97 116.25 115.97 3jyi h VAL 80 Ca 0.08 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 3jyi h VAL 80 Cb 0.57 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3jyi h VAL 80 CO 0.03 0.07 -0.05 -0.07 0.02 0.00 0.00 177.57 177.57 3jyi h LEU 81 N 0.37 0.63 -1.41 2.57 3.38 -1.16 -1.72 115.31 117.97 3jyi h LEU 81 Ca 0.25 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.11 3jyi h LEU 81 Cb 0.26 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 3jyi h LEU 81 CO -0.25 0.74 0.44 -1.28 0.09 0.00 0.00 178.44 178.18 3jyi h SER 82 N 0.61 0.66 0.10 -0.43 0.87 -0.48 -1.13 113.55 113.75 3jyi h SER 82 Ca 0.12 -0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.40 3jyi h SER 82 Cb 0.46 -0.15 0.02 0.00 -0.44 0.00 0.00 62.40 62.30 3jyi h SER 82 CO 0.02 0.44 -1.13 0.03 -0.53 0.00 0.00 176.83 175.66 3jyi h ARG 83 N 0.76 0.64 -1.00 2.24 3.08 -0.96 -2.75 114.38 116.38 3jyi h ARG 83 Ca 0.28 -0.76 0.10 0.00 0.07 0.00 0.00 59.98 59.67 3jyi h ARG 83 Cb 0.14 0.23 -0.08 0.00 0.08 0.00 0.00 29.97 30.35 3jyi h ARG 83 CO -0.08 1.33 0.63 0.28 -1.07 0.00 0.00 179.97 181.06 3jyi h VAL 84 N 0.32 0.97 0.00 2.04 2.07 -0.77 0.11 116.25 120.99 3jyi h VAL 84 Ca -0.15 -0.36 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 3jyi h VAL 84 Cb 1.79 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 3jyi h VAL 84 CO 0.22 0.19 -0.24 0.44 0.02 0.00 0.00 177.57 178.20 3jyi h ASP 85 N 1.04 0.00 -0.43 0.57 3.32 -1.17 -2.88 116.42 116.87 3jyi h ASP 85 Ca 0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.53 3jyi h ASP 85 Cb 0.39 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3jyi h ASP 85 CO -0.24 0.24 0.00 0.00 -1.72 0.00 0.00 179.24 177.52 3jyi n ALA 86 N -2.46 2.43 -1.13 3.45 0.00 0.22 -4.93 120.51 118.08 3jyi n ALA 86 Ca -0.02 -0.95 -0.05 0.00 0.00 0.00 0.00 53.44 52.42 3jyi n ALA 86 Cb 0.30 -0.94 -0.02 0.00 0.00 0.00 0.00 19.45 18.79 3jyi n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3jyi n GLY 87 N 1.45 0.73 0.76 0.00 0.00 -0.46 -4.90 105.19 102.76 3jyi n GLY 87 Ca 0.19 -0.80 0.07 0.00 0.00 0.00 0.00 46.02 45.49 3jyi n GLY 87 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3jyi n GLN 88 N -2.81 2.43 -3.49 1.61 6.02 -0.29 -4.98 117.38 115.87 3jyi n GLN 88 Ca -0.05 -2.01 -0.10 0.00 -0.01 0.00 0.00 57.00 54.83 3jyi n GLN 88 Cb 0.16 -1.33 -0.03 0.00 1.02 0.00 0.00 30.24 30.06 3jyi n GLN 88 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 3jyi s GLU 89 N -1.04 0.96 -0.05 -1.09 2.56 -1.22 -4.85 118.70 113.97 3jyi s GLU 89 Ca 0.27 -0.27 0.00 0.00 0.00 0.00 0.00 54.97 54.97 3jyi s GLU 89 Cb 0.15 0.44 0.02 0.00 2.00 0.00 0.00 34.13 36.74 3jyi s GLU 89 CO 0.19 -0.40 -0.03 -0.65 -0.56 0.00 0.00 175.26 173.81 3jyi s GLN 90 N -2.98 0.73 0.57 4.30 -0.21 -1.26 -4.20 119.66 116.61 3jyi s GLN 90 Ca 0.02 -0.03 0.28 0.00 0.02 0.00 0.00 55.36 55.64 3jyi s GLN 90 Cb -0.01 -0.85 1.50 0.00 1.00 0.00 0.00 33.01 34.66 3jyi s GLN 90 CO -0.08 -0.15 1.98 -0.07 -2.12 0.00 0.00 175.29 174.86 3jyi h LEU 91 N 7.50 0.00 -0.06 2.90 4.07 -1.96 -0.69 115.31 127.06 3jyi h LEU 91 Ca -0.34 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.62 3jyi h LEU 91 Cb 1.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.88 3jyi h LEU 91 CO 0.42 0.00 -0.29 0.61 -1.08 0.00 0.00 178.44 178.10 3jyi n GLY 92 N -1.53 -1.24 3.73 0.83 0.00 -1.26 -1.32 105.19 104.41 3jyi n GLY 92 Ca 0.07 -0.27 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 3jyi n GLY 92 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3jyi n ARG 93 N -1.38 2.77 -3.93 1.61 0.63 -0.27 -4.77 116.66 111.33 3jyi n ARG 93 Ca 0.07 0.99 -0.36 0.00 -0.92 0.00 0.00 57.85 57.64 3jyi n ARG 93 Cb 0.33 -2.82 -0.07 0.00 0.45 0.00 0.00 32.46 30.35 3jyi n ARG 93 CO 0.00 0.00 0.00 0.50 -2.51 0.00 0.00 177.63 175.62 3jyi s ARG 94 N 0.49 3.60 -0.08 -0.14 3.52 -1.26 -1.42 118.95 123.67 3jyi s ARG 94 Ca 0.71 -0.21 0.05 0.00 -0.13 0.00 0.00 55.73 56.14 3jyi s ARG 94 Cb -0.50 -3.19 -0.01 0.00 -1.56 0.00 0.00 34.95 29.70 3jyi s ARG 94 CO 0.39 0.61 -0.23 0.42 -0.81 0.00 0.00 175.30 175.68 3jyi s ILE 95 N -0.56 2.18 -0.00 4.11 1.01 0.10 -4.94 121.20 123.10 3jyi s ILE 95 Ca 0.12 -1.00 0.02 0.00 0.00 0.00 0.00 60.65 59.79 3jyi s ILE 95 Cb -0.12 -1.82 -0.03 0.00 0.01 0.00 0.00 42.46 40.50 3jyi s ILE 95 CO 0.02 0.56 -0.03 -1.00 0.00 0.00 0.00 174.94 174.49 3jyi s HIS 96 N 0.04 2.98 0.31 3.97 3.76 -1.26 -1.21 115.29 123.88 3jyi s HIS 96 Ca -0.09 0.02 0.02 0.00 -0.15 0.00 0.00 55.06 54.86 3jyi s HIS 96 Cb -0.15 -1.65 -0.02 0.00 1.11 0.00 0.00 32.58 31.87 3jyi s HIS 96 CO 0.06 0.41 0.32 1.52 -0.85 0.00 0.00 174.74 176.20 3jyi s TYR 97 N -1.03 1.39 0.22 1.40 -0.85 -1.26 -5.06 117.35 112.16 3jyi s TYR 97 Ca 0.18 -1.46 0.10 0.00 -0.52 0.00 0.00 57.07 55.36 3jyi s TYR 97 Cb -0.11 -0.46 -0.04 0.00 0.38 0.00 0.00 41.96 41.72 3jyi s TYR 97 CO 0.08 -0.91 -0.10 0.45 -1.52 0.00 0.00 175.55 173.55 3jyi s SER 98 N -3.28 4.16 0.43 -0.18 0.15 -1.26 -4.89 113.70 108.83 3jyi s SER 98 Ca 0.37 -0.68 0.27 0.00 0.70 0.00 0.00 55.95 56.60 3jyi s SER 98 Cb 0.02 -0.65 1.33 0.00 -1.71 0.00 0.00 66.02 65.01 3jyi s SER 98 CO 0.22 0.07 1.69 -0.61 1.20 0.00 0.00 173.24 175.81 3jyi h GLN 99 N 2.59 0.18 0.00 5.44 5.75 -1.98 0.10 115.11 127.19 3jyi h GLN 99 Ca -0.45 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.04 3jyi h GLN 99 Cb 1.22 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 29.73 3jyi h GLN 99 CO 0.56 0.12 0.00 -1.71 -2.65 0.00 0.00 178.83 175.15 3jyi n ASN 100 N -4.61 0.00 0.00 -0.69 5.15 -1.26 -2.78 115.26 111.07 3jyi n ASN 100 Ca 0.32 0.49 -0.08 0.00 -0.60 0.00 0.00 54.58 54.70 3jyi n ASN 100 Cb 1.23 -0.49 -0.13 0.00 -0.53 0.00 0.00 39.78 39.85 3jyi n ASN 100 CO 0.00 0.00 0.00 0.44 1.40 0.00 0.00 177.26 179.10 3jyi h ASP 101 N 0.00 0.01 -2.15 1.20 3.32 -1.18 -3.47 116.42 114.16 3jyi h ASP 101 Ca 0.00 -0.02 -0.60 0.00 0.02 0.00 0.00 57.03 56.43 3jyi h ASP 101 Cb 0.33 -0.00 0.05 0.00 0.22 0.00 0.00 39.33 39.92 3jyi h ASP 101 CO 0.00 1.02 0.79 0.18 -1.72 0.00 0.00 179.24 179.51 3jyi n LEU 102 N -3.14 2.93 0.00 1.55 4.32 -1.12 -4.90 117.00 116.65 3jyi n LEU 102 Ca -0.12 1.07 -0.14 0.00 -0.02 0.00 0.00 56.01 56.80 3jyi n LEU 102 Cb 1.02 -1.38 -0.00 0.00 -1.62 0.00 0.00 43.42 41.44 3jyi n LEU 102 CO 0.46 -0.36 0.02 1.33 -1.22 0.00 0.00 177.39 177.61 3jyi n VAL 103 N 3.55 0.00 -1.68 4.08 0.24 -1.26 -5.07 118.33 118.19 3jyi n VAL 103 Ca 0.18 -1.18 -0.44 0.00 -2.04 0.00 0.00 64.34 60.86 3jyi n VAL 103 Cb 0.27 -0.20 -0.02 0.00 -1.47 0.00 0.00 33.84 32.42 3jyi n VAL 103 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 3jyi n GLU 104 N -1.14 2.11 -2.74 7.34 2.13 -1.26 -4.07 120.64 123.01 3jyi n GLU 104 Ca -0.02 0.75 -0.05 0.00 0.66 0.00 0.00 57.16 58.50 3jyi n GLU 104 Cb 0.34 -2.42 0.01 0.00 0.27 0.00 0.00 31.44 29.63 3jyi n GLU 104 CO 0.00 0.00 0.00 0.98 -0.41 0.00 0.00 177.13 177.70 3jyi n TYR 105 N 1.87 -3.01 -3.16 4.31 9.36 -1.26 -4.60 117.16 120.68 3jyi n TYR 105 Ca 0.11 1.20 -0.23 0.00 3.32 0.00 0.00 57.90 62.29 3jyi n TYR 105 Cb 0.32 -3.82 -0.05 0.00 -0.63 0.00 0.00 39.34 35.17 3jyi n TYR 105 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 3jyi n SER 106 N -0.64 2.23 -0.30 2.98 7.64 -1.26 -1.92 113.62 122.35 3jyi n SER 106 Ca 0.08 -3.21 0.09 0.00 1.01 0.00 0.00 58.87 56.84 3jyi n SER 106 Cb 0.43 -0.62 0.24 0.00 -1.01 0.00 0.00 64.21 63.26 3jyi n SER 106 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3jyi h PRO 107 N 3.40 0.55 0.00 1.43 0.13 -1.95 -1.83 132.00 133.73 3jyi h PRO 107 Ca 0.12 -0.03 -0.38 0.00 -0.87 0.00 0.00 66.00 64.84 3jyi h PRO 107 Cb 0.77 -0.12 -0.07 0.00 0.13 0.00 0.00 31.00 31.70 3jyi h PRO 107 CO 0.64 0.37 -2.42 1.55 -0.23 0.00 0.00 178.00 177.90 3jyi n VAL 108 N -4.91 1.43 0.06 1.56 3.14 -1.26 -4.50 118.33 113.84 3jyi n VAL 108 Ca 0.18 -0.72 -0.02 0.00 -2.96 0.00 0.00 64.34 60.82 3jyi n VAL 108 Cb 0.49 -0.90 0.25 0.00 -1.06 0.00 0.00 33.84 32.62 3jyi n VAL 108 CO 0.00 0.00 0.00 0.71 -6.46 0.00 0.00 176.83 171.08 3jyi h THR 109 N 0.00 1.26 -0.67 1.55 1.35 -1.96 -2.41 112.91 112.03 3jyi h THR 109 Ca -0.56 -1.23 0.19 0.00 -0.55 0.00 0.00 66.41 64.26 3jyi h THR 109 Cb 2.08 1.41 -0.03 0.00 -1.73 0.00 0.00 68.15 69.88 3jyi h THR 109 CO -0.02 0.38 0.67 -0.33 -0.25 0.00 0.00 175.52 175.96 3jyi h GLU 110 N 0.32 0.00 -0.73 4.72 5.08 -1.56 -2.65 114.58 119.77 3jyi h GLU 110 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3jyi h GLU 110 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3jyi h GLU 110 CO 0.05 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.69 3jyi n LYS 111 N -3.71 2.70 -2.72 2.33 5.02 -0.90 -4.34 118.16 116.54 3jyi n LYS 111 Ca 0.14 -2.64 -0.05 0.00 -2.02 0.00 0.00 58.31 53.73 3jyi n LYS 111 Cb 0.91 -1.57 0.04 0.00 -0.02 0.00 0.00 35.03 34.39 3jyi n LYS 111 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3jyi n HIS 112 N 1.66 1.42 -0.07 2.13 8.25 -1.00 -4.87 115.22 122.73 3jyi n HIS 112 Ca 0.25 -2.34 -0.14 0.00 -0.26 0.00 0.00 57.72 55.22 3jyi n HIS 112 Cb 0.62 -0.27 -0.03 0.00 1.12 0.00 0.00 29.99 31.43 3jyi n HIS 112 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3jyi h LEU 113 N 2.68 0.94 0.03 2.41 3.38 -1.76 -1.01 115.31 121.98 3jyi h LEU 113 Ca -0.08 -0.50 -0.12 0.00 0.09 0.00 0.00 57.88 57.27 3jyi h LEU 113 Cb 1.26 -0.27 0.01 0.00 0.09 0.00 0.00 40.66 41.75 3jyi h LEU 113 CO 0.33 1.29 -0.50 0.71 0.09 0.00 0.00 178.44 180.36 3jyi h THR 114 N 0.65 1.51 0.00 0.22 1.35 -1.90 -3.38 112.91 111.36 3jyi h THR 114 Ca 0.02 -2.17 0.00 0.00 -0.55 0.00 0.00 66.41 63.70 3jyi h THR 114 Cb 1.14 2.86 0.00 0.00 -1.73 0.00 0.00 68.15 70.42 3jyi h THR 114 CO 0.12 0.61 -0.97 -0.90 -0.25 0.00 0.00 175.52 174.13 3jyi n ASP 115 N -4.31 0.67 -0.63 5.36 5.75 -1.25 -5.04 116.55 117.10 3jyi n ASP 115 Ca -0.11 -0.43 0.02 0.00 -0.01 0.00 0.00 54.79 54.27 3jyi n ASP 115 Cb 0.64 0.82 -0.01 0.00 -1.03 0.00 0.00 41.12 41.54 3jyi n ASP 115 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3jyi n GLY 116 N 1.42 -1.55 3.11 6.12 0.00 -0.38 -4.93 105.19 108.99 3jyi n GLY 116 Ca 0.03 -1.20 -0.10 0.00 0.00 0.00 0.00 46.02 44.75 3jyi n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3jyi s MET 117 N -0.33 0.56 0.56 1.61 -1.94 -0.35 -4.89 119.30 114.52 3jyi s MET 117 Ca 0.00 -0.63 -0.08 0.00 -1.71 0.00 0.00 55.69 53.27 3jyi s MET 117 Cb 0.00 0.22 -0.03 0.00 2.01 0.00 0.00 34.83 37.03 3jyi s MET 117 CO 0.00 -0.14 0.91 0.95 -0.01 0.00 0.00 175.02 176.73 3jyi s THR 118 N -2.20 4.64 0.28 2.05 -4.23 -1.26 0.02 115.64 114.95 3jyi s THR 118 Ca -0.08 0.47 0.01 0.00 -1.18 0.00 0.00 61.69 60.90 3jyi s THR 118 Cb -0.03 -3.81 0.28 0.00 1.34 0.00 0.00 72.50 70.28 3jyi s THR 118 CO -0.03 -0.92 1.83 0.58 -0.54 0.00 0.00 174.62 175.54 3jyi h VAL 119 N -0.07 0.91 -0.13 2.29 2.07 -1.19 -0.04 116.25 120.09 3jyi h VAL 119 Ca -0.46 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 66.76 3jyi h VAL 119 Cb 1.21 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 3jyi h VAL 119 CO 0.62 0.18 -0.04 -0.09 0.02 0.00 0.00 177.57 178.25 3jyi h ARG 120 N 0.97 -0.02 -0.00 1.57 2.43 -1.49 -1.14 114.38 116.71 3jyi h ARG 120 Ca 0.49 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.60 3jyi h ARG 120 Cb 0.50 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 3jyi h ARG 120 CO -0.27 -0.01 -0.32 0.93 -1.51 0.00 0.00 179.97 178.79 3jyi h GLU 121 N -0.02 0.00 -0.11 0.20 5.08 -1.61 -1.63 114.58 116.49 3jyi h GLU 121 Ca 0.07 -0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.24 3jyi h GLU 121 Cb 0.12 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.38 3jyi h GLU 121 CO -0.15 0.32 -0.66 -0.07 -1.00 0.00 0.00 179.01 177.45 3jyi h LEU 122 N 0.00 0.76 -0.70 1.33 4.07 -0.70 -1.38 115.31 118.69 3jyi h LEU 122 Ca -0.00 -0.65 -0.11 0.00 0.08 0.00 0.00 57.88 57.19 3jyi h LEU 122 Cb 0.56 -0.23 -0.01 0.00 1.08 0.00 0.00 40.66 42.06 3jyi h LEU 122 CO 0.04 1.30 -0.23 0.00 -1.08 0.00 0.00 178.44 178.47 3jyi h SER 124 N 0.66 0.46 -0.29 0.00 0.87 -1.30 -2.06 113.55 111.89 3jyi h SER 124 Ca 0.09 -0.13 -0.09 0.00 -1.23 0.00 0.00 61.79 60.43 3jyi h SER 124 Cb 0.74 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 3jyi h SER 124 CO 0.06 0.46 -0.14 0.00 -0.53 0.00 0.00 176.83 176.68 3jyi h ALA 125 N 1.02 1.02 -0.00 6.23 0.00 -0.93 0.10 119.26 126.71 3jyi h ALA 125 Ca 0.12 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 3jyi h ALA 125 Cb 0.12 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 3jyi h ALA 125 CO -0.02 0.59 -0.00 0.00 0.00 0.00 0.00 179.25 179.82 3jyi h ALA 126 N 1.20 0.00 0.02 0.00 0.00 -0.71 -1.68 119.26 118.09 3jyi h ALA 126 Ca 0.11 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3jyi h ALA 126 Cb 0.60 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.40 3jyi h ALA 126 CO 0.04 -0.31 -0.44 0.82 0.00 0.00 0.00 179.25 179.36 3jyi h ILE 127 N -0.38 1.52 -0.05 0.00 2.04 -1.38 -1.48 117.51 117.78 3jyi h ILE 127 Ca 0.00 -2.13 -0.25 0.00 1.00 0.00 0.00 64.86 63.48 3jyi h ILE 127 Cb 0.38 2.84 0.02 0.00 -0.74 0.00 0.00 36.82 39.32 3jyi h ILE 127 CO 0.00 0.59 -0.96 0.74 0.00 0.00 0.00 178.15 178.53 3jyi h THR 128 N -0.39 1.28 -0.03 -0.27 2.02 -0.91 -3.35 112.91 111.25 3jyi h THR 128 Ca -0.06 -2.16 0.00 0.00 0.77 0.00 0.00 66.41 64.96 3jyi h THR 128 Cb 1.22 2.27 0.00 0.00 -1.74 0.00 0.00 68.15 69.89 3jyi h THR 128 CO 0.09 0.67 0.00 0.23 0.37 0.00 0.00 175.52 176.88 3jyi n MET 129 N -3.89 0.29 -2.10 6.66 2.81 -0.71 -1.68 117.12 118.50 3jyi n MET 129 Ca -0.10 -0.96 -0.19 0.00 -1.81 0.00 0.00 57.70 54.63 3jyi n MET 129 Cb 0.84 -1.09 -0.04 0.00 -0.71 0.00 0.00 33.22 32.22 3jyi n MET 129 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 3jyi n SER 130 N 0.20 -5.39 -4.68 7.83 2.88 -0.56 -4.90 113.62 109.00 3jyi n SER 130 Ca 0.03 0.19 -0.46 0.00 -1.33 0.00 0.00 58.87 57.30 3jyi n SER 130 Cb 0.16 -4.60 -0.04 0.00 -0.75 0.00 0.00 64.21 58.97 3jyi n SER 130 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 3jyi n ASP 131 N -1.70 3.57 -0.02 -3.46 4.64 -0.72 -4.93 116.55 113.92 3jyi n ASP 131 Ca -0.22 0.99 -0.15 0.00 -1.38 0.00 0.00 54.79 54.03 3jyi n ASP 131 Cb 0.66 -1.43 -0.10 0.00 -1.04 0.00 0.00 41.12 39.21 3jyi n ASP 131 CO 0.00 0.00 0.00 0.78 -0.82 0.00 0.00 177.20 177.16 3jyi h ASN 132 N 8.64 0.33 -0.77 1.67 2.35 -1.64 -2.92 115.58 123.24 3jyi h ASN 132 Ca -0.48 -0.71 0.01 0.00 -0.55 0.00 0.00 56.30 54.58 3jyi h ASN 132 Cb 1.26 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 39.49 3jyi h ASN 132 CO 0.94 0.99 0.51 0.74 -1.65 0.00 0.00 177.43 178.95 3jyi h THR 133 N -0.30 1.19 -0.78 2.81 2.02 -1.85 -1.59 112.91 114.41 3jyi h THR 133 Ca -0.03 -0.36 0.15 0.00 0.77 0.00 0.00 66.41 66.94 3jyi h THR 133 Cb 1.01 0.06 -0.10 0.00 -1.74 0.00 0.00 68.15 67.38 3jyi h THR 133 CO 0.06 0.19 0.33 0.00 0.37 0.00 0.00 175.52 176.47 3jyi h ALA 134 N 1.29 1.12 -0.32 6.16 0.00 -1.90 0.17 119.26 125.77 3jyi h ALA 134 Ca 0.29 0.11 -0.10 0.00 0.00 0.00 0.00 54.91 55.21 3jyi h ALA 134 Cb -0.10 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3jyi h ALA 134 CO -0.07 -0.20 -0.18 0.00 0.00 0.00 0.00 179.25 178.81 3jyi h ALA 135 N 1.56 0.45 0.20 0.00 0.00 -1.15 -2.49 119.26 117.83 3jyi h ALA 135 Ca 0.43 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3jyi h ALA 135 Cb 0.65 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 3jyi h ALA 135 CO -0.40 0.37 -0.26 -0.91 0.00 0.00 0.00 179.25 178.05 3jyi h ASN 136 N 0.44 -0.71 -0.91 0.00 2.35 -0.67 -0.10 115.58 115.97 3jyi h ASN 136 Ca 0.07 0.07 0.24 0.00 -0.55 0.00 0.00 56.30 56.13 3jyi h ASN 136 Cb 0.72 0.25 -0.13 0.00 0.05 0.00 0.00 38.32 39.21 3jyi h ASN 136 CO 0.05 -0.36 0.41 -0.07 -1.65 0.00 0.00 177.43 175.80 3jyi h LEU 137 N -0.51 0.33 -0.52 1.61 -0.00 -0.95 0.94 115.31 116.21 3jyi h LEU 137 Ca 0.01 0.16 -0.17 0.00 -0.00 0.00 0.00 57.88 57.89 3jyi h LEU 137 Cb 0.50 0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 41.30 3jyi h LEU 137 CO -0.09 -0.03 -0.68 -0.07 -0.00 0.00 0.00 178.44 177.56 3jyi h LEU 138 N 0.38 0.35 -0.37 1.67 3.38 -0.96 -2.17 115.31 117.58 3jyi h LEU 138 Ca 0.59 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 58.33 3jyi h LEU 138 Cb 1.15 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 3jyi h LEU 138 CO -0.55 0.92 0.19 -0.07 0.09 0.00 0.00 178.44 179.02 3jyi h LEU 139 N 0.21 0.47 -0.42 1.67 3.38 0.10 -2.66 115.31 118.05 3jyi h LEU 139 Ca -0.02 -0.10 0.08 0.00 0.09 0.00 0.00 57.88 57.93 3jyi h LEU 139 Cb 1.23 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 3jyi h LEU 139 CO 0.11 0.44 0.00 0.74 0.09 0.00 0.00 178.44 179.82 3jyi h THR 140 N 0.46 0.68 -1.02 0.22 2.02 -1.02 0.32 112.91 114.57 3jyi h THR 140 Ca 0.13 -0.04 0.42 0.00 0.77 0.00 0.00 66.41 67.69 3jyi h THR 140 Cb 0.08 0.56 -0.18 0.00 -1.74 0.00 0.00 68.15 66.87 3jyi h THR 140 CO -0.02 0.02 0.56 0.74 0.37 0.00 0.00 175.52 177.19 3jyi h THR 141 N 0.11 0.00 -0.01 3.16 2.02 -1.03 -2.09 112.91 115.06 3jyi h THR 141 Ca 0.21 -0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.39 3jyi h THR 141 Cb 0.30 -0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.71 3jyi h THR 141 CO -0.35 0.00 -0.07 2.30 0.37 0.00 0.00 175.52 177.77 3jyi n ILE 142 N -5.23 0.00 0.00 3.11 -5.35 -0.53 -4.98 119.36 106.38 3jyi n ILE 142 Ca 0.38 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.40 3jyi n ILE 142 Cb 1.30 1.18 0.00 0.00 -1.74 0.00 0.00 39.64 40.38 3jyi n ILE 142 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3jyi n GLY 143 N 0.68 1.41 0.00 3.28 0.00 -0.37 -4.75 105.19 105.44 3jyi n GLY 143 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3jyi n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3jyi n GLY 144 N -1.35 -0.85 0.32 -0.02 0.00 0.97 -4.27 105.19 99.99 3jyi n GLY 144 Ca 0.00 -1.69 0.16 0.00 0.00 0.00 0.00 46.02 44.49 3jyi n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3jyi h PRO 145 N 0.00 0.22 -0.58 1.61 0.11 -1.85 -0.10 132.00 131.40 3jyi h PRO 145 Ca 0.00 -0.01 0.06 0.00 0.11 0.00 0.00 66.00 66.15 3jyi h PRO 145 Cb 0.00 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.03 3jyi h PRO 145 CO 0.00 0.14 0.39 0.87 -0.21 0.00 0.00 178.00 179.19 3jyi h LYS 146 N 0.23 0.56 0.12 1.05 1.57 -1.80 -1.60 116.57 116.69 3jyi h LYS 146 Ca 0.60 -0.03 -0.29 0.00 -1.87 0.00 0.00 60.65 59.06 3jyi h LYS 146 Cb 1.27 -0.13 0.02 0.00 0.08 0.00 0.00 32.23 33.48 3jyi h LYS 146 CO -0.66 0.37 -1.23 0.93 -0.57 0.00 0.00 179.45 178.29 3jyi h GLU 147 N 0.58 0.50 -0.47 3.15 4.39 -1.19 -1.42 114.58 120.11 3jyi h GLU 147 Ca 0.25 -0.70 0.07 0.00 0.34 0.00 0.00 59.36 59.32 3jyi h GLU 147 Cb 0.26 0.24 -0.06 0.00 -0.10 0.00 0.00 28.75 29.08 3jyi h GLU 147 CO -0.07 1.31 0.13 1.25 -1.16 0.00 0.00 179.01 180.47 3jyi h LEU 148 N 0.20 0.09 -1.04 1.33 6.46 -1.28 0.10 115.31 121.17 3jyi h LEU 148 Ca -0.17 0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.65 3jyi h LEU 148 Cb 1.91 0.08 -0.04 0.00 -0.73 0.00 0.00 40.66 41.88 3jyi h LEU 148 CO 0.22 0.08 0.44 0.74 -0.62 0.00 0.00 178.44 179.30 3jyi h THR 149 N 0.28 1.23 -0.53 1.05 2.02 -1.22 -1.65 112.91 114.10 3jyi h THR 149 Ca 0.23 -0.58 -0.04 0.00 0.77 0.00 0.00 66.41 66.78 3jyi h THR 149 Cb 0.27 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 66.81 3jyi h THR 149 CO -0.27 0.26 0.16 0.00 0.37 0.00 0.00 175.52 176.04 3jyi h ALA 150 N 1.37 0.70 -0.58 6.16 0.00 -0.57 -2.20 119.26 124.13 3jyi h ALA 150 Ca 0.28 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3jyi h ALA 150 Cb 0.02 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3jyi h ALA 150 CO -0.05 0.37 0.38 0.35 0.00 0.00 0.00 179.25 180.30 3jyi h PHE 151 N 0.73 0.72 -0.53 0.00 3.57 -0.02 -1.81 116.94 119.61 3jyi h PHE 151 Ca 0.17 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.70 3jyi h PHE 151 Cb 0.29 -0.24 -0.03 0.00 2.79 0.00 0.00 35.95 38.76 3jyi h PHE 151 CO 0.02 0.45 0.33 -0.07 -2.23 0.00 0.00 178.31 176.81 3jyi h LEU 152 N 0.78 0.55 -0.65 0.59 4.07 -1.22 -2.76 115.31 116.67 3jyi h LEU 152 Ca 0.21 -0.00 -0.01 0.00 0.08 0.00 0.00 57.88 58.16 3jyi h LEU 152 Cb -0.09 -0.12 -0.03 0.00 1.08 0.00 0.00 40.66 41.50 3jyi h LEU 152 CO -0.05 0.39 0.37 -0.74 -1.08 0.00 0.00 178.44 177.33 3jyi h HIS 153 N 0.66 0.88 0.00 1.13 2.76 -1.07 -1.83 115.15 117.68 3jyi h HIS 153 Ca 0.20 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.36 3jyi h HIS 153 Cb -0.02 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.66 3jyi h HIS 153 CO -0.05 0.62 0.00 0.09 -1.30 0.00 0.00 177.93 177.29 3jyi n ASN 154 N -4.55 0.59 -0.89 3.26 3.02 -0.71 -1.47 115.26 114.51 3jyi n ASN 154 Ca 0.05 0.67 0.09 0.00 -0.03 0.00 0.00 54.58 55.35 3jyi n ASN 154 Cb 0.08 -0.78 0.18 0.00 -0.61 0.00 0.00 39.78 38.64 3jyi n ASN 154 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 3jyi n MET 155 N -2.18 2.31 0.00 3.52 0.00 -0.97 -4.96 117.12 114.85 3jyi n MET 155 Ca 0.01 -2.07 0.00 0.00 0.00 0.00 0.00 57.70 55.64 3jyi n MET 155 Cb 0.18 -1.39 0.00 0.00 0.00 0.00 0.00 33.22 32.01 3jyi n MET 155 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3jyi n GLY 156 N 1.05 0.86 3.36 3.17 0.00 -0.54 -5.05 105.19 108.03 3jyi n GLY 156 Ca 0.15 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.72 3jyi n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3jyi s ASP 157 N -2.19 6.19 -0.25 1.61 -1.08 -0.73 -4.89 116.67 115.33 3jyi s ASP 157 Ca 0.00 -1.53 0.12 0.00 -0.52 0.00 0.00 52.55 50.62 3jyi s ASP 157 Cb 0.00 -2.26 0.75 0.00 -1.46 0.00 0.00 42.92 39.95 3jyi s ASP 157 CO 0.00 -0.97 1.69 1.41 0.52 0.00 0.00 175.17 177.82 3jyi n HIS 158 N 5.83 2.07 0.00 -5.34 8.25 -1.26 -3.04 115.22 121.72 3jyi n HIS 158 Ca -0.11 -0.82 0.00 0.00 -0.26 0.00 0.00 57.72 56.53 3jyi n HIS 158 Cb 0.42 -0.54 0.00 0.00 1.12 0.00 0.00 29.99 30.98 3jyi n HIS 158 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3jyi n VAL 159 N 0.37 0.00 -1.98 1.59 0.31 -1.26 -5.03 118.33 112.33 3jyi n VAL 159 Ca 0.30 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 64.22 3jyi n VAL 159 Cb 1.20 -1.29 -0.01 0.00 -0.91 0.00 0.00 33.84 32.82 3jyi n VAL 159 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3jyi s THR 160 N -1.99 2.43 -0.22 2.52 2.01 -1.26 -4.74 115.64 114.39 3jyi s THR 160 Ca 0.00 0.43 -0.12 0.00 0.31 0.00 0.00 61.69 62.31 3jyi s THR 160 Cb 0.00 -3.27 0.07 0.00 0.01 0.00 0.00 72.50 69.30 3jyi s THR 160 CO 0.00 0.10 0.53 0.00 -0.69 0.00 0.00 174.62 174.56 3jyi s ARG 161 N -1.80 0.54 -0.10 4.92 1.70 -0.96 -4.88 118.95 118.37 3jyi s ARG 161 Ca 0.51 0.98 -0.01 0.00 -0.47 0.00 0.00 55.73 56.74 3jyi s ARG 161 Cb -0.43 0.05 -0.03 0.00 -0.57 0.00 0.00 34.95 33.98 3jyi s ARG 161 CO 0.56 -0.15 -0.04 -1.17 -1.08 0.00 0.00 175.30 173.42 3jyi s LEU 162 N 1.49 3.29 0.00 -1.89 2.96 -1.26 -2.88 118.68 120.39 3jyi s LEU 162 Ca -0.10 -0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.80 3jyi s LEU 162 Cb -0.07 -1.75 0.00 0.00 0.50 0.00 0.00 46.19 44.87 3jyi s LEU 162 CO -0.16 0.31 0.00 0.47 -1.32 0.00 0.00 176.35 175.65 3jyi n ASP 163 N 2.59 2.98 -4.75 3.68 8.00 -1.26 -4.22 116.55 123.57 3jyi n ASP 163 Ca -0.18 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 54.99 3jyi n ASP 163 Cb 0.53 0.23 -0.07 0.00 -0.02 0.00 0.00 41.12 41.79 3jyi n ASP 163 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3jyi s ARG 164 N -1.63 2.22 0.53 -1.24 0.52 -1.26 -4.87 118.95 113.21 3jyi s ARG 164 Ca 0.00 -2.44 0.07 0.00 -0.52 0.00 0.00 55.73 52.84 3jyi s ARG 164 Cb 0.00 -1.47 0.07 0.00 0.52 0.00 0.00 34.95 34.07 3jyi s ARG 164 CO 0.00 -0.41 0.56 0.91 0.02 0.00 0.00 175.30 176.38 3jyi n TRP 165 N -1.29 -1.43 -2.86 -0.53 7.02 -1.26 -4.75 117.44 112.34 3jyi n TRP 165 Ca -0.21 -2.09 -0.39 0.00 -1.02 0.00 0.00 57.50 53.79 3jyi n TRP 165 Cb 0.67 -0.47 -0.06 0.00 -2.42 0.00 0.00 31.31 29.03 3jyi n TRP 165 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 3jyi s GLU 166 N -4.28 4.68 0.00 -0.99 0.41 -1.26 -1.66 118.70 115.59 3jyi s GLU 166 Ca 0.42 1.31 0.26 0.00 -0.41 0.00 0.00 54.97 56.56 3jyi s GLU 166 Cb -0.03 -3.17 0.69 0.00 -1.78 0.00 0.00 34.13 29.83 3jyi s GLU 166 CO 0.27 0.49 1.54 -2.30 -0.49 0.00 0.00 175.26 174.77 3jyi n PRO 167 N 1.32 1.95 0.01 0.39 -0.02 -1.26 -4.94 135.00 132.45 3jyi n PRO 167 Ca -0.03 -1.37 0.10 0.00 -2.02 0.00 0.00 63.50 60.18 3jyi n PRO 167 Cb 0.48 -1.47 0.42 0.00 -0.02 0.00 0.00 33.50 32.92 3jyi n PRO 167 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 3jyi n GLU 168 N 0.67 0.02 0.00 -0.52 0.00 -0.89 -3.04 120.64 116.88 3jyi n GLU 168 Ca 0.17 0.18 0.10 0.00 0.00 0.00 0.00 57.16 57.61 3jyi n GLU 168 Cb 0.46 -1.53 0.51 0.00 0.00 0.00 0.00 31.44 30.88 3jyi n GLU 168 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.13 178.60 3jyi n LEU 169 N -1.56 0.00 -2.20 -1.84 -0.00 -0.67 -3.31 117.00 107.42 3jyi n LEU 169 Ca 0.05 0.33 -0.30 0.00 -0.00 0.00 0.00 56.01 56.08 3jyi n LEU 169 Cb 0.24 -0.33 0.05 0.00 -0.00 0.00 0.00 43.42 43.38 3jyi n LEU 169 CO 0.19 -0.10 0.90 0.61 -0.00 0.00 0.00 177.39 178.99 3jyi n GLY 170 N 0.50 6.11 0.10 1.47 0.00 -1.17 -4.62 105.19 107.58 3jyi n GLY 170 Ca 0.09 -2.47 -0.13 0.00 0.00 0.00 0.00 46.02 43.51 3jyi n GLY 170 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3jyi h GLU 171 N 2.09 0.11 -6.02 1.61 4.81 -1.82 -0.84 114.58 114.52 3jyi h GLU 171 Ca 0.50 -0.19 -0.42 0.00 -0.13 0.00 0.00 59.36 59.12 3jyi h GLU 171 Cb 1.12 0.07 0.07 0.00 0.63 0.00 0.00 28.75 30.64 3jyi h GLU 171 CO 1.23 0.81 -0.74 0.00 -0.73 0.00 0.00 179.01 179.59 3jyi n ALA 172 N -2.68 -1.46 -1.73 2.92 0.00 -1.26 -4.58 120.51 111.72 3jyi n ALA 172 Ca -0.20 0.21 -0.42 0.00 0.00 0.00 0.00 53.44 53.03 3jyi n ALA 172 Cb 1.04 -4.40 -0.03 0.00 0.00 0.00 0.00 19.45 16.07 3jyi n ALA 172 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3jyi n ILE 173 N -4.71 0.22 -1.62 0.00 5.41 -1.26 -4.89 119.36 112.50 3jyi n ILE 173 Ca -0.05 -0.05 -0.47 0.00 1.00 0.00 0.00 62.75 63.18 3jyi n ILE 173 Cb 0.57 -2.00 -0.03 0.00 -0.71 0.00 0.00 39.64 37.47 3jyi n ILE 173 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 3jyi n PRO 174 N 3.60 1.59 0.00 0.38 -0.02 -1.26 -1.27 135.00 138.02 3jyi n PRO 174 Ca 0.14 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 3jyi n PRO 174 Cb 0.35 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 3jyi n PRO 174 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3jyi n ASN 175 N 2.12 0.00 -4.66 2.55 3.02 -1.26 -4.97 115.26 112.05 3jyi n ASN 175 Ca 0.13 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.26 3jyi n ASN 175 Cb 0.28 -0.35 -0.03 0.00 -0.61 0.00 0.00 39.78 39.07 3jyi n ASN 175 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3jyi s ASP 176 N -2.47 6.69 0.00 6.41 -1.08 -0.40 -4.90 116.67 120.93 3jyi s ASP 176 Ca 0.00 2.21 0.27 0.00 -0.52 0.00 0.00 52.55 54.51 3jyi s ASP 176 Cb 0.00 -2.54 0.94 0.00 -1.46 0.00 0.00 42.92 39.86 3jyi s ASP 176 CO 0.00 -0.90 1.68 -0.62 0.52 0.00 0.00 175.17 175.85 3jyi n GLU 177 N 6.91 1.45 -2.04 4.34 1.02 -1.26 -4.83 120.64 126.23 3jyi n GLU 177 Ca 0.17 -0.86 -0.41 0.00 -0.02 0.00 0.00 57.16 56.04 3jyi n GLU 177 Cb 0.43 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.35 3jyi n GLU 177 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3jyi s ARG 178 N -2.14 4.29 -1.08 3.49 0.52 -1.26 -3.54 118.95 119.23 3jyi s ARG 178 Ca 0.34 2.29 -0.05 0.00 -0.52 0.00 0.00 55.73 57.78 3jyi s ARG 178 Cb 0.20 -3.08 0.01 0.00 0.52 0.00 0.00 34.95 32.60 3jyi s ARG 178 CO 0.39 -0.33 0.71 -0.25 0.02 0.00 0.00 175.30 175.84 3jyi n ASP 179 N 1.48 -5.17 -4.48 0.23 8.00 -1.14 -4.91 116.55 110.56 3jyi n ASP 179 Ca 0.03 -0.33 -0.24 0.00 0.71 0.00 0.00 54.79 54.96 3jyi n ASP 179 Cb 0.41 -3.87 -0.10 0.00 -0.02 0.00 0.00 41.12 37.53 3jyi n ASP 179 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3jyi s THR 180 N -3.15 2.34 0.32 -3.53 -4.23 -1.14 -1.28 115.64 104.96 3jyi s THR 180 Ca 0.35 -2.33 0.05 0.00 -1.18 0.00 0.00 61.69 58.58 3jyi s THR 180 Cb -0.16 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.26 3jyi s THR 180 CO 0.44 -0.35 0.29 0.28 -0.54 0.00 0.00 174.62 174.74 3jyi s THR 181 N -2.58 0.00 0.06 3.99 -1.32 -0.49 -2.26 115.64 113.04 3jyi s THR 181 Ca 0.30 -1.94 0.05 0.00 -1.21 0.00 0.00 61.69 58.89 3jyi s THR 181 Cb -0.02 -2.52 -0.04 0.00 -1.51 0.00 0.00 72.50 68.41 3jyi s THR 181 CO 0.15 0.00 -0.06 -0.04 -2.21 0.00 0.00 174.62 172.46 3jyi s MET 182 N -3.48 2.42 0.24 7.08 -1.94 -1.26 -1.13 119.30 121.23 3jyi s MET 182 Ca 0.39 -0.85 -0.05 0.00 -1.71 0.00 0.00 55.69 53.48 3jyi s MET 182 Cb 0.03 -2.45 0.46 0.00 2.01 0.00 0.00 34.83 34.87 3jyi s MET 182 CO 0.25 0.56 1.71 -1.35 -0.01 0.00 0.00 175.02 176.17 3jyi h PRO 183 N 3.95 0.35 -0.91 2.03 0.11 -1.68 -0.81 132.00 135.03 3jyi h PRO 183 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 3jyi h PRO 183 Cb 1.17 -0.08 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 3jyi h PRO 183 CO 0.55 0.23 0.53 0.00 -0.21 0.00 0.00 178.00 179.10 3jyi h ALA 184 N 1.57 1.17 0.08 -0.75 0.00 -1.38 -2.70 119.26 117.24 3jyi h ALA 184 Ca 0.41 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 3jyi h ALA 184 Cb 0.66 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3jyi h ALA 184 CO -0.44 0.65 -0.04 0.00 0.00 0.00 0.00 179.25 179.42 3jyi h ALA 185 N 1.29 -0.11 -0.97 0.00 0.00 -1.48 -2.10 119.26 115.90 3jyi h ALA 185 Ca 0.33 -0.25 0.19 0.00 0.00 0.00 0.00 54.91 55.17 3jyi h ALA 185 Cb -0.02 0.04 -0.11 0.00 0.00 0.00 0.00 17.79 17.71 3jyi h ALA 185 CO -0.06 -0.28 0.56 1.98 0.00 0.00 0.00 179.25 181.45 3jyi h MET 186 N -0.66 0.67 -0.03 0.00 -1.53 -1.21 0.16 114.93 112.32 3jyi h MET 186 Ca -0.01 -0.04 -0.05 0.00 -3.44 0.00 0.00 59.70 56.15 3jyi h MET 186 Cb 0.54 -0.15 0.00 0.00 -0.55 0.00 0.00 31.60 31.44 3jyi h MET 186 CO 0.02 0.44 -0.19 0.00 0.14 0.00 0.00 176.91 177.32 3jyi h ALA 187 N 1.65 0.07 -0.55 0.39 0.00 -1.50 0.26 119.26 119.57 3jyi h ALA 187 Ca 0.56 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 55.09 3jyi h ALA 187 Cb 0.91 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 3jyi h ALA 187 CO -0.40 0.04 0.36 1.15 0.00 0.00 0.00 179.25 180.41 3jyi h THR 188 N -0.40 1.09 0.07 0.00 2.02 -0.98 -1.39 112.91 113.32 3jyi h THR 188 Ca -0.02 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 3jyi h THR 188 Cb 0.87 0.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 3jyi h THR 188 CO 0.04 0.12 -0.03 0.74 0.37 0.00 0.00 175.52 176.76 3jyi h THR 189 N 0.67 1.17 -0.97 3.16 2.02 -0.53 -2.47 112.91 115.95 3jyi h THR 189 Ca 0.21 -1.47 0.22 0.00 0.77 0.00 0.00 66.41 66.14 3jyi h THR 189 Cb 0.03 2.03 -0.08 0.00 -1.74 0.00 0.00 68.15 68.39 3jyi h THR 189 CO -0.05 0.33 0.62 0.25 0.37 0.00 0.00 175.52 177.04 3jyi h LEU 190 N -0.83 0.51 -0.35 2.58 5.85 -0.40 -1.03 115.31 121.63 3jyi h LEU 190 Ca -0.01 0.07 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 3jyi h LEU 190 Cb 0.61 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 3jyi h LEU 190 CO 0.02 0.17 0.02 -0.09 -0.34 0.00 0.00 178.44 178.22 3jyi h ARG 191 N 0.49 0.62 -0.83 1.25 2.43 -1.20 -1.28 114.38 115.86 3jyi h ARG 191 Ca 0.53 -0.19 -0.03 0.00 -0.81 0.00 0.00 59.98 59.48 3jyi h ARG 191 Cb 1.20 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.65 3jyi h ARG 191 CO -0.25 0.72 0.39 0.87 -1.51 0.00 0.00 179.97 180.18 3jyi h LYS 192 N 0.43 1.20 -0.53 0.20 1.57 -0.74 0.53 116.57 119.24 3jyi h LYS 192 Ca 0.10 -0.18 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3jyi h LYS 192 Cb 0.43 -0.21 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 3jyi h LYS 192 CO 0.02 0.92 0.24 -0.07 -0.57 0.00 0.00 179.45 179.99 3jyi h LEU 193 N 1.18 0.70 0.00 2.94 4.07 -1.25 -0.71 115.31 122.24 3jyi h LEU 193 Ca 0.28 -0.14 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 3jyi h LEU 193 Cb 0.13 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 41.69 3jyi h LEU 193 CO -0.03 0.64 -0.61 -0.07 -1.08 0.00 0.00 178.44 177.29 3jyi h LEU 194 N 0.71 0.00 0.00 1.67 3.38 -0.85 -3.42 115.31 116.80 3jyi h LEU 194 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3jyi h LEU 194 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3jyi h LEU 194 CO -0.02 0.03 -0.47 0.41 0.09 0.00 0.00 178.44 178.49 3jyi n THR 195 N -2.87 0.00 -1.65 0.22 -1.04 0.15 -4.89 114.28 104.19 3jyi n THR 195 Ca 0.01 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.87 3jyi n THR 195 Cb 0.56 -0.41 0.10 0.00 -1.82 0.00 0.00 70.33 68.76 3jyi n THR 195 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3jyi n GLY 196 N 1.63 -1.00 0.66 3.41 0.00 -0.27 -4.96 105.19 104.65 3jyi n GLY 196 Ca 0.00 -1.74 0.07 0.00 0.00 0.00 0.00 46.02 44.35 3jyi n GLY 196 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3jyi n GLU 197 N -2.43 1.84 -0.05 1.61 4.07 -1.26 -4.30 120.64 120.12 3jyi n GLU 197 Ca 0.09 -1.30 -0.11 0.00 -0.06 0.00 0.00 57.16 55.78 3jyi n GLU 197 Cb 0.31 -1.32 -0.05 0.00 -0.06 0.00 0.00 31.44 30.32 3jyi n GLU 197 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 3jyi h LEU 198 N 2.23 0.25 -9.82 4.31 5.85 -1.92 -3.43 115.31 112.78 3jyi h LEU 198 Ca 0.00 -0.19 -0.54 0.00 0.84 0.00 0.00 57.88 57.99 3jyi h LEU 198 Cb 0.50 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.41 3jyi h LEU 198 CO 0.00 0.37 -0.55 -0.76 -0.34 0.00 0.00 178.44 177.16 3jyi s LEU 199 N -9.78 3.79 0.72 2.25 1.02 -1.26 -4.98 118.68 110.44 3jyi s LEU 199 Ca -0.14 -0.20 -0.12 0.00 0.02 0.00 0.00 54.13 53.69 3jyi s LEU 199 Cb 0.07 -2.36 0.03 0.00 0.02 0.00 0.00 46.19 43.95 3jyi s LEU 199 CO 0.71 0.02 1.10 0.42 0.02 0.00 0.00 176.35 178.61 3jyi s THR 200 N -1.95 3.35 0.36 5.49 -4.23 -1.26 -4.72 115.64 112.68 3jyi s THR 200 Ca 0.32 0.51 0.05 0.00 -1.18 0.00 0.00 61.69 61.39 3jyi s THR 200 Cb -0.09 -3.03 0.20 0.00 1.34 0.00 0.00 72.50 70.93 3jyi s THR 200 CO 0.24 -0.50 1.94 0.17 -0.54 0.00 0.00 174.62 175.93 3jyi h LEU 201 N -0.63 0.52 -1.40 4.79 8.10 -1.97 0.75 115.31 125.47 3jyi h LEU 201 Ca -0.45 -0.06 0.05 0.00 0.11 0.00 0.00 57.88 57.53 3jyi h LEU 201 Cb 1.23 -0.13 -0.04 0.00 -0.44 0.00 0.00 40.66 41.28 3jyi h LEU 201 CO 0.53 0.50 0.46 0.00 -4.11 0.00 0.00 178.44 175.81 3jyi h ALA 202 N 1.58 1.68 0.06 0.17 0.00 -1.99 -0.09 119.26 120.68 3jyi h ALA 202 Ca 0.14 -0.03 -0.21 0.00 0.00 0.00 0.00 54.91 54.81 3jyi h ALA 202 Cb 0.17 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.77 3jyi h ALA 202 CO -0.01 0.22 -0.85 0.77 0.00 0.00 0.00 179.25 179.38 3jyi h SER 203 N 0.75 0.64 -0.60 0.00 0.02 -1.39 -1.83 113.55 111.15 3jyi h SER 203 Ca 0.29 -0.82 0.09 0.00 -0.84 0.00 0.00 61.79 60.51 3jyi h SER 203 Cb 0.19 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 62.46 3jyi h SER 203 CO -0.09 1.38 0.22 0.03 -1.14 0.00 0.00 176.83 177.24 3jyi h ARG 204 N -0.03 0.39 -0.42 3.45 3.08 -0.73 -0.80 114.38 119.33 3jyi h ARG 204 Ca -0.12 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 3jyi h ARG 204 Cb 1.57 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.51 3jyi h ARG 204 CO 0.16 0.26 0.22 0.37 -1.07 0.00 0.00 179.97 179.92 3jyi h GLN 205 N 0.40 0.58 -0.75 0.04 5.75 -1.02 -2.20 115.11 117.92 3jyi h GLN 205 Ca 0.30 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.71 3jyi h GLN 205 Cb 0.37 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.77 3jyi h GLN 205 CO -0.30 0.48 0.38 0.37 -2.65 0.00 0.00 178.83 177.10 3jyi h GLN 206 N 0.54 1.08 0.31 1.69 5.75 -0.78 0.11 115.11 123.81 3jyi h GLN 206 Ca 0.15 -0.15 -0.02 0.00 -0.15 0.00 0.00 58.65 58.48 3jyi h GLN 206 Cb 0.06 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 28.42 3jyi h GLN 206 CO -0.02 0.83 -0.15 1.25 -2.65 0.00 0.00 178.83 178.09 3jyi h LEU 207 N 1.06 -0.36 -0.93 -2.39 5.85 -0.92 -1.36 115.31 116.25 3jyi h LEU 207 Ca 0.26 -0.00 -0.09 0.00 0.84 0.00 0.00 57.88 58.89 3jyi h LEU 207 Cb 0.10 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3jyi h LEU 207 CO -0.04 -0.24 -0.17 -0.29 -0.34 0.00 0.00 178.44 177.37 3jyi h ILE 208 N -0.45 1.25 -0.38 4.05 2.10 -1.26 -2.08 117.51 120.75 3jyi h ILE 208 Ca -0.04 -1.16 0.01 0.00 1.08 0.00 0.00 64.86 64.74 3jyi h ILE 208 Cb 0.34 1.19 -0.02 0.00 -1.09 0.00 0.00 36.82 37.24 3jyi h ILE 208 CO 0.07 0.38 0.25 0.44 -1.08 0.00 0.00 178.15 178.21 3jyi h ASP 209 N 0.53 0.43 -0.13 2.19 3.32 -0.45 0.37 116.42 122.69 3jyi h ASP 209 Ca 0.09 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.00 3jyi h ASP 209 Cb 0.59 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.04 3jyi h ASP 209 CO 0.04 0.31 -0.40 -0.50 -1.72 0.00 0.00 179.24 176.97 3jyi h TRP 210 N 0.51 0.65 -0.20 4.55 6.55 -0.59 -2.90 115.95 124.53 3jyi h TRP 210 Ca 0.14 -0.26 -0.01 0.00 0.95 0.00 0.00 58.89 59.71 3jyi h TRP 210 Cb -0.05 -0.11 -0.01 0.00 -0.86 0.00 0.00 29.16 28.14 3jyi h TRP 210 CO -0.00 1.01 0.09 0.52 -1.05 0.00 0.00 178.44 179.01 3jyi h MET 211 N 0.11 0.28 -0.93 0.49 2.86 -0.99 -2.18 114.93 114.57 3jyi h MET 211 Ca -0.01 -0.04 0.25 0.00 -2.06 0.00 0.00 59.70 57.83 3jyi h MET 211 Cb 1.03 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 32.59 3jyi h MET 211 CO 0.09 0.32 0.65 1.49 1.06 0.00 0.00 176.91 180.51 3jyi h GLU 212 N 0.18 0.14 -0.25 1.72 4.81 -0.97 -0.13 114.58 120.08 3jyi h GLU 212 Ca 0.07 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3jyi h GLU 212 Cb 0.13 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.48 3jyi h GLU 212 CO -0.01 0.09 0.00 0.00 -0.73 0.00 0.00 179.01 178.37 3jyi n ALA 213 N -2.64 2.47 -1.56 2.92 0.00 -0.82 -4.87 120.51 116.00 3jyi n ALA 213 Ca 0.20 -0.49 -0.56 0.00 0.00 0.00 0.00 53.44 52.60 3jyi n ALA 213 Cb 0.91 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 19.27 3jyi n ALA 213 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3jyi n ASP 214 N 0.28 2.10 0.04 0.00 4.64 -0.07 -4.86 116.55 118.67 3jyi n ASP 214 Ca 0.11 0.80 0.11 0.00 -1.38 0.00 0.00 54.79 54.44 3jyi n ASP 214 Cb 0.25 -1.15 -0.01 0.00 -1.04 0.00 0.00 41.12 39.17 3jyi n ASP 214 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 3jyi n LYS 215 N 6.61 0.41 0.00 -0.67 4.76 -0.67 -4.84 118.16 123.75 3jyi n LYS 215 Ca 0.35 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.79 3jyi n LYS 215 Cb 0.14 -1.64 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 3jyi n LYS 215 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 3jyi n VAL 216 N -2.17 0.00 -0.90 -0.18 0.31 -1.23 -4.66 118.33 109.51 3jyi n VAL 216 Ca 0.01 0.00 -0.00 0.00 -0.01 0.00 0.00 64.34 64.34 3jyi n VAL 216 Cb 0.48 -0.24 -0.00 0.00 -0.91 0.00 0.00 33.84 33.17 3jyi n VAL 216 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3jyi n ALA 217 N -3.00 -0.00 -0.04 3.52 0.00 -1.26 -4.86 120.51 114.87 3jyi n ALA 217 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3jyi n ALA 217 Cb 0.00 -1.34 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 3jyi n ALA 217 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3jyi h GLY 218 N 0.00 0.11 1.51 0.00 0.00 -1.91 -2.65 103.07 100.13 3jyi h GLY 218 Ca -0.00 0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3jyi h GLY 218 CO 0.00 -0.10 0.00 -1.05 0.00 0.00 0.00 176.54 175.40 3jyi n PRO 219 N -5.22 0.23 0.00 4.80 -0.02 -1.26 -2.74 135.00 130.78 3jyi n PRO 219 Ca -0.02 0.14 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 3jyi n PRO 219 Cb 0.15 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 3jyi n PRO 219 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3jyi n LEU 220 N -1.25 0.00 -0.32 2.45 4.32 -1.00 -4.54 117.00 116.67 3jyi n LEU 220 Ca 0.07 0.00 0.22 0.00 -0.02 0.00 0.00 56.01 56.28 3jyi n LEU 220 Cb 0.10 0.00 0.50 0.00 -1.62 0.00 0.00 43.42 42.41 3jyi n LEU 220 CO 0.10 0.00 1.22 -0.07 -1.22 0.00 0.00 177.39 177.42 3jyi h LEU 221 N 0.00 0.45 -1.52 2.23 4.07 -1.84 -2.41 115.31 116.29 3jyi h LEU 221 Ca 0.00 0.08 -0.03 0.00 0.08 0.00 0.00 57.88 58.00 3jyi h LEU 221 Cb 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.73 3jyi h LEU 221 CO 0.00 0.10 -0.06 0.03 -1.08 0.00 0.00 178.44 177.43 3jyi h ARG 222 N 0.41 0.24 0.00 1.13 3.08 -1.75 -1.90 114.38 115.58 3jyi h ARG 222 Ca 0.58 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.59 3jyi h ARG 222 Cb 1.46 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.47 3jyi h ARG 222 CO -0.28 0.31 0.00 -1.13 -1.07 0.00 0.00 179.97 177.80 3jyi n SER 223 N -4.34 0.00 -0.57 7.04 3.41 -0.91 -2.10 113.62 116.15 3jyi n SER 223 Ca -0.01 0.13 0.06 0.00 -0.26 0.00 0.00 58.87 58.79 3jyi n SER 223 Cb 0.21 -0.34 0.12 0.00 -0.26 0.00 0.00 64.21 63.94 3jyi n SER 223 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3jyi n ALA 224 N -1.34 2.28 -2.68 7.33 0.00 -0.72 -4.99 120.51 120.39 3jyi n ALA 224 Ca 0.08 -0.95 -0.36 0.00 0.00 0.00 0.00 53.44 52.21 3jyi n ALA 224 Cb 0.17 -0.41 -0.09 0.00 0.00 0.00 0.00 19.45 19.12 3jyi n ALA 224 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3jyi s LEU 225 N -0.97 4.15 0.76 0.00 2.96 -0.89 -4.68 118.68 120.00 3jyi s LEU 225 Ca 0.20 0.22 -0.11 0.00 -0.22 0.00 0.00 54.13 54.22 3jyi s LEU 225 Cb 0.11 -2.18 0.05 0.00 0.50 0.00 0.00 46.19 44.67 3jyi s LEU 225 CO 0.15 0.07 1.08 -2.84 -1.32 0.00 0.00 176.35 173.50 3jyi s PRO 226 N 0.90 2.36 0.49 0.98 0.02 -1.26 -5.00 135.00 133.48 3jyi s PRO 226 Ca 0.10 0.84 -0.23 0.00 0.02 0.00 0.00 61.00 61.73 3jyi s PRO 226 Cb -0.13 -1.93 -0.06 0.00 0.02 0.00 0.00 34.50 32.39 3jyi s PRO 226 CO 0.03 -1.48 1.30 0.00 -0.33 0.00 0.00 177.00 176.53 3jyi s ALA 227 N -3.06 2.97 0.00 -1.55 0.00 -1.26 -3.13 121.76 115.73 3jyi s ALA 227 Ca 0.60 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.78 3jyi s ALA 227 Cb -0.15 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.46 3jyi s ALA 227 CO 0.55 -1.08 0.00 0.41 0.00 0.00 0.00 175.76 175.64 3jyi n GLY 228 N 0.63 2.99 3.78 0.00 0.00 -1.26 -5.00 105.19 106.33 3jyi n GLY 228 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 3jyi n GLY 228 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3jyi s TRP 229 N -2.71 3.84 0.03 1.61 0.52 -1.18 0.12 118.94 121.17 3jyi s TRP 229 Ca 0.00 1.64 -0.20 0.00 0.02 0.00 0.00 56.10 57.55 3jyi s TRP 229 Cb 0.00 -2.78 -0.06 0.00 -1.15 0.00 0.00 33.47 29.48 3jyi s TRP 229 CO 0.00 0.44 0.60 0.12 0.02 0.00 0.00 176.95 178.13 3jyi s PHE 230 N -1.28 3.73 -0.11 -1.98 5.36 0.13 -4.75 117.98 119.08 3jyi s PHE 230 Ca 0.39 1.24 -0.05 0.00 -0.96 0.00 0.00 56.93 57.56 3jyi s PHE 230 Cb -0.22 -2.58 0.05 0.00 -0.34 0.00 0.00 43.02 39.93 3jyi s PHE 230 CO 0.26 0.43 0.23 -1.50 -1.46 0.00 0.00 175.22 173.18 3jyi s ILE 231 N -0.51 -0.20 -0.18 3.12 2.07 -1.26 -0.98 121.20 123.27 3jyi s ILE 231 Ca 0.31 0.22 -0.00 0.00 -1.41 0.00 0.00 60.65 59.77 3jyi s ILE 231 Cb -0.19 -0.38 0.01 0.00 0.13 0.00 0.00 42.46 42.03 3jyi s ILE 231 CO 0.18 0.09 -0.15 0.00 -1.91 0.00 0.00 174.94 173.15 3jyi s ALA 232 N 1.78 2.47 0.20 1.50 0.00 0.82 -4.34 121.76 124.19 3jyi s ALA 232 Ca -0.04 -1.15 -0.11 0.00 0.00 0.00 0.00 51.96 50.66 3jyi s ALA 232 Cb -0.11 -1.29 -0.00 0.00 0.00 0.00 0.00 23.12 21.72 3jyi s ALA 232 CO -0.08 -0.25 0.38 0.16 0.00 0.00 0.00 175.76 175.97 3jyi s ASP 233 N 1.16 -0.04 -0.09 0.00 -4.77 -1.14 -0.68 116.67 111.09 3jyi s ASP 233 Ca 0.01 -0.87 -0.04 0.00 -3.30 0.00 0.00 52.55 48.35 3jyi s ASP 233 Cb -0.14 0.51 0.05 0.00 -1.09 0.00 0.00 42.92 42.25 3jyi s ASP 233 CO -0.06 -1.00 0.20 -0.75 0.70 0.00 0.00 175.17 174.25 3jyi s LYS 234 N -3.99 0.11 0.43 2.11 2.47 -0.68 -4.67 119.74 115.53 3jyi s LYS 234 Ca 0.19 0.55 0.03 0.00 -1.56 0.00 0.00 55.97 55.18 3jyi s LYS 234 Cb 0.01 -0.16 -0.00 0.00 -1.46 0.00 0.00 37.83 36.22 3jyi s LYS 234 CO 0.04 -0.23 0.62 -1.54 0.16 0.00 0.00 175.35 174.39 3jyi s SER 235 N 1.79 5.80 -0.04 1.43 1.04 -1.26 -1.60 113.70 120.85 3jyi s SER 235 Ca -0.03 0.08 -0.04 0.00 0.48 0.00 0.00 55.95 56.44 3jyi s SER 235 Cb -0.12 -1.33 0.01 0.00 0.10 0.00 0.00 66.02 64.69 3jyi s SER 235 CO -0.07 -0.68 0.11 -0.83 0.98 0.00 0.00 173.24 172.76 3jyi s GLY 236 N -4.23 -0.08 0.12 7.32 0.00 0.49 -3.84 107.32 107.09 3jyi s GLY 236 Ca 0.49 0.34 0.07 0.00 0.00 0.00 0.00 44.72 45.62 3jyi s GLY 236 CO 0.36 0.33 -0.17 0.00 0.00 0.00 0.00 173.10 173.62 3jyi s ALA 237 N 0.16 1.61 0.29 3.20 0.00 -1.26 -1.15 121.76 124.60 3jyi s ALA 237 Ca -0.01 -1.26 -0.05 0.00 0.00 0.00 0.00 51.96 50.64 3jyi s ALA 237 Cb -0.02 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 22.98 3jyi s ALA 237 CO -0.00 0.20 0.47 0.41 0.00 0.00 0.00 175.76 176.84 3jyi n GLY 238 N 0.77 1.90 3.79 0.00 0.00 -0.62 -4.46 105.19 106.57 3jyi n GLY 238 Ca -0.17 -1.43 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 3jyi n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3jyi s GLU 239 N -2.43 2.11 -1.30 1.61 2.56 -0.32 -3.68 118.70 117.25 3jyi s GLU 239 Ca 0.19 0.76 -0.03 0.00 0.00 0.00 0.00 54.97 55.90 3jyi s GLU 239 Cb -0.02 -1.91 -0.00 0.00 2.00 0.00 0.00 34.13 34.20 3jyi s GLU 239 CO 0.14 -1.63 0.65 0.54 -0.56 0.00 0.00 175.26 174.40 3jyi n ARG 240 N -3.46 -3.99 -1.46 4.30 1.74 -1.26 -2.43 116.66 110.10 3jyi n ARG 240 Ca 0.07 0.56 -0.16 0.00 -0.77 0.00 0.00 57.85 57.55 3jyi n ARG 240 Cb 0.55 -4.93 -0.07 0.00 -1.02 0.00 0.00 32.46 27.00 3jyi n ARG 240 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3jyi n GLY 241 N -1.67 1.51 3.75 -0.13 0.00 -1.18 -0.88 105.19 106.60 3jyi n GLY 241 Ca -0.27 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 3jyi n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3jyi s SER 242 N -2.60 6.77 0.01 1.61 0.01 -1.02 -4.31 113.70 114.17 3jyi s SER 242 Ca 0.00 2.60 -0.29 0.00 1.31 0.00 0.00 55.95 59.58 3jyi s SER 242 Cb 0.00 -2.63 0.07 0.00 0.21 0.00 0.00 66.02 63.67 3jyi s SER 242 CO 0.00 -0.58 0.68 -0.60 0.41 0.00 0.00 173.24 173.14 3jyi s ARG 243 N -0.88 1.10 -0.05 12.44 6.06 0.24 -1.59 118.95 136.27 3jyi s ARG 243 Ca 0.54 0.02 -0.31 0.00 -2.50 0.00 0.00 55.73 53.48 3jyi s ARG 243 Cb -0.39 0.51 0.13 0.00 0.06 0.00 0.00 34.95 35.26 3jyi s ARG 243 CO 0.46 -0.39 1.34 0.20 -2.50 0.00 0.00 175.30 174.41 3jyi s GLY 244 N -1.68 -0.44 -0.22 8.12 0.00 -0.30 -0.48 107.32 112.32 3jyi s GLY 244 Ca -0.07 0.77 -0.27 0.00 0.00 0.00 0.00 44.72 45.15 3jyi s GLY 244 CO 0.02 0.37 0.80 -1.50 0.00 0.00 0.00 173.10 172.79 3jyi s ILE 245 N -2.26 0.00 0.15 0.90 2.07 0.42 -0.38 121.20 122.09 3jyi s ILE 245 Ca 0.15 0.00 0.11 0.00 -1.41 0.00 0.00 60.65 59.50 3jyi s ILE 245 Cb 0.06 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.61 3jyi s ILE 245 CO -0.05 0.00 -0.25 0.27 -1.91 0.00 0.00 174.94 173.00 3jyi s ILE 246 N -0.08 2.23 -0.14 2.00 -4.36 -0.63 -0.95 121.20 119.27 3jyi s ILE 246 Ca -0.02 -1.83 -0.29 0.00 -0.26 0.00 0.00 60.65 58.25 3jyi s ILE 246 Cb -0.04 -2.00 0.10 0.00 1.25 0.00 0.00 42.46 41.78 3jyi s ILE 246 CO 0.01 0.00 0.84 0.00 0.24 0.00 0.00 174.94 176.04 3jyi s ALA 247 N -1.28 -1.86 -0.19 2.27 0.00 -0.50 -1.68 121.76 118.51 3jyi s ALA 247 Ca 0.15 1.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.62 3jyi s ALA 247 Cb -0.09 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 3jyi s ALA 247 CO 0.07 -0.33 -0.02 0.00 0.00 0.00 0.00 175.76 175.48 3jyi s ALA 248 N -0.86 2.98 0.11 0.00 0.00 0.14 -1.28 121.76 122.85 3jyi s ALA 248 Ca -0.05 -0.99 -0.03 0.00 0.00 0.00 0.00 51.96 50.89 3jyi s ALA 248 Cb -0.01 -1.71 -0.03 0.00 0.00 0.00 0.00 23.12 21.37 3jyi s ALA 248 CO 0.04 -0.13 0.09 -0.48 0.00 0.00 0.00 175.76 175.29 3jyi s LEU 249 N 0.96 1.76 -0.19 0.00 2.34 -0.78 -0.13 118.68 122.64 3jyi s LEU 249 Ca 0.01 -1.04 -0.35 0.00 0.06 0.00 0.00 54.13 52.80 3jyi s LEU 249 Cb -0.14 0.51 0.14 0.00 -0.56 0.00 0.00 46.19 46.14 3jyi s LEU 249 CO 0.01 -0.73 1.29 -0.83 -1.06 0.00 0.00 176.35 175.04 3jyi s GLY 250 N -2.98 -0.29 0.66 -3.48 0.00 -0.15 -1.27 107.32 99.80 3jyi s GLY 250 Ca 0.17 1.53 -0.11 0.00 0.00 0.00 0.00 44.72 46.31 3jyi s GLY 250 CO -0.03 0.49 1.06 2.56 0.00 0.00 0.00 173.10 177.18 3jyi s PRO 251 N -2.28 3.29 -1.03 2.90 0.05 -1.22 0.18 135.00 136.90 3jyi s PRO 251 Ca 0.11 0.65 -0.03 0.00 0.05 0.00 0.00 61.00 61.78 3jyi s PRO 251 Cb 0.00 -2.05 0.00 0.00 0.05 0.00 0.00 34.50 32.50 3jyi s PRO 251 CO -0.04 -0.77 0.40 -0.25 0.05 0.00 0.00 177.00 176.40 3jyi n ASP 252 N -2.86 -4.58 0.00 6.66 8.00 -1.05 -2.95 116.55 119.76 3jyi n ASP 252 Ca 0.06 -0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.38 3jyi n ASP 252 Cb 0.55 -3.45 0.00 0.00 -0.02 0.00 0.00 41.12 38.20 3jyi n ASP 252 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3jyi n GLY 253 N -1.26 0.27 3.23 0.44 0.00 0.33 -4.95 105.19 103.26 3jyi n GLY 253 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 3jyi n GLY 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3jyi s LYS 254 N -0.98 1.47 0.31 1.61 1.02 -1.15 -4.61 119.74 117.41 3jyi s LYS 254 Ca 0.00 -0.85 -0.23 0.00 0.02 0.00 0.00 55.97 54.91 3jyi s LYS 254 Cb 0.00 -1.52 -0.10 0.00 -0.52 0.00 0.00 37.83 35.69 3jyi s LYS 254 CO 0.00 0.40 0.87 -1.25 -0.92 0.00 0.00 175.35 174.45 3jyi s PRO 255 N -0.90 4.42 0.00 -1.68 0.04 -1.26 -3.43 135.00 132.19 3jyi s PRO 255 Ca 0.07 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.26 3jyi s PRO 255 Cb -0.08 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.73 3jyi s PRO 255 CO 0.01 0.27 0.00 -1.13 0.04 0.00 0.00 177.00 176.19 3jyi n SER 256 N 0.41 0.00 -4.10 6.66 3.41 -0.40 -4.85 113.62 114.76 3jyi n SER 256 Ca 0.01 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.50 3jyi n SER 256 Cb 0.51 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.35 3jyi n SER 256 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3jyi s ARG 257 N 0.00 0.63 -0.11 4.33 0.52 -0.95 -1.28 118.95 122.08 3jyi s ARG 257 Ca 0.00 -0.94 -0.02 0.00 -0.52 0.00 0.00 55.73 54.25 3jyi s ARG 257 Cb 0.00 -0.27 -0.03 0.00 0.52 0.00 0.00 34.95 35.17 3jyi s ARG 257 CO 0.00 0.03 -0.05 0.42 0.02 0.00 0.00 175.30 175.72 3jyi s ILE 258 N -2.10 3.86 -0.08 1.52 1.01 0.03 -1.87 121.20 123.58 3jyi s ILE 258 Ca -0.03 -0.40 0.04 0.00 0.00 0.00 0.00 60.65 60.26 3jyi s ILE 258 Cb -0.05 -2.63 0.00 0.00 0.01 0.00 0.00 42.46 39.79 3jyi s ILE 258 CO -0.01 0.55 -0.21 -0.69 0.00 0.00 0.00 174.94 174.58 3jyi s VAL 259 N -0.26 1.78 -0.07 2.92 1.01 -0.40 -0.20 120.40 125.18 3jyi s VAL 259 Ca 0.04 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.18 3jyi s VAL 259 Cb -0.13 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.71 3jyi s VAL 259 CO 0.02 0.50 -0.17 -0.69 0.00 0.00 0.00 175.10 174.77 3jyi s VAL 260 N 0.31 1.47 -0.03 2.92 1.01 -0.61 -1.42 120.40 124.05 3jyi s VAL 260 Ca -0.14 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3jyi s VAL 260 Cb -0.16 -1.29 0.03 0.00 0.00 0.00 0.00 36.38 34.95 3jyi s VAL 260 CO 0.06 0.43 -0.00 -0.63 0.00 0.00 0.00 175.10 174.96 3jyi s ILE 261 N 0.41 0.19 -0.01 2.22 1.01 -0.12 -1.97 121.20 122.94 3jyi s ILE 261 Ca -0.13 0.08 -0.00 0.00 0.00 0.00 0.00 60.65 60.60 3jyi s ILE 261 Cb -0.15 -0.28 0.00 0.00 0.01 0.00 0.00 42.46 42.04 3jyi s ILE 261 CO 0.05 0.15 0.01 -0.31 0.00 0.00 0.00 174.94 174.84 3jyi s TYR 262 N 1.03 -0.01 0.02 3.97 2.02 -0.81 -0.44 117.35 123.13 3jyi s TYR 262 Ca -0.10 0.04 0.01 0.00 -0.37 0.00 0.00 57.07 56.66 3jyi s TYR 262 Cb -0.14 -0.03 -0.02 0.00 -0.40 0.00 0.00 41.96 41.38 3jyi s TYR 262 CO -0.02 -0.02 -0.05 -0.08 -1.57 0.00 0.00 175.55 173.82 3jyi s THR 263 N 0.14 0.30 -0.08 -0.71 -1.32 0.37 0.15 115.64 114.48 3jyi s THR 263 Ca -0.01 -0.69 -0.09 0.00 -1.21 0.00 0.00 61.69 59.69 3jyi s THR 263 Cb -0.02 -0.35 0.02 0.00 -1.51 0.00 0.00 72.50 70.64 3jyi s THR 263 CO -0.00 -0.26 0.24 0.28 -2.21 0.00 0.00 174.62 172.67 3jyi s THR 264 N -0.94 0.01 0.00 5.08 -1.32 -1.24 -0.60 115.64 116.64 3jyi s THR 264 Ca -0.08 -0.12 0.00 0.00 -1.21 0.00 0.00 61.69 60.28 3jyi s THR 264 Cb -0.07 -0.39 0.00 0.00 -1.51 0.00 0.00 72.50 70.54 3jyi s THR 264 CO -0.00 -0.06 0.00 0.61 -2.21 0.00 0.00 174.62 172.95 3jyi n GLY 265 N 2.63 0.60 3.68 6.08 0.00 -0.06 -3.88 105.19 114.24 3jyi n GLY 265 Ca -0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.55 3jyi n GLY 265 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3jyi n SER 266 N 0.00 0.67 -0.62 1.61 2.88 -1.25 -4.77 113.62 112.14 3jyi n SER 266 Ca 0.00 0.50 0.05 0.00 -1.33 0.00 0.00 58.87 58.09 3jyi n SER 266 Cb 0.00 -1.49 0.15 0.00 -0.75 0.00 0.00 64.21 62.12 3jyi n SER 266 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3jyi n GLN 267 N -3.83 2.88 -2.04 -1.46 6.02 -1.26 -3.07 117.38 114.62 3jyi n GLN 267 Ca 0.13 -2.06 -0.32 0.00 -0.01 0.00 0.00 57.00 54.73 3jyi n GLN 267 Cb 0.51 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.49 3jyi n GLN 267 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3jyi s ALA 268 N -1.09 2.86 0.90 -1.58 0.00 -1.26 -5.03 121.76 116.57 3jyi s ALA 268 Ca 0.23 0.22 -0.12 0.00 0.00 0.00 0.00 51.96 52.29 3jyi s ALA 268 Cb 0.13 -3.17 0.08 0.00 0.00 0.00 0.00 23.12 20.15 3jyi s ALA 268 CO 0.15 -0.71 0.81 2.41 0.00 0.00 0.00 175.76 178.42 3jyi n THR 269 N -2.18 0.44 -0.06 0.00 -1.04 -1.26 -4.75 114.28 105.43 3jyi n THR 269 Ca 0.08 -0.14 -0.07 0.00 -2.04 0.00 0.00 64.05 61.87 3jyi n THR 269 Cb 0.53 -0.86 -0.01 0.00 -1.82 0.00 0.00 70.33 68.18 3jyi n THR 269 CO 0.00 0.00 0.00 -0.03 -0.64 0.00 0.00 175.07 174.40 3jyi h MET 270 N -1.50 0.06 -0.94 -2.82 4.05 -1.99 -1.00 114.93 110.79 3jyi h MET 270 Ca -0.44 -0.00 0.15 0.00 -0.28 0.00 0.00 59.70 59.13 3jyi h MET 270 Cb 1.28 -0.01 -0.09 0.00 -0.80 0.00 0.00 31.60 31.98 3jyi h MET 270 CO 0.39 0.04 0.55 -0.44 0.23 0.00 0.00 176.91 177.68 3jyi h ASP 271 N 0.06 0.74 -0.07 1.39 3.32 -1.99 0.20 116.42 120.07 3jyi h ASP 271 Ca 0.12 0.08 -0.17 0.00 0.02 0.00 0.00 57.03 57.08 3jyi h ASP 271 Cb 0.16 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 3jyi h ASP 271 CO -0.22 0.33 -0.55 -0.33 -1.72 0.00 0.00 179.24 176.75 3jyi h GLU 272 N 0.79 0.66 -0.03 3.56 5.08 -1.74 -0.91 114.58 121.99 3jyi h GLU 272 Ca 0.51 -0.41 -0.15 0.00 -1.00 0.00 0.00 59.36 58.30 3jyi h GLU 272 Cb 0.67 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 3jyi h GLU 272 CO -0.33 1.03 -0.66 0.00 -1.00 0.00 0.00 179.01 178.05 3jyi h ARG 273 N 0.51 0.12 0.44 2.33 3.08 -0.56 -2.82 114.38 117.48 3jyi h ARG 273 Ca 0.01 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3jyi h ARG 273 Cb 1.11 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3jyi h ARG 273 CO 0.11 0.74 -0.21 -0.91 -1.07 0.00 0.00 179.97 178.62 3jyi h ASN 274 N 0.08 -0.50 -0.76 7.04 2.35 -0.70 -2.82 115.58 120.27 3jyi h ASN 274 Ca -0.01 -0.02 0.15 0.00 -0.55 0.00 0.00 56.30 55.87 3jyi h ASN 274 Cb 1.18 0.13 -0.10 0.00 0.05 0.00 0.00 38.32 39.58 3jyi h ASN 274 CO 0.09 -0.30 0.28 -0.09 -1.65 0.00 0.00 177.43 175.76 3jyi h ARG 275 N -0.66 0.38 -0.25 0.81 2.43 -1.11 0.39 114.38 116.38 3jyi h ARG 275 Ca -0.06 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 3jyi h ARG 275 Cb 0.49 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 3jyi h ARG 275 CO 0.10 0.25 -0.12 1.96 -1.51 0.00 0.00 179.97 180.65 3jyi h GLN 276 N 0.40 0.41 0.22 0.20 1.08 -1.47 -0.98 115.11 114.96 3jyi h GLN 276 Ca 0.42 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.50 3jyi h GLN 276 Cb 0.68 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 3jyi h GLN 276 CO -0.44 0.53 -0.10 0.82 -0.95 0.00 0.00 178.83 178.69 3jyi h ILE 277 N 0.38 0.85 -0.94 2.54 1.08 -0.75 -2.49 117.51 118.18 3jyi h ILE 277 Ca 0.07 -0.78 0.12 0.00 -0.39 0.00 0.00 64.86 63.89 3jyi h ILE 277 Cb 0.45 1.27 -0.08 0.00 -3.07 0.00 0.00 36.82 35.38 3jyi h ILE 277 CO 0.03 0.16 0.57 0.00 -0.69 0.00 0.00 178.15 178.22 3jyi h ALA 278 N -0.07 1.41 -0.02 1.87 0.00 -0.84 -1.14 119.26 120.47 3jyi h ALA 278 Ca -0.03 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3jyi h ALA 278 Cb 0.49 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3jyi h ALA 278 CO 0.05 0.14 -0.49 0.93 0.00 0.00 0.00 179.25 179.89 3jyi h GLU 279 N 0.89 0.05 -0.64 0.00 5.08 -1.16 0.97 114.58 119.76 3jyi h GLU 279 Ca 0.47 -0.03 -0.09 0.00 -1.00 0.00 0.00 59.36 58.72 3jyi h GLU 279 Cb 0.50 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 3jyi h GLU 279 CO -0.28 0.52 0.06 0.82 -1.00 0.00 0.00 179.01 179.13 3jyi h ILE 280 N 0.04 1.27 -0.28 3.13 2.04 -0.76 -2.41 117.51 120.54 3jyi h ILE 280 Ca -0.00 -1.10 -0.03 0.00 1.00 0.00 0.00 64.86 64.73 3jyi h ILE 280 Cb 0.87 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 3jyi h ILE 280 CO 0.07 0.41 0.05 1.23 0.00 0.00 0.00 178.15 179.90 3jyi h GLY 281 N 1.00 0.50 -0.06 5.37 0.00 -0.60 -1.30 103.07 107.98 3jyi h GLY 281 Ca 0.19 -0.33 0.21 0.00 0.00 0.00 0.00 47.33 47.40 3jyi h GLY 281 CO 0.02 0.31 0.48 0.00 0.00 0.00 0.00 176.54 177.35 3jyi h ALA 282 N 0.87 1.53 -0.13 3.60 0.00 -0.73 -0.01 119.26 124.39 3jyi h ALA 282 Ca 0.09 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 3jyi h ALA 282 Cb 0.33 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 3jyi h ALA 282 CO 0.00 -0.24 -0.19 0.77 0.00 0.00 0.00 179.25 179.60 3jyi h SER 283 N 0.54 0.40 -0.95 0.00 0.02 -1.17 -0.88 113.55 111.50 3jyi h SER 283 Ca 0.57 -0.52 0.18 0.00 -0.84 0.00 0.00 61.79 61.18 3jyi h SER 283 Cb 1.01 -0.11 -0.10 0.00 0.14 0.00 0.00 62.40 63.33 3jyi h SER 283 CO -0.46 0.84 0.55 0.25 -1.14 0.00 0.00 176.83 176.86 3jyi h LEU 284 N -0.04 0.68 0.01 5.07 5.85 -0.42 -0.43 115.31 126.03 3jyi h LEU 284 Ca 0.01 0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 3jyi h LEU 284 Cb 0.75 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.77 3jyi h LEU 284 CO 0.04 0.24 -0.01 0.40 -0.34 0.00 0.00 178.44 178.78 3jyi h ILE 285 N 0.70 1.20 -1.03 4.05 2.04 -1.01 -2.68 117.51 120.78 3jyi h ILE 285 Ca 0.55 -1.85 0.28 0.00 1.00 0.00 0.00 64.86 64.83 3jyi h ILE 285 Cb 0.84 2.25 -0.06 0.00 -0.74 0.00 0.00 36.82 39.11 3jyi h ILE 285 CO -0.39 0.40 0.70 0.50 0.00 0.00 0.00 178.15 179.36 3jyi h LYS 286 N -0.98 0.19 -0.29 2.37 3.64 -1.04 -1.69 116.57 118.77 3jyi h LYS 286 Ca -0.00 -0.01 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 3jyi h LYS 286 Cb 0.67 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.38 3jyi h LYS 286 CO 0.00 0.13 -0.05 0.72 -2.27 0.00 0.00 179.45 177.99 3jyi n HIS 287 N -4.41 0.95 0.00 1.91 8.25 -0.18 -5.08 115.22 116.66 3jyi n HIS 287 Ca 0.23 -1.30 0.00 0.00 -0.26 0.00 0.00 57.72 56.39 3jyi n HIS 287 Cb 0.97 -0.40 0.00 0.00 1.12 0.00 0.00 29.99 31.68 3jyi n HIS 287 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85