#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qe0 s ILE 2 N 0.00 5.16 0.13 3.17 1.01 -1.26 -5.09 121.20 124.32 1qe0 s ILE 2 Ca 0.00 0.70 0.07 0.00 0.00 0.00 0.00 60.65 61.43 1qe0 s ILE 2 Cb 0.00 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 1qe0 s ILE 2 CO 0.00 0.54 -0.08 -0.54 0.00 0.00 0.00 174.94 174.86 1qe0 s LYS 3 N -0.74 2.17 0.52 2.79 1.02 -1.26 -5.10 119.74 119.13 1qe0 s LYS 3 Ca 0.21 -1.08 -0.21 0.00 0.02 0.00 0.00 55.97 54.91 1qe0 s LYS 3 Cb -0.15 -2.29 -0.08 0.00 -0.52 0.00 0.00 37.83 34.78 1qe0 s LYS 3 CO 0.10 0.48 0.87 -0.89 -0.92 0.00 0.00 175.35 174.99 1qe0 n ILE 4 N 0.42 2.81 -1.88 2.17 5.41 -1.26 -4.91 119.36 122.11 1qe0 n ILE 4 Ca -0.12 -0.50 -0.37 0.00 1.00 0.00 0.00 62.75 62.76 1qe0 n ILE 4 Cb 0.53 -1.02 0.05 0.00 -0.71 0.00 0.00 39.64 38.49 1qe0 n ILE 4 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1qe0 s PRO 5 N -2.26 2.86 0.39 0.38 0.02 -1.26 -4.89 135.00 130.23 1qe0 s PRO 5 Ca 0.69 1.98 -0.27 0.00 0.02 0.00 0.00 61.00 63.42 1qe0 s PRO 5 Cb -0.49 -1.96 -0.11 0.00 0.02 0.00 0.00 34.50 31.97 1qe0 s PRO 5 CO 0.53 -1.34 1.43 -2.13 -0.33 0.00 0.00 177.00 175.16 1qe0 n ARG 6 N -1.59 2.44 -1.82 5.54 0.63 -1.26 -2.10 116.66 118.50 1qe0 n ARG 6 Ca 0.14 0.86 -0.13 0.00 -0.92 0.00 0.00 57.85 57.80 1qe0 n ARG 6 Cb 0.48 -2.59 -0.03 0.00 0.45 0.00 0.00 32.46 30.78 1qe0 n ARG 6 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1qe0 n GLY 7 N 0.56 0.57 3.18 5.14 0.00 -1.26 -4.67 105.19 108.70 1qe0 n GLY 7 Ca 0.03 -0.40 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 1qe0 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qe0 s THR 8 N -2.55 1.30 0.04 2.61 2.01 -0.89 0.03 115.64 118.19 1qe0 s THR 8 Ca 0.00 -1.06 0.01 0.00 0.31 0.00 0.00 61.69 60.96 1qe0 s THR 8 Cb 0.00 -1.16 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 1qe0 s THR 8 CO 0.00 0.08 -0.06 0.00 -0.69 0.00 0.00 174.62 173.95 1qe0 s GLN 9 N -1.13 0.50 0.16 4.92 -2.07 -1.26 -4.79 119.66 115.99 1qe0 s GLN 9 Ca 0.04 -0.80 -0.06 0.00 -1.82 0.00 0.00 55.36 52.71 1qe0 s GLN 9 Cb -0.08 -0.13 -0.06 0.00 -1.09 0.00 0.00 33.01 31.65 1qe0 s GLN 9 CO 0.01 0.00 0.42 -0.51 -1.32 0.00 0.00 175.29 173.90 1qe0 s ASP 10 N -1.78 6.53 -0.62 12.60 1.01 -1.26 -5.04 116.67 128.12 1qe0 s ASP 10 Ca -0.08 0.68 -0.10 0.00 0.71 0.00 0.00 52.55 53.76 1qe0 s ASP 10 Cb -0.07 -2.13 0.16 0.00 1.01 0.00 0.00 42.92 41.89 1qe0 s ASP 10 CO -0.01 0.02 0.51 -0.63 0.21 0.00 0.00 175.17 175.27 1qe0 s ILE 11 N -1.69 4.60 0.78 0.77 1.01 -1.26 -5.06 121.20 120.35 1qe0 s ILE 11 Ca 0.42 -2.25 -0.11 0.00 0.00 0.00 0.00 60.65 58.71 1qe0 s ILE 11 Cb -0.12 -3.95 0.06 0.00 0.01 0.00 0.00 42.46 38.46 1qe0 s ILE 11 CO 0.23 -0.89 1.09 -0.76 0.00 0.00 0.00 174.94 174.62 1qe0 s LEU 12 N 0.68 2.72 0.61 2.97 1.43 -1.26 -4.54 118.68 121.29 1qe0 s LEU 12 Ca 0.12 1.41 0.26 0.00 -1.03 0.00 0.00 54.13 54.89 1qe0 s LEU 12 Cb -0.20 -4.08 0.89 0.00 0.03 0.00 0.00 46.19 42.83 1qe0 s LEU 12 CO -0.03 -1.89 1.29 -0.65 0.23 0.00 0.00 176.35 175.30 1qe0 h PRO 13 N -1.03 0.00 0.00 1.29 0.11 -1.99 0.22 132.00 130.60 1qe0 h PRO 13 Ca -0.46 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 1qe0 h PRO 13 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1qe0 h PRO 13 CO 0.58 0.00 -0.36 1.49 -0.21 0.00 0.00 178.00 179.50 1qe0 h GLU 14 N 0.00 0.00 0.00 1.05 4.81 -2.02 -3.37 114.58 115.05 1qe0 h GLU 14 Ca 0.48 0.00 -0.24 0.00 -0.13 0.00 0.00 59.36 59.48 1qe0 h GLU 14 Cb 2.92 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 32.26 1qe0 h GLU 14 CO -0.01 0.19 -1.89 -0.25 -0.73 0.00 0.00 179.01 176.32 1qe0 n ASP 15 N -3.09 2.09 -0.32 1.04 8.00 -0.03 -4.53 116.55 119.71 1qe0 n ASP 15 Ca 0.02 -0.02 0.23 0.00 0.71 0.00 0.00 54.79 55.72 1qe0 n ASP 15 Cb 0.62 0.51 0.50 0.00 -0.02 0.00 0.00 41.12 42.74 1qe0 n ASP 15 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1qe0 h SER 16 N 0.00 0.45 -0.42 -2.24 4.64 -1.45 0.56 113.55 115.09 1qe0 h SER 16 Ca -0.35 0.09 -0.06 0.00 -0.47 0.00 0.00 61.79 60.99 1qe0 h SER 16 Cb 1.73 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.81 1qe0 h SER 16 CO -0.00 0.09 0.05 0.07 -0.87 0.00 0.00 176.83 176.17 1qe0 h LYS 17 N 0.40 0.78 -0.40 4.77 2.10 -1.80 0.62 116.57 123.04 1qe0 h LYS 17 Ca 0.60 -0.19 -0.15 0.00 -2.00 0.00 0.00 60.65 58.91 1qe0 h LYS 17 Cb 1.50 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.72 1qe0 h LYS 17 CO -0.30 0.76 -0.35 0.87 -2.00 0.00 0.00 179.45 178.42 1qe0 h LYS 18 N 0.74 0.94 -0.25 0.07 1.57 -0.18 -1.19 116.57 118.27 1qe0 h LYS 18 Ca 0.15 -0.48 -0.01 0.00 -1.87 0.00 0.00 60.65 58.44 1qe0 h LYS 18 Cb 0.38 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 1qe0 h LYS 18 CO 0.01 1.14 0.10 -1.49 -0.57 0.00 0.00 179.45 178.64 1qe0 h TRP 19 N 0.77 0.38 -0.16 -1.35 4.06 -0.58 -2.31 115.95 116.76 1qe0 h TRP 19 Ca 0.07 -0.03 -0.05 0.00 2.06 0.00 0.00 58.89 60.94 1qe0 h TRP 19 Cb 0.95 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.98 1qe0 h TRP 19 CO 0.06 0.40 -0.12 0.00 -3.56 0.00 0.00 178.44 175.22 1qe0 h ARG 20 N 0.25 0.26 -0.00 0.49 3.08 -0.75 0.62 114.38 118.32 1qe0 h ARG 20 Ca 0.08 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1qe0 h ARG 20 Cb 0.18 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.19 1qe0 h ARG 20 CO -0.01 0.39 0.00 -0.92 -1.07 0.00 0.00 179.97 178.36 1qe0 h TYR 21 N 0.24 0.00 0.86 3.04 5.03 -1.00 -0.89 116.97 124.26 1qe0 h TYR 21 Ca 0.05 -0.00 -0.04 0.00 2.58 0.00 0.00 58.73 61.32 1qe0 h TYR 21 Cb 0.37 -0.00 0.01 0.00 1.55 0.00 0.00 36.73 38.66 1qe0 h TYR 21 CO 0.01 0.23 -0.41 0.82 -1.32 0.00 0.00 178.16 177.48 1qe0 h ILE 22 N -0.22 0.00 -0.82 1.81 2.04 -1.13 -0.76 117.51 118.43 1qe0 h ILE 22 Ca 0.00 -0.08 0.20 0.00 1.00 0.00 0.00 64.86 65.98 1qe0 h ILE 22 Cb 0.23 0.00 -0.14 0.00 -0.74 0.00 0.00 36.82 36.16 1qe0 h ILE 22 CO 0.00 0.00 0.06 -0.33 0.00 0.00 0.00 178.15 177.88 1qe0 h GLU 23 N -1.23 0.11 -0.39 2.37 5.08 -0.94 0.25 114.58 119.84 1qe0 h GLU 23 Ca -0.12 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.13 1qe0 h GLU 23 Cb 0.88 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.09 1qe0 h GLU 23 CO 0.19 0.07 -0.19 -0.97 -1.00 0.00 0.00 179.01 177.12 1qe0 h ASN 24 N 0.12 0.74 -0.29 1.42 -0.73 -1.04 -2.61 115.58 113.19 1qe0 h ASN 24 Ca 0.47 -0.25 -0.07 0.00 1.87 0.00 0.00 56.30 58.32 1qe0 h ASN 24 Cb 0.88 -0.20 -0.02 0.00 0.27 0.00 0.00 38.32 39.25 1qe0 h ASN 24 CO -0.70 0.92 -0.05 -0.61 -0.37 0.00 0.00 177.43 176.62 1qe0 h GLN 25 N 0.65 0.67 -0.32 6.67 4.15 0.52 -2.78 115.11 124.67 1qe0 h GLN 25 Ca 0.10 -0.18 -0.14 0.00 0.77 0.00 0.00 58.65 59.20 1qe0 h GLN 25 Cb 0.68 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 28.28 1qe0 h GLN 25 CO 0.05 0.72 -0.36 -0.07 -1.93 0.00 0.00 178.83 177.24 1qe0 h LEU 26 N 0.62 0.77 -1.00 -2.39 3.38 -0.77 -1.44 115.31 114.47 1qe0 h LEU 26 Ca 0.12 -0.33 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 1qe0 h LEU 26 Cb 0.47 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1qe0 h LEU 26 CO 0.02 1.05 -0.29 0.44 0.09 0.00 0.00 178.44 179.76 1qe0 h ASP 27 N 0.60 0.37 -0.04 -0.43 3.32 -1.39 -1.00 116.42 117.84 1qe0 h ASP 27 Ca 0.06 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1qe0 h ASP 27 Cb 0.90 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.35 1qe0 h ASP 27 CO 0.08 0.65 -0.08 -0.33 -1.72 0.00 0.00 179.24 177.85 1qe0 h GLU 28 N 0.32 0.13 -0.88 3.56 5.08 -1.37 -2.56 114.58 118.85 1qe0 h GLU 28 Ca 0.05 -0.08 0.12 0.00 -1.00 0.00 0.00 59.36 58.45 1qe0 h GLU 28 Cb 0.68 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.85 1qe0 h GLU 28 CO 0.05 0.65 0.51 -0.07 -1.00 0.00 0.00 179.01 179.15 1qe0 h LEU 29 N -0.38 0.69 -2.06 1.33 4.07 -1.11 0.17 115.31 118.01 1qe0 h LEU 29 Ca 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 57.88 58.01 1qe0 h LEU 29 Cb 0.64 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 42.32 1qe0 h LEU 29 CO 0.02 0.35 -0.09 0.24 -1.08 0.00 0.00 178.44 177.88 1qe0 h MET 30 N 0.78 0.00 -0.35 1.13 2.86 -1.12 -1.27 114.93 116.96 1qe0 h MET 30 Ca 0.45 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 58.05 1qe0 h MET 30 Cb 0.52 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.17 1qe0 h MET 30 CO -0.30 0.09 0.06 1.15 1.06 0.00 0.00 176.91 178.97 1qe0 h THR 31 N 0.00 1.24 -0.36 2.22 2.02 -0.24 0.34 112.91 118.12 1qe0 h THR 31 Ca -0.00 -0.83 -0.09 0.00 0.77 0.00 0.00 66.41 66.27 1qe0 h THR 31 Cb 0.24 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 1qe0 h THR 31 CO 0.01 0.28 -0.13 -0.26 0.37 0.00 0.00 175.52 175.79 1qe0 h PHE 32 N 0.41 0.70 0.00 3.16 0.05 -1.05 -2.66 116.94 117.56 1qe0 h PHE 32 Ca 0.11 -0.12 0.00 0.00 3.82 0.00 0.00 57.97 61.77 1qe0 h PHE 32 Cb 0.35 -0.18 0.00 0.00 2.00 0.00 0.00 35.95 38.12 1qe0 h PHE 32 CO 0.02 0.75 -0.54 1.88 -0.18 0.00 0.00 178.31 180.23 1qe0 h TYR 33 N 0.58 0.00 -1.44 -0.55 0.05 -1.30 -3.48 116.97 110.84 1qe0 h TYR 33 Ca 0.10 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.79 1qe0 h TYR 33 Cb 0.57 0.00 0.02 0.00 1.01 0.00 0.00 36.73 38.32 1qe0 h TYR 33 CO 0.02 0.00 -0.13 -1.71 -1.05 0.00 0.00 178.16 175.29 1qe0 n ASN 34 N -2.23 -2.56 -4.86 3.88 5.15 0.11 -5.03 115.26 109.72 1qe0 n ASN 34 Ca 0.03 -0.07 -0.37 0.00 -0.60 0.00 0.00 54.58 53.58 1qe0 n ASN 34 Cb 0.45 -1.46 -0.06 0.00 -0.53 0.00 0.00 39.78 38.18 1qe0 n ASN 34 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1qe0 s TYR 35 N -2.71 3.60 -0.02 1.20 2.02 -0.28 -4.80 117.35 116.36 1qe0 s TYR 35 Ca 0.07 0.58 0.00 0.00 -0.37 0.00 0.00 57.07 57.36 1qe0 s TYR 35 Cb -0.03 -2.02 -0.04 0.00 -0.40 0.00 0.00 41.96 39.47 1qe0 s TYR 35 CO 0.09 0.67 0.01 0.15 -1.57 0.00 0.00 175.55 174.91 1qe0 s LYS 36 N -0.88 2.88 0.30 -0.62 -0.14 -0.36 -4.56 119.74 116.36 1qe0 s LYS 36 Ca 0.16 -0.54 -0.27 0.00 -1.36 0.00 0.00 55.97 53.95 1qe0 s LYS 36 Cb -0.13 -2.73 -0.09 0.00 -1.68 0.00 0.00 37.83 33.20 1qe0 s LYS 36 CO 0.05 0.65 0.97 -2.00 -0.76 0.00 0.00 175.35 174.26 1qe0 s GLU 37 N -1.43 4.62 0.04 1.68 2.12 -1.26 -0.83 118.70 123.65 1qe0 s GLU 37 Ca 0.19 1.44 0.04 0.00 0.36 0.00 0.00 54.97 57.00 1qe0 s GLU 37 Cb -0.12 -2.95 -0.02 0.00 0.26 0.00 0.00 34.13 31.31 1qe0 s GLU 37 CO 0.09 0.30 -0.12 -1.50 -0.54 0.00 0.00 175.26 173.48 1qe0 s ILE 38 N -1.45 0.95 -0.15 -3.70 2.07 -0.41 -4.87 121.20 113.63 1qe0 s ILE 38 Ca 0.48 -0.98 -0.00 0.00 -1.41 0.00 0.00 60.65 58.74 1qe0 s ILE 38 Cb -0.22 -0.89 0.04 0.00 0.13 0.00 0.00 42.46 41.51 1qe0 s ILE 38 CO 0.28 -0.07 -0.07 -0.13 -1.91 0.00 0.00 174.94 173.04 1qe0 s ARG 39 N -1.18 1.56 0.25 3.50 0.52 -1.26 -4.53 118.95 117.80 1qe0 s ARG 39 Ca -0.01 -0.47 -0.01 0.00 -0.52 0.00 0.00 55.73 54.73 1qe0 s ARG 39 Cb -0.08 -1.92 -0.04 0.00 0.52 0.00 0.00 34.95 33.43 1qe0 s ARG 39 CO 0.01 -0.37 0.45 0.99 0.02 0.00 0.00 175.30 176.40 1qe0 s THR 40 N 1.63 5.15 0.92 0.02 2.01 -1.26 -5.09 115.64 119.03 1qe0 s THR 40 Ca 0.02 -0.32 -0.10 0.00 0.31 0.00 0.00 61.69 61.60 1qe0 s THR 40 Cb -0.14 -3.76 0.15 0.00 0.01 0.00 0.00 72.50 68.76 1qe0 s THR 40 CO -0.08 -0.27 1.14 -2.84 -0.69 0.00 0.00 174.62 171.88 1qe0 s PRO 41 N -3.56 0.95 0.37 4.92 0.02 -1.26 -4.89 135.00 131.54 1qe0 s PRO 41 Ca 0.40 1.51 0.10 0.00 0.02 0.00 0.00 61.00 63.03 1qe0 s PRO 41 Cb -0.11 -1.72 0.72 0.00 0.02 0.00 0.00 34.50 33.41 1qe0 s PRO 41 CO 0.30 -2.67 1.86 0.82 -0.33 0.00 0.00 177.00 176.98 1qe0 h ILE 42 N -1.90 1.22 -2.62 2.83 1.08 -1.96 -3.44 117.51 112.73 1qe0 h ILE 42 Ca -0.44 -1.04 -0.53 0.00 -0.39 0.00 0.00 64.86 62.46 1qe0 h ILE 42 Cb 1.27 1.43 -0.15 0.00 -3.07 0.00 0.00 36.82 36.31 1qe0 h ILE 42 CO 0.42 0.31 -0.75 0.72 -0.69 0.00 0.00 178.15 178.16 1qe0 s PHE 43 N -4.47 1.99 0.28 1.37 -0.71 -1.26 -1.66 117.98 113.52 1qe0 s PHE 43 Ca -0.04 -0.45 0.02 0.00 -1.04 0.00 0.00 56.93 55.41 1qe0 s PHE 43 Cb 0.15 -0.90 -0.04 0.00 -1.21 0.00 0.00 43.02 41.02 1qe0 s PHE 43 CO 0.74 0.52 0.13 -1.21 -1.34 0.00 0.00 175.22 174.05 1qe0 s GLU 44 N -3.50 1.51 0.23 1.99 0.41 -0.20 -4.91 118.70 114.24 1qe0 s GLU 44 Ca 0.25 -1.84 -0.31 0.00 -0.41 0.00 0.00 54.97 52.67 1qe0 s GLU 44 Cb -0.03 -0.18 -0.10 0.00 -1.78 0.00 0.00 34.13 32.03 1qe0 s GLU 44 CO 0.10 -0.38 1.53 0.45 -0.49 0.00 0.00 175.26 176.47 1qe0 s SER 45 N -3.35 6.56 0.37 -0.19 0.15 -1.26 -0.09 113.70 115.90 1qe0 s SER 45 Ca 0.36 2.73 0.16 0.00 0.70 0.00 0.00 55.95 59.90 1qe0 s SER 45 Cb 0.06 -2.62 1.04 0.00 -1.71 0.00 0.00 66.02 62.79 1qe0 s SER 45 CO 0.15 -0.80 1.76 0.74 1.20 0.00 0.00 173.24 176.30 1qe0 h THR 46 N 3.65 0.53 0.00 6.45 2.02 -1.65 0.56 112.91 124.47 1qe0 h THR 46 Ca -0.45 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.57 1qe0 h THR 46 Cb 1.21 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.66 1qe0 h THR 46 CO 0.83 0.08 0.01 0.47 0.37 0.00 0.00 175.52 177.28 1qe0 n ASP 47 N -4.70 0.08 -0.05 4.18 10.43 -1.26 -0.82 116.55 124.41 1qe0 n ASP 47 Ca 0.26 0.53 -0.17 0.00 2.57 0.00 0.00 54.79 57.98 1qe0 n ASP 47 Cb 0.83 -0.54 -0.13 0.00 1.84 0.00 0.00 41.12 43.12 1qe0 n ASP 47 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 1qe0 h LEU 48 N 0.00 0.11 -0.01 0.64 5.85 -1.24 -3.29 115.31 117.38 1qe0 h LEU 48 Ca 0.00 -0.88 0.00 0.00 0.84 0.00 0.00 57.88 57.84 1qe0 h LEU 48 Cb 0.02 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.01 1qe0 h LEU 48 CO 0.00 1.22 0.00 0.49 -0.34 0.00 0.00 178.44 179.81 1qe0 n PHE 49 N -4.43 0.07 -0.05 1.25 3.72 -0.48 -2.79 117.46 114.74 1qe0 n PHE 49 Ca -0.16 0.02 -0.11 0.00 -0.05 0.00 0.00 57.45 57.14 1qe0 n PHE 49 Cb 0.62 -0.53 0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1qe0 n PHE 49 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qe0 h ALA 50 N 2.91 0.65 0.00 4.37 0.00 -1.05 -3.52 119.26 122.61 1qe0 h ALA 50 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1qe0 h ALA 50 Cb 0.48 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1qe0 h ALA 50 CO 0.00 0.67 0.30 0.54 0.00 0.00 0.00 179.25 180.76 1qe0 n ARG 51 N -4.01 0.00 -2.20 0.00 5.12 -1.12 -5.08 116.66 109.37 1qe0 n ARG 51 Ca -0.03 0.01 -0.25 0.00 -1.93 0.00 0.00 57.85 55.66 1qe0 n ARG 51 Cb 0.57 -1.80 0.15 0.00 -1.16 0.00 0.00 32.46 30.22 1qe0 n ARG 51 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1qe0 n GLU 63 N -0.83 -0.59 -4.17 5.56 -0.58 -1.26 -5.11 120.64 113.66 1qe0 n GLU 63 Ca 0.00 -2.34 -0.11 0.00 -0.42 0.00 0.00 57.16 54.30 1qe0 n GLU 63 Cb 0.30 -0.93 -0.10 0.00 -0.57 0.00 0.00 31.44 30.14 1qe0 n GLU 63 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 1qe0 s MET 64 N -5.34 0.86 -0.80 3.49 -1.94 -1.26 -1.63 119.30 112.68 1qe0 s MET 64 Ca 0.67 -1.36 -0.22 0.00 -1.71 0.00 0.00 55.69 53.07 1qe0 s MET 64 Cb -0.03 -0.14 0.08 0.00 2.01 0.00 0.00 34.83 36.75 1qe0 s MET 64 CO 0.46 -0.06 1.11 0.71 -0.01 0.00 0.00 175.02 177.23 1qe0 s TYR 65 N -3.69 2.75 0.03 -0.03 1.51 -1.26 -4.90 117.35 111.76 1qe0 s TYR 65 Ca 0.14 -0.80 0.03 0.00 -1.01 0.00 0.00 57.07 55.43 1qe0 s TYR 65 Cb 0.06 -4.38 -0.04 0.00 -0.11 0.00 0.00 41.96 37.49 1qe0 s TYR 65 CO -0.03 -1.68 -0.02 0.99 -1.11 0.00 0.00 175.55 173.69 1qe0 s THR 66 N 3.93 3.96 -0.25 -0.71 2.01 -1.26 -0.98 115.64 122.34 1qe0 s THR 66 Ca 0.30 -0.76 -0.16 0.00 0.31 0.00 0.00 61.69 61.38 1qe0 s THR 66 Cb -0.10 -2.79 0.07 0.00 0.01 0.00 0.00 72.50 69.69 1qe0 s THR 66 CO 0.02 0.31 0.62 0.72 -0.69 0.00 0.00 174.62 175.60 1qe0 s PHE 67 N -1.12 -0.90 -1.02 4.92 -0.12 -0.75 -5.00 117.98 113.99 1qe0 s PHE 67 Ca 0.20 1.88 -0.07 0.00 -0.05 0.00 0.00 56.93 58.90 1qe0 s PHE 67 Cb -0.11 0.48 -0.07 0.00 -0.63 0.00 0.00 43.02 42.69 1qe0 s PHE 67 CO 0.12 -0.45 2.37 1.63 -0.05 0.00 0.00 175.22 178.83 1qe0 n LYS 68 N 3.99 2.43 0.00 1.99 5.02 -1.26 -1.82 118.16 128.51 1qe0 n LYS 68 Ca -0.19 -1.57 0.00 0.00 -2.02 0.00 0.00 58.31 54.52 1qe0 n LYS 68 Cb 0.58 -2.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.10 1qe0 n LYS 68 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1qe0 n ASP 69 N 3.91 0.00 -1.83 4.39 10.43 0.05 -2.51 116.55 130.99 1qe0 n ASP 69 Ca 0.52 0.00 -0.18 0.00 2.57 0.00 0.00 54.79 57.70 1qe0 n ASP 69 Cb 0.20 0.00 -0.05 0.00 1.84 0.00 0.00 41.12 43.10 1qe0 n ASP 69 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1qe0 n LYS 70 N 0.00 -1.56 -0.67 -1.24 3.00 -1.26 0.52 118.16 116.95 1qe0 n LYS 70 Ca 0.00 1.01 0.00 0.00 -0.00 0.00 0.00 58.31 59.32 1qe0 n LYS 70 Cb 0.00 -5.45 0.00 0.00 0.00 0.00 0.00 35.03 29.58 1qe0 n LYS 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1qe0 n GLY 71 N -0.55 0.76 4.41 3.14 0.00 -1.26 -4.15 105.19 107.53 1qe0 n GLY 71 Ca -0.19 -0.46 0.00 0.00 0.00 0.00 0.00 46.02 45.37 1qe0 n GLY 71 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1qe0 n ASP 72 N -0.52 0.00 -4.77 1.61 4.64 -0.68 -4.91 116.55 111.92 1qe0 n ASP 72 Ca 0.00 0.00 -0.37 0.00 -1.38 0.00 0.00 54.79 53.04 1qe0 n ASP 72 Cb 0.20 -2.08 -0.00 0.00 -1.04 0.00 0.00 41.12 38.20 1qe0 n ASP 72 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1qe0 s ARG 73 N -0.58 3.67 -0.27 -0.67 0.52 0.18 -4.52 118.95 117.29 1qe0 s ARG 73 Ca 0.00 1.87 -0.19 0.00 -0.52 0.00 0.00 55.73 56.89 1qe0 s ARG 73 Cb 0.00 -2.41 -0.02 0.00 0.52 0.00 0.00 34.95 33.04 1qe0 s ARG 73 CO 0.00 -0.65 0.59 0.45 0.02 0.00 0.00 175.30 175.71 1qe0 s SER 74 N -1.25 6.51 0.32 0.23 0.15 -1.26 -0.77 113.70 117.62 1qe0 s SER 74 Ca 0.64 0.57 0.10 0.00 0.70 0.00 0.00 55.95 57.97 1qe0 s SER 74 Cb -0.31 -2.32 -0.06 0.00 -1.71 0.00 0.00 66.02 61.63 1qe0 s SER 74 CO 0.38 -0.37 -0.08 0.27 1.20 0.00 0.00 173.24 174.64 1qe0 s ILE 75 N 2.46 2.56 -0.10 6.45 -4.36 -0.76 -2.03 121.20 125.42 1qe0 s ILE 75 Ca 0.24 -2.15 -0.06 0.00 -0.26 0.00 0.00 60.65 58.42 1qe0 s ILE 75 Cb -0.15 -2.62 0.04 0.00 1.25 0.00 0.00 42.46 40.97 1qe0 s ILE 75 CO 0.09 -0.27 0.24 -0.89 0.24 0.00 0.00 174.94 174.35 1qe0 s THR 76 N -2.52 -0.03 -0.04 8.37 2.01 0.88 -1.82 115.64 122.49 1qe0 s THR 76 Ca 0.32 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 62.14 1qe0 s THR 76 Cb -0.01 -0.37 -0.07 0.00 0.01 0.00 0.00 72.50 72.06 1qe0 s THR 76 CO 0.17 0.04 1.83 -0.76 -0.69 0.00 0.00 174.62 175.22 1qe0 s LEU 77 N 0.96 4.29 0.26 4.42 1.02 -0.15 -1.03 118.68 128.45 1qe0 s LEU 77 Ca -0.07 2.37 -0.31 0.00 0.02 0.00 0.00 54.13 56.14 1qe0 s LEU 77 Cb -0.08 -3.53 -0.12 0.00 0.02 0.00 0.00 46.19 42.48 1qe0 s LEU 77 CO -0.06 -1.07 1.55 -2.11 0.02 0.00 0.00 176.35 174.68 1qe0 n ARG 78 N 7.46 2.47 0.10 1.70 1.85 -0.67 -4.41 116.66 125.16 1qe0 n ARG 78 Ca 0.19 0.88 0.12 0.00 -1.00 0.00 0.00 57.85 58.04 1qe0 n ARG 78 Cb 0.42 -2.63 0.02 0.00 -1.05 0.00 0.00 32.46 29.22 1qe0 n ARG 78 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 1qe0 n PRO 79 N 2.40 0.56 -3.49 2.89 -0.04 -1.26 -0.81 135.00 135.25 1qe0 n PRO 79 Ca 0.11 0.12 -0.11 0.00 -0.04 0.00 0.00 63.50 63.57 1qe0 n PRO 79 Cb 0.34 -1.80 -0.02 0.00 -0.04 0.00 0.00 33.50 31.98 1qe0 n PRO 79 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 1qe0 s GLU 80 N -3.34 1.30 0.00 0.54 4.04 -1.26 -4.41 118.70 115.57 1qe0 s GLU 80 Ca 0.00 -0.53 0.22 0.00 0.04 0.00 0.00 54.97 54.71 1qe0 s GLU 80 Cb 0.10 0.57 0.53 0.00 0.02 0.00 0.00 34.13 35.35 1qe0 s GLU 80 CO 0.78 -0.57 1.45 0.41 -1.84 0.00 0.00 175.26 175.49 1qe0 n GLY 81 N -0.38 1.14 0.08 -3.83 0.00 -1.26 -4.52 105.19 96.43 1qe0 n GLY 81 Ca -0.14 -0.61 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 1qe0 n GLY 81 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1qe0 h THR 82 N 3.62 1.32 0.00 2.61 2.02 -1.99 -2.27 112.91 118.22 1qe0 h THR 82 Ca 0.00 -1.52 -0.02 0.00 0.77 0.00 0.00 66.41 65.64 1qe0 h THR 82 Cb 0.79 2.28 -0.00 0.00 -1.74 0.00 0.00 68.15 69.48 1qe0 h THR 82 CO 0.00 0.37 -0.08 0.00 0.37 0.00 0.00 175.52 176.18 1qe0 h ALA 83 N 0.06 1.83 0.01 6.16 0.00 -1.98 0.03 119.26 125.36 1qe0 h ALA 83 Ca -0.01 -0.07 -0.24 0.00 0.00 0.00 0.00 54.91 54.59 1qe0 h ALA 83 Cb 0.65 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1qe0 h ALA 83 CO 0.01 0.10 -0.98 0.00 0.00 0.00 0.00 179.25 178.39 1qe0 h ALA 84 N 1.92 0.30 -0.45 0.00 0.00 -1.80 0.32 119.26 119.55 1qe0 h ALA 84 Ca -0.00 -0.71 -0.09 0.00 0.00 0.00 0.00 54.91 54.11 1qe0 h ALA 84 Cb 0.15 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1qe0 h ALA 84 CO 0.01 0.79 -0.07 0.28 0.00 0.00 0.00 179.25 180.26 1qe0 h VAL 85 N 0.26 1.25 -0.16 0.00 2.07 -0.71 0.10 116.25 119.06 1qe0 h VAL 85 Ca -0.09 -1.12 -0.16 0.00 0.82 0.00 0.00 66.70 66.16 1qe0 h VAL 85 Cb 1.62 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 1qe0 h VAL 85 CO 0.17 0.39 -0.56 0.58 0.02 0.00 0.00 177.57 178.17 1qe0 h VAL 86 N 0.73 1.33 -0.33 2.57 2.07 -0.91 0.76 116.25 122.47 1qe0 h VAL 86 Ca 0.13 -1.84 -0.07 0.00 0.82 0.00 0.00 66.70 65.75 1qe0 h VAL 86 Cb 0.54 1.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.12 1qe0 h VAL 86 CO 0.03 0.56 -0.08 -0.09 0.02 0.00 0.00 177.57 178.01 1qe0 h ARG 87 N 0.37 0.55 -0.04 1.57 1.12 0.15 0.23 114.38 118.32 1qe0 h ARG 87 Ca 0.00 -0.15 -0.18 0.00 -1.11 0.00 0.00 59.98 58.55 1qe0 h ARG 87 Cb 1.10 -0.06 0.01 0.00 -0.01 0.00 0.00 29.97 31.00 1qe0 h ARG 87 CO 0.10 0.64 -0.67 1.03 -3.11 0.00 0.00 179.97 177.96 1qe0 h SER 88 N 0.51 0.66 -0.33 -3.80 0.87 -0.69 -1.84 113.55 108.92 1qe0 h SER 88 Ca 0.10 -0.71 0.06 0.00 -1.23 0.00 0.00 61.79 60.00 1qe0 h SER 88 Cb 0.46 -0.20 -0.05 0.00 -0.44 0.00 0.00 62.40 62.17 1qe0 h SER 88 CO 0.02 1.28 0.02 0.22 -0.53 0.00 0.00 176.83 177.84 1qe0 h TYR 89 N 0.10 0.03 0.63 2.24 3.20 -0.55 -0.18 116.97 122.44 1qe0 h TYR 89 Ca -0.07 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.79 1qe0 h TYR 89 Cb 1.34 0.04 0.01 0.00 1.54 0.00 0.00 36.73 39.66 1qe0 h TYR 89 CO 0.12 -0.03 -0.30 0.82 -1.64 0.00 0.00 178.16 177.13 1qe0 h ILE 90 N 0.12 0.19 -0.94 1.81 2.04 -0.99 -1.71 117.51 118.04 1qe0 h ILE 90 Ca 0.16 -0.33 0.22 0.00 1.00 0.00 0.00 64.86 65.92 1qe0 h ILE 90 Cb 0.21 0.25 -0.07 0.00 -0.74 0.00 0.00 36.82 36.47 1qe0 h ILE 90 CO -0.25 0.03 0.62 -0.08 0.00 0.00 0.00 178.15 178.47 1qe0 h GLU 91 N -1.12 0.35 -0.51 2.37 4.81 -1.28 0.26 114.58 119.46 1qe0 h GLU 91 Ca -0.09 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1qe0 h GLU 91 Cb 0.69 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.99 1qe0 h GLU 91 CO 0.14 0.23 0.00 0.72 -0.73 0.00 0.00 179.01 179.37 1qe0 n HIS 92 N -4.50 0.71 -4.01 0.92 8.25 -0.09 -4.93 115.22 111.57 1qe0 n HIS 92 Ca 0.21 -0.34 -0.37 0.00 -0.26 0.00 0.00 57.72 56.96 1qe0 n HIS 92 Cb 0.77 -0.02 -0.00 0.00 1.12 0.00 0.00 29.99 31.86 1qe0 n HIS 92 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1qe0 n LYS 93 N 0.93 -1.14 0.19 -0.41 5.02 0.93 -4.85 118.16 118.83 1qe0 n LYS 93 Ca 0.17 0.23 0.07 0.00 -2.02 0.00 0.00 58.31 56.75 1qe0 n LYS 93 Cb 0.45 -3.45 0.28 0.00 -0.02 0.00 0.00 35.03 32.29 1qe0 n LYS 93 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1qe0 h MET 94 N -2.17 0.00 -0.26 1.97 2.86 -1.54 -2.94 114.93 112.85 1qe0 h MET 94 Ca -0.68 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.04 1qe0 h MET 94 Cb 1.39 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.04 1qe0 h MET 94 CO 0.56 0.32 0.25 -0.56 1.06 0.00 0.00 176.91 178.54 1qe0 h GLN 95 N 0.00 0.00 -0.08 1.72 -0.00 -1.89 0.14 115.11 115.01 1qe0 h GLN 95 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1qe0 h GLN 95 Cb 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.47 1qe0 h GLN 95 CO 0.04 0.00 0.00 0.41 -0.00 0.00 0.00 178.83 179.28 1qe0 n GLY 96 N -1.47 0.14 3.75 0.06 0.00 -1.11 -4.92 105.19 101.63 1qe0 n GLY 96 Ca 0.03 -0.44 -0.41 0.00 0.00 0.00 0.00 46.02 45.20 1qe0 n GLY 96 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qe0 s ASN 97 N -1.83 6.60 0.46 1.61 -0.87 0.50 -4.91 114.94 116.49 1qe0 s ASN 97 Ca 0.36 2.73 0.17 0.00 -1.57 0.00 0.00 52.86 54.56 1qe0 s ASN 97 Cb 0.20 -2.63 1.08 0.00 -0.02 0.00 0.00 41.25 39.88 1qe0 s ASN 97 CO 0.31 -0.74 1.99 1.55 -2.57 0.00 0.00 177.10 177.64 1qe0 h PRO 98 N 4.83 0.00 -5.29 -0.60 0.13 -1.91 -3.39 132.00 125.77 1qe0 h PRO 98 Ca -0.46 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.01 1qe0 h PRO 98 Cb 1.22 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.19 1qe0 h PRO 98 CO 0.77 0.19 0.04 1.21 -0.23 0.00 0.00 178.00 179.97 1qe0 s ASN 99 N -6.79 6.31 0.05 1.44 2.47 -1.26 -5.05 114.94 112.11 1qe0 s ASN 99 Ca -0.04 -0.30 0.01 0.00 0.42 0.00 0.00 52.86 52.96 1qe0 s ASN 99 Cb 0.15 -2.29 -0.03 0.00 -1.45 0.00 0.00 41.25 37.63 1qe0 s ASN 99 CO 0.67 -0.67 -0.06 -1.10 -3.72 0.00 0.00 177.10 172.22 1qe0 s GLN 100 N 2.61 0.55 0.66 0.43 -1.52 -1.26 -4.38 119.66 116.75 1qe0 s GLN 100 Ca 0.20 -0.90 -0.14 0.00 -1.95 0.00 0.00 55.36 52.57 1qe0 s GLN 100 Cb -0.15 -0.11 0.00 0.00 -0.22 0.00 0.00 33.01 32.53 1qe0 s GLN 100 CO 0.17 -0.01 1.10 -1.25 -0.25 0.00 0.00 175.29 175.04 1qe0 s PRO 101 N -2.31 2.84 -0.30 2.91 0.04 -1.26 -5.07 135.00 131.85 1qe0 s PRO 101 Ca -0.05 1.31 -0.29 0.00 0.04 0.00 0.00 61.00 62.01 1qe0 s PRO 101 Cb -0.05 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 1qe0 s PRO 101 CO -0.02 -1.21 1.46 0.42 0.04 0.00 0.00 177.00 177.69 1qe0 s ILE 102 N -2.46 3.90 -0.43 0.56 -1.09 0.11 -4.83 121.20 116.96 1qe0 s ILE 102 Ca 0.65 0.99 -0.08 0.00 -2.23 0.00 0.00 60.65 59.98 1qe0 s ILE 102 Cb -0.19 -3.98 0.09 0.00 -1.58 0.00 0.00 42.46 36.80 1qe0 s ILE 102 CO 0.43 -0.47 0.26 -0.54 -1.23 0.00 0.00 174.94 173.39 1qe0 s LYS 103 N 4.60 2.47 0.15 2.79 1.02 -1.26 -0.11 119.74 129.40 1qe0 s LYS 103 Ca 0.64 -1.59 0.09 0.00 0.02 0.00 0.00 55.97 55.13 1qe0 s LYS 103 Cb -0.19 -3.77 -0.04 0.00 -0.52 0.00 0.00 37.83 33.31 1qe0 s LYS 103 CO 0.28 -1.03 -0.20 -0.51 -0.92 0.00 0.00 175.35 172.97 1qe0 s LEU 104 N 1.36 2.40 0.10 3.17 1.43 -0.42 -1.22 118.68 125.50 1qe0 s LEU 104 Ca 0.04 -0.82 0.00 0.00 -1.03 0.00 0.00 54.13 52.32 1qe0 s LEU 104 Cb -0.24 -0.90 -0.04 0.00 0.03 0.00 0.00 46.19 45.05 1qe0 s LEU 104 CO 0.00 0.01 -0.01 -0.72 0.23 0.00 0.00 176.35 175.86 1qe0 s TYR 105 N -1.76 0.79 0.19 0.29 -0.85 -0.01 -0.78 117.35 115.21 1qe0 s TYR 105 Ca 0.14 -1.07 -0.08 0.00 -0.52 0.00 0.00 57.07 55.54 1qe0 s TYR 105 Cb -0.07 -0.49 -0.01 0.00 0.38 0.00 0.00 41.96 41.77 1qe0 s TYR 105 CO 0.06 -0.34 0.30 1.52 -1.52 0.00 0.00 175.55 175.57 1qe0 s TYR 106 N -3.85 0.52 -0.30 -3.49 1.13 -0.41 -1.29 117.35 109.66 1qe0 s TYR 106 Ca 0.15 -0.86 -0.07 0.00 -1.41 0.00 0.00 57.07 54.88 1qe0 s TYR 106 Cb 0.07 -0.09 0.17 0.00 -1.10 0.00 0.00 41.96 41.01 1qe0 s TYR 106 CO -0.04 -0.76 0.75 1.21 -2.51 0.00 0.00 175.55 174.20 1qe0 s ASN 107 N -3.01 -1.05 -0.05 -0.18 3.84 -1.26 -1.81 114.94 111.41 1qe0 s ASN 107 Ca 0.22 0.88 -0.31 0.00 0.21 0.00 0.00 52.86 53.86 1qe0 s ASN 107 Cb 0.03 1.97 0.12 0.00 -0.55 0.00 0.00 41.25 42.82 1qe0 s ASN 107 CO 0.04 -0.20 1.35 -0.83 -2.79 0.00 0.00 177.10 174.67 1qe0 s GLY 108 N 2.84 -0.33 0.32 1.21 0.00 -0.34 -4.98 107.32 106.03 1qe0 s GLY 108 Ca 0.08 0.50 -0.29 0.00 0.00 0.00 0.00 44.72 45.02 1qe0 s GLY 108 CO -0.18 2.82 1.20 2.56 0.00 0.00 0.00 173.10 179.50 1qe0 s PRO 109 N -2.13 4.45 0.15 2.90 0.04 -1.26 -1.53 135.00 137.62 1qe0 s PRO 109 Ca 0.22 1.99 0.10 0.00 0.04 0.00 0.00 61.00 63.35 1qe0 s PRO 109 Cb 0.03 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.45 1qe0 s PRO 109 CO -0.04 -0.02 -0.24 -1.64 0.04 0.00 0.00 177.00 175.10 1qe0 s MET 110 N -1.70 1.38 -0.25 4.56 -1.94 0.44 -4.89 119.30 116.90 1qe0 s MET 110 Ca 0.48 -1.37 0.01 0.00 -1.71 0.00 0.00 55.69 53.09 1qe0 s MET 110 Cb -0.35 -1.75 0.07 0.00 2.01 0.00 0.00 34.83 34.81 1qe0 s MET 110 CO 0.46 0.40 -0.02 -0.06 -0.01 0.00 0.00 175.02 175.79 1qe0 s PHE 111 N -1.34 2.31 -0.07 -0.03 0.08 0.01 -0.73 117.98 118.21 1qe0 s PHE 111 Ca 0.15 -1.78 0.04 0.00 0.12 0.00 0.00 56.93 55.46 1qe0 s PHE 111 Cb -0.09 -1.66 -0.00 0.00 -0.57 0.00 0.00 43.02 40.70 1qe0 s PHE 111 CO 0.07 -0.79 -0.20 1.03 -0.10 0.00 0.00 175.22 175.23 1qe0 s ARG 112 N 1.42 2.30 -0.33 0.44 0.52 -0.43 -3.99 118.95 118.88 1qe0 s ARG 112 Ca -0.02 -0.71 -0.02 0.00 -0.52 0.00 0.00 55.73 54.46 1qe0 s ARG 112 Cb -0.19 -1.87 -0.02 0.00 0.52 0.00 0.00 34.95 33.39 1qe0 s ARG 112 CO -0.09 0.21 1.40 0.66 0.02 0.00 0.00 175.30 177.51 1qe0 n TYR 113 N 3.34 0.49 -0.59 -0.53 4.01 -0.64 -4.31 117.16 118.94 1qe0 n TYR 113 Ca -0.19 -1.03 -0.22 0.00 -0.16 0.00 0.00 57.90 56.30 1qe0 n TYR 113 Cb 0.53 -0.99 -0.03 0.00 -0.31 0.00 0.00 39.34 38.54 1qe0 n TYR 113 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1qe0 n TYR 121 N 4.69 0.15 0.19 -0.72 0.53 -1.26 -4.81 117.16 115.93 1qe0 n TYR 121 Ca 0.16 0.41 0.05 0.00 -1.02 0.00 0.00 57.90 57.50 1qe0 n TYR 121 Cb 0.05 -0.82 0.34 0.00 -1.03 0.00 0.00 39.34 37.88 1qe0 n TYR 121 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1qe0 h ARG 122 N 1.01 0.00 -4.96 -0.72 -0.00 -0.58 -3.39 114.38 105.73 1qe0 h ARG 122 Ca -0.18 0.00 -0.66 0.00 -0.50 0.00 0.00 59.98 58.64 1qe0 h ARG 122 Cb 0.57 0.00 -0.28 0.00 0.00 0.00 0.00 29.97 30.25 1qe0 h ARG 122 CO 0.25 0.39 -0.72 -1.14 0.00 0.00 0.00 179.97 178.75 1qe0 s GLN 123 N -3.69 3.25 0.12 0.04 0.74 -1.25 -1.32 119.66 117.55 1qe0 s GLN 123 Ca -0.01 -0.71 0.05 0.00 0.05 0.00 0.00 55.36 54.74 1qe0 s GLN 123 Cb 0.12 -3.03 -0.04 0.00 1.10 0.00 0.00 33.01 31.16 1qe0 s GLN 123 CO 0.69 -0.25 -0.11 -0.59 -0.55 0.00 0.00 175.29 174.48 1qe0 s PHE 124 N 1.45 1.22 -0.58 1.67 -0.71 0.10 -4.85 117.98 116.28 1qe0 s PHE 124 Ca 0.05 -0.67 -0.06 0.00 -1.04 0.00 0.00 56.93 55.21 1qe0 s PHE 124 Cb -0.15 -0.64 0.15 0.00 -1.21 0.00 0.00 43.02 41.17 1qe0 s PHE 124 CO -0.03 0.07 0.43 -0.80 -1.34 0.00 0.00 175.22 173.54 1qe0 s ASN 125 N -2.71 5.61 0.06 1.98 0.02 -1.26 0.17 114.94 118.80 1qe0 s ASN 125 Ca 0.10 -2.43 -0.19 0.00 -1.02 0.00 0.00 52.86 49.32 1qe0 s ASN 125 Cb -0.01 -1.95 -0.06 0.00 0.02 0.00 0.00 41.25 39.24 1qe0 s ASN 125 CO 0.01 -0.52 0.57 0.00 0.02 0.00 0.00 177.10 177.17 1qe0 s GLN 126 N 0.56 4.21 0.06 -0.60 -2.07 -0.58 -2.29 119.66 118.95 1qe0 s GLN 126 Ca 0.12 0.72 0.08 0.00 -1.82 0.00 0.00 55.36 54.46 1qe0 s GLN 126 Cb -0.21 -3.25 -0.03 0.00 -1.09 0.00 0.00 33.01 28.42 1qe0 s GLN 126 CO -0.04 0.60 -0.19 0.12 -1.32 0.00 0.00 175.29 174.47 1qe0 s PHE 127 N -0.96 2.53 0.08 9.60 5.36 0.76 -1.20 117.98 134.14 1qe0 s PHE 127 Ca 0.29 -0.27 -0.27 0.00 -0.96 0.00 0.00 56.93 55.72 1qe0 s PHE 127 Cb -0.19 -1.43 0.08 0.00 -0.34 0.00 0.00 43.02 41.15 1qe0 s PHE 127 CO 0.18 0.28 1.01 0.20 -1.46 0.00 0.00 175.22 175.44 1qe0 s GLY 128 N -1.61 -0.31 0.21 13.12 0.00 -0.75 0.89 107.32 118.86 1qe0 s GLY 128 Ca 0.15 0.48 0.06 0.00 0.00 0.00 0.00 44.72 45.41 1qe0 s GLY 128 CO 0.06 0.12 -0.11 -1.34 0.00 0.00 0.00 173.10 171.83 1qe0 s VAL 129 N -3.06 1.52 -0.15 1.40 -7.23 -0.87 -1.29 120.40 110.71 1qe0 s VAL 129 Ca 0.11 -2.14 -0.06 0.00 -1.81 0.00 0.00 61.98 58.08 1qe0 s VAL 129 Cb -0.00 -2.09 0.07 0.00 0.56 0.00 0.00 36.38 34.91 1qe0 s VAL 129 CO -0.01 -0.56 0.31 -1.61 -0.31 0.00 0.00 175.10 172.92 1qe0 s GLU 130 N -3.70 0.22 -0.33 4.82 0.41 0.04 -2.30 118.70 117.85 1qe0 s GLU 130 Ca 0.23 0.81 -0.02 0.00 -0.41 0.00 0.00 54.97 55.58 1qe0 s GLU 130 Cb 0.01 0.06 0.07 0.00 -1.78 0.00 0.00 34.13 32.49 1qe0 s GLU 130 CO 0.06 -0.25 0.06 0.00 -0.49 0.00 0.00 175.26 174.64 1qe0 s ALA 131 N 2.27 2.92 -0.10 5.21 0.00 0.14 -1.30 121.76 130.90 1qe0 s ALA 131 Ca -0.02 -1.98 0.01 0.00 0.00 0.00 0.00 51.96 49.97 1qe0 s ALA 131 Cb -0.12 -2.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.90 1qe0 s ALA 131 CO -0.10 -1.42 -0.11 0.42 0.00 0.00 0.00 175.76 174.54 1qe0 s ILE 132 N 1.22 3.25 0.00 0.00 1.01 0.84 -1.91 121.20 125.62 1qe0 s ILE 132 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 60.65 60.02 1qe0 s ILE 132 Cb -0.20 -2.34 0.00 0.00 0.01 0.00 0.00 42.46 39.92 1qe0 s ILE 132 CO -0.02 0.55 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1qe0 n GLY 133 N 2.98 1.58 2.70 6.18 0.00 0.13 0.04 105.19 118.80 1qe0 n GLY 133 Ca -0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.80 1qe0 n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qe0 n ALA 134 N -0.57 -2.95 -1.86 4.61 0.00 -1.26 -4.42 120.51 114.05 1qe0 n ALA 134 Ca 0.00 -0.50 -0.43 0.00 0.00 0.00 0.00 53.44 52.52 1qe0 n ALA 134 Cb 0.00 -2.58 -0.03 0.00 0.00 0.00 0.00 19.45 16.85 1qe0 n ALA 134 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1qe0 s GLU 135 N 0.69 3.65 -0.29 0.00 2.12 -1.26 -4.85 118.70 118.76 1qe0 s GLU 135 Ca 0.27 1.96 -0.15 0.00 0.36 0.00 0.00 54.97 57.41 1qe0 s GLU 135 Cb 0.14 -4.17 0.13 0.00 0.26 0.00 0.00 34.13 30.49 1qe0 s GLU 135 CO -0.11 -1.49 0.86 1.21 -0.54 0.00 0.00 175.26 175.19 1qe0 s ASN 136 N 5.56 -0.72 0.27 -1.70 3.84 -1.26 -5.04 114.94 115.89 1qe0 s ASN 136 Ca 0.84 1.09 -0.02 0.00 0.21 0.00 0.00 52.86 54.98 1qe0 s ASN 136 Cb -0.31 1.53 0.60 0.00 -0.55 0.00 0.00 41.25 42.52 1qe0 s ASN 136 CO 0.34 -0.16 1.63 -0.65 -2.79 0.00 0.00 177.10 175.47 1qe0 h PRO 137 N 6.91 0.13 -0.10 0.43 0.11 -1.90 0.22 132.00 137.80 1qe0 h PRO 137 Ca -0.24 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.89 1qe0 h PRO 137 Cb 1.17 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 1qe0 h PRO 137 CO 0.15 0.09 0.11 0.66 -0.21 0.00 0.00 178.00 178.79 1qe0 h SER 138 N 0.14 0.00 0.06 -2.05 4.64 -1.96 0.44 113.55 114.82 1qe0 h SER 138 Ca 0.50 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.65 1qe0 h SER 138 Cb 0.97 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.07 1qe0 h SER 138 CO -0.70 0.00 -0.69 0.58 -0.87 0.00 0.00 176.83 175.15 1qe0 h VAL 139 N 0.00 1.46 -0.89 0.95 2.07 -1.29 -2.20 116.25 116.35 1qe0 h VAL 139 Ca 0.05 -2.26 0.00 0.00 0.82 0.00 0.00 66.70 65.32 1qe0 h VAL 139 Cb 0.26 2.83 -0.04 0.00 -1.52 0.00 0.00 31.29 32.81 1qe0 h VAL 139 CO -0.00 0.65 0.57 0.44 0.02 0.00 0.00 177.57 179.25 1qe0 h ASP 140 N -0.20 1.04 -0.30 0.57 3.45 -0.86 -0.74 116.42 119.38 1qe0 h ASP 140 Ca -0.10 -0.04 -0.01 0.00 0.43 0.00 0.00 57.03 57.31 1qe0 h ASP 140 Cb 1.45 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 39.94 1qe0 h ASP 140 CO 0.13 0.77 0.17 0.00 -1.57 0.00 0.00 179.24 178.74 1qe0 h ALA 141 N 1.41 0.39 -0.47 3.45 0.00 -0.98 -0.65 119.26 122.42 1qe0 h ALA 141 Ca 0.32 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1qe0 h ALA 141 Cb -0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 1qe0 h ALA 141 CO -0.07 -0.09 0.27 1.49 0.00 0.00 0.00 179.25 180.85 1qe0 h GLU 142 N 0.37 0.52 -0.07 0.00 4.81 -0.72 0.17 114.58 119.67 1qe0 h GLU 142 Ca 0.11 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.19 1qe0 h GLU 142 Cb 0.06 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1qe0 h GLU 142 CO -0.02 0.35 -0.49 -0.39 -0.73 0.00 0.00 179.01 177.73 1qe0 h VAL 143 N 0.54 1.35 -0.10 0.32 -1.51 -0.85 -2.50 116.25 113.51 1qe0 h VAL 143 Ca 0.19 -1.72 -0.18 0.00 -1.23 0.00 0.00 66.70 63.76 1qe0 h VAL 143 Cb 0.03 1.84 -0.00 0.00 -2.13 0.00 0.00 31.29 31.03 1qe0 h VAL 143 CO -0.09 0.51 -0.70 -0.07 -1.23 0.00 0.00 177.57 175.98 1qe0 h LEU 144 N 0.14 0.51 -1.27 4.19 3.38 -0.63 -1.03 115.31 120.61 1qe0 h LEU 144 Ca 0.01 -0.32 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 1qe0 h LEU 144 Cb 0.93 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1qe0 h LEU 144 CO 0.07 1.06 -0.06 0.00 0.09 0.00 0.00 178.44 179.60 1qe0 h ALA 145 N 0.94 1.41 -0.10 1.53 0.00 -0.60 -2.23 119.26 120.20 1qe0 h ALA 145 Ca -0.02 -0.21 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1qe0 h ALA 145 Cb 1.26 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1qe0 h ALA 145 CO 0.12 0.41 -0.22 1.98 0.00 0.00 0.00 179.25 181.54 1qe0 h MET 146 N 0.40 0.32 -0.26 0.00 1.85 -1.16 0.32 114.93 116.40 1qe0 h MET 146 Ca 0.08 -0.22 -0.00 0.00 -0.61 0.00 0.00 59.70 58.96 1qe0 h MET 146 Cb 0.36 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.41 1qe0 h MET 146 CO 0.02 0.82 0.14 -0.24 -0.40 0.00 0.00 176.91 177.25 1qe0 h VAL 147 N -0.14 1.08 -0.01 -5.77 3.04 -0.97 0.12 116.25 113.60 1qe0 h VAL 147 Ca -0.00 -0.21 -0.15 0.00 -1.01 0.00 0.00 66.70 65.32 1qe0 h VAL 147 Cb 0.82 0.73 0.01 0.00 -2.01 0.00 0.00 31.29 30.85 1qe0 h VAL 147 CO 0.05 0.09 -0.60 -0.03 -1.01 0.00 0.00 177.57 176.07 1qe0 h MET 148 N 0.36 0.42 0.17 4.17 -1.53 -1.34 -3.29 114.93 113.90 1qe0 h MET 148 Ca 0.09 -0.44 0.01 0.00 -3.44 0.00 0.00 59.70 55.93 1qe0 h MET 148 Cb 0.01 0.12 -0.03 0.00 -0.55 0.00 0.00 31.60 31.15 1qe0 h MET 148 CO -0.02 1.10 -0.27 1.25 0.14 0.00 0.00 176.91 179.11 1qe0 h HIS 149 N -0.07 -0.74 -0.47 1.39 6.17 -0.05 -0.14 115.15 121.23 1qe0 h HIS 149 Ca -0.07 0.01 0.06 0.00 0.71 0.00 0.00 60.37 61.08 1qe0 h HIS 149 Cb 1.30 0.30 -0.09 0.00 2.52 0.00 0.00 27.41 31.44 1qe0 h HIS 149 CO 0.14 -0.39 -0.54 0.82 0.71 0.00 0.00 177.93 178.68 1qe0 h ILE 150 N -0.52 0.02 -0.50 6.26 2.04 -0.92 0.45 117.51 124.33 1qe0 h ILE 150 Ca 0.02 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.83 1qe0 h ILE 150 Cb 0.52 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.59 1qe0 h ILE 150 CO -0.12 0.00 0.13 1.88 0.00 0.00 0.00 178.15 180.03 1qe0 h TYR 151 N -0.35 0.78 0.00 1.37 0.05 -1.60 -2.14 116.97 115.08 1qe0 h TYR 151 Ca 0.09 -0.06 -0.07 0.00 0.05 0.00 0.00 58.73 58.74 1qe0 h TYR 151 Cb 0.58 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 38.08 1qe0 h TYR 151 CO -0.74 0.66 -0.32 1.96 -1.05 0.00 0.00 178.16 178.67 1qe0 h GLN 152 N 0.74 0.00 0.00 4.88 4.20 0.40 -3.00 115.11 122.33 1qe0 h GLN 152 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 1qe0 h GLN 152 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1qe0 h GLN 152 CO -0.00 0.32 0.00 0.66 -0.67 0.00 0.00 178.83 179.13 1qe0 h SER 153 N 0.00 0.00 -0.01 1.46 4.64 0.54 -1.68 113.55 118.50 1qe0 h SER 153 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qe0 h SER 153 Cb 0.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 1qe0 h SER 153 CO 0.04 0.00 -0.04 0.49 -0.87 0.00 0.00 176.83 176.45 1qe0 n PHE 154 N -2.93 0.00 -0.39 4.77 3.72 -1.14 -4.96 117.46 116.53 1qe0 n PHE 154 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1qe0 n PHE 154 Cb 0.23 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 1qe0 n PHE 154 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1qe0 n GLY 155 N 1.29 0.75 3.76 1.37 0.00 -0.63 -4.99 105.19 106.74 1qe0 n GLY 155 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1qe0 n GLY 155 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qe0 s LEU 156 N 0.00 3.86 0.00 0.99 2.01 -1.20 -4.95 118.68 119.38 1qe0 s LEU 156 Ca 0.00 2.42 0.00 0.00 0.01 0.00 0.00 54.13 56.56 1qe0 s LEU 156 Cb 0.00 -4.38 0.00 0.00 0.01 0.00 0.00 46.19 41.82 1qe0 s LEU 156 CO 0.00 -1.28 0.00 0.29 1.01 0.00 0.00 176.35 176.37 1qe0 n LYS 157 N -0.98 3.38 -1.91 1.70 5.02 -1.26 -4.64 118.16 119.47 1qe0 n LYS 157 Ca 0.10 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 56.01 1qe0 n LYS 157 Cb 0.48 -0.71 0.04 0.00 -0.02 0.00 0.00 35.03 34.82 1qe0 n LYS 157 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1qe0 n HIS 158 N -0.66 3.04 -1.75 2.13 8.25 -1.26 -4.98 115.22 119.98 1qe0 n HIS 158 Ca 0.00 -2.46 -0.31 0.00 -0.26 0.00 0.00 57.72 54.69 1qe0 n HIS 158 Cb 0.01 -1.12 0.03 0.00 1.12 0.00 0.00 29.99 30.04 1qe0 n HIS 158 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1qe0 s LEU 159 N -4.00 3.26 -0.34 2.41 2.01 -1.26 -0.52 118.68 120.24 1qe0 s LEU 159 Ca 0.53 1.66 0.06 0.00 0.01 0.00 0.00 54.13 56.39 1qe0 s LEU 159 Cb 0.44 -4.50 0.19 0.00 0.01 0.00 0.00 46.19 42.33 1qe0 s LEU 159 CO -0.35 -1.30 0.62 -0.75 1.01 0.00 0.00 176.35 175.58 1qe0 s LYS 160 N -4.74 0.65 -0.06 1.70 2.20 0.18 -4.88 119.74 114.80 1qe0 s LYS 160 Ca 0.59 0.22 -0.30 0.00 -0.36 0.00 0.00 55.97 56.13 1qe0 s LYS 160 Cb -0.14 0.19 -0.03 0.00 -1.51 0.00 0.00 37.83 36.34 1qe0 s LYS 160 CO 0.49 -1.08 1.11 -1.17 -0.36 0.00 0.00 175.35 174.34 1qe0 s LEU 161 N 2.44 4.29 -0.12 5.43 1.98 -1.26 -0.80 118.68 130.63 1qe0 s LEU 161 Ca 0.13 1.72 0.03 0.00 -2.89 0.00 0.00 54.13 53.11 1qe0 s LEU 161 Cb -0.07 -3.56 0.00 0.00 0.66 0.00 0.00 46.19 43.22 1qe0 s LEU 161 CO -0.18 -0.49 -0.22 -0.69 -1.89 0.00 0.00 176.35 172.88 1qe0 s VAL 162 N 1.90 2.17 0.24 1.68 1.01 -0.15 -0.44 120.40 126.81 1qe0 s VAL 162 Ca 0.53 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.62 1qe0 s VAL 162 Cb -0.22 -1.85 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 1qe0 s VAL 162 CO 0.22 0.55 -0.10 0.27 0.00 0.00 0.00 175.10 176.04 1qe0 s ILE 163 N 0.55 1.68 0.27 2.22 -4.36 0.08 -1.34 121.20 120.30 1qe0 s ILE 163 Ca -0.13 -2.17 -0.21 0.00 -0.26 0.00 0.00 60.65 57.87 1qe0 s ILE 163 Cb -0.17 -2.23 0.02 0.00 1.25 0.00 0.00 42.46 41.33 1qe0 s ILE 163 CO 0.04 -0.45 0.74 0.21 0.24 0.00 0.00 174.94 175.71 1qe0 s ASN 164 N -3.37 -0.26 -0.02 4.36 3.04 -0.37 -1.39 114.94 116.93 1qe0 s ASN 164 Ca 0.26 -0.58 -0.02 0.00 0.04 0.00 0.00 52.86 52.56 1qe0 s ASN 164 Cb 0.01 0.71 0.00 0.00 -1.54 0.00 0.00 41.25 40.44 1qe0 s ASN 164 CO 0.09 -1.31 0.04 -0.55 -3.04 0.00 0.00 177.10 172.33 1qe0 s SER 165 N -2.92 -0.04 -0.28 -4.21 0.15 -1.26 -1.53 113.70 103.62 1qe0 s SER 165 Ca 0.11 0.07 0.09 0.00 0.70 0.00 0.00 55.95 56.92 1qe0 s SER 165 Cb -0.06 0.09 0.50 0.00 -1.71 0.00 0.00 66.02 64.85 1qe0 s SER 165 CO 0.06 -0.03 1.45 1.33 1.20 0.00 0.00 173.24 177.25 1qe0 n VAL 166 N 3.00 2.52 -3.49 4.45 0.24 -0.47 -4.98 118.33 119.61 1qe0 n VAL 166 Ca -0.13 -2.72 0.02 0.00 -2.04 0.00 0.00 64.34 59.47 1qe0 n VAL 166 Cb 0.60 -0.31 -0.00 0.00 -1.47 0.00 0.00 33.84 32.65 1qe0 n VAL 166 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1qe0 n GLY 167 N -1.09 -0.76 1.02 7.63 0.00 -1.24 -4.80 105.19 105.95 1qe0 n GLY 167 Ca 0.32 -0.76 -0.07 0.00 0.00 0.00 0.00 46.02 45.51 1qe0 n GLY 167 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1qe0 n ASP 168 N -3.36 0.12 0.15 1.61 5.75 -1.26 -3.56 116.55 115.99 1qe0 n ASP 168 Ca 0.00 -1.18 0.01 0.00 -0.01 0.00 0.00 54.79 53.61 1qe0 n ASP 168 Cb 0.05 -0.24 0.20 0.00 -1.03 0.00 0.00 41.12 40.10 1qe0 n ASP 168 CO 0.00 0.00 0.00 -0.03 -0.11 0.00 0.00 177.20 177.06 1qe0 h MET 169 N 0.00 0.00 -0.71 0.11 1.85 -1.89 -2.83 114.93 111.46 1qe0 h MET 169 Ca -0.11 0.00 -0.07 0.00 -0.61 0.00 0.00 59.70 58.91 1qe0 h MET 169 Cb 0.32 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 32.32 1qe0 h MET 169 CO 0.08 0.57 0.16 0.00 -0.40 0.00 0.00 176.91 177.32 1qe0 h ALA 170 N 1.43 0.94 -3.00 0.39 0.00 -1.98 -3.54 119.26 113.50 1qe0 h ALA 170 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1qe0 h ALA 170 Cb 1.09 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1qe0 h ALA 170 CO 0.07 0.67 0.00 0.43 0.00 0.00 0.00 179.25 180.43 1qe0 n SER 171 N -4.22 0.00 0.00 0.00 7.64 -1.07 -5.22 113.62 110.75 1qe0 n SER 171 Ca 0.05 0.17 0.00 0.00 1.01 0.00 0.00 58.87 60.10 1qe0 n SER 171 Cb 0.27 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.47 1qe0 n SER 171 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1qe0 n SER 231 N -0.33 0.00 -0.26 6.43 7.64 -1.26 -5.00 113.62 120.85 1qe0 n SER 231 Ca 0.00 0.00 0.05 0.00 1.01 0.00 0.00 58.87 59.93 1qe0 n SER 231 Cb 0.00 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.32 1qe0 n SER 231 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1qe0 n LYS 232 N 0.00 -0.06 0.22 1.43 5.02 -1.26 0.30 118.16 123.80 1qe0 n LYS 232 Ca 0.00 1.11 0.09 0.00 -2.02 0.00 0.00 58.31 57.49 1qe0 n LYS 232 Cb 0.00 -1.68 0.49 0.00 -0.02 0.00 0.00 35.03 33.83 1qe0 n LYS 232 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qe0 h ALA 233 N 1.43 1.13 0.72 7.82 0.00 -2.05 0.17 119.26 128.48 1qe0 h ALA 233 Ca 0.36 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1qe0 h ALA 233 Cb 0.58 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1qe0 h ALA 233 CO -0.73 0.32 -0.34 -0.92 0.00 0.00 0.00 179.25 177.57 1qe0 h TYR 234 N 0.00 -0.89 -0.79 0.00 5.03 0.41 -0.56 116.97 120.16 1qe0 h TYR 234 Ca -0.00 -0.02 0.10 0.00 2.58 0.00 0.00 58.73 61.39 1qe0 h TYR 234 Cb 0.66 0.30 -0.07 0.00 1.55 0.00 0.00 36.73 39.16 1qe0 h TYR 234 CO 0.00 -0.53 0.43 -0.92 -1.32 0.00 0.00 178.16 175.82 1qe0 h TYR 235 N -1.11 0.78 0.00 -3.82 -0.00 -0.85 0.34 116.97 112.31 1qe0 h TYR 235 Ca -0.10 0.03 -0.05 0.00 -0.00 0.00 0.00 58.73 58.61 1qe0 h TYR 235 Cb 0.76 -0.23 -0.01 0.00 -0.00 0.00 0.00 36.73 37.26 1qe0 h TYR 235 CO -0.00 0.29 -0.26 0.93 -0.00 0.00 0.00 178.16 179.12 1qe0 h GLU 236 N 0.72 0.00 -0.06 1.82 4.39 -0.61 -1.86 114.58 118.98 1qe0 h GLU 236 Ca 0.39 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.94 1qe0 h GLU 236 Cb 0.40 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1qe0 h GLU 236 CO -0.27 0.26 -0.56 0.37 -1.16 0.00 0.00 179.01 177.65 1qe0 h GLN 237 N 0.00 0.48 -0.25 2.33 5.75 0.12 0.28 115.11 123.82 1qe0 h GLN 237 Ca -0.00 -0.44 0.03 0.00 -0.15 0.00 0.00 58.65 58.09 1qe0 h GLN 237 Cb 0.50 0.11 -0.03 0.00 1.07 0.00 0.00 27.48 29.12 1qe0 h GLN 237 CO 0.03 1.08 0.04 0.28 -2.65 0.00 0.00 178.83 177.62 1qe0 h VAL 238 N 0.03 0.88 0.00 2.39 2.07 -0.78 0.23 116.25 121.06 1qe0 h VAL 238 Ca -0.05 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.36 1qe0 h VAL 238 Cb 1.23 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1qe0 h VAL 238 CO 0.11 0.02 -0.30 0.11 0.02 0.00 0.00 177.57 177.54 1qe0 h LYS 239 N 0.14 0.00 0.40 1.57 1.57 -1.32 0.06 116.57 118.99 1qe0 h LYS 239 Ca 0.12 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1qe0 h LYS 239 Cb 0.12 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1qe0 h LYS 239 CO -0.16 0.30 -0.19 0.00 -0.57 0.00 0.00 179.45 178.83 1qe0 h ALA 240 N 1.70 -0.54 -0.27 3.86 0.00 0.15 -0.63 119.26 123.54 1qe0 h ALA 240 Ca -0.00 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.84 1qe0 h ALA 240 Cb 0.76 0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.71 1qe0 h ALA 240 CO 0.04 -0.79 -0.07 1.88 0.00 0.00 0.00 179.25 180.30 1qe0 h TYR 241 N -0.55 -0.15 -0.96 0.00 0.05 -0.28 0.59 116.97 115.67 1qe0 h TYR 241 Ca -0.05 0.02 0.13 0.00 0.05 0.00 0.00 58.73 58.88 1qe0 h TYR 241 Cb 0.42 0.11 -0.08 0.00 1.01 0.00 0.00 36.73 38.19 1qe0 h TYR 241 CO -0.04 -0.12 0.61 -0.07 -1.05 0.00 0.00 178.16 177.48 1qe0 h LEU 242 N -0.01 0.82 -0.55 3.88 4.07 -0.68 0.26 115.31 123.10 1qe0 h LEU 242 Ca 0.13 0.05 -0.12 0.00 0.08 0.00 0.00 57.88 58.02 1qe0 h LEU 242 Cb 0.20 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 1qe0 h LEU 242 CO -0.28 0.41 -0.14 0.44 -1.08 0.00 0.00 178.44 177.79 1qe0 h ASP 243 N 0.86 1.03 0.28 -0.43 3.45 0.61 0.17 116.42 122.40 1qe0 h ASP 243 Ca 0.49 -0.36 0.00 0.00 0.43 0.00 0.00 57.03 57.59 1qe0 h ASP 243 Cb 0.61 -0.28 -0.02 0.00 -0.56 0.00 0.00 39.33 39.08 1qe0 h ASP 243 CO -0.25 1.16 -0.26 0.44 -1.57 0.00 0.00 179.24 178.75 1qe0 h ASP 244 N 0.90 -0.70 0.49 6.45 5.19 0.14 -2.25 116.42 126.64 1qe0 h ASP 244 Ca 0.13 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.60 1qe0 h ASP 244 Cb 0.71 0.24 0.00 0.00 0.18 0.00 0.00 39.33 40.46 1qe0 h ASP 244 CO 0.05 -0.38 0.00 0.18 -3.12 0.00 0.00 179.24 175.97 1qe0 n LEU 245 N -5.38 0.41 -1.20 1.55 4.77 0.60 -4.89 117.00 112.86 1qe0 n LEU 245 Ca -0.09 0.62 -0.07 0.00 -0.03 0.00 0.00 56.01 56.44 1qe0 n LEU 245 Cb 0.29 -0.59 0.01 0.00 -2.33 0.00 0.00 43.42 40.81 1qe0 n LEU 245 CO 0.30 -0.54 0.02 0.61 -1.33 0.00 0.00 177.39 176.45 1qe0 n GLY 246 N -0.35 0.34 3.49 -0.72 0.00 -0.36 -5.02 105.19 102.57 1qe0 n GLY 246 Ca 0.02 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 1qe0 n GLY 246 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qe0 s ILE 247 N -2.81 4.70 0.31 -0.61 1.01 0.47 -5.02 121.20 119.25 1qe0 s ILE 247 Ca 0.11 -0.12 -0.27 0.00 0.00 0.00 0.00 60.65 60.37 1qe0 s ILE 247 Cb -0.05 -3.26 -0.10 0.00 0.01 0.00 0.00 42.46 39.07 1qe0 s ILE 247 CO 0.14 0.24 0.98 -2.84 0.00 0.00 0.00 174.94 173.46 1qe0 s PRO 248 N 1.66 4.58 0.10 2.79 0.02 -1.26 -4.40 135.00 138.50 1qe0 s PRO 248 Ca 0.06 1.44 -0.12 0.00 0.02 0.00 0.00 61.00 62.41 1qe0 s PRO 248 Cb -0.16 -2.90 0.01 0.00 0.02 0.00 0.00 34.50 31.48 1qe0 s PRO 248 CO 0.07 0.26 0.28 1.52 -0.33 0.00 0.00 177.00 178.79 1qe0 s TYR 249 N -1.48 0.00 -0.14 6.54 -0.85 -1.26 -4.33 117.35 115.82 1qe0 s TYR 249 Ca 0.49 -0.39 0.02 0.00 -0.52 0.00 0.00 57.07 56.67 1qe0 s TYR 249 Cb -0.22 0.07 0.01 0.00 0.38 0.00 0.00 41.96 42.21 1qe0 s TYR 249 CO 0.28 -0.61 -0.20 0.99 -1.52 0.00 0.00 175.55 174.49 1qe0 s THR 250 N -3.84 1.94 -0.33 -3.49 2.01 0.42 -5.00 115.64 107.35 1qe0 s THR 250 Ca 0.04 -0.90 -0.22 0.00 0.31 0.00 0.00 61.69 60.92 1qe0 s THR 250 Cb 0.04 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.81 1qe0 s THR 250 CO -0.11 0.53 0.74 -1.61 -0.69 0.00 0.00 174.62 173.47 1qe0 s GLU 251 N 0.99 3.85 -0.57 4.92 2.02 -1.26 -0.74 118.70 127.91 1qe0 s GLU 251 Ca -0.04 0.38 -0.05 0.00 0.02 0.00 0.00 54.97 55.29 1qe0 s GLU 251 Cb -0.15 -3.76 0.15 0.00 0.10 0.00 0.00 34.13 30.47 1qe0 s GLU 251 CO -0.05 -0.72 0.40 0.34 0.02 0.00 0.00 175.26 175.25 1qe0 s ASP 252 N 1.71 5.42 0.49 -0.19 2.15 -0.49 -4.93 116.67 120.84 1qe0 s ASP 252 Ca 0.30 -2.53 0.38 0.00 0.43 0.00 0.00 52.55 51.13 1qe0 s ASP 252 Cb -0.14 -1.90 1.56 0.00 -0.30 0.00 0.00 42.92 42.15 1qe0 s ASP 252 CO 0.14 -0.47 1.61 -0.65 -0.17 0.00 0.00 175.17 175.63 1qe0 h PRO 253 N 7.51 0.04 -0.02 4.34 0.11 -1.95 0.57 132.00 142.60 1qe0 h PRO 253 Ca -0.06 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 1qe0 h PRO 253 Cb 1.00 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1qe0 h PRO 253 CO 0.73 0.02 0.00 0.09 -0.21 0.00 0.00 178.00 178.64 1qe0 n ASN 254 N -4.39 0.82 -4.44 -2.05 4.13 -1.26 -4.59 115.26 103.48 1qe0 n ASN 254 Ca 0.39 -1.31 -0.44 0.00 1.68 0.00 0.00 54.58 54.91 1qe0 n ASN 254 Cb 1.65 -0.01 -0.03 0.00 -1.54 0.00 0.00 39.78 39.86 1qe0 n ASN 254 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1qe0 s LEU 255 N -1.95 5.16 0.30 3.41 2.96 0.20 -4.96 118.68 123.81 1qe0 s LEU 255 Ca 0.41 -2.06 0.03 0.00 -0.22 0.00 0.00 54.13 52.28 1qe0 s LEU 255 Cb 0.21 -2.39 -0.05 0.00 0.50 0.00 0.00 46.19 44.46 1qe0 s LEU 255 CO 0.34 -1.04 0.10 0.68 -1.32 0.00 0.00 176.35 175.11 1qe0 s VAL 256 N 2.53 0.69 -0.04 1.68 -7.23 -1.26 -4.57 120.40 112.21 1qe0 s VAL 256 Ca 0.31 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.49 1qe0 s VAL 256 Cb -0.06 -2.62 0.03 0.00 0.56 0.00 0.00 36.38 34.29 1qe0 s VAL 256 CO -0.09 0.00 -0.01 -0.13 -0.31 0.00 0.00 175.10 174.56 1qe0 s ARG 257 N -3.91 0.49 0.28 4.82 0.52 -1.26 -5.06 118.95 114.82 1qe0 s ARG 257 Ca 0.35 0.02 -0.00 0.00 -0.52 0.00 0.00 55.73 55.58 1qe0 s ARG 257 Cb 0.07 -0.63 0.40 0.00 0.52 0.00 0.00 34.95 35.31 1qe0 s ARG 257 CO 0.15 -0.13 1.79 0.78 0.02 0.00 0.00 175.30 177.92 1qe0 h GLY 258 N 7.30 0.79 -6.80 -3.53 0.00 -2.01 -3.44 103.07 95.37 1qe0 h GLY 258 Ca -0.39 -0.50 -0.67 0.00 0.00 0.00 0.00 47.33 45.76 1qe0 h GLY 258 CO 0.46 0.47 1.33 1.04 0.00 0.00 0.00 176.54 179.84 1qe0 n LEU 259 N -4.24 2.31 0.00 3.11 7.99 -1.26 -4.81 117.00 120.10 1qe0 n LEU 259 Ca 0.02 0.53 0.00 0.00 -0.01 0.00 0.00 56.01 56.56 1qe0 n LEU 259 Cb 0.28 -1.26 0.00 0.00 -0.11 0.00 0.00 43.42 42.32 1qe0 n LEU 259 CO 0.41 -0.63 0.40 -0.90 -1.51 0.00 0.00 177.39 175.15 1qe0 n ASP 260 N 9.09 0.00 -1.36 -1.43 5.68 -1.26 -0.34 116.55 126.92 1qe0 n ASP 260 Ca 0.38 0.28 0.11 0.00 -0.50 0.00 0.00 54.79 55.05 1qe0 n ASP 260 Cb 0.23 -0.28 0.32 0.00 -1.14 0.00 0.00 41.12 40.25 1qe0 n ASP 260 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1qe0 n TYR 261 N -1.26 1.05 -3.12 2.11 4.11 -1.26 -4.64 117.16 114.15 1qe0 n TYR 261 Ca 0.00 -0.50 -0.45 0.00 -0.00 0.00 0.00 57.90 56.96 1qe0 n TYR 261 Cb 0.03 -0.05 -0.01 0.00 -0.00 0.00 0.00 39.34 39.31 1qe0 n TYR 261 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 1qe0 s TYR 262 N -1.21 3.71 0.00 -3.48 1.51 0.54 0.96 117.35 119.37 1qe0 s TYR 262 Ca 0.48 -2.15 0.00 0.00 -1.01 0.00 0.00 57.07 54.39 1qe0 s TYR 262 Cb 0.26 -4.09 0.00 0.00 -0.11 0.00 0.00 41.96 38.02 1qe0 s TYR 262 CO 0.31 -1.22 0.80 0.25 -1.11 0.00 0.00 175.55 174.58 1qe0 n THR 263 N 4.10 0.00 0.00 -0.71 -2.24 -1.19 -4.86 114.28 109.38 1qe0 n THR 263 Ca 0.27 1.29 0.00 0.00 -2.27 0.00 0.00 64.05 63.34 1qe0 n THR 263 Cb 0.44 -2.28 0.00 0.00 -2.10 0.00 0.00 70.33 66.38 1qe0 n THR 263 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1qe0 n HIS 264 N -1.45 0.00 -2.06 4.78 8.25 -1.23 -3.66 115.22 119.85 1qe0 n HIS 264 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 1qe0 n HIS 264 Cb 0.00 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.10 1qe0 n HIS 264 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1qe0 s THR 265 N 0.97 2.61 -0.03 1.59 -4.23 -1.26 -1.36 115.64 113.92 1qe0 s THR 265 Ca 0.00 0.57 0.00 0.00 -1.18 0.00 0.00 61.69 61.08 1qe0 s THR 265 Cb 0.00 -3.35 0.03 0.00 1.34 0.00 0.00 72.50 70.52 1qe0 s THR 265 CO 0.00 0.11 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 1qe0 s ALA 266 N -1.21 0.33 0.11 3.99 0.00 -0.58 -1.06 121.76 123.34 1qe0 s ALA 266 Ca 0.54 0.15 -0.02 0.00 0.00 0.00 0.00 51.96 52.64 1qe0 s ALA 266 Cb -0.39 -0.36 -0.04 0.00 0.00 0.00 0.00 23.12 22.33 1qe0 s ALA 266 CO 0.51 -0.12 0.05 -0.59 0.00 0.00 0.00 175.76 175.61 1qe0 s PHE 267 N 1.14 0.75 -0.12 0.00 -0.71 0.21 -1.23 117.98 118.02 1qe0 s PHE 267 Ca -0.08 -1.16 -0.11 0.00 -1.04 0.00 0.00 56.93 54.54 1qe0 s PHE 267 Cb -0.13 -0.43 0.03 0.00 -1.21 0.00 0.00 43.02 41.28 1qe0 s PHE 267 CO -0.02 -0.50 0.32 -1.21 -1.34 0.00 0.00 175.22 172.47 1qe0 s GLU 268 N -4.01 0.36 -0.24 1.99 2.02 -0.45 -0.78 118.70 117.59 1qe0 s GLU 268 Ca 0.20 0.46 -0.10 0.00 0.02 0.00 0.00 54.97 55.55 1qe0 s GLU 268 Cb 0.07 0.15 -0.05 0.00 0.10 0.00 0.00 34.13 34.41 1qe0 s GLU 268 CO -0.01 -0.06 0.15 -1.17 0.02 0.00 0.00 175.26 174.19 1qe0 s LEU 269 N 0.29 4.00 0.05 1.80 0.20 0.14 -0.98 118.68 124.19 1qe0 s LEU 269 Ca -0.01 0.06 0.04 0.00 0.69 0.00 0.00 54.13 54.91 1qe0 s LEU 269 Cb -0.03 -2.07 -0.04 0.00 -0.43 0.00 0.00 46.19 43.62 1qe0 s LEU 269 CO -0.01 0.05 -0.04 -0.04 -0.29 0.00 0.00 176.35 176.02 1qe0 s MET 270 N 1.14 2.52 -0.19 1.98 -1.94 0.02 0.19 119.30 123.02 1qe0 s MET 270 Ca 0.07 -0.79 0.00 0.00 -1.71 0.00 0.00 55.69 53.26 1qe0 s MET 270 Cb -0.14 -2.51 0.04 0.00 2.01 0.00 0.00 34.83 34.24 1qe0 s MET 270 CO 0.05 0.57 -0.07 1.41 -0.01 0.00 0.00 175.02 176.96 1qe0 s MET 271 N -1.87 1.72 -0.27 2.03 0.00 0.64 0.51 119.30 122.06 1qe0 s MET 271 Ca 0.21 -0.72 -0.24 0.00 0.00 0.00 0.00 55.69 54.94 1qe0 s MET 271 Cb -0.11 -2.26 -0.00 0.00 0.00 0.00 0.00 34.83 32.45 1qe0 s MET 271 CO 0.13 -0.45 0.83 0.16 0.00 0.00 0.00 175.02 175.69 1qe0 s ASP 272 N 1.50 6.78 -0.23 1.11 -4.77 0.33 -0.48 116.67 120.91 1qe0 s ASP 272 Ca -0.01 0.91 -0.09 0.00 -3.30 0.00 0.00 52.55 50.06 1qe0 s ASP 272 Cb -0.16 -2.43 0.10 0.00 -1.09 0.00 0.00 42.92 39.33 1qe0 s ASP 272 CO -0.08 -0.57 0.51 0.21 0.70 0.00 0.00 175.17 175.94 1qe0 s ASN 273 N 1.45 -0.62 0.56 2.11 2.47 0.15 -4.69 114.94 116.38 1qe0 s ASN 273 Ca 0.35 1.20 0.46 0.00 0.42 0.00 0.00 52.86 55.29 1qe0 s ASN 273 Cb -0.15 1.55 1.67 0.00 -1.45 0.00 0.00 41.25 42.88 1qe0 s ASN 273 CO 0.10 -0.22 1.63 -0.65 -3.72 0.00 0.00 177.10 174.23 1qe0 h PRO 274 N 7.87 0.00 0.00 0.43 0.11 -1.95 -1.70 132.00 136.76 1qe0 h PRO 274 Ca -0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1qe0 h PRO 274 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1qe0 h PRO 274 CO 0.14 0.00 0.00 -0.91 -0.21 0.00 0.00 178.00 177.02 1qe0 h ASN 275 N 0.00 0.00 -2.51 -2.05 4.21 -1.96 -3.43 115.58 109.84 1qe0 h ASN 275 Ca 0.82 0.00 -0.52 0.00 1.21 0.00 0.00 56.30 57.81 1qe0 h ASN 275 Cb 3.33 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 40.51 1qe0 h ASN 275 CO -0.01 0.00 -0.44 -0.31 -1.29 0.00 0.00 177.43 175.38 1qe0 s TYR 276 N -3.64 3.48 -0.13 1.19 2.02 -0.64 -4.99 117.35 114.65 1qe0 s TYR 276 Ca 0.02 0.11 -0.29 0.00 -0.37 0.00 0.00 57.07 56.54 1qe0 s TYR 276 Cb 0.09 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 39.94 1qe0 s TYR 276 CO 0.55 0.48 1.58 -0.51 -1.57 0.00 0.00 175.55 176.08 1qe0 s ASP 277 N -3.40 6.62 0.00 2.29 -0.00 -1.26 0.21 116.67 121.13 1qe0 s ASP 277 Ca 0.35 1.95 0.00 0.00 -0.00 0.00 0.00 52.55 54.85 1qe0 s ASP 277 Cb -0.11 -2.53 0.00 0.00 -0.00 0.00 0.00 42.92 40.28 1qe0 s ASP 277 CO 0.29 -1.01 0.00 0.61 -0.00 0.00 0.00 175.17 175.06 1qe0 n GLY 278 N 4.21 1.97 2.24 0.21 0.00 -1.26 -4.39 105.19 108.18 1qe0 n GLY 278 Ca 0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 1qe0 n GLY 278 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qe0 n ALA 279 N -1.41 -0.30 -3.19 4.61 0.00 0.13 -4.98 120.51 115.38 1qe0 n ALA 279 Ca 0.00 0.11 -0.11 0.00 0.00 0.00 0.00 53.44 53.44 1qe0 n ALA 279 Cb 0.00 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.00 1qe0 n ALA 279 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1qe0 s ILE 280 N -2.54 0.04 0.07 0.00 -5.25 -1.25 0.33 121.20 112.61 1qe0 s ILE 280 Ca 0.00 -0.32 -0.15 0.00 -0.99 0.00 0.00 60.65 59.20 1qe0 s ILE 280 Cb 0.00 -1.09 0.02 0.00 2.95 0.00 0.00 42.46 44.35 1qe0 s ILE 280 CO 0.00 -0.18 0.34 0.28 -1.79 0.00 0.00 174.94 173.59 1qe0 s THR 281 N -3.74 0.08 -0.37 8.37 -1.32 0.37 -4.61 115.64 114.42 1qe0 s THR 281 Ca 0.02 -0.67 -0.18 0.00 -1.21 0.00 0.00 61.69 59.64 1qe0 s THR 281 Cb 0.01 -1.05 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 1qe0 s THR 281 CO -0.12 -0.37 0.52 -0.89 -2.21 0.00 0.00 174.62 171.54 1qe0 s THR 282 N -3.02 5.00 -0.11 5.08 2.01 -1.26 -0.26 115.64 123.07 1qe0 s THR 282 Ca -0.02 0.20 -0.25 0.00 0.31 0.00 0.00 61.69 61.94 1qe0 s THR 282 Cb 0.01 -4.01 -0.27 0.00 0.01 0.00 0.00 72.50 68.24 1qe0 s THR 282 CO -0.06 -0.30 0.74 -0.07 -0.69 0.00 0.00 174.62 174.24 1qe0 h LEU 283 N 9.17 0.20 -8.08 4.42 4.07 -0.60 -3.49 115.31 121.00 1qe0 h LEU 283 Ca -0.27 -0.92 -0.11 0.00 0.08 0.00 0.00 57.88 56.65 1qe0 h LEU 283 Cb 1.12 -0.06 -0.15 0.00 1.08 0.00 0.00 40.66 42.65 1qe0 h LEU 283 CO 0.79 1.24 -0.57 0.00 -1.08 0.00 0.00 178.44 178.82 1qe0 s GLY 285 N -2.83 -0.51 0.00 0.00 0.00 -1.20 0.23 107.32 103.00 1qe0 s GLY 285 Ca 0.05 0.97 0.00 0.00 0.00 0.00 0.00 44.72 45.74 1qe0 s GLY 285 CO -0.10 0.64 0.00 0.61 0.00 0.00 0.00 173.10 174.25 1qe0 n GLY 286 N 0.66 -0.85 0.00 0.20 0.00 0.04 -1.97 105.19 103.28 1qe0 n GLY 286 Ca -0.19 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.00 1qe0 n GLY 286 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1qe0 n GLY 287 N 0.00 1.21 3.72 -0.02 0.00 0.66 -0.62 105.19 110.14 1qe0 n GLY 287 Ca 0.00 -1.37 -0.29 0.00 0.00 0.00 0.00 46.02 44.36 1qe0 n GLY 287 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qe0 s ARG 288 N -1.89 0.90 -0.27 1.61 0.52 -0.22 -2.70 118.95 116.90 1qe0 s ARG 288 Ca 0.00 0.52 -0.25 0.00 -0.52 0.00 0.00 55.73 55.48 1qe0 s ARG 288 Cb 0.00 -1.79 0.08 0.00 0.52 0.00 0.00 34.95 33.76 1qe0 s ARG 288 CO 0.00 -2.41 0.77 1.52 0.02 0.00 0.00 175.30 175.20 1qe0 s TYR 289 N -3.06 -0.74 -0.25 -0.53 -0.85 0.14 -3.20 117.35 108.85 1qe0 s TYR 289 Ca 0.64 1.81 -0.04 0.00 -0.52 0.00 0.00 57.07 58.96 1qe0 s TYR 289 Cb -0.17 0.29 0.09 0.00 0.38 0.00 0.00 41.96 42.55 1qe0 s TYR 289 CO 0.56 -0.36 0.14 1.21 -1.52 0.00 0.00 175.55 175.59 1qe0 s ASN 290 N 0.38 2.85 0.00 -0.18 3.04 0.27 -1.75 114.94 119.56 1qe0 s ASN 290 Ca 0.00 -0.97 0.00 0.00 0.04 0.00 0.00 52.86 51.94 1qe0 s ASN 290 Cb -0.05 -0.17 0.00 0.00 -1.54 0.00 0.00 41.25 39.49 1qe0 s ASN 290 CO -0.01 -0.40 0.00 0.61 -3.04 0.00 0.00 177.10 174.26 1qe0 n GLY 291 N 5.27 0.64 0.06 1.21 0.00 -1.26 -4.45 105.19 106.66 1qe0 n GLY 291 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 1qe0 n GLY 291 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1qe0 h LEU 292 N 0.00 -0.03 -0.90 0.99 5.85 -1.87 -3.03 115.31 116.32 1qe0 h LEU 292 Ca 0.00 -0.29 0.13 0.00 0.84 0.00 0.00 57.88 58.56 1qe0 h LEU 292 Cb 0.00 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 40.95 1qe0 h LEU 292 CO 0.00 0.28 0.51 -0.07 -0.34 0.00 0.00 178.44 178.82 1qe0 h LEU 293 N -0.33 0.68 -0.80 2.25 -0.00 -1.85 -1.56 115.31 113.70 1qe0 h LEU 293 Ca -0.00 0.07 -0.12 0.00 -0.00 0.00 0.00 57.88 57.83 1qe0 h LEU 293 Cb 0.31 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 40.91 1qe0 h LEU 293 CO 0.01 0.33 -0.40 -0.33 -0.00 0.00 0.00 178.44 178.04 1qe0 h GLU 294 N 0.76 0.42 -0.57 1.13 5.08 -1.58 0.25 114.58 120.08 1qe0 h GLU 294 Ca 0.47 -0.21 -0.04 0.00 -1.00 0.00 0.00 59.36 58.59 1qe0 h GLU 294 Cb 0.58 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 1qe0 h GLU 294 CO -0.32 0.75 0.21 -0.07 -1.00 0.00 0.00 179.01 178.58 1qe0 h LEU 295 N 0.35 0.76 -1.75 1.33 3.38 -1.17 -1.44 115.31 116.78 1qe0 h LEU 295 Ca 0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1qe0 h LEU 295 Cb 0.85 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1qe0 h LEU 295 CO 0.07 0.70 0.01 0.18 0.09 0.00 0.00 178.44 179.49 1qe0 n LEU 296 N -4.31 2.40 -2.57 1.67 7.99 -0.95 -4.87 117.00 116.36 1qe0 n LEU 296 Ca 0.05 -1.22 -0.13 0.00 -0.01 0.00 0.00 56.01 54.70 1qe0 n LEU 296 Cb 0.18 -0.55 0.06 0.00 -0.11 0.00 0.00 43.42 42.99 1qe0 n LEU 296 CO 0.39 0.37 0.11 0.47 -1.51 0.00 0.00 177.39 177.22 1qe0 n ASP 297 N 0.17 -3.12 -3.11 -1.43 10.43 -0.54 -4.97 116.55 113.98 1qe0 n ASP 297 Ca 0.08 -0.39 -0.18 0.00 2.57 0.00 0.00 54.79 56.87 1qe0 n ASP 297 Cb 0.53 -3.52 -0.07 0.00 1.84 0.00 0.00 41.12 39.90 1qe0 n ASP 297 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1qe0 n GLY 298 N -1.24 3.16 3.33 0.44 0.00 0.83 -4.96 105.19 106.74 1qe0 n GLY 298 Ca -0.12 -1.93 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 1qe0 n GLY 298 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1qe0 n PRO 299 N -0.62 -2.06 -0.55 1.61 -0.02 -1.26 -3.44 135.00 128.66 1qe0 n PRO 299 Ca 0.03 -0.58 -0.09 0.00 -2.02 0.00 0.00 63.50 60.83 1qe0 n PRO 299 Cb 0.52 -1.84 0.10 0.00 -0.02 0.00 0.00 33.50 32.26 1qe0 n PRO 299 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1qe0 n SER 300 N -2.85 3.33 -4.66 2.55 7.64 -1.26 -3.81 113.62 114.57 1qe0 n SER 300 Ca 0.01 -2.71 -0.40 0.00 1.01 0.00 0.00 58.87 56.78 1qe0 n SER 300 Cb 0.59 -0.65 0.02 0.00 -1.01 0.00 0.00 64.21 63.16 1qe0 n SER 300 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1qe0 n GLU 301 N -0.20 1.54 -2.95 1.43 -0.58 -1.26 -4.86 120.64 113.75 1qe0 n GLU 301 Ca 0.26 0.56 -0.26 0.00 -0.42 0.00 0.00 57.16 57.30 1qe0 n GLU 301 Cb 1.01 -2.24 -0.00 0.00 -0.57 0.00 0.00 31.44 29.63 1qe0 n GLU 301 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1qe0 s THR 302 N -1.28 4.93 0.02 2.62 -4.23 -1.26 -4.52 115.64 111.91 1qe0 s THR 302 Ca 0.65 -0.11 -0.28 0.00 -1.18 0.00 0.00 61.69 60.77 1qe0 s THR 302 Cb -0.51 -3.84 0.08 0.00 1.34 0.00 0.00 72.50 69.58 1qe0 s THR 302 CO 0.55 -0.70 0.73 -0.83 -0.54 0.00 0.00 174.62 173.83 1qe0 s GLY 303 N -4.09 -0.54 0.05 3.99 0.00 -0.72 -0.70 107.32 105.33 1qe0 s GLY 303 Ca 0.44 1.04 0.01 0.00 0.00 0.00 0.00 44.72 46.22 1qe0 s GLY 303 CO 0.41 0.56 -0.06 -1.50 0.00 0.00 0.00 173.10 172.51 1qe0 s ILE 304 N -2.48 0.43 0.03 0.90 2.07 -0.80 0.24 121.20 121.59 1qe0 s ILE 304 Ca -0.02 -1.39 -0.27 0.00 -1.41 0.00 0.00 60.65 57.56 1qe0 s ILE 304 Cb -0.01 -0.96 0.09 0.00 0.13 0.00 0.00 42.46 41.71 1qe0 s ILE 304 CO -0.03 -0.64 1.23 -0.83 -1.91 0.00 0.00 174.94 172.76 1qe0 s GLY 305 N -2.16 -0.06 0.18 1.50 0.00 -1.10 -0.69 107.32 104.99 1qe0 s GLY 305 Ca -0.03 -0.07 -0.21 0.00 0.00 0.00 0.00 44.72 44.42 1qe0 s GLY 305 CO -0.03 5.08 0.58 -0.11 0.00 0.00 0.00 173.10 178.62 1qe0 s PHE 306 N -2.04 -0.36 0.12 1.90 -0.12 -0.97 -0.25 117.98 116.26 1qe0 s PHE 306 Ca 0.28 0.07 0.04 0.00 -0.05 0.00 0.00 56.93 57.28 1qe0 s PHE 306 Cb -0.01 0.51 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 1qe0 s PHE 306 CO 0.01 -0.90 -0.11 0.00 -0.05 0.00 0.00 175.22 174.16 1qe0 s ALA 307 N -3.81 1.32 -0.05 1.99 0.00 -0.83 -2.05 121.76 118.33 1qe0 s ALA 307 Ca 0.04 -1.32 -0.21 0.00 0.00 0.00 0.00 51.96 50.48 1qe0 s ALA 307 Cb -0.01 0.01 0.04 0.00 0.00 0.00 0.00 23.12 23.16 1qe0 s ALA 307 CO -0.08 -0.02 0.47 -1.17 0.00 0.00 0.00 175.76 174.96 1qe0 s LEU 308 N -2.69 0.19 -0.21 0.00 0.20 0.26 -3.25 118.68 113.17 1qe0 s LEU 308 Ca 0.10 0.44 -0.08 0.00 0.69 0.00 0.00 54.13 55.27 1qe0 s LEU 308 Cb -0.02 1.81 -0.04 0.00 -0.43 0.00 0.00 46.19 47.51 1qe0 s LEU 308 CO 0.01 -0.48 0.09 -0.55 -0.29 0.00 0.00 176.35 175.13 1qe0 s SER 309 N -1.09 5.73 0.21 3.68 0.15 -1.26 -0.17 113.70 120.94 1qe0 s SER 309 Ca -0.11 0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.61 1qe0 s SER 309 Cb -0.03 -2.00 0.16 0.00 -1.71 0.00 0.00 66.02 62.44 1qe0 s SER 309 CO 0.06 0.12 1.51 0.40 1.20 0.00 0.00 173.24 176.53 1qe0 h ILE 310 N 4.98 1.37 -0.03 6.45 1.08 -1.83 -2.16 117.51 127.38 1qe0 h ILE 310 Ca -0.38 -1.98 0.00 0.00 -0.39 0.00 0.00 64.86 62.11 1qe0 h ILE 310 Cb 1.17 1.98 -0.00 0.00 -3.07 0.00 0.00 36.82 36.89 1qe0 h ILE 310 CO 0.68 0.60 0.02 -0.33 -0.69 0.00 0.00 178.15 178.42 1qe0 h GLU 311 N 0.27 0.04 -0.75 2.37 5.08 -1.94 0.47 114.58 120.11 1qe0 h GLU 311 Ca -0.01 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1qe0 h GLU 311 Cb 1.16 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.36 1qe0 h GLU 311 CO 0.10 0.02 0.49 0.00 -1.00 0.00 0.00 179.01 178.62 1qe0 h ARG 312 N 0.04 0.94 -0.56 2.33 3.08 -1.94 -1.09 114.38 117.18 1qe0 h ARG 312 Ca 0.01 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.03 1qe0 h ARG 312 Cb -0.00 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 29.80 1qe0 h ARG 312 CO -0.00 0.62 0.33 1.25 -1.07 0.00 0.00 179.97 181.10 1qe0 h LEU 313 N 0.97 0.53 -0.25 3.04 5.85 -1.01 0.19 115.31 124.64 1qe0 h LEU 313 Ca 0.29 0.01 0.04 0.00 0.84 0.00 0.00 57.88 59.05 1qe0 h LEU 313 Cb -0.05 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 1qe0 h LEU 313 CO -0.08 0.37 0.00 -0.07 -0.34 0.00 0.00 178.44 178.32 1qe0 h LEU 314 N 0.65 -0.09 -1.10 2.25 -0.00 -0.31 -1.89 115.31 114.82 1qe0 h LEU 314 Ca 0.23 0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 58.14 1qe0 h LEU 314 Cb 0.04 0.09 -0.03 0.00 -0.00 0.00 0.00 40.66 40.76 1qe0 h LEU 314 CO -0.10 -0.01 0.37 0.25 -0.00 0.00 0.00 178.44 178.94 1qe0 h LEU 315 N 0.08 0.89 -0.73 1.67 6.46 -0.54 -2.27 115.31 120.87 1qe0 h LEU 315 Ca 0.12 -0.08 -0.00 0.00 -0.12 0.00 0.00 57.88 57.79 1qe0 h LEU 315 Cb 0.15 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 39.81 1qe0 h LEU 315 CO -0.19 0.73 0.44 0.00 -0.62 0.00 0.00 178.44 178.81 1qe0 h ALA 316 N 1.41 0.93 -0.38 1.25 0.00 0.04 -0.37 119.26 122.13 1qe0 h ALA 316 Ca 0.25 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1qe0 h ALA 316 Cb 0.06 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1qe0 h ALA 316 CO -0.04 0.40 0.02 -0.07 0.00 0.00 0.00 179.25 179.56 1qe0 h LEU 317 N 1.00 0.55 0.55 0.00 -0.00 -0.88 -1.33 115.31 115.20 1qe0 h LEU 317 Ca 0.26 -0.10 -0.03 0.00 -0.00 0.00 0.00 57.88 58.01 1qe0 h LEU 317 Cb -0.04 -0.14 0.01 0.00 -0.00 0.00 0.00 40.66 40.48 1qe0 h LEU 317 CO -0.05 0.61 -0.26 -0.08 -0.00 0.00 0.00 178.44 178.65 1qe0 h GLU 318 N 0.56 -0.71 -0.96 1.13 4.81 -0.64 0.62 114.58 119.40 1qe0 h GLU 318 Ca 0.12 0.05 0.19 0.00 -0.13 0.00 0.00 59.36 59.59 1qe0 h GLU 318 Cb 0.33 0.16 -0.09 0.00 0.63 0.00 0.00 28.75 29.79 1qe0 h GLU 318 CO 0.01 -0.47 0.61 0.93 -0.73 0.00 0.00 179.01 179.36 1qe0 h GLU 319 N -0.79 0.60 0.00 1.92 4.39 -1.04 1.04 114.58 120.71 1qe0 h GLU 319 Ca -0.08 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.59 1qe0 h GLU 319 Cb 0.56 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1qe0 h GLU 319 CO 0.12 0.40 0.00 0.39 -1.16 0.00 0.00 179.01 178.76 1qe0 n GLU 320 N -4.63 0.25 -2.36 2.33 -0.58 -0.51 -4.91 120.64 110.22 1qe0 n GLU 320 Ca 0.21 0.01 -0.06 0.00 -0.42 0.00 0.00 57.16 56.90 1qe0 n GLU 320 Cb 0.61 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 30.01 1qe0 n GLU 320 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1qe0 n GLY 321 N 1.31 0.15 3.36 0.62 0.00 0.36 -5.05 105.19 105.95 1qe0 n GLY 321 Ca 0.11 -0.14 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 1qe0 n GLY 321 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qe0 s ILE 322 N -3.14 2.36 0.01 -0.61 1.01 0.21 -5.02 121.20 116.03 1qe0 s ILE 322 Ca 0.07 -1.00 0.05 0.00 0.00 0.00 0.00 60.65 59.77 1qe0 s ILE 322 Cb -0.01 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.57 1qe0 s ILE 322 CO 0.27 0.58 -0.15 -1.83 0.00 0.00 0.00 174.94 173.80 1qe0 s GLU 323 N -0.67 2.28 0.21 2.79 4.04 -1.26 -4.51 118.70 121.58 1qe0 s GLU 323 Ca 0.11 -0.85 -0.03 0.00 0.04 0.00 0.00 54.97 54.23 1qe0 s GLU 323 Cb -0.10 -2.30 -0.05 0.00 0.02 0.00 0.00 34.13 31.70 1qe0 s GLU 323 CO -0.00 0.57 0.43 -0.51 -1.84 0.00 0.00 175.26 173.91 1qe0 s LEU 324 N -1.24 4.19 -0.32 1.83 1.43 -1.26 -4.98 118.68 118.34 1qe0 s LEU 324 Ca 0.14 0.53 -0.05 0.00 -1.03 0.00 0.00 54.13 53.73 1qe0 s LEU 324 Cb -0.11 -3.30 -0.14 0.00 0.03 0.00 0.00 46.19 42.67 1qe0 s LEU 324 CO 0.04 -0.06 2.45 0.47 0.23 0.00 0.00 176.35 179.48 1qe0 n ASP 325 N -0.56 4.09 0.00 2.29 9.92 -1.26 -4.54 116.55 126.49 1qe0 n ASP 325 Ca -0.03 -2.20 0.00 0.00 -0.53 0.00 0.00 54.79 52.02 1qe0 n ASP 325 Cb 0.53 -1.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.01 1qe0 n ASP 325 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1qe0 n ILE 326 N 3.11 0.00 -3.15 0.53 2.08 -1.26 -5.03 119.36 115.64 1qe0 n ILE 326 Ca 0.35 0.00 -0.17 0.00 0.56 0.00 0.00 62.75 63.49 1qe0 n ILE 326 Cb 0.46 -0.04 0.02 0.00 -0.75 0.00 0.00 39.64 39.32 1qe0 n ILE 326 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1qe0 n GLU 327 N 0.00 -1.93 -2.27 0.38 2.13 -1.26 -4.81 120.64 112.87 1qe0 n GLU 327 Ca 0.00 1.68 -0.42 0.00 0.66 0.00 0.00 57.16 59.08 1qe0 n GLU 327 Cb 0.00 -3.27 -0.02 0.00 0.27 0.00 0.00 31.44 28.42 1qe0 n GLU 327 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 1qe0 s GLU 328 N -2.05 3.34 -0.08 5.31 -1.05 -1.26 -4.97 118.70 117.95 1qe0 s GLU 328 Ca 0.21 0.82 0.02 0.00 -0.15 0.00 0.00 54.97 55.87 1qe0 s GLU 328 Cb -0.03 -4.13 0.01 0.00 -0.44 0.00 0.00 34.13 29.55 1qe0 s GLU 328 CO 0.64 -1.86 -0.13 -0.80 0.95 0.00 0.00 175.26 174.07 1qe0 s ASN 329 N 4.89 1.95 0.54 0.83 -0.87 -1.26 -4.88 114.94 116.15 1qe0 s ASN 329 Ca 0.62 -0.33 -0.22 0.00 -1.57 0.00 0.00 52.86 51.36 1qe0 s ASN 329 Cb -0.14 -0.88 -0.05 0.00 -0.02 0.00 0.00 41.25 40.16 1qe0 s ASN 329 CO 0.29 0.02 1.38 -0.11 -2.57 0.00 0.00 177.10 176.11 1qe0 n LEU 330 N 3.98 5.58 0.04 0.60 7.94 -1.14 -4.83 117.00 129.17 1qe0 n LEU 330 Ca -0.21 0.99 -0.21 0.00 -1.11 0.00 0.00 56.01 55.47 1qe0 n LEU 330 Cb 0.51 -1.59 -0.14 0.00 0.53 0.00 0.00 43.42 42.73 1qe0 n LEU 330 CO 0.24 -0.50 -0.63 0.44 -1.11 0.00 0.00 177.39 175.83 1qe0 h ASP 331 N 1.53 0.50 -3.30 1.96 5.19 -1.21 0.85 116.42 121.94 1qe0 h ASP 331 Ca -0.51 -0.88 -0.16 0.00 -0.62 0.00 0.00 57.03 54.86 1qe0 h ASP 331 Cb 1.30 -0.16 -0.28 0.00 0.18 0.00 0.00 39.33 40.36 1qe0 h ASP 331 CO 0.57 1.77 -0.39 -0.22 -3.12 0.00 0.00 179.24 177.85 1qe0 s LEU 332 N -7.14 0.18 -0.18 1.55 0.20 -0.70 -2.32 118.68 110.27 1qe0 s LEU 332 Ca -0.18 0.71 -0.02 0.00 0.69 0.00 0.00 54.13 55.33 1qe0 s LEU 332 Cb 0.06 1.04 -0.01 0.00 -0.43 0.00 0.00 46.19 46.86 1qe0 s LEU 332 CO 0.82 -0.18 -0.09 0.12 -0.29 0.00 0.00 176.35 176.73 1qe0 s PHE 333 N 1.30 2.89 -0.36 5.38 5.36 -0.94 -1.35 117.98 130.25 1qe0 s PHE 333 Ca -0.09 -0.88 -0.19 0.00 -0.96 0.00 0.00 56.93 54.81 1qe0 s PHE 333 Cb -0.09 -1.98 0.00 0.00 -0.34 0.00 0.00 43.02 40.61 1qe0 s PHE 333 CO -0.10 -0.43 0.56 0.42 -1.46 0.00 0.00 175.22 174.21 1qe0 s ILE 334 N 0.99 4.96 -0.27 3.12 1.01 0.36 -2.63 121.20 128.74 1qe0 s ILE 334 Ca -0.01 0.37 -0.13 0.00 0.00 0.00 0.00 60.65 60.88 1qe0 s ILE 334 Cb -0.15 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 1qe0 s ILE 334 CO -0.01 -0.29 0.30 -0.69 0.00 0.00 0.00 174.94 174.25 1qe0 s VAL 335 N 2.53 5.23 0.09 2.92 1.01 0.84 -3.51 120.40 129.51 1qe0 s VAL 335 Ca 0.21 0.41 0.08 0.00 0.00 0.00 0.00 61.98 62.68 1qe0 s VAL 335 Cb -0.15 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1qe0 s VAL 335 CO 0.14 0.20 -0.18 0.42 0.00 0.00 0.00 175.10 175.69 1qe0 s THR 336 N 1.88 2.84 -0.33 3.92 -4.23 -1.26 0.16 115.64 118.62 1qe0 s THR 336 Ca 0.12 -1.39 -0.03 0.00 -1.18 0.00 0.00 61.69 59.21 1qe0 s THR 336 Cb -0.16 -2.26 0.06 0.00 1.34 0.00 0.00 72.50 71.48 1qe0 s THR 336 CO 0.10 0.18 0.06 -0.04 -0.54 0.00 0.00 174.62 174.38 1qe0 s MET 337 N -1.90 2.40 0.12 3.99 -1.94 0.24 -4.88 119.30 117.33 1qe0 s MET 337 Ca 0.17 -1.34 0.00 0.00 -1.71 0.00 0.00 55.69 52.81 1qe0 s MET 337 Cb -0.11 -3.31 0.00 0.00 2.01 0.00 0.00 34.83 33.42 1qe0 s MET 337 CO 0.08 -0.71 0.00 0.41 -0.01 0.00 0.00 175.02 174.80 1qe0 n GLY 338 N 4.66 -2.16 0.33 -0.03 0.00 -1.26 -4.10 105.19 102.64 1qe0 n GLY 338 Ca -0.11 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.39 1qe0 n GLY 338 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1qe0 h ASP 339 N -0.32 -0.94 -0.18 1.61 3.32 -1.98 -1.39 116.42 116.54 1qe0 h ASP 339 Ca -0.02 0.12 0.04 0.00 0.02 0.00 0.00 57.03 57.19 1qe0 h ASP 339 Cb 0.32 0.38 -0.07 0.00 0.22 0.00 0.00 39.33 40.17 1qe0 h ASP 339 CO 0.01 -0.38 -0.50 -0.61 -1.72 0.00 0.00 179.24 176.04 1qe0 h GLN 340 N -0.47 -0.51 -0.76 3.56 4.15 -1.99 0.28 115.11 119.37 1qe0 h GLN 340 Ca 0.06 0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.57 1qe0 h GLN 340 Cb 0.55 0.11 -0.06 0.00 0.21 0.00 0.00 27.48 28.30 1qe0 h GLN 340 CO -0.26 -0.34 0.45 0.00 -1.93 0.00 0.00 178.83 176.76 1qe0 h ALA 341 N -0.10 1.04 -0.56 3.38 0.00 -1.69 -2.26 119.26 119.07 1qe0 h ALA 341 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 1qe0 h ALA 341 Cb 0.66 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 1qe0 h ALA 341 CO -0.45 0.17 0.01 0.22 0.00 0.00 0.00 179.25 179.19 1qe0 h ASP 342 N 0.83 0.93 1.07 0.00 1.82 -0.19 -1.74 116.42 119.14 1qe0 h ASP 342 Ca 0.34 -0.25 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 1qe0 h ASP 342 Cb 0.18 -0.25 0.00 0.00 0.68 0.00 0.00 39.33 39.94 1qe0 h ASP 342 CO -0.18 0.98 0.00 0.03 -1.61 0.00 0.00 179.24 178.47 1qe0 h ARG 343 N 0.88 0.00 0.25 0.28 3.08 -0.02 -2.67 114.38 116.19 1qe0 h ARG 343 Ca 0.16 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.88 1qe0 h ARG 343 Cb 0.51 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.60 1qe0 h ARG 343 CO 0.02 0.00 -1.47 -0.92 -1.07 0.00 0.00 179.97 176.53 1qe0 h TYR 344 N 0.00 1.00 -0.03 3.04 3.20 -0.85 -3.26 116.97 120.08 1qe0 h TYR 344 Ca 0.00 -0.72 0.01 0.00 3.14 0.00 0.00 58.73 61.16 1qe0 h TYR 344 Cb 0.53 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.76 1qe0 h TYR 344 CO 0.00 1.56 0.03 0.00 -1.64 0.00 0.00 178.16 178.11 1qe0 h ALA 345 N 0.16 1.67 -0.10 1.82 0.00 -0.99 -1.41 119.26 120.42 1qe0 h ALA 345 Ca -0.25 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1qe0 h ALA 345 Cb 2.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.95 1qe0 h ALA 345 CO 0.28 -0.04 -0.24 0.28 0.00 0.00 0.00 179.25 179.52 1qe0 h VAL 346 N 0.00 1.39 -0.48 0.00 2.07 -1.57 -0.80 116.25 116.86 1qe0 h VAL 346 Ca 0.01 -1.55 -0.06 0.00 0.82 0.00 0.00 66.70 65.92 1qe0 h VAL 346 Cb 0.07 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1qe0 h VAL 346 CO -0.00 0.45 0.06 0.11 0.02 0.00 0.00 177.57 178.21 1qe0 h LYS 347 N -0.09 0.81 -0.35 1.57 1.57 -1.56 -2.69 116.57 115.83 1qe0 h LYS 347 Ca -0.00 -0.23 0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1qe0 h LYS 347 Cb 0.84 -0.09 -0.06 0.00 0.08 0.00 0.00 32.23 33.01 1qe0 h LYS 347 CO 0.05 0.83 -0.00 1.25 -0.57 0.00 0.00 179.45 181.01 1qe0 h LEU 348 N 0.68 -0.15 0.15 2.94 5.85 -1.28 -0.72 115.31 122.78 1qe0 h LEU 348 Ca 0.14 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1qe0 h LEU 348 Cb 0.42 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 1qe0 h LEU 348 CO 0.01 -0.04 -0.26 0.25 -0.34 0.00 0.00 178.44 178.06 1qe0 h LEU 349 N 0.10 -0.74 -1.44 2.25 5.85 -1.02 0.14 115.31 120.45 1qe0 h LEU 349 Ca 0.17 0.08 0.18 0.00 0.84 0.00 0.00 57.88 59.15 1qe0 h LEU 349 Cb 0.24 0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.47 1qe0 h LEU 349 CO -0.29 -0.36 0.58 -1.13 -0.34 0.00 0.00 178.44 176.90 1qe0 h ASN 350 N -0.49 0.49 0.32 1.25 -1.24 -1.18 0.52 115.58 115.25 1qe0 h ASN 350 Ca 0.02 0.04 -0.02 0.00 0.71 0.00 0.00 56.30 57.06 1qe0 h ASN 350 Cb 0.50 -0.05 0.00 0.00 0.73 0.00 0.00 38.32 39.50 1qe0 h ASN 350 CO -0.13 0.22 -0.15 -0.74 -1.29 0.00 0.00 177.43 175.33 1qe0 h HIS 351 N 0.50 -0.40 -0.14 0.67 2.76 -0.07 -2.31 115.15 116.15 1qe0 h HIS 351 Ca 0.45 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.66 1qe0 h HIS 351 Cb 0.99 0.13 -0.06 0.00 1.55 0.00 0.00 27.41 30.02 1qe0 h HIS 351 CO -0.00 -0.07 -0.22 -0.07 -1.30 0.00 0.00 177.93 176.26 1qe0 h LEU 352 N -0.96 -0.69 -1.75 0.26 3.38 -0.63 -2.32 115.31 112.60 1qe0 h LEU 352 Ca -0.04 0.12 0.14 0.00 0.09 0.00 0.00 57.88 58.18 1qe0 h LEU 352 Cb 0.51 0.31 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 1qe0 h LEU 352 CO 0.07 -0.27 0.43 0.03 0.09 0.00 0.00 178.44 178.79 1qe0 h ARG 353 N -0.28 0.25 0.00 1.13 3.08 -0.95 0.71 114.38 118.32 1qe0 h ARG 353 Ca 0.10 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1qe0 h ARG 353 Cb 0.43 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1qe0 h ARG 353 CO -0.30 0.17 0.00 0.72 -1.07 0.00 0.00 179.97 179.49 1qe0 n HIS 354 N -4.44 0.00 -1.73 3.04 8.25 -0.87 -2.95 115.22 116.52 1qe0 n HIS 354 Ca 0.12 0.00 0.05 0.00 -0.26 0.00 0.00 57.72 57.62 1qe0 n HIS 354 Cb 0.52 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.70 1qe0 n HIS 354 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1qe0 n ASN 355 N -0.68 1.12 -0.23 0.41 3.02 0.25 -5.00 115.26 114.14 1qe0 n ASN 355 Ca 0.08 -2.59 -0.03 0.00 -0.03 0.00 0.00 54.58 52.01 1qe0 n ASN 355 Cb 0.03 -0.33 -0.01 0.00 -0.61 0.00 0.00 39.78 38.86 1qe0 n ASN 355 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qe0 n GLY 356 N -0.52 0.56 3.80 7.41 0.00 -1.15 -4.88 105.19 110.41 1qe0 n GLY 356 Ca 0.08 -0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 1qe0 n GLY 356 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1qe0 s ILE 357 N -1.86 5.24 -0.34 -0.61 1.09 -1.15 -5.04 121.20 118.53 1qe0 s ILE 357 Ca 0.00 0.60 -0.19 0.00 -1.10 0.00 0.00 60.65 59.96 1qe0 s ILE 357 Cb 0.00 -3.62 -0.00 0.00 -1.06 0.00 0.00 42.46 37.78 1qe0 s ILE 357 CO 0.00 0.50 0.55 -0.54 -0.10 0.00 0.00 174.94 175.35 1qe0 s LYS 358 N -0.41 3.68 0.16 2.79 3.01 -1.26 -4.00 119.74 123.71 1qe0 s LYS 358 Ca 0.19 -0.06 0.02 0.00 -1.01 0.00 0.00 55.97 55.11 1qe0 s LYS 358 Cb -0.14 -3.79 -0.05 0.00 -1.01 0.00 0.00 37.83 32.84 1qe0 s LYS 358 CO 0.08 -0.64 -0.02 0.00 0.51 0.00 0.00 175.35 175.27 1qe0 s ALA 359 N 2.47 1.32 0.01 5.17 0.00 -1.26 -0.67 121.76 128.80 1qe0 s ALA 359 Ca 0.20 -1.55 -0.29 0.00 0.00 0.00 0.00 51.96 50.33 1qe0 s ALA 359 Cb -0.15 0.42 0.07 0.00 0.00 0.00 0.00 23.12 23.46 1qe0 s ALA 359 CO 0.13 -0.28 0.66 0.34 0.00 0.00 0.00 175.76 176.62 1qe0 s ASP 360 N -3.16 -0.63 0.00 0.00 3.68 -0.45 -4.96 116.67 111.15 1qe0 s ASP 360 Ca 0.21 0.51 0.00 0.00 2.13 0.00 0.00 52.55 55.40 1qe0 s ASP 360 Cb 0.05 0.55 0.00 0.00 -1.45 0.00 0.00 42.92 42.08 1qe0 s ASP 360 CO 0.02 -0.71 0.00 2.29 0.13 0.00 0.00 175.17 176.91 1qe0 n LYS 361 N 0.54 2.72 -3.77 4.34 2.85 -1.26 -0.49 118.16 123.09 1qe0 n LYS 361 Ca -0.18 0.00 -0.37 0.00 -1.05 0.00 0.00 58.31 56.70 1qe0 n LYS 361 Cb 0.59 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.85 1qe0 n LYS 361 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 177.40 177.69 1qe0 s ASP 362 N 0.05 5.23 0.24 -5.58 -1.08 -1.23 -4.88 116.67 109.41 1qe0 s ASP 362 Ca 0.00 -1.07 0.00 0.00 -0.52 0.00 0.00 52.55 50.96 1qe0 s ASP 362 Cb 0.00 -1.85 0.00 0.00 -1.46 0.00 0.00 42.92 39.61 1qe0 s ASP 362 CO 0.00 -0.29 0.00 -1.22 0.52 0.00 0.00 175.17 174.18 1qe0 n TYR 363 N 4.80 -1.41 -0.28 -5.34 4.01 -1.26 -4.25 117.16 113.43 1qe0 n TYR 363 Ca -0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1qe0 n TYR 363 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.48 1qe0 n TYR 363 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1qe0 n LEU 364 N 0.00 0.54 -2.88 7.72 4.32 -1.26 -4.42 117.00 121.02 1qe0 n LEU 364 Ca 0.00 0.00 -0.18 0.00 -0.02 0.00 0.00 56.01 55.81 1qe0 n LEU 364 Cb 0.00 -1.03 0.02 0.00 -1.62 0.00 0.00 43.42 40.79 1qe0 n LEU 364 CO 0.00 -0.27 -0.31 0.00 -1.22 0.00 0.00 177.39 175.59 1qe0 n GLN 365 N -2.00 -0.95 -4.50 3.23 6.02 -1.26 -4.98 117.38 112.94 1qe0 n GLN 365 Ca 0.00 0.91 -0.24 0.00 -0.01 0.00 0.00 57.00 57.66 1qe0 n GLN 365 Cb 0.00 -1.24 -0.11 0.00 1.02 0.00 0.00 30.24 29.92 1qe0 n GLN 365 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1qe0 s ARG 366 N -1.45 1.73 0.64 -1.09 1.70 -1.26 -5.13 118.95 114.09 1qe0 s ARG 366 Ca 0.17 -1.93 -0.17 0.00 -0.47 0.00 0.00 55.73 53.33 1qe0 s ARG 366 Cb -0.02 -1.30 -0.01 0.00 -0.57 0.00 0.00 34.95 33.06 1qe0 s ARG 366 CO 0.39 -0.03 1.22 0.15 -1.08 0.00 0.00 175.30 175.95 1qe0 s LYS 367 N -3.75 2.66 0.29 3.89 1.02 -1.26 -4.60 119.74 117.99 1qe0 s LYS 367 Ca 0.33 1.85 0.03 0.00 0.02 0.00 0.00 55.97 58.20 1qe0 s LYS 367 Cb 0.07 -1.89 0.75 0.00 -0.52 0.00 0.00 37.83 36.24 1qe0 s LYS 367 CO 0.15 -1.46 1.64 0.82 -0.92 0.00 0.00 175.35 175.58 1qe0 h ILE 368 N 0.47 0.27 -0.93 2.17 2.04 -1.98 0.93 117.51 120.49 1qe0 h ILE 368 Ca -0.50 -0.06 0.05 0.00 1.00 0.00 0.00 64.86 65.35 1qe0 h ILE 368 Cb 1.30 0.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.40 1qe0 h ILE 368 CO 0.53 0.03 0.60 0.50 0.00 0.00 0.00 178.15 179.81 1qe0 h LYS 369 N 0.18 1.08 -0.18 2.37 3.64 -1.98 0.46 116.57 122.14 1qe0 h LYS 369 Ca 0.57 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.73 1qe0 h LYS 369 Cb 1.19 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.76 1qe0 h LYS 369 CO -0.69 0.72 -0.55 0.78 -2.27 0.00 0.00 179.45 177.45 1qe0 h GLY 370 N 1.12 0.59 0.97 5.01 0.00 0.46 -0.60 103.07 110.62 1qe0 h GLY 370 Ca 0.39 -0.69 -0.13 0.00 0.00 0.00 0.00 47.33 46.91 1qe0 h GLY 370 CO -0.15 0.61 -0.33 1.46 0.00 0.00 0.00 176.54 178.14 1qe0 h GLN 371 N 0.42 0.68 -0.71 4.80 4.20 0.04 -2.15 115.11 122.39 1qe0 h GLN 371 Ca 0.01 -0.39 -0.00 0.00 0.06 0.00 0.00 58.65 58.33 1qe0 h GLN 371 Cb 1.09 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.86 1qe0 h GLN 371 CO 0.10 1.00 0.43 0.52 -0.67 0.00 0.00 178.83 180.22 1qe0 h MET 372 N 0.41 0.95 -0.36 1.46 2.86 0.10 -0.87 114.93 119.48 1qe0 h MET 372 Ca 0.03 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.51 1qe0 h MET 372 Cb 0.91 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 1qe0 h MET 372 CO 0.08 0.66 -0.13 0.87 1.06 0.00 0.00 176.91 179.45 1qe0 h LYS 373 N 0.97 0.73 -0.88 1.72 1.57 -1.03 -2.14 116.57 117.50 1qe0 h LYS 373 Ca 0.25 -0.30 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1qe0 h LYS 373 Cb -0.05 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.18 1qe0 h LYS 373 CO -0.05 0.90 0.58 0.37 -0.57 0.00 0.00 179.45 180.68 1qe0 h GLN 374 N 0.52 1.12 -0.67 3.15 5.75 -0.68 0.63 115.11 124.93 1qe0 h GLN 374 Ca 0.09 -0.07 0.07 0.00 -0.15 0.00 0.00 58.65 58.59 1qe0 h GLN 374 Cb 0.65 -0.25 -0.06 0.00 1.07 0.00 0.00 27.48 28.89 1qe0 h GLN 374 CO 0.04 0.74 0.35 0.00 -2.65 0.00 0.00 178.83 177.32 1qe0 h ALA 375 N 1.34 0.90 -0.31 3.38 0.00 -0.95 0.32 119.26 123.95 1qe0 h ALA 375 Ca 0.34 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.21 1qe0 h ALA 375 Cb -0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1qe0 h ALA 375 CO -0.09 0.00 -0.07 0.22 0.00 0.00 0.00 179.25 179.31 1qe0 h ASP 376 N 0.64 0.59 -0.59 0.00 3.58 -0.62 0.56 116.42 120.58 1qe0 h ASP 376 Ca 0.31 -0.36 0.06 0.00 0.42 0.00 0.00 57.03 57.45 1qe0 h ASP 376 Cb 0.24 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 41.08 1qe0 h ASP 376 CO -0.21 0.82 0.30 -0.09 -2.88 0.00 0.00 179.24 177.18 1qe0 h ARG 377 N 0.36 0.55 0.00 0.28 2.43 0.15 -1.03 114.38 117.12 1qe0 h ARG 377 Ca 0.08 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 1qe0 h ARG 377 Cb 0.56 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1qe0 h ARG 377 CO 0.03 0.37 0.00 1.28 -1.51 0.00 0.00 179.97 180.14 1qe0 n LEU 378 N -4.85 0.00 0.00 3.80 4.32 0.10 -4.92 117.00 115.45 1qe0 n LEU 378 Ca 0.07 0.42 0.00 0.00 -0.02 0.00 0.00 56.01 56.48 1qe0 n LEU 378 Cb 0.16 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.54 1qe0 n LEU 378 CO 0.28 -0.03 0.00 0.61 -1.22 0.00 0.00 177.39 177.04 1qe0 n GLY 379 N 1.26 0.47 3.51 -0.72 0.00 -0.39 -2.89 105.19 106.43 1qe0 n GLY 379 Ca 0.09 -0.77 -0.55 0.00 0.00 0.00 0.00 46.02 44.79 1qe0 n GLY 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qe0 n ALA 380 N 0.67 0.48 -0.26 4.61 0.00 0.11 -3.77 120.51 122.35 1qe0 n ALA 380 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1qe0 n ALA 380 Cb 0.00 -2.35 0.22 0.00 0.00 0.00 0.00 19.45 17.32 1qe0 n ALA 380 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1qe0 h LYS 381 N 9.92 1.05 -5.17 0.00 1.57 -0.91 -3.43 116.57 119.60 1qe0 h LYS 381 Ca -0.32 -0.06 -0.43 0.00 -1.87 0.00 0.00 60.65 57.97 1qe0 h LYS 381 Cb 1.34 -0.24 -0.14 0.00 0.08 0.00 0.00 32.23 33.27 1qe0 h LYS 381 CO 1.01 0.70 -0.63 -0.06 -0.57 0.00 0.00 179.45 179.90 1qe0 s PHE 382 N -5.91 1.81 0.02 -1.35 0.08 -0.98 -0.72 117.98 110.94 1qe0 s PHE 382 Ca -0.11 -0.96 -0.07 0.00 0.12 0.00 0.00 56.93 55.91 1qe0 s PHE 382 Cb 0.18 -1.12 -0.00 0.00 -0.57 0.00 0.00 43.02 41.50 1qe0 s PHE 382 CO 0.79 -0.03 0.13 0.99 -0.10 0.00 0.00 175.22 177.00 1qe0 s THR 383 N -3.37 0.11 -0.03 0.64 2.01 -0.89 -2.22 115.64 111.88 1qe0 s THR 383 Ca 0.34 -0.89 -0.11 0.00 0.31 0.00 0.00 61.69 61.35 1qe0 s THR 383 Cb 0.07 -0.70 0.02 0.00 0.01 0.00 0.00 72.50 71.90 1qe0 s THR 383 CO 0.13 -0.49 0.24 0.27 -0.69 0.00 0.00 174.62 174.09 1qe0 s ILE 384 N -2.09 0.05 -0.27 1.82 -4.36 -1.08 -2.45 121.20 112.82 1qe0 s ILE 384 Ca -0.09 -0.44 0.03 0.00 -0.26 0.00 0.00 60.65 59.89 1qe0 s ILE 384 Cb -0.04 -0.50 0.06 0.00 1.25 0.00 0.00 42.46 43.23 1qe0 s ILE 384 CO -0.02 -0.24 -0.08 -0.69 0.24 0.00 0.00 174.94 174.15 1qe0 s VAL 385 N -1.02 2.24 -0.12 8.37 1.01 -1.25 -0.11 120.40 129.53 1qe0 s VAL 385 Ca -0.11 -1.72 -0.14 0.00 0.00 0.00 0.00 61.98 60.02 1qe0 s VAL 385 Cb -0.05 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 1qe0 s VAL 385 CO 0.02 -0.11 0.31 -0.63 0.00 0.00 0.00 175.10 174.70 1qe0 s ILE 386 N 1.08 5.26 0.25 2.22 1.01 0.43 -4.89 121.20 126.56 1qe0 s ILE 386 Ca -0.06 0.60 -0.06 0.00 0.00 0.00 0.00 60.65 61.14 1qe0 s ILE 386 Cb -0.20 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.62 1qe0 s ILE 386 CO -0.05 0.45 0.34 -0.83 0.00 0.00 0.00 174.94 174.85 1qe0 s GLY 387 N -0.02 1.13 0.35 6.18 0.00 -1.26 0.79 107.32 114.48 1qe0 s GLY 387 Ca 0.19 -1.35 0.06 0.00 0.00 0.00 0.00 44.72 43.61 1qe0 s GLY 387 CO 0.06 -1.02 1.92 -0.55 0.00 0.00 0.00 173.10 173.52 1qe0 h ASP 388 N 2.35 0.71 -0.76 1.64 3.45 -1.97 -1.48 116.42 120.36 1qe0 h ASP 388 Ca -0.30 0.02 0.01 0.00 0.43 0.00 0.00 57.03 57.19 1qe0 h ASP 388 Cb 1.25 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 39.84 1qe0 h ASP 388 CO 0.42 0.43 0.50 0.06 -1.57 0.00 0.00 179.24 179.08 1qe0 h GLN 389 N 0.79 0.99 -0.22 3.56 3.07 -1.98 -1.91 115.11 119.40 1qe0 h GLN 389 Ca 0.37 -0.06 -0.11 0.00 0.09 0.00 0.00 58.65 58.94 1qe0 h GLN 389 Cb 0.39 -0.22 -0.01 0.00 0.08 0.00 0.00 27.48 27.72 1qe0 h GLN 389 CO -0.14 0.65 -0.33 0.93 0.09 0.00 0.00 178.83 180.03 1qe0 h GLU 390 N 1.01 0.47 0.00 0.06 3.07 -1.59 -1.97 114.58 115.63 1qe0 h GLU 390 Ca 0.28 -0.21 -0.01 0.00 -0.50 0.00 0.00 59.36 58.93 1qe0 h GLU 390 Cb -0.10 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 27.80 1qe0 h GLU 390 CO -0.07 0.75 -0.05 1.25 -1.40 0.00 0.00 179.01 179.49 1qe0 h LEU 391 N 0.40 0.00 0.00 1.33 5.85 -0.52 -0.47 115.31 121.91 1qe0 h LEU 391 Ca 0.05 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.40 1qe0 h LEU 391 Cb 0.78 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.75 1qe0 h LEU 391 CO 0.06 0.05 -2.21 -1.84 -0.34 0.00 0.00 178.44 174.15 1qe0 n GLU 392 N -3.44 0.54 0.28 1.25 0.28 -0.97 -4.40 120.64 114.18 1qe0 n GLU 392 Ca -0.02 0.23 0.18 0.00 -0.16 0.00 0.00 57.16 57.40 1qe0 n GLU 392 Cb 0.17 -1.41 0.94 0.00 1.43 0.00 0.00 31.44 32.57 1qe0 n GLU 392 CO 0.00 0.00 0.00 -0.91 -0.16 0.00 0.00 177.13 176.06 1qe0 h ASN 393 N -0.92 0.00 -5.76 -1.84 -0.26 -1.40 -3.45 115.58 101.95 1qe0 h ASN 393 Ca -0.56 0.00 -0.35 0.00 -0.56 0.00 0.00 56.30 54.84 1qe0 h ASN 393 Cb 1.48 0.00 0.14 0.00 -1.06 0.00 0.00 38.32 38.88 1qe0 h ASN 393 CO -0.34 0.00 -0.80 -3.20 -1.06 0.00 0.00 177.43 172.03 1qe0 n ASN 394 N -3.31 -2.37 -3.64 5.81 5.15 -0.20 -4.92 115.26 111.79 1qe0 n ASN 394 Ca -0.01 -0.69 -0.12 0.00 -0.60 0.00 0.00 54.58 53.16 1qe0 n ASN 394 Cb 0.27 -4.82 -0.07 0.00 -0.53 0.00 0.00 39.78 34.64 1qe0 n ASN 394 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1qe0 s LYS 395 N -5.43 0.79 0.12 1.20 -2.85 -1.12 -1.61 119.74 110.83 1qe0 s LYS 395 Ca 0.06 1.07 0.01 0.00 -1.00 0.00 0.00 55.97 56.11 1qe0 s LYS 395 Cb -0.01 0.32 -0.04 0.00 -2.06 0.00 0.00 37.83 36.03 1qe0 s LYS 395 CO 0.76 -0.12 -0.03 0.96 0.10 0.00 0.00 175.35 177.02 1qe0 s ILE 396 N 0.79 0.56 -0.30 3.79 -5.25 0.55 -4.59 121.20 116.75 1qe0 s ILE 396 Ca -0.03 -1.93 -0.10 0.00 -0.99 0.00 0.00 60.65 57.59 1qe0 s ILE 396 Cb -0.05 -1.84 -0.02 0.00 2.95 0.00 0.00 42.46 43.50 1qe0 s ILE 396 CO -0.06 -0.72 0.17 -1.81 -1.79 0.00 0.00 174.94 170.73 1qe0 s ASP 397 N -3.07 5.71 -0.60 4.36 1.01 -1.26 -0.40 116.67 122.42 1qe0 s ASP 397 Ca 0.16 -0.35 -0.20 0.00 0.71 0.00 0.00 52.55 52.87 1qe0 s ASP 397 Cb 0.06 -2.05 0.08 0.00 1.01 0.00 0.00 42.92 42.03 1qe0 s ASP 397 CO -0.02 -0.15 0.78 -0.69 0.21 0.00 0.00 175.17 175.30 1qe0 s VAL 398 N 1.67 4.65 -0.16 -1.27 1.01 0.29 -4.54 120.40 122.05 1qe0 s VAL 398 Ca 0.06 -0.65 -0.21 0.00 0.00 0.00 0.00 61.98 61.17 1qe0 s VAL 398 Cb -0.17 -4.52 -0.03 0.00 0.00 0.00 0.00 36.38 31.66 1qe0 s VAL 398 CO 0.08 -1.18 0.63 -0.75 0.00 0.00 0.00 175.10 173.88 1qe0 s LYS 399 N 3.17 4.27 -0.24 2.72 2.20 -1.03 -1.08 119.74 129.75 1qe0 s LYS 399 Ca 0.16 0.65 -0.29 0.00 -0.36 0.00 0.00 55.97 56.13 1qe0 s LYS 399 Cb -0.21 -3.54 -0.02 0.00 -1.51 0.00 0.00 37.83 32.56 1qe0 s LYS 399 CO 0.09 -0.14 1.50 1.21 -0.36 0.00 0.00 175.35 177.65 1qe0 s ASN 400 N 1.05 6.50 0.38 1.43 3.84 0.85 -2.10 114.94 126.89 1qe0 s ASN 400 Ca 0.30 1.50 0.27 0.00 0.21 0.00 0.00 52.86 55.13 1qe0 s ASN 400 Cb -0.16 -2.53 1.36 0.00 -0.55 0.00 0.00 41.25 39.36 1qe0 s ASN 400 CO 0.12 -1.18 1.81 0.24 -2.79 0.00 0.00 177.10 175.30 1qe0 h MET 401 N 10.16 0.00 0.00 0.43 2.86 -1.19 0.35 114.93 127.54 1qe0 h MET 401 Ca -0.31 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.12 1qe0 h MET 401 Cb 1.13 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.76 1qe0 h MET 401 CO 1.01 0.00 -1.47 2.41 1.06 0.00 0.00 176.91 179.92 1qe0 n THR 402 N -2.44 1.50 0.24 2.22 -1.04 -1.26 -4.31 114.28 109.19 1qe0 n THR 402 Ca -0.01 -0.06 0.12 0.00 -2.04 0.00 0.00 64.05 62.06 1qe0 n THR 402 Cb 0.09 -2.13 0.52 0.00 -1.82 0.00 0.00 70.33 66.99 1qe0 n THR 402 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 1qe0 h THR 403 N -1.00 0.39 -0.04 12.58 1.35 -1.95 -3.46 112.91 120.78 1qe0 h THR 403 Ca -0.32 -0.94 -0.02 0.00 -0.55 0.00 0.00 66.41 64.58 1qe0 h THR 403 Cb 1.18 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 69.29 1qe0 h THR 403 CO -0.19 0.15 -0.02 0.61 -0.25 0.00 0.00 175.52 175.82 1qe0 n GLY 404 N 0.13 0.45 3.72 5.82 0.00 0.12 -5.00 105.19 110.43 1qe0 n GLY 404 Ca 0.00 -0.16 -0.40 0.00 0.00 0.00 0.00 46.02 45.47 1qe0 n GLY 404 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qe0 s GLU 405 N -0.81 4.42 0.36 1.61 2.12 -1.21 -4.78 118.70 120.41 1qe0 s GLU 405 Ca 0.00 0.83 -0.02 0.00 0.36 0.00 0.00 54.97 56.15 1qe0 s GLU 405 Cb 0.00 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.90 1qe0 s GLU 405 CO 0.00 0.07 0.59 -1.12 -0.54 0.00 0.00 175.26 174.25 1qe0 s SER 406 N 0.79 6.32 -0.05 -1.70 0.01 -1.26 -0.11 113.70 117.71 1qe0 s SER 406 Ca 0.36 0.59 -0.02 0.00 1.31 0.00 0.00 55.95 58.19 1qe0 s SER 406 Cb -0.17 -2.09 0.03 0.00 0.21 0.00 0.00 66.02 64.00 1qe0 s SER 406 CO 0.17 -0.32 0.08 -0.70 0.41 0.00 0.00 173.24 172.88 1qe0 s GLU 407 N -4.21 -0.03 -0.24 12.44 2.56 -0.24 -4.91 118.70 124.07 1qe0 s GLU 407 Ca 0.42 0.36 -0.14 0.00 0.00 0.00 0.00 54.97 55.61 1qe0 s GLU 407 Cb -0.10 -0.36 -0.04 0.00 2.00 0.00 0.00 34.13 35.63 1qe0 s GLU 407 CO 0.36 -0.26 0.32 0.99 -0.56 0.00 0.00 175.26 176.11 1qe0 s THR 408 N 1.77 5.24 0.33 -1.70 2.01 -1.26 0.11 115.64 122.14 1qe0 s THR 408 Ca -0.01 0.50 0.03 0.00 0.31 0.00 0.00 61.69 62.52 1qe0 s THR 408 Cb -0.12 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1qe0 s THR 408 CO -0.04 0.25 0.11 0.27 -0.69 0.00 0.00 174.62 174.52 1qe0 s ILE 409 N 1.50 0.66 0.42 1.82 -4.36 0.46 -4.96 121.20 116.74 1qe0 s ILE 409 Ca 0.14 -2.00 -0.21 0.00 -0.26 0.00 0.00 60.65 58.32 1qe0 s ILE 409 Cb -0.15 -2.56 -0.11 0.00 1.25 0.00 0.00 42.46 40.90 1qe0 s ILE 409 CO 0.08 0.00 0.93 -1.83 0.24 0.00 0.00 174.94 174.36 1qe0 s GLU 410 N -3.84 4.23 0.34 0.37 -1.05 -1.26 -0.33 118.70 117.15 1qe0 s GLU 410 Ca 0.33 1.09 0.05 0.00 -0.15 0.00 0.00 54.97 56.28 1qe0 s GLU 410 Cb 0.06 -2.23 0.68 0.00 -0.44 0.00 0.00 34.13 32.20 1qe0 s GLU 410 CO 0.15 0.00 1.93 1.25 0.95 0.00 0.00 175.26 179.55 1qe0 h LEU 411 N 2.00 0.74 -0.83 1.83 5.85 -1.61 -1.28 115.31 122.00 1qe0 h LEU 411 Ca -0.49 0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.32 1qe0 h LEU 411 Cb 1.18 -0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.99 1qe0 h LEU 411 CO 0.62 0.47 0.50 0.44 -0.34 0.00 0.00 178.44 180.12 1qe0 h ASP 412 N 0.84 0.75 -0.42 1.25 3.32 -1.93 -2.39 116.42 117.84 1qe0 h ASP 412 Ca 0.35 0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.48 1qe0 h ASP 412 Cb 0.29 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 1qe0 h ASP 412 CO -0.13 0.46 0.28 0.00 -1.72 0.00 0.00 179.24 178.14 1qe0 h ALA 413 N 1.42 1.94 -0.08 3.45 0.00 -1.61 -3.32 119.26 121.06 1qe0 h ALA 413 Ca 0.38 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.28 1qe0 h ALA 413 Cb 0.25 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1qe0 h ALA 413 CO -0.20 -0.02 -0.05 -0.11 0.00 0.00 0.00 179.25 178.87 1qe0 n LEU 414 N -4.48 -0.08 0.23 0.00 -0.00 -0.90 0.42 117.00 112.18 1qe0 n LEU 414 Ca 0.05 0.20 -0.15 0.00 -0.00 0.00 0.00 56.01 56.11 1qe0 n LEU 414 Cb 0.23 -0.05 -0.08 0.00 -0.00 0.00 0.00 43.42 43.52 1qe0 n LEU 414 CO 0.35 -0.14 0.70 -0.37 -0.00 0.00 0.00 177.39 177.93 1qe0 h VAL 415 N 0.00 0.62 -0.82 1.96 -1.51 -1.82 -0.83 116.25 113.85 1qe0 h VAL 415 Ca 0.01 -0.12 0.08 0.00 -1.23 0.00 0.00 66.70 65.45 1qe0 h VAL 415 Cb 0.03 0.68 -0.05 0.00 -2.13 0.00 0.00 31.29 29.82 1qe0 h VAL 415 CO -0.07 0.02 0.54 -0.08 -1.23 0.00 0.00 177.57 176.75 1qe0 h GLU 416 N -0.59 0.82 -0.07 5.19 4.57 -0.45 0.22 114.58 124.27 1qe0 h GLU 416 Ca -0.05 -0.05 -0.22 0.00 -1.18 0.00 0.00 59.36 57.85 1qe0 h GLU 416 Cb 0.44 -0.18 0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1qe0 h GLU 416 CO 0.09 0.54 -0.86 -0.92 -1.18 0.00 0.00 179.01 176.68 1qe0 h TYR 417 N 0.84 0.82 0.16 0.92 5.03 0.05 -3.28 116.97 121.52 1qe0 h TYR 417 Ca 0.37 -0.40 -0.29 0.00 2.58 0.00 0.00 58.73 60.98 1qe0 h TYR 417 Cb 0.33 -0.11 0.02 0.00 1.55 0.00 0.00 36.73 38.51 1qe0 h TYR 417 CO -0.00 1.21 -1.30 0.74 -1.32 0.00 0.00 178.16 177.50 1qe0 h PHE 418 N 0.37 0.69 0.00 -3.82 0.04 -0.46 -3.50 116.94 110.26 1qe0 h PHE 418 Ca -0.07 -0.49 0.00 0.00 2.80 0.00 0.00 57.97 60.21 1qe0 h PHE 418 Cb 1.49 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.60 1qe0 h PHE 418 CO 0.07 1.37 0.00 1.17 -0.60 0.00 0.00 178.31 180.32