#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x60 s MET 2 N 0.00 2.69 0.14 5.55 -2.45 -1.26 -4.22 119.30 119.74 2x60 s MET 2 Ca 0.00 -0.61 0.06 0.00 -1.25 0.00 0.00 55.69 53.89 2x60 s MET 2 Cb 0.00 -2.57 -0.04 0.00 1.25 0.00 0.00 34.83 33.47 2x60 s MET 2 CO 0.00 0.64 -0.01 0.15 1.05 0.00 0.00 175.02 176.85 2x60 s LYS 3 N -1.07 2.44 -0.10 4.11 1.02 -0.91 -4.89 119.74 120.35 2x60 s LYS 3 Ca 0.14 -1.00 0.01 0.00 0.02 0.00 0.00 55.97 55.15 2x60 s LYS 3 Cb -0.11 -2.42 -0.02 0.00 -0.52 0.00 0.00 37.83 34.75 2x60 s LYS 3 CO 0.04 0.49 -0.11 0.00 -0.92 0.00 0.00 175.35 174.85 2x60 s ALA 4 N -1.52 2.75 -0.31 5.17 0.00 -0.66 -0.55 121.76 126.64 2x60 s ALA 4 Ca 0.26 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.34 2x60 s ALA 4 Cb -0.10 -1.19 0.09 0.00 0.00 0.00 0.00 23.12 21.92 2x60 s ALA 4 CO 0.18 0.40 0.02 -1.17 0.00 0.00 0.00 175.76 175.20 2x60 s LEU 5 N -0.21 3.91 -0.30 0.00 0.20 0.02 -0.10 118.68 122.20 2x60 s LEU 5 Ca 0.01 -1.85 -0.19 0.00 0.69 0.00 0.00 54.13 52.79 2x60 s LEU 5 Cb -0.13 -1.44 -0.01 0.00 -0.43 0.00 0.00 46.19 44.18 2x60 s LEU 5 CO 0.03 -0.34 0.56 -0.63 -0.29 0.00 0.00 176.35 175.68 2x60 s ILE 6 N 1.11 5.00 -0.49 6.68 1.01 0.17 -1.04 121.20 133.64 2x60 s ILE 6 Ca 0.06 0.74 -0.25 0.00 0.00 0.00 0.00 60.65 61.20 2x60 s ILE 6 Cb -0.19 -3.93 0.03 0.00 0.01 0.00 0.00 42.46 38.38 2x60 s ILE 6 CO -0.10 -0.08 0.95 -0.76 0.00 0.00 0.00 174.94 174.95 2x60 s LEU 7 N 2.46 3.98 -0.14 2.97 1.43 -0.18 -0.90 118.68 128.30 2x60 s LEU 7 Ca 0.22 0.02 0.23 0.00 -1.03 0.00 0.00 54.13 53.57 2x60 s LEU 7 Cb -0.15 -3.12 0.47 0.00 0.03 0.00 0.00 46.19 43.41 2x60 s LEU 7 CO 0.11 -1.12 1.15 0.00 0.23 0.00 0.00 176.35 176.72 2x60 n ALA 8 N 7.33 2.67 0.65 4.21 0.00 -0.56 -2.36 120.51 132.45 2x60 n ALA 8 Ca 0.05 -2.66 0.10 0.00 0.00 0.00 0.00 53.44 50.94 2x60 n ALA 8 Cb 0.48 -0.76 0.11 0.00 0.00 0.00 0.00 19.45 19.29 2x60 n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x60 n GLY 9 N -0.15 0.90 3.93 0.00 0.00 -1.06 -4.52 105.19 104.30 2x60 n GLY 9 Ca 0.09 -0.59 -0.29 0.00 0.00 0.00 0.00 46.02 45.23 2x60 n GLY 9 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x60 s GLY 10 N -1.56 1.74 -0.05 -0.02 0.00 -1.26 -4.06 107.32 102.11 2x60 s GLY 10 Ca 0.26 -1.15 0.21 0.00 0.00 0.00 0.00 44.72 44.04 2x60 s GLY 10 CO 0.26 -0.48 0.45 1.44 0.00 0.00 0.00 173.10 174.77 2x60 n SER 11 N -3.53 0.15 -2.21 1.64 7.64 -1.26 -4.86 113.62 111.19 2x60 n SER 11 Ca 0.14 0.06 -0.15 0.00 1.01 0.00 0.00 58.87 59.93 2x60 n SER 11 Cb 0.60 1.44 0.03 0.00 -1.01 0.00 0.00 64.21 65.27 2x60 n SER 11 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2x60 n GLY 12 N 1.39 -0.10 0.36 0.23 0.00 -1.26 -4.16 105.19 101.65 2x60 n GLY 12 Ca -0.12 -0.14 0.08 0.00 0.00 0.00 0.00 46.02 45.84 2x60 n GLY 12 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2x60 h GLU 13 N -1.15 0.74 0.00 1.61 5.08 -1.94 -0.97 114.58 117.94 2x60 h GLU 13 Ca -0.36 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 2x60 h GLU 13 Cb 1.25 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2x60 h GLU 13 CO 0.38 0.49 0.00 0.54 -1.00 0.00 0.00 179.01 179.42 2x60 n ARG 14 N -4.50 0.53 -0.75 2.33 1.74 -1.26 -2.82 116.66 111.92 2x60 n ARG 14 Ca 0.13 0.00 0.01 0.00 -0.77 0.00 0.00 57.85 57.22 2x60 n ARG 14 Cb 0.29 -1.47 0.28 0.00 -1.02 0.00 0.00 32.46 30.54 2x60 n ARG 14 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2x60 n PHE 15 N -0.97 1.61 -2.11 -1.55 3.72 -0.37 -4.25 117.46 113.54 2x60 n PHE 15 Ca 0.12 -1.11 -0.39 0.00 -0.05 0.00 0.00 57.45 56.02 2x60 n PHE 15 Cb 0.05 -0.50 -0.01 0.00 -0.94 0.00 0.00 39.48 38.09 2x60 n PHE 15 CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 2x60 s TRP 16 N -2.96 2.88 -2.51 1.38 -0.00 -1.13 -0.10 118.94 116.50 2x60 s TRP 16 Ca 0.48 1.44 0.26 0.00 -0.00 0.00 0.00 56.10 58.28 2x60 s TRP 16 Cb 0.40 -3.61 0.84 0.00 -0.00 0.00 0.00 33.47 31.09 2x60 s TRP 16 CO 0.10 -1.92 1.62 -0.35 -0.00 0.00 0.00 176.95 176.40 2x60 n PRO 17 N 0.15 1.81 -0.12 5.86 -0.04 -1.26 -4.83 135.00 136.57 2x60 n PRO 17 Ca 0.04 -1.18 -0.09 0.00 -0.04 0.00 0.00 63.50 62.22 2x60 n PRO 17 Cb 0.44 -1.46 0.05 0.00 -0.04 0.00 0.00 33.50 32.49 2x60 n PRO 17 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2x60 h LEU 18 N 2.73 0.89 -9.05 1.53 5.85 -1.48 -3.42 115.31 112.36 2x60 h LEU 18 Ca 0.00 -0.33 -0.62 0.00 0.84 0.00 0.00 57.88 57.77 2x60 h LEU 18 Cb 0.58 -0.24 -0.14 0.00 0.37 0.00 0.00 40.66 41.23 2x60 h LEU 18 CO 0.00 1.08 -0.42 -0.55 -0.34 0.00 0.00 178.44 178.21 2x60 s SER 19 N -6.75 6.18 0.25 1.25 0.15 0.85 -4.93 113.70 110.70 2x60 s SER 19 Ca -0.10 0.19 0.10 0.00 0.70 0.00 0.00 55.95 56.84 2x60 s SER 19 Cb 0.13 -2.14 -0.05 0.00 -1.71 0.00 0.00 66.02 62.24 2x60 s SER 19 CO 0.85 -0.01 -0.17 0.42 1.20 0.00 0.00 173.24 175.53 2x60 s THR 20 N 1.34 2.14 0.51 6.45 -4.23 -0.53 -3.92 115.64 117.41 2x60 s THR 20 Ca 0.10 -2.32 0.24 0.00 -1.18 0.00 0.00 61.69 58.54 2x60 s THR 20 Cb -0.14 -2.18 0.40 0.00 1.34 0.00 0.00 72.50 71.92 2x60 s THR 20 CO 0.07 -0.49 1.96 -0.65 -0.54 0.00 0.00 174.62 174.97 2x60 h PRO 21 N 2.41 0.09 -0.22 3.99 0.11 -1.97 0.27 132.00 136.66 2x60 h PRO 21 Ca -0.39 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 65.55 2x60 h PRO 21 Cb 1.24 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 2x60 h PRO 21 CO 0.61 0.06 -0.52 0.93 -0.21 0.00 0.00 178.00 178.86 2x60 h GLU 22 N 0.09 0.65 -2.56 1.05 4.39 -1.96 -3.41 114.58 112.83 2x60 h GLU 22 Ca 0.31 -0.40 -0.59 0.00 0.34 0.00 0.00 59.36 59.03 2x60 h GLU 22 Cb 1.11 0.04 -0.39 0.00 -0.10 0.00 0.00 28.75 29.41 2x60 h GLU 22 CO -0.03 1.01 -0.88 0.99 -1.16 0.00 0.00 179.01 178.94 2x60 s THR 23 N -4.07 0.52 1.00 1.13 2.01 -0.03 -5.07 115.64 111.12 2x60 s THR 23 Ca -0.08 -2.37 -0.16 0.00 0.31 0.00 0.00 61.69 59.39 2x60 s THR 23 Cb 0.11 -1.37 0.21 0.00 0.01 0.00 0.00 72.50 71.45 2x60 s THR 23 CO 0.85 -1.09 1.27 -2.84 -0.69 0.00 0.00 174.62 172.12 2x60 s PRO 24 N 0.40 0.39 0.45 4.92 0.02 -0.53 -1.45 135.00 139.20 2x60 s PRO 24 Ca 0.25 -0.28 0.13 0.00 0.02 0.00 0.00 61.00 61.12 2x60 s PRO 24 Cb -0.10 -1.81 1.03 0.00 0.02 0.00 0.00 34.50 33.64 2x60 s PRO 24 CO -0.09 -2.60 2.04 1.57 -0.33 0.00 0.00 177.00 177.59 2x60 h LYS 25 N -1.78 0.14 -0.02 5.54 2.10 -1.82 -2.28 116.57 118.45 2x60 h LYS 25 Ca -0.45 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 2x60 h LYS 25 Cb 1.26 -0.03 -0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2x60 h LYS 25 CO 0.40 0.19 0.07 -0.56 -2.00 0.00 0.00 179.45 177.54 2x60 h GLN 26 N 0.14 0.00 -0.36 0.07 -0.00 -1.91 -1.34 115.11 111.70 2x60 h GLN 26 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 2x60 h GLN 26 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.64 2x60 h GLN 26 CO 0.01 0.00 0.00 1.19 -0.00 0.00 0.00 178.83 180.03 2x60 n PHE 27 N -3.22 0.47 -3.24 0.06 3.72 -0.86 -2.09 117.46 112.30 2x60 n PHE 27 Ca -0.02 -0.29 -0.27 0.00 -0.05 0.00 0.00 57.45 56.81 2x60 n PHE 27 Cb 0.14 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 2x60 n PHE 27 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2x60 s LEU 28 N -1.27 3.99 -0.96 4.37 1.43 -0.51 -4.78 118.68 120.95 2x60 s LEU 28 Ca 0.33 0.70 -0.01 0.00 -1.03 0.00 0.00 54.13 54.12 2x60 s LEU 28 Cb 0.19 -3.55 0.30 0.00 0.03 0.00 0.00 46.19 43.16 2x60 s LEU 28 CO 0.26 -0.27 1.34 0.29 0.23 0.00 0.00 176.35 178.20 2x60 n LYS 29 N -1.30 4.11 0.08 1.70 5.02 -1.26 -2.18 118.16 124.33 2x60 n LYS 29 Ca -0.02 -4.60 -0.01 0.00 -2.02 0.00 0.00 58.31 51.66 2x60 n LYS 29 Cb 0.55 -2.44 0.27 0.00 -0.02 0.00 0.00 35.03 33.39 2x60 n LYS 29 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 2x60 h LEU 30 N 4.98 0.30 -7.78 -0.35 3.38 -1.92 -3.43 115.31 110.49 2x60 h LEU 30 Ca 0.23 -0.10 -0.22 0.00 0.09 0.00 0.00 57.88 57.88 2x60 h LEU 30 Cb 0.59 -0.08 -0.26 0.00 0.09 0.00 0.00 40.66 41.00 2x60 h LEU 30 CO 1.20 0.57 -0.71 -0.36 0.09 0.00 0.00 178.44 179.23 2x60 s PHE 31 N -4.43 0.06 0.23 1.13 0.08 -1.26 -5.09 117.98 108.69 2x60 s PHE 31 Ca -0.05 -0.11 0.00 0.00 0.12 0.00 0.00 56.93 56.88 2x60 s PHE 31 Cb 0.14 -0.04 0.00 0.00 -0.57 0.00 0.00 43.02 42.55 2x60 s PHE 31 CO 0.76 -0.04 0.00 0.41 -0.10 0.00 0.00 175.22 176.25 2x60 n GLY 32 N 2.74 -1.69 1.93 4.36 0.00 -1.26 -4.16 105.19 107.11 2x60 n GLY 32 Ca -0.15 -1.28 -0.17 0.00 0.00 0.00 0.00 46.02 44.42 2x60 n GLY 32 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2x60 n ASN 33 N -3.22 3.66 -4.23 1.61 5.15 -1.26 -4.87 115.26 112.11 2x60 n ASN 33 Ca 0.01 -3.21 -0.19 0.00 -0.60 0.00 0.00 54.58 50.58 2x60 n ASN 33 Cb 0.45 -0.76 -0.12 0.00 -0.53 0.00 0.00 39.78 38.83 2x60 n ASN 33 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 2x60 s LYS 34 N -2.55 0.97 0.90 1.20 1.02 -1.26 -5.06 119.74 114.96 2x60 s LYS 34 Ca 0.44 -1.13 -0.12 0.00 0.02 0.00 0.00 55.97 55.19 2x60 s LYS 34 Cb 0.37 -0.97 0.13 0.00 -0.52 0.00 0.00 37.83 36.84 2x60 s LYS 34 CO 0.09 0.20 1.09 -1.54 -0.92 0.00 0.00 175.35 174.27 2x60 s SER 35 N -2.12 3.46 0.19 2.83 1.04 -1.26 -4.44 113.70 113.41 2x60 s SER 35 Ca 0.05 1.47 -0.12 0.00 0.48 0.00 0.00 55.95 57.83 2x60 s SER 35 Cb -0.08 -2.15 0.21 0.00 0.10 0.00 0.00 66.02 64.10 2x60 s SER 35 CO 0.03 -2.64 1.74 -0.07 0.98 0.00 0.00 173.24 173.28 2x60 h LEU 36 N -1.55 0.15 -0.54 2.42 3.38 -1.46 -1.75 115.31 115.96 2x60 h LEU 36 Ca -0.50 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 57.46 2x60 h LEU 36 Cb 1.29 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 42.09 2x60 h LEU 36 CO 0.55 0.10 -0.02 -0.03 0.09 0.00 0.00 178.44 179.13 2x60 h MET 37 N 0.34 0.96 -0.09 1.13 4.05 -1.45 -1.55 114.93 118.31 2x60 h MET 37 Ca 0.26 -0.32 -0.01 0.00 -0.28 0.00 0.00 59.70 59.36 2x60 h MET 37 Cb 0.31 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.03 2x60 h MET 37 CO -0.28 0.98 0.04 -0.09 0.23 0.00 0.00 176.91 177.79 2x60 h ARG 38 N 0.84 0.14 -0.33 0.39 9.65 -1.75 -0.85 114.38 122.47 2x60 h ARG 38 Ca 0.15 -0.03 0.06 0.00 -1.10 0.00 0.00 59.98 59.07 2x60 h ARG 38 Cb 0.57 -0.02 -0.06 0.00 -1.39 0.00 0.00 29.97 29.06 2x60 h ARG 38 CO 0.03 0.26 -0.06 -1.49 2.80 0.00 0.00 179.97 181.51 2x60 h TRP 39 N -0.01 -0.12 -0.88 2.20 4.06 -1.08 0.11 115.95 120.23 2x60 h TRP 39 Ca 0.03 0.03 0.13 0.00 2.06 0.00 0.00 58.89 61.14 2x60 h TRP 39 Cb 0.17 0.11 -0.09 0.00 -1.00 0.00 0.00 29.16 28.35 2x60 h TRP 39 CO -0.02 -0.12 0.49 1.15 -3.56 0.00 0.00 178.44 176.39 2x60 h THR 40 N 0.03 0.82 -0.15 1.49 2.02 -1.05 -0.72 112.91 115.35 2x60 h THR 40 Ca 0.16 -0.26 -0.12 0.00 0.77 0.00 0.00 66.41 66.96 2x60 h THR 40 Cb 0.24 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.65 2x60 h THR 40 CO -0.32 0.14 -0.37 0.15 0.37 0.00 0.00 175.52 175.49 2x60 h PHE 41 N 0.76 0.66 -0.13 3.16 3.57 0.07 -2.88 116.94 122.15 2x60 h PHE 41 Ca 0.45 -0.25 -0.05 0.00 3.53 0.00 0.00 57.97 61.65 2x60 h PHE 41 Cb 0.54 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 2x60 h PHE 41 CO -0.06 0.99 -0.15 0.93 -2.23 0.00 0.00 178.31 177.79 2x60 h GLU 42 N 0.14 0.20 -0.29 1.11 5.08 -0.43 -0.34 114.58 120.06 2x60 h GLU 42 Ca -0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2x60 h GLU 42 Cb 0.98 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 2x60 h GLU 42 CO 0.08 0.37 0.16 -0.09 -1.00 0.00 0.00 179.01 178.53 2x60 h ARG 43 N 0.19 0.41 -0.21 2.33 2.43 -1.12 -3.16 114.38 115.25 2x60 h ARG 43 Ca 0.04 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 2x60 h ARG 43 Cb 0.40 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 2x60 h ARG 43 CO 0.02 0.34 -0.00 0.28 -1.51 0.00 0.00 179.97 179.11 2x60 h VAL 44 N 0.36 1.25 0.00 0.20 2.07 -1.17 -3.19 116.25 115.77 2x60 h VAL 44 Ca 0.10 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2x60 h VAL 44 Cb 0.05 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 2x60 h VAL 44 CO -0.02 0.27 0.00 -0.07 0.02 0.00 0.00 177.57 177.77 2x60 h LEU 45 N 0.13 0.00 -0.71 2.57 3.38 -1.06 -2.65 115.31 116.98 2x60 h LEU 45 Ca 0.06 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.12 2x60 h LEU 45 Cb 0.40 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 2x60 h LEU 45 CO 0.01 0.00 0.36 -0.33 0.09 0.00 0.00 178.44 178.57 2x60 h GLU 46 N 0.00 0.60 0.00 1.13 5.08 -1.54 -3.22 114.58 116.64 2x60 h GLU 46 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2x60 h GLU 46 Cb 0.09 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2x60 h GLU 46 CO 0.00 0.40 -0.61 0.39 -1.00 0.00 0.00 179.01 178.19 2x60 n GLU 47 N -4.85 3.27 -4.81 2.33 -0.58 -1.13 -5.05 120.64 109.82 2x60 n GLU 47 Ca 0.11 -0.01 -0.30 0.00 -0.42 0.00 0.00 57.16 56.53 2x60 n GLU 47 Cb 0.25 -1.00 -0.14 0.00 -0.57 0.00 0.00 31.44 29.98 2x60 n GLU 47 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2x60 s MET 48 N -2.04 1.82 0.10 3.49 -1.94 -1.01 -5.12 119.30 114.60 2x60 s MET 48 Ca 0.03 -1.11 -0.30 0.00 -1.71 0.00 0.00 55.69 52.60 2x60 s MET 48 Cb 0.07 -2.01 -0.06 0.00 2.01 0.00 0.00 34.83 34.84 2x60 s MET 48 CO 0.40 0.51 1.04 0.34 -0.01 0.00 0.00 175.02 177.30 2x60 s ASP 49 N -1.35 7.35 0.51 3.03 2.15 -1.26 -4.40 116.67 122.69 2x60 s ASP 49 Ca 0.12 1.88 0.36 0.00 0.43 0.00 0.00 52.55 55.34 2x60 s ASP 49 Cb -0.10 -2.59 1.52 0.00 -0.30 0.00 0.00 42.92 41.45 2x60 s ASP 49 CO 0.03 -0.21 1.71 -0.65 -0.17 0.00 0.00 175.17 175.88 2x60 h PRO 50 N 5.90 0.07 0.00 4.34 0.11 -1.94 -0.35 132.00 140.13 2x60 h PRO 50 Ca -0.43 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.68 2x60 h PRO 50 Cb 1.21 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.31 2x60 h PRO 50 CO 0.74 0.05 -0.02 1.57 -0.21 0.00 0.00 178.00 180.13 2x60 h LYS 51 N 0.07 0.00 -0.20 1.05 2.10 -1.93 -2.15 116.57 115.52 2x60 h LYS 51 Ca 0.71 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.36 2x60 h LYS 51 Cb 2.60 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.93 2x60 h LYS 51 CO -0.13 0.02 0.00 -0.25 -2.00 0.00 0.00 179.45 177.09 2x60 n ASP 52 N -3.19 2.44 -4.45 7.07 8.00 -0.14 -4.89 116.55 121.40 2x60 n ASP 52 Ca -0.02 -1.82 -0.33 0.00 0.71 0.00 0.00 54.79 53.33 2x60 n ASP 52 Cb 0.18 -0.12 -0.13 0.00 -0.02 0.00 0.00 41.12 41.02 2x60 n ASP 52 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2x60 s VAL 53 N -1.75 3.26 -0.07 2.53 1.01 -0.81 -1.66 120.40 122.91 2x60 s VAL 53 Ca 0.34 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.76 2x60 s VAL 53 Cb 0.20 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 2x60 s VAL 53 CO 0.30 0.55 -0.24 -0.63 0.00 0.00 0.00 175.10 175.08 2x60 s ILE 54 N -0.11 1.99 -0.20 2.22 1.01 0.86 -4.83 121.20 122.15 2x60 s ILE 54 Ca -0.01 -1.01 -0.04 0.00 0.00 0.00 0.00 60.65 59.60 2x60 s ILE 54 Cb -0.14 -1.70 -0.01 0.00 0.01 0.00 0.00 42.46 40.62 2x60 s ILE 54 CO 0.03 0.55 -0.05 -0.69 0.00 0.00 0.00 174.94 174.79 2x60 s VAL 55 N 0.08 3.50 -0.22 2.92 1.01 -0.75 0.45 120.40 127.40 2x60 s VAL 55 Ca -0.10 -0.47 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 2x60 s VAL 55 Cb -0.15 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 2x60 s VAL 55 CO 0.06 0.45 0.22 -0.69 0.00 0.00 0.00 175.10 175.13 2x60 s VAL 56 N 1.09 5.33 0.24 2.92 1.01 -0.08 -1.72 120.40 129.18 2x60 s VAL 56 Ca 0.01 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.33 2x60 s VAL 56 Cb -0.15 -3.55 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 2x60 s VAL 56 CO -0.00 0.35 0.08 -0.89 0.00 0.00 0.00 175.10 174.64 2x60 s THR 57 N 0.91 0.55 0.65 3.92 2.01 -0.56 -1.50 115.64 121.62 2x60 s THR 57 Ca 0.11 -2.00 -0.16 0.00 0.31 0.00 0.00 61.69 59.96 2x60 s THR 57 Cb -0.13 -2.51 -0.00 0.00 0.01 0.00 0.00 72.50 69.86 2x60 s THR 57 CO 0.04 -0.11 1.12 -2.28 -0.69 0.00 0.00 174.62 172.70 2x60 s HIS 58 N -3.76 2.58 0.35 4.92 2.46 -1.26 0.13 115.29 120.70 2x60 s HIS 58 Ca 0.35 1.55 0.03 0.00 0.47 0.00 0.00 55.06 57.46 2x60 s HIS 58 Cb 0.07 -3.21 0.63 0.00 -0.13 0.00 0.00 32.58 29.94 2x60 s HIS 58 CO 0.11 -1.75 1.94 1.57 -2.47 0.00 0.00 174.74 174.15 2x60 h LYS 59 N 0.16 0.67 0.00 2.88 2.10 -0.56 -2.73 116.57 119.09 2x60 h LYS 59 Ca -0.47 -0.09 -0.05 0.00 -2.00 0.00 0.00 60.65 58.04 2x60 h LYS 59 Cb 1.25 -0.13 -0.01 0.00 -0.90 0.00 0.00 32.23 32.45 2x60 h LYS 59 CO 0.54 0.55 -0.24 -0.44 -2.00 0.00 0.00 179.45 177.86 2x60 h ASP 60 N 0.67 0.00 -0.36 7.07 3.32 -1.94 -2.65 116.42 122.53 2x60 h ASP 60 Ca 0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.21 2x60 h ASP 60 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2x60 h ASP 60 CO -0.02 0.24 0.00 -1.22 -1.72 0.00 0.00 179.24 176.52 2x60 n TYR 61 N -4.14 0.48 0.14 4.55 4.01 -1.03 -4.43 117.16 116.73 2x60 n TYR 61 Ca -0.02 -0.24 -0.12 0.00 -0.16 0.00 0.00 57.90 57.36 2x60 n TYR 61 Cb 0.30 0.00 -0.08 0.00 -0.31 0.00 0.00 39.34 39.25 2x60 n TYR 61 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2x60 h VAL 62 N 2.11 0.66 -0.91 -0.72 2.07 -1.57 -0.89 116.25 117.01 2x60 h VAL 62 Ca 0.00 -0.74 0.06 0.00 0.82 0.00 0.00 66.70 66.84 2x60 h VAL 62 Cb 0.48 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 2x60 h VAL 62 CO 0.00 0.13 0.57 -0.33 0.02 0.00 0.00 177.57 177.96 2x60 h GLU 63 N -0.84 1.00 -0.76 1.57 4.39 -1.81 -2.03 114.58 116.10 2x60 h GLU 63 Ca -0.04 -0.06 -0.05 0.00 0.34 0.00 0.00 59.36 59.55 2x60 h GLU 63 Cb 0.52 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 28.91 2x60 h GLU 63 CO 0.07 0.66 0.26 -0.09 -1.16 0.00 0.00 179.01 178.75 2x60 h ARG 64 N 1.03 1.17 -0.67 2.33 9.65 -1.81 -2.71 114.38 123.37 2x60 h ARG 64 Ca 0.40 -0.23 -0.02 0.00 -1.10 0.00 0.00 59.98 59.02 2x60 h ARG 64 Cb 0.18 -0.18 -0.03 0.00 -1.39 0.00 0.00 29.97 28.55 2x60 h ARG 64 CO -0.18 0.97 0.35 1.15 2.80 0.00 0.00 179.97 185.07 2x60 h THR 65 N 1.12 1.21 -0.48 0.20 2.02 -0.47 -2.22 112.91 114.30 2x60 h THR 65 Ca 0.25 -0.56 0.05 0.00 0.77 0.00 0.00 66.41 66.92 2x60 h THR 65 Cb 0.27 0.36 -0.05 0.00 -1.74 0.00 0.00 68.15 67.00 2x60 h THR 65 CO -0.01 0.24 0.21 0.11 0.37 0.00 0.00 175.52 176.44 2x60 h LYS 66 N 0.92 0.41 -0.26 6.66 1.57 -1.21 0.22 116.57 124.87 2x60 h LYS 66 Ca 0.23 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 59.00 2x60 h LYS 66 Cb 0.07 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 2x60 h LYS 66 CO -0.03 0.27 0.16 0.87 -0.57 0.00 0.00 179.45 180.14 2x60 h LYS 67 N 0.42 0.31 -0.29 3.15 1.79 -1.16 -2.30 116.57 118.49 2x60 h LYS 67 Ca 0.22 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.61 2x60 h LYS 67 Cb 0.18 -0.07 -0.02 0.00 -1.58 0.00 0.00 32.23 30.74 2x60 h LYS 67 CO -0.19 0.21 -0.08 0.93 -1.08 0.00 0.00 179.45 179.24 2x60 h GLU 68 N 0.32 0.47 -2.16 3.15 4.39 -0.89 -3.36 114.58 116.50 2x60 h GLU 68 Ca 0.10 -0.12 -0.57 0.00 0.34 0.00 0.00 59.36 59.11 2x60 h GLU 68 Cb -0.01 -0.06 -0.41 0.00 -0.10 0.00 0.00 28.75 28.17 2x60 h GLU 68 CO -0.04 0.57 -0.79 1.28 -1.16 0.00 0.00 179.01 178.86 2x60 n LEU 69 N -4.24 2.91 0.20 1.33 4.77 0.74 -4.91 117.00 117.80 2x60 n LEU 69 Ca 0.01 -5.32 0.14 0.00 -0.03 0.00 0.00 56.01 50.81 2x60 n LEU 69 Cb 0.29 -0.20 0.69 0.00 -2.33 0.00 0.00 43.42 41.88 2x60 n LEU 69 CO 0.40 2.19 0.92 1.55 -1.33 0.00 0.00 177.39 181.11 2x60 h PRO 70 N 3.61 0.00 0.00 3.23 0.13 -1.63 -2.38 132.00 134.96 2x60 h PRO 70 Ca 0.14 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.11 2x60 h PRO 70 Cb 0.70 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.80 2x60 h PRO 70 CO 0.72 0.00 -0.94 0.93 -0.23 0.00 0.00 178.00 178.48 2x60 h GLU 71 N 0.00 0.00 -6.30 0.86 3.07 -1.91 -3.45 114.58 106.85 2x60 h GLU 71 Ca 0.00 0.00 -0.55 0.00 -0.50 0.00 0.00 59.36 58.31 2x60 h GLU 71 Cb 0.12 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 2x60 h GLU 71 CO 0.00 0.55 0.72 -1.17 -1.40 0.00 0.00 179.01 177.71 2x60 s LEU 72 N -6.31 4.27 0.39 1.33 2.96 -0.90 -4.87 118.68 115.55 2x60 s LEU 72 Ca 0.01 1.81 -0.27 0.00 -0.22 0.00 0.00 54.13 55.46 2x60 s LEU 72 Cb 0.08 -3.56 -0.11 0.00 0.50 0.00 0.00 46.19 43.11 2x60 s LEU 72 CO 0.78 -0.60 1.32 -2.65 -1.32 0.00 0.00 176.35 173.88 2x60 n PRO 73 N 5.33 2.13 -0.34 0.98 -0.02 -1.26 -4.88 135.00 136.94 2x60 n PRO 73 Ca 0.11 0.75 0.17 0.00 -2.02 0.00 0.00 63.50 62.52 2x60 n PRO 73 Cb 0.46 -2.42 0.38 0.00 -0.02 0.00 0.00 33.50 31.90 2x60 n PRO 73 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2x60 h ASP 74 N 2.40 0.66 0.42 2.55 5.19 -1.95 -1.39 116.42 124.31 2x60 h ASP 74 Ca -0.48 0.14 -0.05 0.00 -0.62 0.00 0.00 57.03 56.02 2x60 h ASP 74 Cb 1.28 0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.82 2x60 h ASP 74 CO 0.62 0.10 -0.22 1.05 -3.12 0.00 0.00 179.24 177.67 2x60 h GLU 75 N 0.58 0.00 0.00 3.56 4.11 -2.02 -2.54 114.58 118.27 2x60 h GLU 75 Ca 0.64 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.07 2x60 h GLU 75 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 2x60 h GLU 75 CO -0.48 0.22 0.00 0.09 0.07 0.00 0.00 179.01 178.91 2x60 n ASN 76 N -3.82 0.00 -4.47 3.06 4.13 -0.52 -4.53 115.26 109.11 2x60 n ASN 76 Ca -0.02 -1.10 -0.43 0.00 1.68 0.00 0.00 54.58 54.71 2x60 n ASN 76 Cb 0.32 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.48 2x60 n ASN 76 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2x60 s ILE 77 N -2.00 5.04 -0.21 2.41 1.01 -0.96 -1.80 121.20 124.68 2x60 s ILE 77 Ca 0.36 -0.40 -0.22 0.00 0.00 0.00 0.00 60.65 60.39 2x60 s ILE 77 Cb 0.17 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.50 2x60 s ILE 77 CO 0.28 -0.53 0.70 -0.63 0.00 0.00 0.00 174.94 174.76 2x60 s ILE 78 N 2.25 4.95 -0.16 2.92 -1.09 -0.70 -5.01 121.20 124.36 2x60 s ILE 78 Ca 0.13 1.32 -0.16 0.00 -2.23 0.00 0.00 60.65 59.71 2x60 s ILE 78 Cb -0.18 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.65 2x60 s ILE 78 CO 0.13 0.04 0.38 0.00 -1.23 0.00 0.00 174.94 174.27 2x60 s ALA 79 N 2.27 3.54 0.07 9.38 0.00 -1.26 -1.50 121.76 134.27 2x60 s ALA 79 Ca 0.31 -0.40 -0.07 0.00 0.00 0.00 0.00 51.96 51.79 2x60 s ALA 79 Cb -0.16 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.36 2x60 s ALA 79 CO 0.10 -0.07 0.35 -1.21 0.00 0.00 0.00 175.76 174.92 2x60 s GLU 80 N 0.81 3.66 0.21 0.00 2.02 0.34 -4.80 118.70 120.94 2x60 s GLU 80 Ca 0.20 0.02 0.02 0.00 0.02 0.00 0.00 54.97 55.23 2x60 s GLU 80 Cb -0.14 -2.99 0.17 0.00 0.10 0.00 0.00 34.13 31.27 2x60 s GLU 80 CO 0.07 0.56 1.51 -1.00 0.02 0.00 0.00 175.26 176.43 2x60 h PRO 81 N 3.56 0.33 -1.70 0.39 0.13 -1.90 0.37 132.00 133.18 2x60 h PRO 81 Ca -0.48 -0.24 0.08 0.00 -0.87 0.00 0.00 66.00 64.49 2x60 h PRO 81 Cb 1.19 0.04 -0.21 0.00 0.13 0.00 0.00 31.00 32.14 2x60 h PRO 81 CO 0.68 0.86 0.53 0.00 -0.23 0.00 0.00 178.00 179.83 2x60 s MET 82 N -3.74 0.65 0.12 0.86 0.23 -1.26 -4.83 119.30 111.32 2x60 s MET 82 Ca -0.05 0.07 -0.31 0.00 -1.03 0.00 0.00 55.69 54.37 2x60 s MET 82 Cb 0.11 0.30 -0.10 0.00 -1.53 0.00 0.00 34.83 33.62 2x60 s MET 82 CO 0.82 -0.22 1.71 0.15 -2.03 0.00 0.00 175.02 175.44 2x60 s LYS 83 N -1.49 4.17 -0.13 3.16 1.02 -1.26 -4.90 119.74 120.32 2x60 s LYS 83 Ca -0.01 2.45 0.16 0.00 0.02 0.00 0.00 55.97 58.59 2x60 s LYS 83 Cb -0.01 -3.48 0.29 0.00 -0.52 0.00 0.00 37.83 34.12 2x60 s LYS 83 CO 0.00 -0.75 1.15 1.63 -0.92 0.00 0.00 175.35 176.46 2x60 n LYS 84 N 5.21 1.18 -0.27 1.68 4.76 -1.26 -4.90 118.16 124.57 2x60 n LYS 84 Ca 0.16 -2.55 0.04 0.00 -2.87 0.00 0.00 58.31 53.09 2x60 n LYS 84 Cb 0.39 -1.39 -0.01 0.00 -1.84 0.00 0.00 35.03 32.18 2x60 n LYS 84 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2x60 n ASN 85 N -1.19 -5.61 -0.04 4.39 2.85 -1.26 -1.67 115.26 112.73 2x60 n ASN 85 Ca 0.15 0.29 -0.15 0.00 -0.11 0.00 0.00 54.58 54.76 2x60 n ASN 85 Cb 0.67 -0.81 -0.03 0.00 1.24 0.00 0.00 39.78 40.85 2x60 n ASN 85 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 2x60 h THR 86 N -0.25 1.29 -0.66 -0.44 1.35 -1.90 -3.30 112.91 109.01 2x60 h THR 86 Ca 0.01 -1.86 0.11 0.00 -0.55 0.00 0.00 66.41 64.12 2x60 h THR 86 Cb 0.25 1.81 -0.08 0.00 -1.73 0.00 0.00 68.15 68.40 2x60 h THR 86 CO 0.00 0.59 0.23 0.00 -0.25 0.00 0.00 175.52 176.09 2x60 h ALA 87 N 0.70 0.86 0.08 6.62 0.00 -1.71 0.56 119.26 126.38 2x60 h ALA 87 Ca -0.01 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 2x60 h ALA 87 Cb 1.25 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2x60 h ALA 87 CO 0.13 -0.22 -0.04 -1.35 0.00 0.00 0.00 179.25 177.77 2x60 h PRO 88 N 0.38 -0.10 -0.36 0.00 0.11 -1.75 -2.70 132.00 127.59 2x60 h PRO 88 Ca 0.35 0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.51 2x60 h PRO 88 Cb 0.48 0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 2x60 h PRO 88 CO -0.36 0.17 0.24 0.00 -0.21 0.00 0.00 178.00 177.84 2x60 h ALA 89 N 0.52 1.98 -0.35 -0.75 0.00 -1.37 0.19 119.26 119.49 2x60 h ALA 89 Ca -0.01 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2x60 h ALA 89 Cb 0.32 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2x60 h ALA 89 CO 0.02 -0.04 0.14 0.00 0.00 0.00 0.00 179.25 179.37 2x60 h PHE 91 N 0.48 -0.03 0.00 0.00 3.04 -0.31 -2.10 116.94 118.02 2x60 h PHE 91 Ca 0.12 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 62.03 2x60 h PHE 91 Cb 0.10 0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.61 2x60 h PHE 91 CO 0.00 0.72 -0.20 -0.84 -2.02 0.00 0.00 178.31 175.97 2x60 h ILE 92 N -0.86 0.67 -0.01 1.41 3.07 -1.41 -0.40 117.51 119.97 2x60 h ILE 92 Ca -0.00 -0.88 -0.01 0.00 1.55 0.00 0.00 64.86 65.52 2x60 h ILE 92 Cb 0.75 1.56 0.00 0.00 -0.27 0.00 0.00 36.82 38.87 2x60 h ILE 92 CO 0.00 0.20 -0.02 1.23 -1.05 0.00 0.00 178.15 178.52 2x60 h GLY 93 N 1.34 0.03 1.15 0.16 0.00 -1.43 -3.33 103.07 101.00 2x60 h GLY 93 Ca -0.00 -0.04 -0.11 0.00 0.00 0.00 0.00 47.33 47.18 2x60 h GLY 93 CO 0.03 0.03 -0.08 -0.84 0.00 0.00 0.00 176.54 175.68 2x60 h THR 94 N -0.53 1.27 -0.90 4.70 2.02 -1.07 -2.79 112.91 115.61 2x60 h THR 94 Ca 0.00 -1.22 0.23 0.00 0.77 0.00 0.00 66.41 66.18 2x60 h THR 94 Cb 0.59 0.93 -0.13 0.00 -1.74 0.00 0.00 68.15 67.80 2x60 h THR 94 CO 0.00 0.43 0.39 0.50 0.37 0.00 0.00 175.52 177.22 2x60 h LYS 95 N 0.90 0.37 -0.09 6.66 3.64 -1.20 -0.02 116.57 126.82 2x60 h LYS 95 Ca 0.15 -0.02 0.03 0.00 -1.27 0.00 0.00 60.65 59.53 2x60 h LYS 95 Cb 0.63 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2x60 h LYS 95 CO 0.04 0.24 0.12 -0.07 -2.27 0.00 0.00 179.45 177.51 2x60 h LEU 96 N 0.38 0.00-10.40 5.20 3.38 -1.60 -3.43 115.31 108.85 2x60 h LEU 96 Ca 0.57 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 58.09 2x60 h LEU 96 Cb 1.10 0.00 0.15 0.00 0.09 0.00 0.00 40.66 42.00 2x60 h LEU 96 CO -0.55 0.00 0.22 0.00 0.09 0.00 0.00 178.44 178.20 2x60 s ALA 97 N -4.58 1.13 0.81 1.53 0.00 -0.02 -5.06 121.76 115.57 2x60 s ALA 97 Ca -0.05 -0.44 -0.12 0.00 0.00 0.00 0.00 51.96 51.35 2x60 s ALA 97 Cb 0.15 -3.08 0.08 0.00 0.00 0.00 0.00 23.12 20.26 2x60 s ALA 97 CO 0.53 -2.74 1.15 -0.51 0.00 0.00 0.00 175.76 174.19 2x60 s ASP 98 N -3.63 4.48 0.16 0.00 1.01 -1.26 -4.98 116.67 112.45 2x60 s ASP 98 Ca 0.65 0.93 -0.13 0.00 0.71 0.00 0.00 52.55 54.71 2x60 s ASP 98 Cb -0.17 -1.52 0.05 0.00 1.01 0.00 0.00 42.92 42.29 2x60 s ASP 98 CO 0.56 -1.94 1.72 0.44 0.21 0.00 0.00 175.17 176.17 2x60 h ASP 99 N -1.07 0.74 -0.52 0.27 3.32 -1.93 -2.67 116.42 114.55 2x60 h ASP 99 Ca -0.47 -0.16 -0.11 0.00 0.02 0.00 0.00 57.03 56.31 2x60 h ASP 99 Cb 1.31 -0.19 -0.07 0.00 0.22 0.00 0.00 39.33 40.60 2x60 h ASP 99 CO 0.64 0.69 0.14 0.47 -1.72 0.00 0.00 179.24 179.46 2x60 n ASP 100 N -4.53 4.28 -4.58 6.45 8.00 -1.26 -0.06 116.55 124.84 2x60 n ASP 100 Ca 0.03 -2.84 -0.41 0.00 0.71 0.00 0.00 54.79 52.28 2x60 n ASP 100 Cb 0.15 -0.67 -0.08 0.00 -0.02 0.00 0.00 41.12 40.50 2x60 n ASP 100 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2x60 s GLU 101 N -2.36 3.82 -0.12 -1.24 2.12 -1.01 -4.84 118.70 115.08 2x60 s GLU 101 Ca 0.41 0.05 -0.29 0.00 0.36 0.00 0.00 54.97 55.50 2x60 s GLU 101 Cb 0.33 -3.74 -0.03 0.00 0.26 0.00 0.00 34.13 30.94 2x60 s GLU 101 CO 0.11 -0.52 1.48 -1.25 -0.54 0.00 0.00 175.26 174.54 2x60 s PRO 102 N 2.37 4.17 -0.17 4.30 0.04 -1.26 -0.80 135.00 143.67 2x60 s PRO 102 Ca 0.20 1.91 -0.07 0.00 0.04 0.00 0.00 61.00 63.08 2x60 s PRO 102 Cb -0.15 -3.89 -0.04 0.00 0.04 0.00 0.00 34.50 30.45 2x60 s PRO 102 CO 0.12 -0.82 0.08 0.08 0.04 0.00 0.00 177.00 176.50 2x60 s VAL 103 N 3.88 5.00 -0.29 -0.36 1.01 0.29 -2.14 120.40 127.81 2x60 s VAL 103 Ca 0.65 0.04 -0.08 0.00 0.00 0.00 0.00 61.98 62.58 2x60 s VAL 103 Cb -0.27 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 32.86 2x60 s VAL 103 CO 0.23 0.50 0.11 -0.22 0.00 0.00 0.00 175.10 175.71 2x60 s LEU 104 N 0.02 3.84 -0.24 3.92 2.96 0.29 -1.47 118.68 128.00 2x60 s LEU 104 Ca 0.07 -0.48 -0.10 0.00 -0.22 0.00 0.00 54.13 53.40 2x60 s LEU 104 Cb -0.12 -1.94 -0.05 0.00 0.50 0.00 0.00 46.19 44.58 2x60 s LEU 104 CO 0.00 -0.15 0.15 -0.69 -1.32 0.00 0.00 176.35 174.35 2x60 s VAL 105 N 1.58 5.27 -0.14 1.68 1.01 0.27 -0.80 120.40 129.28 2x60 s VAL 105 Ca 0.05 0.15 -0.00 0.00 0.00 0.00 0.00 61.98 62.17 2x60 s VAL 105 Cb -0.16 -3.45 0.03 0.00 0.00 0.00 0.00 36.38 32.79 2x60 s VAL 105 CO 0.04 0.35 -0.08 -0.76 0.00 0.00 0.00 175.10 174.66 2x60 s LEU 106 N 1.05 1.41 0.55 3.92 1.43 -0.20 -1.95 118.68 124.89 2x60 s LEU 106 Ca 0.07 -0.45 -0.21 0.00 -1.03 0.00 0.00 54.13 52.51 2x60 s LEU 106 Cb -0.14 -0.92 -0.05 0.00 0.03 0.00 0.00 46.19 45.11 2x60 s LEU 106 CO 0.04 -0.13 1.24 -2.65 0.23 0.00 0.00 176.35 175.08 2x60 n PRO 107 N 4.89 1.45 -0.17 1.29 -0.02 -1.26 -1.01 135.00 140.18 2x60 n PRO 107 Ca -0.13 0.54 0.06 0.00 -2.02 0.00 0.00 63.50 61.95 2x60 n PRO 107 Cb 0.49 -2.43 0.17 0.00 -0.02 0.00 0.00 33.50 31.71 2x60 n PRO 107 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2x60 n ALA 108 N -1.18 2.45 -2.21 3.55 0.00 -1.00 -4.28 120.51 117.84 2x60 n ALA 108 Ca 0.11 -0.60 0.02 0.00 0.00 0.00 0.00 53.44 52.98 2x60 n ALA 108 Cb 0.45 -0.98 0.08 0.00 0.00 0.00 0.00 19.45 19.00 2x60 n ALA 108 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2x60 n ASP 109 N 0.50 1.56 -4.92 0.00 5.75 -1.26 -3.48 116.55 114.69 2x60 n ASP 109 Ca 0.12 -2.73 -0.28 0.00 -0.01 0.00 0.00 54.79 51.89 2x60 n ASP 109 Cb 0.30 -0.40 -0.04 0.00 -1.03 0.00 0.00 41.12 39.95 2x60 n ASP 109 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2x60 s HIS 110 N -1.70 3.47 -0.22 2.11 3.76 -1.26 -2.04 115.29 119.41 2x60 s HIS 110 Ca 0.36 0.15 -0.04 0.00 -0.15 0.00 0.00 55.06 55.38 2x60 s HIS 110 Cb 0.38 -1.69 -0.01 0.00 1.11 0.00 0.00 32.58 32.37 2x60 s HIS 110 CO -0.11 0.54 -0.03 0.50 -0.85 0.00 0.00 174.74 174.80 2x60 s ARG 111 N -2.94 3.43 -0.39 1.40 3.52 -0.94 -4.85 118.95 118.18 2x60 s ARG 111 Ca 0.34 -0.60 0.02 0.00 -0.13 0.00 0.00 55.73 55.37 2x60 s ARG 111 Cb -0.12 -3.05 0.16 0.00 -1.56 0.00 0.00 34.95 30.38 2x60 s ARG 111 CO 0.28 -0.18 0.30 0.42 -0.81 0.00 0.00 175.30 175.31 2x60 s ILE 112 N 1.45 0.16 0.41 4.11 1.01 -1.26 -2.33 121.20 124.74 2x60 s ILE 112 Ca 0.05 -2.09 0.07 0.00 0.00 0.00 0.00 60.65 58.69 2x60 s ILE 112 Cb -0.14 -1.11 0.26 0.00 0.01 0.00 0.00 42.46 41.48 2x60 s ILE 112 CO -0.02 -1.05 2.05 1.55 0.00 0.00 0.00 174.94 177.48 2x60 h PRO 113 N 6.28 0.53 -4.63 2.79 0.13 -1.97 -3.36 132.00 131.77 2x60 h PRO 113 Ca 0.16 -0.04 -0.73 0.00 -0.87 0.00 0.00 66.00 64.53 2x60 h PRO 113 Cb 0.95 -0.12 -0.20 0.00 0.13 0.00 0.00 31.00 31.76 2x60 h PRO 113 CO 0.30 0.36 0.76 0.34 -0.23 0.00 0.00 178.00 179.53 2x60 s ASP 114 N -6.69 6.79 0.08 1.44 -1.08 -1.26 -4.86 116.67 111.09 2x60 s ASP 114 Ca -0.08 -2.47 -0.17 0.00 -0.52 0.00 0.00 52.55 49.31 2x60 s ASP 114 Cb 0.17 -2.35 -0.09 0.00 -1.46 0.00 0.00 42.92 39.19 2x60 s ASP 114 CO 0.73 -0.85 1.42 0.71 0.52 0.00 0.00 175.17 177.71 2x60 h THR 115 N 5.24 1.31 -0.58 1.71 1.35 -1.99 -1.68 112.91 118.27 2x60 h THR 115 Ca 0.18 -1.30 0.11 0.00 -0.55 0.00 0.00 66.41 64.84 2x60 h THR 115 Cb 0.99 1.60 -0.11 0.00 -1.73 0.00 0.00 68.15 68.89 2x60 h THR 115 CO 1.05 0.41 -0.29 0.11 -0.25 0.00 0.00 175.52 176.55 2x60 h LYS 116 N 0.29 -0.13 -0.00 4.72 1.79 -1.96 0.40 116.57 121.68 2x60 h LYS 116 Ca 0.05 0.01 -0.09 0.00 -2.18 0.00 0.00 60.65 58.44 2x60 h LYS 116 Cb 0.71 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.38 2x60 h LYS 116 CO 0.05 -0.09 -0.43 -0.22 -1.08 0.00 0.00 179.45 177.68 2x60 h LYS 117 N -0.14 0.00 0.42 3.15 3.64 -1.95 -1.57 116.57 120.13 2x60 h LYS 117 Ca 0.24 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 2x60 h LYS 117 Cb 0.53 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 2x60 h LYS 117 CO -0.66 0.43 -0.20 0.35 -2.27 0.00 0.00 179.45 177.10 2x60 h PHE 118 N 0.00 -0.52 -0.52 1.91 3.57 -0.28 -2.44 116.94 118.66 2x60 h PHE 118 Ca -0.00 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.49 2x60 h PHE 118 Cb 0.76 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.64 2x60 h PHE 118 CO 0.00 -0.26 0.34 -1.49 -2.23 0.00 0.00 178.31 174.67 2x60 h TRP 119 N -0.70 0.64 -0.87 0.41 4.06 -0.81 0.10 115.95 118.78 2x60 h TRP 119 Ca -0.06 0.02 0.20 0.00 2.06 0.00 0.00 58.89 61.11 2x60 h TRP 119 Cb 0.50 -0.21 -0.16 0.00 -1.00 0.00 0.00 29.16 28.29 2x60 h TRP 119 CO -0.02 0.40 -0.06 -0.22 -3.56 0.00 0.00 178.44 174.98 2x60 h LYS 120 N 0.69 0.04 -0.24 0.49 3.64 -1.32 -0.02 116.57 119.85 2x60 h LYS 120 Ca 0.19 -0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.42 2x60 h LYS 120 Cb -0.07 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 2x60 h LYS 120 CO -0.05 0.03 -0.48 1.15 -2.27 0.00 0.00 179.45 177.83 2x60 h THR 121 N 0.04 1.30 -0.21 1.00 2.02 -0.34 -2.46 112.91 114.26 2x60 h THR 121 Ca 0.47 -1.69 -0.12 0.00 0.77 0.00 0.00 66.41 65.84 2x60 h THR 121 Cb 0.85 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.89 2x60 h THR 121 CO -0.82 0.53 -0.38 0.58 0.37 0.00 0.00 175.52 175.80 2x60 h VAL 122 N 0.50 1.30 -0.21 3.16 2.07 -0.30 -1.32 116.25 121.44 2x60 h VAL 122 Ca 0.03 -1.51 -0.00 0.00 0.82 0.00 0.00 66.70 66.03 2x60 h VAL 122 Cb 1.02 1.55 -0.01 0.00 -1.52 0.00 0.00 31.29 32.33 2x60 h VAL 122 CO 0.10 0.47 0.12 0.11 0.02 0.00 0.00 177.57 178.39 2x60 h LYS 123 N 0.40 0.29 -0.61 1.57 1.57 -0.92 0.21 116.57 119.08 2x60 h LYS 123 Ca 0.04 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2x60 h LYS 123 Cb 0.84 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 2x60 h LYS 123 CO 0.07 0.26 0.40 -0.22 -0.57 0.00 0.00 179.45 179.39 2x60 h LYS 124 N 0.25 0.59 -0.33 3.15 3.64 -1.29 -0.91 116.57 121.67 2x60 h LYS 124 Ca 0.08 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 2x60 h LYS 124 Cb 0.04 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2x60 h LYS 124 CO -0.01 0.39 -0.13 0.00 -2.27 0.00 0.00 179.45 177.43 2x60 h ALA 125 N 1.67 0.46 -0.85 5.00 0.00 -0.72 -2.65 119.26 122.18 2x60 h ALA 125 Ca 0.26 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.86 2x60 h ALA 125 Cb 0.26 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2x60 h ALA 125 CO -0.08 0.34 0.56 -0.07 0.00 0.00 0.00 179.25 180.01 2x60 h LEU 126 N 0.44 0.97 -0.57 0.00 3.38 0.70 0.11 115.31 120.35 2x60 h LEU 126 Ca 0.08 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 2x60 h LEU 126 Cb 0.65 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 2x60 h LEU 126 CO 0.04 0.70 -0.15 0.44 0.09 0.00 0.00 178.44 179.56 2x60 h ASP 127 N 1.14 0.99 -0.37 -0.43 3.32 -1.34 -2.48 116.42 117.25 2x60 h ASP 127 Ca 0.31 -0.35 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 2x60 h ASP 127 Cb -0.13 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.13 2x60 h ASP 127 CO -0.07 1.13 0.20 0.00 -1.72 0.00 0.00 179.24 178.78 2x60 h ALA 128 N 0.95 1.59 -0.58 3.45 0.00 -0.91 -2.43 119.26 121.33 2x60 h ALA 128 Ca 0.13 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 2x60 h ALA 128 Cb 0.72 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2x60 h ALA 128 CO 0.05 0.34 0.22 1.25 0.00 0.00 0.00 179.25 181.11 2x60 h LEU 129 N 0.57 0.78 -0.08 0.00 5.85 -0.36 -1.70 115.31 120.37 2x60 h LEU 129 Ca 0.14 -0.11 -0.25 0.00 0.84 0.00 0.00 57.88 58.51 2x60 h LEU 129 Cb 0.05 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 40.90 2x60 h LEU 129 CO -0.02 0.71 -0.97 -0.33 -0.34 0.00 0.00 178.44 177.49 2x60 h GLU 130 N 0.84 0.65 -0.06 1.25 4.39 -1.27 -1.77 114.58 118.62 2x60 h GLU 130 Ca 0.20 -0.66 -0.13 0.00 0.34 0.00 0.00 59.36 59.11 2x60 h GLU 130 Cb 0.18 0.18 0.01 0.00 -0.10 0.00 0.00 28.75 29.02 2x60 h GLU 130 CO -0.02 1.26 -0.46 0.87 -1.16 0.00 0.00 179.01 179.50 2x60 h LYS 131 N 0.38 0.41 0.00 2.33 1.57 -1.33 -3.39 116.57 116.54 2x60 h LYS 131 Ca -0.10 -0.37 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2x60 h LYS 131 Cb 1.61 0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.01 2x60 h LYS 131 CO 0.19 1.02 -1.21 0.66 -0.57 0.00 0.00 179.45 179.53 2x60 n TYR 132 N -4.30 0.00 -4.95 -1.35 4.01 -0.65 -5.11 117.16 104.80 2x60 n TYR 132 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 2x60 n TYR 132 Cb 0.58 -0.17 0.00 0.00 -0.31 0.00 0.00 39.34 39.44 2x60 n TYR 132 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2x60 n ASP 133 N -1.70 -2.09 -0.34 7.72 8.00 -0.66 -5.03 116.55 122.45 2x60 n ASP 133 Ca -0.01 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.54 2x60 n ASP 133 Cb 0.23 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.32 2x60 n ASP 133 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2x60 n GLY 134 N 0.00 -1.67 3.76 0.44 0.00 -1.26 -4.84 105.19 101.62 2x60 n GLY 134 Ca 0.00 -1.43 -0.39 0.00 0.00 0.00 0.00 46.02 44.19 2x60 n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x60 s LEU 135 N -4.04 4.47 0.23 0.99 1.43 0.81 -4.69 118.68 117.87 2x60 s LEU 135 Ca 0.00 1.39 0.06 0.00 -1.03 0.00 0.00 54.13 54.56 2x60 s LEU 135 Cb 0.00 -3.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.05 2x60 s LEU 135 CO 0.00 0.09 0.18 -0.36 0.23 0.00 0.00 176.35 176.49 2x60 s PHE 136 N -0.33 3.13 0.28 0.29 0.40 0.04 0.62 117.98 122.41 2x60 s PHE 136 Ca 0.35 -0.08 0.03 0.00 -0.60 0.00 0.00 56.93 56.63 2x60 s PHE 136 Cb -0.20 -1.43 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 2x60 s PHE 136 CO 0.22 0.52 0.18 0.95 0.70 0.00 0.00 175.22 177.79 2x60 s THR 137 N -2.03 0.15 -0.21 0.64 -4.23 -0.56 -2.95 115.64 106.45 2x60 s THR 137 Ca 0.32 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.84 2x60 s THR 137 Cb -0.08 -2.51 0.05 0.00 1.34 0.00 0.00 72.50 71.30 2x60 s THR 137 CO 0.25 0.00 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.87 2x60 s PHE 138 N -3.73 2.53 -0.27 3.99 0.40 -1.12 -1.43 117.98 118.37 2x60 s PHE 138 Ca 0.38 -1.72 -0.10 0.00 -0.60 0.00 0.00 56.93 54.89 2x60 s PHE 138 Cb 0.05 -1.67 -0.05 0.00 0.51 0.00 0.00 43.02 41.86 2x60 s PHE 138 CO 0.19 -0.77 0.16 0.20 0.70 0.00 0.00 175.22 175.70 2x60 s GLY 139 N 1.35 1.91 -0.00 4.36 0.00 0.62 -2.43 107.32 113.12 2x60 s GLY 139 Ca -0.03 -1.06 -0.21 0.00 0.00 0.00 0.00 44.72 43.42 2x60 s GLY 139 CO -0.08 0.57 0.63 -0.42 0.00 0.00 0.00 173.10 173.81 2x60 s ILE 140 N 1.59 4.90 0.01 0.90 -1.09 0.61 -0.48 121.20 127.64 2x60 s ILE 140 Ca 0.07 1.31 -0.30 0.00 -2.23 0.00 0.00 60.65 59.50 2x60 s ILE 140 Cb -0.15 -3.96 -0.08 0.00 -1.58 0.00 0.00 42.46 36.69 2x60 s ILE 140 CO 0.08 0.39 1.79 -0.69 -1.23 0.00 0.00 174.94 175.28 2x60 s VAL 141 N -0.07 3.21 -0.12 2.92 1.01 -0.92 -0.03 120.40 126.41 2x60 s VAL 141 Ca 0.33 0.37 -0.29 0.00 0.00 0.00 0.00 61.98 62.38 2x60 s VAL 141 Cb -0.18 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.93 2x60 s VAL 141 CO 0.18 -0.03 1.39 -2.16 0.00 0.00 0.00 175.10 174.49 2x60 s PRO 142 N 3.90 4.22 0.16 2.72 0.04 -1.26 -4.88 135.00 139.90 2x60 s PRO 142 Ca 0.80 1.84 0.10 0.00 0.04 0.00 0.00 61.00 63.78 2x60 s PRO 142 Cb -0.39 -3.82 -0.12 0.00 0.04 0.00 0.00 34.50 30.21 2x60 s PRO 142 CO 0.35 -0.74 1.30 1.79 0.04 0.00 0.00 177.00 179.74 2x60 h THR 143 N 5.48 1.39 -4.26 1.26 1.35 -2.00 -3.47 112.91 112.66 2x60 h THR 143 Ca -0.31 -2.98 -0.18 0.00 -0.55 0.00 0.00 66.41 62.38 2x60 h THR 143 Cb 1.13 2.68 -0.13 0.00 -1.73 0.00 0.00 68.15 70.10 2x60 h THR 143 CO 0.96 0.79 -0.43 0.00 -0.25 0.00 0.00 175.52 176.59 2x60 s ARG 144 N -2.79 1.36 -1.27 4.72 1.70 -1.26 -5.08 118.95 116.32 2x60 s ARG 144 Ca 0.02 -1.51 -0.12 0.00 -0.47 0.00 0.00 55.73 53.65 2x60 s ARG 144 Cb 0.09 0.35 0.15 0.00 -0.57 0.00 0.00 34.95 34.97 2x60 s ARG 144 CO 0.80 -0.50 1.74 -0.35 -1.08 0.00 0.00 175.30 175.91 2x60 n PRO 145 N -0.33 3.46 -2.00 3.89 -0.04 -1.26 -4.99 135.00 133.73 2x60 n PRO 145 Ca 0.01 -3.56 -0.42 0.00 -0.04 0.00 0.00 63.50 59.49 2x60 n PRO 145 Cb 0.64 -3.02 -0.03 0.00 -0.04 0.00 0.00 33.50 31.05 2x60 n PRO 145 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2x60 s GLU 146 N 1.22 4.26 0.25 0.54 0.41 -1.26 -4.76 118.70 119.35 2x60 s GLU 146 Ca 0.42 2.30 0.13 0.00 -0.41 0.00 0.00 54.97 57.41 2x60 s GLU 146 Cb 0.05 -3.13 0.16 0.00 -1.78 0.00 0.00 34.13 29.44 2x60 s GLU 146 CO 0.00 -0.47 1.49 1.15 -0.49 0.00 0.00 175.26 176.94 2x60 h THR 147 N 3.70 1.24 -0.00 3.63 2.02 -1.93 -3.37 112.91 118.21 2x60 h THR 147 Ca -0.45 -2.43 0.00 0.00 0.77 0.00 0.00 66.41 64.30 2x60 h THR 147 Cb 1.21 2.40 0.00 0.00 -1.74 0.00 0.00 68.15 70.03 2x60 h THR 147 CO 0.82 0.64 -0.16 0.61 0.37 0.00 0.00 175.52 177.79 2x60 n GLY 148 N 0.88 -1.35 3.86 2.16 0.00 -1.26 -4.00 105.19 105.47 2x60 n GLY 148 Ca 0.00 -0.20 -0.22 0.00 0.00 0.00 0.00 46.02 45.61 2x60 n GLY 148 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x60 s TYR 149 N -2.92 3.19 0.33 1.61 2.02 -1.26 -4.89 117.35 115.43 2x60 s TYR 149 Ca 0.15 -0.08 -0.08 0.00 -0.37 0.00 0.00 57.07 56.69 2x60 s TYR 149 Cb 0.19 -1.45 -0.06 0.00 -0.40 0.00 0.00 41.96 40.24 2x60 s TYR 149 CO 0.57 0.50 0.65 0.20 -1.57 0.00 0.00 175.55 175.90 2x60 s GLY 150 N -3.83 1.98 0.23 0.71 0.00 -1.26 -3.28 107.32 101.87 2x60 s GLY 150 Ca 0.33 -0.34 0.11 0.00 0.00 0.00 0.00 44.72 44.82 2x60 s GLY 150 CO 0.26 -0.19 -0.17 -0.19 0.00 0.00 0.00 173.10 172.81 2x60 s TYR 151 N -2.15 2.40 -0.36 1.90 1.51 -1.13 -0.71 117.35 118.81 2x60 s TYR 151 Ca 0.48 -0.31 -0.02 0.00 -1.01 0.00 0.00 57.07 56.21 2x60 s TYR 151 Cb -0.11 -1.12 0.08 0.00 -0.11 0.00 0.00 41.96 40.71 2x60 s TYR 151 CO 0.28 0.59 0.11 0.42 -1.11 0.00 0.00 175.55 175.84 2x60 s ILE 152 N -2.05 3.10 -0.15 2.71 1.01 0.40 -1.09 121.20 125.14 2x60 s ILE 152 Ca 0.26 -1.78 -0.29 0.00 0.00 0.00 0.00 60.65 58.84 2x60 s ILE 152 Cb -0.07 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 2x60 s ILE 152 CO 0.14 -0.43 1.57 -0.70 0.00 0.00 0.00 174.94 175.51 2x60 s GLU 153 N 1.17 4.02 0.21 2.79 2.12 0.17 -2.61 118.70 126.57 2x60 s GLU 153 Ca 0.03 1.86 -0.32 0.00 0.36 0.00 0.00 54.97 56.90 2x60 s GLU 153 Cb -0.21 -3.97 -0.12 0.00 0.26 0.00 0.00 34.13 30.09 2x60 s GLU 153 CO -0.03 -1.02 1.69 0.42 -0.54 0.00 0.00 175.26 175.78 2x60 s ILE 154 N 4.46 2.09 0.00 -3.70 1.01 -1.05 -0.76 121.20 123.26 2x60 s ILE 154 Ca 0.69 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.41 2x60 s ILE 154 Cb -0.27 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.15 2x60 s ILE 154 CO 0.27 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.82 2x60 n GLY 155 N 3.76 1.92 3.70 6.18 0.00 0.42 -4.37 105.19 116.81 2x60 n GLY 155 Ca 0.15 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 43.94 2x60 n GLY 155 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x60 n GLU 156 N 0.00 2.38 -2.54 1.61 2.13 -1.24 -4.57 120.64 118.42 2x60 n GLU 156 Ca 0.00 0.85 -0.42 0.00 0.66 0.00 0.00 57.16 58.25 2x60 n GLU 156 Cb 0.00 -2.59 -0.03 0.00 0.27 0.00 0.00 31.44 29.09 2x60 n GLU 156 CO 0.00 0.00 0.00 -2.00 -0.41 0.00 0.00 177.13 174.72 2x60 s GLU 157 N -0.13 4.51 -0.08 5.31 2.12 -1.26 0.68 118.70 129.85 2x60 s GLU 157 Ca 0.69 1.65 0.12 0.00 0.36 0.00 0.00 54.97 57.78 2x60 s GLU 157 Cb -0.58 -3.37 -0.23 0.00 0.26 0.00 0.00 34.13 30.21 2x60 s GLU 157 CO 0.46 -0.11 0.53 1.28 -0.54 0.00 0.00 175.26 176.88 2x60 n LEU 158 N 3.55 0.87 -3.64 2.70 4.77 0.13 -4.90 117.00 120.48 2x60 n LEU 158 Ca 0.07 0.32 -0.04 0.00 -0.03 0.00 0.00 56.01 56.33 2x60 n LEU 158 Cb 0.48 0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.63 2x60 n LEU 158 CO 0.54 0.45 1.10 -0.70 -1.33 0.00 0.00 177.39 177.45 2x60 s GLU 159 N -2.58 0.13 -0.24 3.23 2.12 -1.02 -5.04 118.70 115.31 2x60 s GLU 159 Ca -0.07 0.10 -0.35 0.00 0.36 0.00 0.00 54.97 55.01 2x60 s GLU 159 Cb 0.08 0.06 -0.16 0.00 0.26 0.00 0.00 34.13 34.37 2x60 s GLU 159 CO 0.82 -0.03 1.10 -0.85 -0.54 0.00 0.00 175.26 175.76 2x60 n GLU 160 N 1.22 0.00 0.00 4.30 0.28 -1.26 0.79 120.64 125.97 2x60 n GLU 160 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.93 2x60 n GLU 160 Cb 0.58 -1.19 0.00 0.00 1.43 0.00 0.00 31.44 32.26 2x60 n GLU 160 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2x60 n GLY 161 N 2.37 2.84 3.36 -1.84 0.00 -1.26 -4.98 105.19 105.68 2x60 n GLY 161 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 2x60 n GLY 161 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x60 s VAL 162 N -1.47 3.17 0.03 1.61 1.01 0.24 -3.29 120.40 121.69 2x60 s VAL 162 Ca 0.00 -0.60 -0.03 0.00 0.00 0.00 0.00 61.98 61.35 2x60 s VAL 162 Cb 0.00 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.00 2x60 s VAL 162 CO 0.00 0.50 0.03 -1.00 0.00 0.00 0.00 175.10 174.63 2x60 s HIS 163 N 0.65 0.25 0.21 5.22 3.76 -1.10 -0.69 115.29 123.59 2x60 s HIS 163 Ca -0.06 -0.54 -0.31 0.00 -0.15 0.00 0.00 55.06 54.00 2x60 s HIS 163 Cb -0.15 -0.19 -0.11 0.00 1.11 0.00 0.00 32.58 33.24 2x60 s HIS 163 CO 0.02 -0.28 1.63 0.15 -0.85 0.00 0.00 174.74 175.42 2x60 s LYS 164 N -2.11 4.17 -0.32 1.40 1.02 0.21 -1.68 119.74 122.43 2x60 s LYS 164 Ca -0.10 2.50 -0.29 0.00 0.02 0.00 0.00 55.97 58.10 2x60 s LYS 164 Cb -0.05 -3.10 -0.01 0.00 -0.52 0.00 0.00 37.83 34.16 2x60 s LYS 164 CO -0.03 -0.66 1.59 0.08 -0.92 0.00 0.00 175.35 175.41 2x60 s VAL 165 N 0.88 3.72 0.29 3.17 1.01 0.24 0.16 120.40 129.87 2x60 s VAL 165 Ca 0.70 0.77 0.08 0.00 0.00 0.00 0.00 61.98 63.53 2x60 s VAL 165 Cb -0.47 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.06 2x60 s VAL 165 CO 0.35 -0.48 1.67 0.00 0.00 0.00 0.00 175.10 176.65 2x60 h ALA 166 N 11.29 1.07 -1.41 5.51 0.00 -1.15 -3.43 119.26 131.14 2x60 h ALA 166 Ca -0.31 -0.46 0.19 0.00 0.00 0.00 0.00 54.91 54.33 2x60 h ALA 166 Cb 1.14 -0.09 -0.23 0.00 0.00 0.00 0.00 17.79 18.62 2x60 h ALA 166 CO 1.04 0.64 0.76 -1.14 0.00 0.00 0.00 179.25 180.55 2x60 s GLN 167 N -3.95 0.34 -0.17 0.00 0.74 -1.12 -4.94 119.66 110.56 2x60 s GLN 167 Ca -0.03 -0.01 -0.05 0.00 0.05 0.00 0.00 55.36 55.31 2x60 s GLN 167 Cb 0.13 0.16 -0.03 0.00 1.10 0.00 0.00 33.01 34.37 2x60 s GLN 167 CO 0.77 -0.12 0.00 -0.06 -0.55 0.00 0.00 175.29 175.32 2x60 s PHE 168 N -1.65 3.10 0.48 1.67 0.08 -1.26 -0.66 117.98 119.75 2x60 s PHE 168 Ca 0.06 -0.19 0.03 0.00 0.12 0.00 0.00 56.93 56.96 2x60 s PHE 168 Cb -0.01 -2.01 -0.03 0.00 -0.57 0.00 0.00 43.02 40.40 2x60 s PHE 168 CO -0.04 0.01 0.05 1.03 -0.10 0.00 0.00 175.22 176.16 2x60 s ARG 169 N 0.43 2.14 0.15 0.44 0.52 -0.25 -4.99 118.95 117.39 2x60 s ARG 169 Ca -0.01 -2.26 -0.01 0.00 -0.52 0.00 0.00 55.73 52.93 2x60 s ARG 169 Cb -0.14 -1.63 -0.04 0.00 0.52 0.00 0.00 34.95 33.66 2x60 s ARG 169 CO 0.02 -0.28 0.06 -1.83 0.02 0.00 0.00 175.30 173.29 2x60 s GLU 170 N -3.87 1.01 0.00 3.54 -1.05 -1.26 -2.84 118.70 114.23 2x60 s GLU 170 Ca 0.18 -1.49 0.00 0.00 -0.15 0.00 0.00 54.97 53.51 2x60 s GLU 170 Cb 0.04 0.18 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 2x60 s GLU 170 CO 0.10 -0.27 0.00 0.36 0.95 0.00 0.00 175.26 176.39 2x60 n LYS 171 N -0.15 0.00 -2.57 -4.83 2.85 -1.21 -4.87 118.16 107.39 2x60 n LYS 171 Ca -0.04 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.90 2x60 n LYS 171 Cb 0.64 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.98 2x60 n LYS 171 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 2x60 s PRO 172 N 0.00 4.01 0.82 -1.58 0.01 -1.26 -5.05 135.00 131.95 2x60 s PRO 172 Ca 0.00 0.94 -0.12 0.00 0.01 0.00 0.00 61.00 61.83 2x60 s PRO 172 Cb 0.00 -2.18 0.09 0.00 0.01 0.00 0.00 34.50 32.42 2x60 s PRO 172 CO 0.00 -0.17 1.16 -0.51 0.01 0.00 0.00 177.00 177.48 2x60 s ASP 173 N -2.83 3.70 0.26 2.53 1.01 -1.26 -4.62 116.67 115.46 2x60 s ASP 173 Ca 0.59 2.19 -0.01 0.00 0.71 0.00 0.00 52.55 56.02 2x60 s ASP 173 Cb -0.10 -2.57 0.53 0.00 1.01 0.00 0.00 42.92 41.80 2x60 s ASP 173 CO 0.26 -2.59 1.75 0.25 0.21 0.00 0.00 175.17 175.05 2x60 h LEU 174 N -1.13 0.44 0.55 1.23 5.85 -1.96 0.66 115.31 120.96 2x60 h LEU 174 Ca -0.45 0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.36 2x60 h LEU 174 Cb 1.27 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 2x60 h LEU 174 CO 0.46 0.17 -0.47 -0.08 -0.34 0.00 0.00 178.44 178.18 2x60 h GLU 175 N 0.55 -0.97 -0.61 1.25 4.81 -1.96 -1.28 114.58 116.37 2x60 h GLU 175 Ca 0.46 0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.67 2x60 h GLU 175 Cb 0.69 0.22 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 2x60 h GLU 175 CO -0.39 -0.64 0.06 1.15 -0.73 0.00 0.00 179.01 178.45 2x60 h THR 176 N -1.00 1.26 -0.85 0.32 2.02 -1.45 -0.87 112.91 112.33 2x60 h THR 176 Ca -0.07 -1.06 -0.00 0.00 0.77 0.00 0.00 66.41 66.05 2x60 h THR 176 Cb 0.86 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.95 2x60 h THR 176 CO -0.02 0.39 0.52 0.00 0.37 0.00 0.00 175.52 176.79 2x60 h ALA 177 N 1.09 1.32 -0.32 6.16 0.00 0.18 -1.94 119.26 125.75 2x60 h ALA 177 Ca 0.18 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 2x60 h ALA 177 Cb 0.48 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2x60 h ALA 177 CO 0.02 0.59 0.12 0.87 0.00 0.00 0.00 179.25 180.86 2x60 h LYS 178 N 1.17 0.45 -0.41 0.00 1.57 0.05 -1.86 116.57 117.54 2x60 h LYS 178 Ca 0.31 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.91 2x60 h LYS 178 Cb -0.07 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2x60 h LYS 178 CO -0.06 0.38 -0.23 0.87 -0.57 0.00 0.00 179.45 179.84 2x60 h LYS 179 N 0.45 0.88 -0.40 3.15 1.57 -0.59 -2.33 116.57 119.31 2x60 h LYS 179 Ca 0.11 -0.40 -0.07 0.00 -1.87 0.00 0.00 60.65 58.43 2x60 h LYS 179 Cb 0.10 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 2x60 h LYS 179 CO -0.01 1.04 -0.01 0.74 -0.57 0.00 0.00 179.45 180.65 2x60 h PHE 180 N 0.70 0.77 -0.01 -1.35 0.04 -0.77 -2.79 116.94 113.54 2x60 h PHE 180 Ca 0.09 -0.14 -0.15 0.00 2.80 0.00 0.00 57.97 60.57 2x60 h PHE 180 Cb 0.80 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 38.73 2x60 h PHE 180 CO 0.06 0.79 -0.70 0.28 -0.60 0.00 0.00 178.31 178.14 2x60 h VAL 181 N 0.53 1.49 0.00 -0.55 2.07 -1.42 -3.17 116.25 115.20 2x60 h VAL 181 Ca 0.11 -2.36 -0.06 0.00 0.82 0.00 0.00 66.70 65.21 2x60 h VAL 181 Cb 0.49 2.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 2x60 h VAL 181 CO 0.02 0.68 -0.28 -0.08 0.02 0.00 0.00 177.57 177.93 2x60 h GLU 182 N 0.03 0.00 0.00 1.57 4.57 -1.33 -3.24 114.58 116.18 2x60 h GLU 182 Ca -0.01 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.99 2x60 h GLU 182 Cb 1.24 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.80 2x60 h GLU 182 CO 0.09 0.28 -0.98 0.66 -1.18 0.00 0.00 179.01 177.88 2x60 h SER 183 N 0.00 0.00 0.00 1.04 4.64 -1.47 -3.48 113.55 114.28 2x60 h SER 183 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2x60 h SER 183 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2x60 h SER 183 CO 0.04 0.77 0.00 0.61 -0.87 0.00 0.00 176.83 177.38 2x60 n GLY 184 N 1.34 0.82 1.13 -0.77 0.00 -1.22 -4.91 105.19 101.58 2x60 n GLY 184 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.96 2x60 n GLY 184 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x60 n ARG 185 N -2.20 1.93 -3.66 1.61 1.74 -1.26 -4.96 116.66 109.86 2x60 n ARG 185 Ca 0.00 -3.15 -0.17 0.00 -0.77 0.00 0.00 57.85 53.76 2x60 n ARG 185 Cb 0.01 -1.82 -0.16 0.00 -1.02 0.00 0.00 32.46 29.47 2x60 n ARG 185 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2x60 s PHE 186 N -3.21 -0.17 0.02 -1.55 0.40 -1.26 -2.53 117.98 109.69 2x60 s PHE 186 Ca 0.44 0.59 -0.00 0.00 -0.60 0.00 0.00 56.93 57.36 2x60 s PHE 186 Cb 0.40 -0.28 -0.04 0.00 0.51 0.00 0.00 43.02 43.61 2x60 s PHE 186 CO 0.01 -0.27 0.12 -0.51 0.70 0.00 0.00 175.22 175.26 2x60 s LEU 187 N 2.29 4.05 0.48 -0.37 1.43 -1.07 -4.57 118.68 120.92 2x60 s LEU 187 Ca 0.03 0.18 -0.23 0.00 -1.03 0.00 0.00 54.13 53.08 2x60 s LEU 187 Cb -0.12 -2.49 -0.07 0.00 0.03 0.00 0.00 46.19 43.55 2x60 s LEU 187 CO -0.06 0.24 1.28 0.26 0.23 0.00 0.00 176.35 178.30 2x60 s TRP 188 N -1.31 2.61 -0.68 0.29 0.51 0.96 -0.45 118.94 120.87 2x60 s TRP 188 Ca 0.27 1.43 -0.20 0.00 -2.12 0.00 0.00 56.10 55.48 2x60 s TRP 188 Cb -0.12 -3.63 0.10 0.00 -0.81 0.00 0.00 33.47 29.00 2x60 s TRP 188 CO 0.19 -2.24 0.89 1.21 -0.51 0.00 0.00 176.95 176.48 2x60 s ASN 189 N -1.04 6.26 0.59 2.95 2.47 0.11 -0.28 114.94 126.00 2x60 s ASN 189 Ca 0.65 -1.37 0.39 0.00 0.42 0.00 0.00 52.86 52.95 2x60 s ASN 189 Cb -0.36 -2.37 2.10 0.00 -1.45 0.00 0.00 41.25 39.18 2x60 s ASN 189 CO 0.44 -1.24 2.18 0.77 -3.72 0.00 0.00 177.10 175.53 2x60 h SER 190 N 9.27 0.00 0.00 -4.21 4.64 -1.81 -3.44 113.55 117.99 2x60 h SER 190 Ca -0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 2x60 h SER 190 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2x60 h SER 190 CO 1.13 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.70 2x60 n GLY 191 N -1.14 0.67 3.88 -0.77 0.00 -1.26 -4.96 105.19 101.62 2x60 n GLY 191 Ca -0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.65 2x60 n GLY 191 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2x60 s MET 192 N -0.15 3.63 0.03 1.61 -1.94 -1.26 -4.51 119.30 116.71 2x60 s MET 192 Ca 0.00 -0.00 -0.00 0.00 -1.71 0.00 0.00 55.69 53.97 2x60 s MET 192 Cb 0.00 -3.05 -0.03 0.00 2.01 0.00 0.00 34.83 33.76 2x60 s MET 192 CO 0.00 0.62 -0.03 -0.06 -0.01 0.00 0.00 175.02 175.54 2x60 s PHE 193 N -1.33 0.35 -0.02 -0.03 0.08 -0.82 -2.78 117.98 113.42 2x60 s PHE 193 Ca 0.29 -0.68 0.00 0.00 0.12 0.00 0.00 56.93 56.67 2x60 s PHE 193 Cb -0.13 -0.25 0.02 0.00 -0.57 0.00 0.00 43.02 42.09 2x60 s PHE 193 CO 0.17 -0.24 0.01 -1.17 -0.10 0.00 0.00 175.22 173.89 2x60 s LEU 194 N -1.88 1.24 0.09 -0.37 2.96 -1.15 0.95 118.68 120.52 2x60 s LEU 194 Ca -0.09 0.01 -0.25 0.00 -0.22 0.00 0.00 54.13 53.57 2x60 s LEU 194 Cb -0.05 -0.13 0.07 0.00 0.50 0.00 0.00 46.19 46.59 2x60 s LEU 194 CO -0.03 -0.10 0.65 -1.66 -1.32 0.00 0.00 176.35 173.88 2x60 s TRP 195 N 0.90 -0.55 0.32 5.38 -2.14 -0.54 -0.78 118.94 121.54 2x60 s TRP 195 Ca -0.08 0.52 -0.26 0.00 2.66 0.00 0.00 56.10 58.93 2x60 s TRP 195 Cb -0.12 0.52 -0.10 0.00 -3.10 0.00 0.00 33.47 30.68 2x60 s TRP 195 CO -0.02 -0.76 0.98 0.15 -2.66 0.00 0.00 176.95 174.63 2x60 s LYS 196 N -3.05 4.54 0.20 3.25 1.02 -1.26 0.11 119.74 124.55 2x60 s LYS 196 Ca -0.02 1.43 -0.10 0.00 0.02 0.00 0.00 55.97 57.30 2x60 s LYS 196 Cb -0.01 -2.84 0.14 0.00 -0.52 0.00 0.00 37.83 34.60 2x60 s LYS 196 CO -0.07 0.22 1.84 0.00 -0.92 0.00 0.00 175.35 176.43 2x60 h ALA 197 N 3.22 0.94 -0.22 5.17 0.00 -0.65 -2.23 119.26 125.48 2x60 h ALA 197 Ca -0.47 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.34 2x60 h ALA 197 Cb 1.20 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2x60 h ALA 197 CO 0.65 0.41 0.06 -0.09 0.00 0.00 0.00 179.25 180.28 2x60 h ARG 198 N 1.00 0.35 -0.30 0.00 2.43 -0.67 -2.94 114.38 114.25 2x60 h ARG 198 Ca 0.26 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 2x60 h ARG 198 Cb -0.03 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2x60 h ARG 198 CO -0.05 0.46 0.12 1.49 -1.51 0.00 0.00 179.97 180.48 2x60 h GLU 199 N 0.18 0.45 0.25 0.20 4.81 -1.68 -1.83 114.58 116.97 2x60 h GLU 199 Ca 0.07 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2x60 h GLU 199 Cb 0.26 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.53 2x60 h GLU 199 CO -0.00 0.47 -0.51 0.35 -0.73 0.00 0.00 179.01 178.58 2x60 h PHE 200 N 0.34 -1.46 -0.73 0.92 3.57 -1.44 -1.96 116.94 116.18 2x60 h PHE 200 Ca 0.10 0.03 0.16 0.00 3.53 0.00 0.00 57.97 61.80 2x60 h PHE 200 Cb 0.18 0.61 -0.12 0.00 2.79 0.00 0.00 35.95 39.40 2x60 h PHE 200 CO -0.01 -0.61 0.04 0.82 -2.23 0.00 0.00 178.31 176.32 2x60 h ILE 201 N -0.83 0.39 -0.95 1.41 2.04 -1.41 0.59 117.51 118.76 2x60 h ILE 201 Ca -0.03 -0.05 0.20 0.00 1.00 0.00 0.00 64.86 65.99 2x60 h ILE 201 Cb 0.79 0.25 -0.08 0.00 -0.74 0.00 0.00 36.82 37.03 2x60 h ILE 201 CO -0.20 0.02 0.61 -0.08 0.00 0.00 0.00 178.15 178.50 2x60 h GLU 202 N 0.13 0.52 -0.09 2.37 4.81 -0.91 -1.14 114.58 120.27 2x60 h GLU 202 Ca 0.40 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 59.41 2x60 h GLU 202 Cb 0.70 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.98 2x60 h GLU 202 CO -0.62 0.34 -0.68 0.93 -0.73 0.00 0.00 179.01 178.25 2x60 h GLU 203 N 0.53 0.62 -0.80 1.92 4.39 0.92 -2.93 114.58 119.23 2x60 h GLU 203 Ca 0.51 -0.55 0.02 0.00 0.34 0.00 0.00 59.36 59.69 2x60 h GLU 203 Cb 1.09 0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 29.83 2x60 h GLU 203 CO -0.25 1.17 0.52 0.28 -1.16 0.00 0.00 179.01 179.57 2x60 h VAL 204 N 0.27 1.15 -0.70 3.13 2.07 -0.53 0.87 116.25 122.51 2x60 h VAL 204 Ca -0.06 -0.35 0.18 0.00 0.82 0.00 0.00 66.70 67.29 2x60 h VAL 204 Cb 1.33 0.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 2x60 h VAL 204 CO 0.14 0.19 0.49 0.50 0.02 0.00 0.00 177.57 178.91 2x60 h LYS 205 N 1.03 0.12 0.04 1.57 3.64 -1.25 1.31 116.57 123.03 2x60 h LYS 205 Ca 0.31 -0.01 -0.36 0.00 -1.27 0.00 0.00 60.65 59.32 2x60 h LYS 205 Cb -0.03 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.71 2x60 h LYS 205 CO -0.10 0.08 -2.17 0.28 -2.27 0.00 0.00 179.45 175.27 2x60 n VAL 206 N -4.39 1.58 0.41 2.00 0.31 0.25 -4.26 118.33 114.23 2x60 n VAL 206 Ca 0.14 -0.70 0.09 0.00 -0.01 0.00 0.00 64.34 63.85 2x60 n VAL 206 Cb 0.69 -1.23 -0.12 0.00 -0.91 0.00 0.00 33.84 32.27 2x60 n VAL 206 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x60 n GLU 208 N -1.77 0.78 -0.36 0.00 4.07 0.45 -4.84 120.64 118.97 2x60 n GLU 208 Ca 0.00 -2.40 -0.00 0.00 -0.06 0.00 0.00 57.16 54.70 2x60 n GLU 208 Cb 0.37 -1.35 0.14 0.00 -0.06 0.00 0.00 31.44 30.54 2x60 n GLU 208 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 2x60 h PRO 209 N 3.87 1.24 -0.68 5.31 0.11 -1.70 -0.61 132.00 139.55 2x60 h PRO 209 Ca -0.05 -0.07 0.09 0.00 0.11 0.00 0.00 66.00 66.07 2x60 h PRO 209 Cb 0.98 -0.28 -0.10 0.00 0.11 0.00 0.00 31.00 31.71 2x60 h PRO 209 CO 0.37 0.82 -0.33 0.43 -0.21 0.00 0.00 178.00 179.09 2x60 n SER 210 N -4.41 -0.57 0.32 -2.05 7.64 -1.26 -0.38 113.62 112.90 2x60 n SER 210 Ca 0.13 1.20 -0.15 0.00 1.01 0.00 0.00 58.87 61.06 2x60 n SER 210 Cb 0.06 -0.22 -0.08 0.00 -1.01 0.00 0.00 64.21 62.96 2x60 n SER 210 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 2x60 h ILE 211 N 0.00 0.22 -0.49 0.44 2.04 -1.47 -3.34 117.51 114.91 2x60 h ILE 211 Ca 0.18 -0.33 0.05 0.00 1.00 0.00 0.00 64.86 65.76 2x60 h ILE 211 Cb 0.35 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 36.66 2x60 h ILE 211 CO -0.66 0.03 -0.33 0.22 0.00 0.00 0.00 178.15 177.41 2x60 h TYR 212 N -1.09 -1.05 -0.70 1.37 3.20 0.09 -2.25 116.97 116.55 2x60 h TYR 212 Ca -0.08 0.07 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 2x60 h TYR 212 Cb 0.68 0.52 -0.03 0.00 1.54 0.00 0.00 36.73 39.44 2x60 h TYR 212 CO 0.00 -0.22 0.33 0.93 -1.64 0.00 0.00 178.16 177.55 2x60 h GLU 213 N -0.05 1.00 0.00 1.82 4.39 -1.43 0.12 114.58 120.43 2x60 h GLU 213 Ca 0.08 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.64 2x60 h GLU 213 Cb 0.26 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 2x60 h GLU 213 CO -0.48 0.78 0.00 0.09 -1.16 0.00 0.00 179.01 178.24 2x60 n ASN 214 N -4.33 0.71 0.00 1.42 3.02 -0.90 -3.47 115.26 111.72 2x60 n ASN 214 Ca 0.07 0.61 0.00 0.00 -0.03 0.00 0.00 54.58 55.22 2x60 n ASN 214 Cb 0.14 -0.78 0.00 0.00 -0.61 0.00 0.00 39.78 38.53 2x60 n ASN 214 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2x60 n LEU 215 N -2.21 1.28 -0.17 3.41 4.77 -0.76 -4.72 117.00 118.61 2x60 n LEU 215 Ca 0.04 -1.28 -0.10 0.00 -0.03 0.00 0.00 56.01 54.64 2x60 n LEU 215 Cb 0.35 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.46 2x60 n LEU 215 CO 0.26 0.32 0.74 0.07 -1.33 0.00 0.00 177.39 177.45 2x60 h LYS 216 N 0.00 1.00 -0.01 3.23 2.10 -0.82 -3.20 116.57 118.87 2x60 h LYS 216 Ca 0.00 -0.38 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 2x60 h LYS 216 Cb 0.48 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.75 2x60 h LYS 216 CO 0.00 1.06 -0.22 -0.25 -2.00 0.00 0.00 179.45 178.04 2x60 n ASP 217 N -4.14 1.54 -4.74 7.07 8.00 -1.26 -5.00 116.55 118.02 2x60 n ASP 217 Ca 0.01 -1.27 -0.42 0.00 0.71 0.00 0.00 54.79 53.83 2x60 n ASP 217 Cb 0.41 0.38 -0.01 0.00 -0.02 0.00 0.00 41.12 41.88 2x60 n ASP 217 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2x60 n VAL 218 N -0.02 1.20 -2.80 2.53 0.31 -1.21 -4.98 118.33 113.36 2x60 n VAL 218 Ca 0.06 -0.30 -0.42 0.00 -0.01 0.00 0.00 64.34 63.66 2x60 n VAL 218 Cb 0.28 -1.90 -0.03 0.00 -0.91 0.00 0.00 33.84 31.28 2x60 n VAL 218 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2x60 s ASP 219 N 0.35 6.92 0.40 4.52 -1.08 -1.26 -4.95 116.67 121.56 2x60 s ASP 219 Ca 0.62 1.14 0.11 0.00 -0.52 0.00 0.00 52.55 53.90 2x60 s ASP 219 Cb -0.51 -2.48 0.91 0.00 -1.46 0.00 0.00 42.92 39.38 2x60 s ASP 219 CO 0.52 -0.60 1.95 -0.65 0.52 0.00 0.00 175.17 176.91 2x60 h PRO 220 N 7.64 0.55 0.00 4.34 0.11 -1.94 -2.10 132.00 140.61 2x60 h PRO 220 Ca -0.21 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.82 2x60 h PRO 220 Cb 1.08 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 2x60 h PRO 220 CO 0.92 0.36 -0.21 0.00 -0.21 0.00 0.00 178.00 178.87 2x60 h ARG 221 N 0.56 0.00 -6.07 1.05 3.08 -1.93 -3.42 114.38 107.66 2x60 h ARG 221 Ca 0.33 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.86 2x60 h ARG 221 Cb 0.52 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.53 2x60 h ARG 221 CO -0.11 0.21 1.31 -0.80 -1.07 0.00 0.00 179.97 179.51 2x60 s ASN 222 N -6.20 5.46 0.20 7.04 0.01 -0.79 -4.87 114.94 115.79 2x60 s ASN 222 Ca 0.03 0.42 -0.11 0.00 -0.71 0.00 0.00 52.86 52.49 2x60 s ASN 222 Cb 0.08 -2.53 0.13 0.00 0.41 0.00 0.00 41.25 39.33 2x60 s ASN 222 CO 0.66 -2.21 1.84 0.15 -1.51 0.00 0.00 177.10 176.04 2x60 h PHE 223 N 14.13 0.90 -0.04 2.20 3.57 -1.85 -1.82 116.94 134.04 2x60 h PHE 223 Ca -0.27 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.11 2x60 h PHE 223 Cb 1.15 -0.30 0.01 0.00 2.79 0.00 0.00 35.95 39.60 2x60 h PHE 223 CO 1.04 0.60 -0.45 1.49 -2.23 0.00 0.00 178.31 178.75 2x60 h GLU 224 N 0.94 0.39 -0.17 1.11 4.57 -1.95 0.20 114.58 119.67 2x60 h GLU 224 Ca 0.25 -0.36 0.05 0.00 -1.18 0.00 0.00 59.36 58.12 2x60 h GLU 224 Cb -0.05 0.09 -0.06 0.00 -0.16 0.00 0.00 28.75 28.57 2x60 h GLU 224 CO -0.05 1.01 -0.21 0.93 -1.18 0.00 0.00 179.01 179.52 2x60 h GLU 225 N -0.11 -0.24 -0.41 1.92 5.08 -1.90 0.12 114.58 119.03 2x60 h GLU 225 Ca -0.04 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2x60 h GLU 225 Cb 1.14 0.05 -0.07 0.00 0.50 0.00 0.00 28.75 30.37 2x60 h GLU 225 CO 0.09 -0.16 -0.04 1.25 -1.00 0.00 0.00 179.01 179.16 2x60 h LEU 226 N -0.25 -0.24 -0.01 1.33 5.85 -1.29 0.49 115.31 121.18 2x60 h LEU 226 Ca 0.11 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.97 2x60 h LEU 226 Cb 0.41 0.20 -0.05 0.00 0.37 0.00 0.00 40.66 41.60 2x60 h LEU 226 CO -0.31 -0.08 -0.26 0.50 -0.34 0.00 0.00 178.44 177.95 2x60 h LYS 227 N 0.07 -0.38 -0.64 1.25 3.64 0.42 0.53 116.57 121.46 2x60 h LYS 227 Ca 0.20 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 2x60 h LYS 227 Cb 0.30 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.17 2x60 h LYS 227 CO -0.37 -0.25 0.43 0.87 -2.27 0.00 0.00 179.45 177.85 2x60 h LYS 228 N -0.40 0.73 -0.48 1.90 1.57 -0.45 -2.11 116.57 117.34 2x60 h LYS 228 Ca 0.06 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.73 2x60 h LYS 228 Cb 0.48 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 2x60 h LYS 228 CO -0.23 0.49 0.02 0.00 -0.57 0.00 0.00 179.45 179.16 2x60 h ALA 229 N 1.63 0.64 -0.01 3.86 0.00 0.23 -3.13 119.26 122.47 2x60 h ALA 229 Ca 0.26 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.77 2x60 h ALA 229 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2x60 h ALA 229 CO -0.07 0.42 -0.62 1.88 0.00 0.00 0.00 179.25 180.86 2x60 h TYR 230 N 0.68 0.06 -0.90 0.00 -1.99 0.20 -2.65 116.97 112.37 2x60 h TYR 230 Ca 0.14 -0.02 0.26 0.00 2.00 0.00 0.00 58.73 61.10 2x60 h TYR 230 Cb 0.47 -0.01 -0.04 0.00 2.00 0.00 0.00 36.73 39.15 2x60 h TYR 230 CO 0.04 0.65 0.64 0.93 -0.00 0.00 0.00 178.16 180.41 2x60 h GLU 231 N 0.03 0.03 -0.55 4.88 4.39 -1.33 -1.88 114.58 120.16 2x60 h GLU 231 Ca -0.01 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2x60 h GLU 231 Cb 1.10 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.74 2x60 h GLU 231 CO 0.08 0.02 0.00 1.63 -1.16 0.00 0.00 179.01 179.58 2x60 n LYS 232 N -4.29 2.65 -5.21 2.33 4.76 -1.00 -5.00 118.16 112.39 2x60 n LYS 232 Ca 0.19 -2.40 -0.32 0.00 -2.87 0.00 0.00 58.31 52.91 2x60 n LYS 232 Cb 0.94 -1.48 -0.16 0.00 -1.84 0.00 0.00 35.03 32.50 2x60 n LYS 232 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2x60 s VAL 233 N -1.09 2.22 0.41 -0.18 1.01 -0.71 -4.86 120.40 117.19 2x60 s VAL 233 Ca 0.40 -1.02 -0.24 0.00 0.00 0.00 0.00 61.98 61.11 2x60 s VAL 233 Cb 0.21 -1.80 -0.09 0.00 0.00 0.00 0.00 36.38 34.70 2x60 s VAL 233 CO 0.28 0.57 1.08 -2.16 0.00 0.00 0.00 175.10 174.88 2x60 s PRO 234 N -0.34 4.10 -0.54 2.72 0.04 -1.26 -4.96 135.00 134.76 2x60 s PRO 234 Ca 0.02 1.59 -0.25 0.00 0.04 0.00 0.00 61.00 62.40 2x60 s PRO 234 Cb -0.12 -2.55 0.04 0.00 0.04 0.00 0.00 34.50 31.90 2x60 s PRO 234 CO 0.02 -0.22 0.98 0.45 0.04 0.00 0.00 177.00 178.28 2x60 s SER 235 N -1.47 6.39 -0.27 6.66 0.15 -1.26 -4.84 113.70 119.05 2x60 s SER 235 Ca 0.58 -0.19 -0.23 0.00 0.70 0.00 0.00 55.95 56.81 2x60 s SER 235 Cb -0.24 -2.46 0.07 0.00 -1.71 0.00 0.00 66.02 61.68 2x60 s SER 235 CO 0.30 -1.24 0.73 -0.51 1.20 0.00 0.00 173.24 173.72 2x60 s ILE 236 N 4.09 0.00 0.85 6.45 2.07 -0.67 -4.90 121.20 129.09 2x60 s ILE 236 Ca 0.34 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.47 2x60 s ILE 236 Cb -0.11 -1.00 0.10 0.00 0.13 0.00 0.00 42.46 41.58 2x60 s ILE 236 CO 0.22 0.00 1.10 -0.94 -1.91 0.00 0.00 174.94 173.41 2x60 s SER 237 N 0.59 3.76 0.47 4.50 1.04 -1.26 -2.82 113.70 119.97 2x60 s SER 237 Ca -0.02 1.87 0.16 0.00 0.48 0.00 0.00 55.95 58.43 2x60 s SER 237 Cb -0.05 -2.47 1.09 0.00 0.10 0.00 0.00 66.02 64.69 2x60 s SER 237 CO -0.03 -2.52 2.03 1.62 0.98 0.00 0.00 173.24 175.33 2x60 h VAL 238 N -1.46 1.07 0.55 5.02 3.04 -1.88 -0.21 116.25 122.36 2x60 h VAL 238 Ca -0.45 -0.48 -0.03 0.00 -1.01 0.00 0.00 66.70 64.74 2x60 h VAL 238 Cb 1.25 1.26 0.01 0.00 -2.01 0.00 0.00 31.29 31.80 2x60 h VAL 238 CO 0.49 0.14 -0.26 0.44 -1.01 0.00 0.00 177.57 177.36 2x60 h ASP 239 N 0.00 -0.62 0.05 3.17 3.32 -1.95 0.30 116.42 120.69 2x60 h ASP 239 Ca -0.00 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.01 2x60 h ASP 239 Cb 0.25 0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.96 2x60 h ASP 239 CO 0.02 -0.33 -0.02 1.88 -1.72 0.00 0.00 179.24 179.07 2x60 h TYR 240 N -0.91 -0.06 0.13 4.55 0.05 -1.93 -1.96 116.97 116.84 2x60 h TYR 240 Ca -0.07 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.70 2x60 h TYR 240 Cb 0.62 0.02 -0.01 0.00 1.01 0.00 0.00 36.73 38.37 2x60 h TYR 240 CO -0.01 0.31 -0.21 0.00 -1.05 0.00 0.00 178.16 177.20 2x60 h ALA 241 N 0.47 -0.83 0.00 3.88 0.00 -1.05 -3.40 119.26 118.33 2x60 h ALA 241 Ca -0.01 -0.06 -0.27 0.00 0.00 0.00 0.00 54.91 54.57 2x60 h ALA 241 Cb 0.40 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2x60 h ALA 241 CO 0.01 -0.86 -1.85 0.28 0.00 0.00 0.00 179.25 176.83 2x60 n VAL 242 N -3.63 1.43 -0.28 0.00 0.31 0.99 -4.64 118.33 112.51 2x60 n VAL 242 Ca -0.04 -0.16 -0.04 0.00 -0.01 0.00 0.00 64.34 64.09 2x60 n VAL 242 Cb 0.18 -2.01 0.11 0.00 -0.91 0.00 0.00 33.84 31.21 2x60 n VAL 242 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 2x60 h MET 243 N -0.91 1.16 -0.18 5.55 2.86 -1.18 -1.94 114.93 120.28 2x60 h MET 243 Ca -0.40 -0.17 -0.11 0.00 -2.06 0.00 0.00 59.70 56.96 2x60 h MET 243 Cb 1.32 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 2x60 h MET 243 CO -0.24 0.89 -0.37 1.49 1.06 0.00 0.00 176.91 179.74 2x60 h GLU 244 N 1.15 0.40 0.16 1.72 4.81 -1.56 -3.33 114.58 117.93 2x60 h GLU 244 Ca 0.28 -0.18 -0.27 0.00 -0.13 0.00 0.00 59.36 59.06 2x60 h GLU 244 Cb 0.11 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.50 2x60 h GLU 244 CO -0.04 0.71 -1.28 0.87 -0.73 0.00 0.00 179.01 178.55 2x60 h LYS 245 N 0.34 0.33 -7.31 1.92 1.57 -1.62 -3.46 116.57 108.34 2x60 h LYS 245 Ca 0.04 -0.57 -0.51 0.00 -1.87 0.00 0.00 60.65 57.74 2x60 h LYS 245 Cb 0.80 0.21 0.13 0.00 0.08 0.00 0.00 32.23 33.45 2x60 h LYS 245 CO 0.06 1.27 0.31 0.45 -0.57 0.00 0.00 179.45 180.98 2x60 s SER 246 N -7.14 4.45 -0.05 0.86 0.15 -0.85 -4.99 113.70 106.13 2x60 s SER 246 Ca -0.16 1.81 0.14 0.00 0.70 0.00 0.00 55.95 58.44 2x60 s SER 246 Cb 0.03 -2.51 0.43 0.00 -1.71 0.00 0.00 66.02 62.26 2x60 s SER 246 CO 0.83 -2.07 1.35 0.29 1.20 0.00 0.00 173.24 174.84 2x60 n LYS 247 N -3.55 2.98 -2.71 5.44 5.02 -1.26 -4.53 118.16 119.55 2x60 n LYS 247 Ca 0.09 -2.36 -0.06 0.00 -2.02 0.00 0.00 58.31 53.96 2x60 n LYS 247 Cb 0.53 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 34.09 2x60 n LYS 247 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2x60 n LYS 248 N 0.44 1.62 -3.22 1.97 5.02 -1.26 -5.05 118.16 117.68 2x60 n LYS 248 Ca 0.16 -3.47 -0.39 0.00 -2.02 0.00 0.00 58.31 52.60 2x60 n LYS 248 Cb 0.60 -1.51 -0.06 0.00 -0.02 0.00 0.00 35.03 34.04 2x60 n LYS 248 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2x60 s VAL 249 N -3.61 5.11 0.36 -0.18 1.01 -1.26 -0.13 120.40 121.69 2x60 s VAL 249 Ca 0.29 1.06 0.09 0.00 0.00 0.00 0.00 61.98 63.42 2x60 s VAL 249 Cb 0.39 -3.88 -0.07 0.00 0.00 0.00 0.00 36.38 32.82 2x60 s VAL 249 CO -0.01 0.22 -0.04 -0.13 0.00 0.00 0.00 175.10 175.13 2x60 s ARG 250 N 1.29 1.91 -0.02 2.72 0.52 0.20 -0.59 118.95 124.97 2x60 s ARG 250 Ca 0.27 -1.95 -0.03 0.00 -0.52 0.00 0.00 55.73 53.51 2x60 s ARG 250 Cb -0.16 -1.73 0.01 0.00 0.52 0.00 0.00 34.95 33.58 2x60 s ARG 250 CO 0.11 0.09 0.07 0.54 0.02 0.00 0.00 175.30 176.13 2x60 s VAL 251 N -2.62 0.01 0.01 3.52 0.11 -0.68 -1.49 120.40 119.27 2x60 s VAL 251 Ca 0.34 -0.07 0.04 0.00 -2.93 0.00 0.00 61.98 59.35 2x60 s VAL 251 Cb 0.04 -0.13 -0.03 0.00 -1.53 0.00 0.00 36.38 34.72 2x60 s VAL 251 CO 0.17 -0.04 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.14 2x60 s VAL 252 N -0.09 3.61 -0.14 2.04 1.01 -0.51 -2.70 120.40 123.62 2x60 s VAL 252 Ca -0.01 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.85 2x60 s VAL 252 Cb -0.01 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 2x60 s VAL 252 CO 0.00 0.36 0.98 -0.75 0.00 0.00 0.00 175.10 175.69 2x60 s LYS 253 N -1.50 4.37 -0.33 2.72 2.20 -1.21 -0.28 119.74 125.71 2x60 s LYS 253 Ca 0.18 1.32 -0.12 0.00 -0.36 0.00 0.00 55.97 56.98 2x60 s LYS 253 Cb -0.11 -3.56 -0.02 0.00 -1.51 0.00 0.00 37.83 32.63 2x60 s LYS 253 CO 0.08 -0.37 0.22 0.00 -0.36 0.00 0.00 175.35 174.92 2x60 s ALA 254 N 2.23 3.46 -0.70 3.13 0.00 0.37 -4.89 121.76 125.36 2x60 s ALA 254 Ca 0.46 -1.35 0.23 0.00 0.00 0.00 0.00 51.96 51.30 2x60 s ALA 254 Cb -0.17 -2.59 0.13 0.00 0.00 0.00 0.00 23.12 20.49 2x60 s ALA 254 CO 0.15 -0.91 1.11 -3.47 0.00 0.00 0.00 175.76 172.63 2x60 n ASP 255 N 5.08 0.63 -4.66 0.00 2.03 -1.26 -2.17 116.55 116.19 2x60 n ASP 255 Ca -0.13 -0.23 -0.29 0.00 0.52 0.00 0.00 54.79 54.66 2x60 n ASP 255 Cb 0.50 0.65 0.17 0.00 -0.72 0.00 0.00 41.12 41.72 2x60 n ASP 255 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 2x60 s PHE 256 N -3.15 2.04 0.04 -0.67 -0.12 -1.26 -4.93 117.98 109.91 2x60 s PHE 256 Ca 0.05 1.25 -0.30 0.00 -0.05 0.00 0.00 56.93 57.88 2x60 s PHE 256 Cb 0.15 -3.18 -0.05 0.00 -0.63 0.00 0.00 43.02 39.31 2x60 s PHE 256 CO 0.78 -2.80 1.14 -2.00 -0.05 0.00 0.00 175.22 172.30 2x60 s GLU 257 N -4.83 4.46 0.03 1.99 2.56 -1.26 -4.89 118.70 116.76 2x60 s GLU 257 Ca 0.65 1.67 0.01 0.00 0.00 0.00 0.00 54.97 57.31 2x60 s GLU 257 Cb -0.20 -3.39 -0.02 0.00 2.00 0.00 0.00 34.13 32.52 2x60 s GLU 257 CO 0.59 -0.22 -0.06 -0.46 -0.56 0.00 0.00 175.26 174.54 2x60 s TRP 258 N 1.15 0.52 -0.11 5.30 -0.00 -1.26 -4.37 118.94 120.18 2x60 s TRP 258 Ca 0.57 -0.48 -0.13 0.00 -0.00 0.00 0.00 56.10 56.06 2x60 s TRP 258 Cb -0.27 -0.33 0.03 0.00 -0.00 0.00 0.00 33.47 32.91 2x60 s TRP 258 CO 0.28 -0.11 0.35 0.45 -0.00 0.00 0.00 176.95 177.92 2x60 s SER 259 N -1.44 -0.34 -0.17 5.86 0.15 -0.98 -4.99 113.70 111.79 2x60 s SER 259 Ca -0.11 0.59 -0.07 0.00 0.70 0.00 0.00 55.95 57.06 2x60 s SER 259 Cb -0.09 0.64 -0.04 0.00 -1.71 0.00 0.00 66.02 64.82 2x60 s SER 259 CO -0.00 -0.19 0.07 -0.62 1.20 0.00 0.00 173.24 173.69 2x60 s ASP 260 N -0.14 5.69 -1.29 5.45 2.15 -1.26 -2.21 116.67 125.05 2x60 s ASP 260 Ca -0.03 0.12 -0.10 0.00 0.43 0.00 0.00 52.55 52.98 2x60 s ASP 260 Cb -0.03 -1.94 0.16 0.00 -0.30 0.00 0.00 42.92 40.81 2x60 s ASP 260 CO 0.01 0.21 1.89 0.18 -0.17 0.00 0.00 175.17 177.29 2x60 n LEU 261 N 3.31 6.66 -0.04 -1.34 7.99 -0.87 -4.66 117.00 128.04 2x60 n LEU 261 Ca -0.17 -4.63 -0.12 0.00 -0.01 0.00 0.00 56.01 51.08 2x60 n LEU 261 Cb 0.52 -1.49 -0.14 0.00 -0.11 0.00 0.00 43.42 42.21 2x60 n LEU 261 CO 0.35 1.37 -0.79 0.61 -1.51 0.00 0.00 177.39 177.42 2x60 n GLY 262 N 2.85 -0.87 0.91 -0.72 0.00 -1.26 -5.01 105.19 101.09 2x60 n GLY 262 Ca 0.40 -0.16 -0.03 0.00 0.00 0.00 0.00 46.02 46.23 2x60 n GLY 262 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2x60 n ASN 263 N -3.07 -0.48 0.24 1.61 0.23 -1.26 -4.78 115.26 107.74 2x60 n ASN 263 Ca -0.26 -1.44 0.11 0.00 -0.53 0.00 0.00 54.58 52.47 2x60 n ASN 263 Cb 1.07 0.83 0.56 0.00 -2.08 0.00 0.00 39.78 40.16 2x60 n ASN 263 CO 0.00 0.00 0.00 -0.50 -0.93 0.00 0.00 177.26 175.83 2x60 h TRP 264 N 1.25 0.00 -0.35 -2.53 4.06 -1.85 -2.09 115.95 114.44 2x60 h TRP 264 Ca -0.08 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.84 2x60 h TRP 264 Cb 0.31 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.45 2x60 h TRP 264 CO 0.00 0.19 0.07 1.03 -3.56 0.00 0.00 178.44 176.17 2x60 h SER 265 N 0.00 0.48 -0.38 -3.49 0.87 -1.95 -2.68 113.55 106.40 2x60 h SER 265 Ca -0.00 -0.07 0.03 0.00 -1.23 0.00 0.00 61.79 60.51 2x60 h SER 265 Cb 0.60 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.40 2x60 h SER 265 CO 0.02 0.50 0.20 0.28 -0.53 0.00 0.00 176.83 177.30 2x60 h SER 266 N 0.51 0.30 -0.42 6.23 0.02 -1.67 0.39 113.55 118.91 2x60 h SER 266 Ca 0.12 0.01 0.05 0.00 -0.84 0.00 0.00 61.79 61.14 2x60 h SER 266 Cb 0.22 -0.04 -0.05 0.00 0.14 0.00 0.00 62.40 62.67 2x60 h SER 266 CO -0.00 0.22 0.14 0.58 -1.14 0.00 0.00 176.83 176.63 2x60 h VAL 267 N 0.41 0.86 -0.47 2.27 2.07 -1.61 -2.73 116.25 117.05 2x60 h VAL 267 Ca 0.16 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.61 2x60 h VAL 267 Cb 0.05 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.32 2x60 h VAL 267 CO -0.10 0.05 0.25 -0.09 0.02 0.00 0.00 177.57 177.71 2x60 h ARG 268 N 0.30 0.49 -0.92 1.57 1.12 -0.92 -0.41 114.38 115.61 2x60 h ARG 268 Ca 0.20 -0.03 0.21 0.00 -1.11 0.00 0.00 59.98 59.25 2x60 h ARG 268 Cb 0.19 -0.11 -0.07 0.00 -0.01 0.00 0.00 29.97 29.97 2x60 h ARG 268 CO -0.21 0.32 0.61 1.49 -3.11 0.00 0.00 179.97 179.08 2x60 h GLU 269 N 0.51 0.38 0.00 0.20 4.57 -0.05 0.74 114.58 120.94 2x60 h GLU 269 Ca 0.20 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.35 2x60 h GLU 269 Cb 0.07 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.58 2x60 h GLU 269 CO -0.12 0.25 -0.15 0.82 -1.18 0.00 0.00 179.01 178.64 2x60 h ILE 270 N 0.39 0.19 0.00 2.32 1.08 -1.10 -3.38 117.51 117.02 2x60 h ILE 270 Ca 0.48 -1.16 -0.03 0.00 -0.39 0.00 0.00 64.86 63.76 2x60 h ILE 270 Cb 1.23 0.38 -0.00 0.00 -3.07 0.00 0.00 36.82 35.35 2x60 h ILE 270 CO -0.18 0.07 -0.14 -0.33 -0.69 0.00 0.00 178.15 176.87 2x60 h GLU 271 N -1.00 0.00 0.00 2.37 4.39 -1.00 -3.50 114.58 115.84 2x60 h GLU 271 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 2x60 h GLU 271 Cb 0.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 2x60 h GLU 271 CO -0.01 0.14 0.00 0.41 -1.16 0.00 0.00 179.01 178.39 2x60 n GLY 272 N -0.24 -1.38 3.77 -3.84 0.00 0.26 -4.91 105.19 98.83 2x60 n GLY 272 Ca -0.01 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.04 2x60 n GLY 272 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x60 s TYR 273 N -2.08 2.74 0.26 1.61 2.02 -1.26 -4.77 117.35 115.87 2x60 s TYR 273 Ca 0.00 1.43 -0.29 0.00 -0.37 0.00 0.00 57.07 57.84 2x60 s TYR 273 Cb 0.00 -3.63 -0.09 0.00 -0.40 0.00 0.00 41.96 37.84 2x60 s TYR 273 CO 0.00 -2.10 0.98 0.99 -1.57 0.00 0.00 175.55 173.85 2x60 s THR 274 N -1.33 3.95 0.23 -0.71 2.01 0.11 -4.95 115.64 114.95 2x60 s THR 274 Ca 0.61 1.92 0.07 0.00 0.31 0.00 0.00 61.69 64.60 2x60 s THR 274 Cb -0.36 -4.20 -0.04 0.00 0.01 0.00 0.00 72.50 67.91 2x60 s THR 274 CO 0.46 0.42 0.16 -1.83 -0.69 0.00 0.00 174.62 173.14 2x60 s GLU 275 N -1.36 2.85 0.38 4.92 1.03 -1.26 -4.62 118.70 120.65 2x60 s GLU 275 Ca 0.43 -1.05 -0.28 0.00 0.03 0.00 0.00 54.97 54.10 2x60 s GLU 275 Cb -0.26 -2.54 -0.11 0.00 -0.80 0.00 0.00 34.13 30.42 2x60 s GLU 275 CO 0.33 0.42 1.45 0.39 -1.33 0.00 0.00 175.26 176.51 2x60 n GLU 276 N -0.96 2.52 -0.91 -4.83 1.02 -1.26 -4.79 120.64 111.42 2x60 n GLU 276 Ca -0.08 0.89 0.00 0.00 -0.02 0.00 0.00 57.16 57.95 2x60 n GLU 276 Cb 0.57 -2.61 0.00 0.00 -0.02 0.00 0.00 31.44 29.38 2x60 n GLU 276 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2x60 n SER 277 N 0.40 0.00 0.29 1.62 3.41 -0.89 -4.97 113.62 113.48 2x60 n SER 277 Ca 0.02 -0.63 0.16 0.00 -0.26 0.00 0.00 58.87 58.17 2x60 n SER 277 Cb 0.39 0.00 0.84 0.00 -0.26 0.00 0.00 64.21 65.18 2x60 n SER 277 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2x60 h ASP 278 N 0.00 0.00 0.00 4.04 3.32 -2.02 -3.31 116.42 118.45 2x60 h ASP 278 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2x60 h ASP 278 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2x60 h ASP 278 CO 0.00 0.06 -1.47 -0.62 -1.72 0.00 0.00 179.24 175.49 2x60 n GLU 279 N -3.43 0.40 -3.64 3.56 1.02 -1.26 -4.86 120.64 112.42 2x60 n GLU 279 Ca -0.02 -0.09 -0.40 0.00 -0.02 0.00 0.00 57.16 56.64 2x60 n GLU 279 Cb 0.20 -1.24 -0.11 0.00 -0.02 0.00 0.00 31.44 30.27 2x60 n GLU 279 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2x60 s VAL 280 N -2.69 4.16 -0.28 2.62 1.01 -1.25 0.94 120.40 124.91 2x60 s VAL 280 Ca -0.04 -1.26 -0.11 0.00 0.00 0.00 0.00 61.98 60.57 2x60 s VAL 280 Cb 0.06 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2x60 s VAL 280 CO 0.42 -0.39 0.18 -0.63 0.00 0.00 0.00 175.10 174.68 2x60 s ILE 281 N 1.43 5.15 -0.09 2.22 -1.09 0.33 -2.09 121.20 127.07 2x60 s ILE 281 Ca 0.02 0.07 -0.00 0.00 -2.23 0.00 0.00 60.65 58.51 2x60 s ILE 281 Cb -0.21 -3.48 -0.03 0.00 -1.58 0.00 0.00 42.46 37.16 2x60 s ILE 281 CO 0.03 0.23 -0.07 -0.76 -1.23 0.00 0.00 174.94 173.14 2x60 s LEU 282 N 1.73 3.15 -0.16 2.97 1.43 -1.26 -0.29 118.68 126.26 2x60 s LEU 282 Ca 0.07 -0.06 -0.04 0.00 -1.03 0.00 0.00 54.13 53.07 2x60 s LEU 282 Cb -0.16 -1.70 0.07 0.00 0.03 0.00 0.00 46.19 44.42 2x60 s LEU 282 CO 0.10 0.32 0.14 -0.69 0.23 0.00 0.00 176.35 176.44 2x60 s VAL 283 N -0.53 -0.19 -1.48 -1.59 1.01 -0.30 -4.83 120.40 112.50 2x60 s VAL 283 Ca 0.08 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.00 2x60 s VAL 283 Cb -0.12 -0.53 0.03 0.00 0.00 0.00 0.00 36.38 35.76 2x60 s VAL 283 CO 0.02 -0.15 0.45 0.47 0.00 0.00 0.00 175.10 175.88 2x60 n ASP 284 N 5.30 -0.78 -3.81 3.32 8.00 -1.26 -0.74 116.55 126.58 2x60 n ASP 284 Ca -0.06 -1.03 -0.23 0.00 0.71 0.00 0.00 54.79 54.18 2x60 n ASP 284 Cb 0.49 -2.86 -0.17 0.00 -0.02 0.00 0.00 41.12 38.56 2x60 n ASP 284 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2x60 s SER 285 N -4.16 1.54 0.36 -2.24 0.01 -1.26 -2.70 113.70 105.25 2x60 s SER 285 Ca 0.15 -0.12 0.08 0.00 1.31 0.00 0.00 55.95 57.37 2x60 s SER 285 Cb -0.08 -0.49 -0.05 0.00 0.21 0.00 0.00 66.02 65.60 2x60 s SER 285 CO 0.91 -0.16 0.06 -1.81 0.41 0.00 0.00 173.24 172.64 2x60 s ASP 286 N 1.75 4.25 -0.44 2.44 1.01 -1.25 -4.85 116.67 119.58 2x60 s ASP 286 Ca 0.02 -1.02 -0.24 0.00 0.71 0.00 0.00 52.55 52.02 2x60 s ASP 286 Cb -0.13 -0.53 0.04 0.00 1.01 0.00 0.00 42.92 43.31 2x60 s ASP 286 CO -0.05 -0.32 0.53 0.54 0.21 0.00 0.00 175.17 176.08 2x60 n ARG 287 N -1.03 -1.48 -4.25 8.23 1.74 -1.26 -2.17 116.66 116.44 2x60 n ARG 287 Ca -0.04 1.01 -0.20 0.00 -0.77 0.00 0.00 57.85 57.85 2x60 n ARG 287 Cb 0.63 -1.66 -0.12 0.00 -1.02 0.00 0.00 32.46 30.29 2x60 n ARG 287 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2x60 s VAL 288 N -1.60 1.23 -0.14 1.55 1.01 -1.26 -1.29 120.40 119.91 2x60 s VAL 288 Ca 0.23 -1.27 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2x60 s VAL 288 Cb -0.02 -1.15 0.02 0.00 0.00 0.00 0.00 36.38 35.23 2x60 s VAL 288 CO 0.72 -0.13 -0.14 0.12 0.00 0.00 0.00 175.10 175.67 2x60 s PHE 289 N -1.14 2.12 -0.09 5.22 5.36 -0.35 0.06 117.98 129.16 2x60 s PHE 289 Ca 0.01 -1.14 -0.00 0.00 -0.96 0.00 0.00 56.93 54.83 2x60 s PHE 289 Cb -0.09 -1.55 0.02 0.00 -0.34 0.00 0.00 43.02 41.06 2x60 s PHE 289 CO 0.02 -0.62 -0.06 0.08 -1.46 0.00 0.00 175.22 173.18 2x60 s VAL 290 N 1.36 0.84 -0.38 3.12 1.01 -1.26 0.54 120.40 125.64 2x60 s VAL 290 Ca 0.02 -0.21 -0.05 0.00 0.00 0.00 0.00 61.98 61.74 2x60 s VAL 290 Cb -0.13 -0.88 0.07 0.00 0.00 0.00 0.00 36.38 35.45 2x60 s VAL 290 CO -0.08 0.33 0.16 -0.75 0.00 0.00 0.00 175.10 174.75 2x60 s LYS 291 N 1.50 2.40 0.57 2.72 2.20 1.00 -4.98 119.74 125.14 2x60 s LYS 291 Ca -0.00 -1.47 -0.11 0.00 -0.36 0.00 0.00 55.97 54.03 2x60 s LYS 291 Cb -0.13 -3.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.60 2x60 s LYS 291 CO -0.05 -0.86 0.96 0.95 -0.36 0.00 0.00 175.35 175.99 2x60 s THR 292 N 1.30 4.73 -0.53 3.43 -4.23 -1.26 -0.98 115.64 118.11 2x60 s THR 292 Ca 0.02 0.78 0.06 0.00 -1.18 0.00 0.00 61.69 61.37 2x60 s THR 292 Cb -0.22 -3.84 0.23 0.00 1.34 0.00 0.00 72.50 70.02 2x60 s THR 292 CO -0.00 -1.00 0.60 1.57 -0.54 0.00 0.00 174.62 175.25 2x60 n HIS 293 N -2.43 1.63 -1.93 3.99 -0.00 -1.26 -4.81 115.22 110.42 2x60 n HIS 293 Ca 0.05 -3.86 -0.21 0.00 0.46 0.00 0.00 57.72 54.16 2x60 n HIS 293 Cb 0.54 -0.41 -0.06 0.00 -0.12 0.00 0.00 29.99 29.95 2x60 n HIS 293 CO 0.00 0.00 0.00 0.09 0.46 0.00 0.00 176.34 176.89 2x60 n ASN 294 N 1.36 -5.67 -3.75 0.26 3.02 -1.26 -4.96 115.26 104.26 2x60 n ASN 294 Ca 0.26 0.30 -0.13 0.00 -0.03 0.00 0.00 54.58 54.97 2x60 n ASN 294 Cb 0.46 -4.88 -0.10 0.00 -0.61 0.00 0.00 39.78 34.65 2x60 n ASN 294 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2x60 s LYS 295 N -4.30 0.50 0.50 3.52 -2.85 -1.26 -5.16 119.74 110.70 2x60 s LYS 295 Ca 0.00 0.25 -0.23 0.00 -1.00 0.00 0.00 55.97 54.99 2x60 s LYS 295 Cb 0.00 0.24 -0.06 0.00 -2.06 0.00 0.00 37.83 35.94 2x60 s LYS 295 CO 0.00 -0.10 1.37 -1.25 0.10 0.00 0.00 175.35 175.47 2x60 s PRO 296 N -0.35 3.40 -0.14 1.78 0.04 -1.26 -4.93 135.00 133.54 2x60 s PRO 296 Ca -0.05 2.27 0.01 0.00 0.04 0.00 0.00 61.00 63.27 2x60 s PRO 296 Cb -0.03 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 32.10 2x60 s PRO 296 CO 0.02 -0.99 -0.16 0.42 0.04 0.00 0.00 177.00 176.32 2x60 s ILE 297 N -1.28 1.67 -0.16 0.56 1.01 0.27 -5.01 121.20 118.25 2x60 s ILE 297 Ca 0.67 -0.71 -0.05 0.00 0.00 0.00 0.00 60.65 60.56 2x60 s ILE 297 Cb -0.41 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 2x60 s ILE 297 CO 0.50 0.48 -0.01 0.00 0.00 0.00 0.00 174.94 175.90 2x60 s ALA 298 N 1.27 3.08 -0.17 9.38 0.00 -1.26 -0.52 121.76 133.54 2x60 s ALA 298 Ca 0.01 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 2x60 s ALA 298 Cb -0.14 -1.64 -0.00 0.00 0.00 0.00 0.00 23.12 21.34 2x60 s ALA 298 CO -0.08 0.18 -0.13 0.08 0.00 0.00 0.00 175.76 175.81 2x60 s VAL 299 N 0.41 2.80 -0.15 0.00 1.01 0.60 -4.95 120.40 120.11 2x60 s VAL 299 Ca -0.02 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.25 2x60 s VAL 299 Cb -0.14 -2.21 0.03 0.00 0.00 0.00 0.00 36.38 34.06 2x60 s VAL 299 CO 0.02 0.50 -0.13 -0.69 0.00 0.00 0.00 175.10 174.80 2x60 s VAL 300 N 1.02 1.56 -0.64 2.92 1.01 -1.26 -1.15 120.40 123.86 2x60 s VAL 300 Ca -0.01 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2x60 s VAL 300 Cb -0.15 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.74 2x60 s VAL 300 CO -0.03 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.10 2x60 n GLY 301 N 4.77 0.33 2.87 4.51 0.00 0.08 -4.99 105.19 112.76 2x60 n GLY 301 Ca -0.16 -0.64 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 2x60 n GLY 301 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x60 s LEU 302 N -1.87 1.12 0.19 0.99 1.43 -1.22 -4.97 118.68 114.37 2x60 s LEU 302 Ca 0.00 -0.16 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 2x60 s LEU 302 Cb 0.00 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 45.64 2x60 s LEU 302 CO 0.00 -0.10 0.12 -0.44 0.23 0.00 0.00 176.35 176.16 2x60 s SER 303 N 1.31 5.32 -1.27 2.29 0.01 -1.26 -3.76 113.70 116.34 2x60 s SER 303 Ca -0.04 -0.24 -0.05 0.00 1.31 0.00 0.00 55.95 56.93 2x60 s SER 303 Cb -0.14 -1.32 -0.01 0.00 0.21 0.00 0.00 66.02 64.77 2x60 s SER 303 CO -0.02 0.04 0.69 0.47 0.41 0.00 0.00 173.24 174.83 2x60 n ASP 304 N -0.54 -2.27 -4.30 2.44 8.00 -0.41 -4.91 116.55 114.57 2x60 n ASP 304 Ca -0.08 -0.88 -0.24 0.00 0.71 0.00 0.00 54.79 54.29 2x60 n ASP 304 Cb 0.56 -3.84 -0.12 0.00 -0.02 0.00 0.00 41.12 37.69 2x60 n ASP 304 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2x60 s VAL 305 N -3.66 1.76 -0.13 2.53 -7.23 -1.24 -0.99 120.40 111.45 2x60 s VAL 305 Ca 0.13 -1.60 -0.04 0.00 -1.81 0.00 0.00 61.98 58.66 2x60 s VAL 305 Cb -0.04 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.25 2x60 s VAL 305 CO 0.83 -0.08 0.01 -0.63 -0.31 0.00 0.00 175.10 174.93 2x60 s ILE 306 N -1.25 4.39 -0.11 -0.62 -1.09 0.25 -1.21 121.20 121.56 2x60 s ILE 306 Ca 0.08 -0.19 0.00 0.00 -2.23 0.00 0.00 60.65 58.31 2x60 s ILE 306 Cb -0.10 -2.91 0.02 0.00 -1.58 0.00 0.00 42.46 37.90 2x60 s ILE 306 CO 0.05 0.53 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.51 2x60 s VAL 307 N -0.18 1.12 -0.13 2.92 1.01 0.19 -0.27 120.40 125.04 2x60 s VAL 307 Ca 0.06 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.69 2x60 s VAL 307 Cb -0.12 -1.10 0.02 0.00 0.00 0.00 0.00 36.38 35.17 2x60 s VAL 307 CO 0.02 0.38 -0.17 -0.63 0.00 0.00 0.00 175.10 174.69 2x60 s ILE 308 N 1.52 1.74 -0.11 2.22 -1.09 -0.73 -0.00 121.20 124.75 2x60 s ILE 308 Ca 0.02 -0.77 0.01 0.00 -2.23 0.00 0.00 60.65 57.68 2x60 s ILE 308 Cb -0.13 -1.58 -0.02 0.00 -1.58 0.00 0.00 42.46 39.16 2x60 s ILE 308 CO -0.07 0.49 -0.13 -0.62 -1.23 0.00 0.00 174.94 173.38 2x60 s ASP 309 N 1.08 4.02 0.25 3.58 2.15 -0.15 -1.34 116.67 126.25 2x60 s ASP 309 Ca -0.03 -0.29 -0.09 0.00 0.43 0.00 0.00 52.55 52.57 2x60 s ASP 309 Cb -0.14 -1.42 -0.01 0.00 -0.30 0.00 0.00 42.92 41.04 2x60 s ASP 309 CO -0.05 0.21 0.40 0.42 -0.17 0.00 0.00 175.17 175.98 2x60 s THR 310 N 0.08 0.00 0.53 1.71 -4.23 -0.79 -4.10 115.64 108.84 2x60 s THR 310 Ca -0.05 -1.57 0.28 0.00 -1.18 0.00 0.00 61.69 59.17 2x60 s THR 310 Cb -0.15 -2.33 0.33 0.00 1.34 0.00 0.00 72.50 71.70 2x60 s THR 310 CO 0.04 0.00 2.19 -0.65 -0.54 0.00 0.00 174.62 175.66 2x60 h PRO 311 N 2.33 0.00 0.00 3.99 0.11 -1.97 -2.99 132.00 133.47 2x60 h PRO 311 Ca -0.29 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 2x60 h PRO 311 Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 2x60 h PRO 311 CO 0.40 0.04 -0.26 -0.91 -0.21 0.00 0.00 178.00 177.07 2x60 h ASN 312 N 0.00 0.00 -0.38 -2.05 2.35 -1.96 -3.49 115.58 110.04 2x60 h ASN 312 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2x60 h ASN 312 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 2x60 h ASN 312 CO 0.01 0.25 0.00 0.61 -1.65 0.00 0.00 177.43 176.65 2x60 n GLY 313 N 1.16 1.35 3.25 2.83 0.00 -1.13 -5.03 105.19 107.62 2x60 n GLY 313 Ca 0.03 -1.22 -0.32 0.00 0.00 0.00 0.00 46.02 44.50 2x60 n GLY 313 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2x60 s ILE 314 N -1.97 2.33 -0.12 -0.61 1.01 -1.26 -1.88 121.20 118.69 2x60 s ILE 314 Ca 0.00 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 59.70 2x60 s ILE 314 Cb 0.00 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.51 2x60 s ILE 314 CO 0.00 0.55 -0.00 -0.22 0.00 0.00 0.00 174.94 175.26 2x60 s LEU 315 N 0.45 3.50 -0.23 2.97 2.96 -0.45 -4.99 118.68 122.89 2x60 s LEU 315 Ca -0.14 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.82 2x60 s LEU 315 Cb -0.17 -1.83 0.06 0.00 0.50 0.00 0.00 46.19 44.75 2x60 s LEU 315 CO 0.06 0.28 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.67 2x60 s ILE 316 N -0.27 1.61 -0.09 6.68 1.01 -1.26 -1.77 121.20 127.10 2x60 s ILE 316 Ca 0.06 -1.24 0.01 0.00 0.00 0.00 0.00 60.65 59.47 2x60 s ILE 316 Cb -0.12 -1.84 0.02 0.00 0.01 0.00 0.00 42.46 40.53 2x60 s ILE 316 CO 0.02 -0.06 -0.09 0.00 0.00 0.00 0.00 174.94 174.81 2x60 s LYS 318 N 1.28 4.20 0.10 0.00 2.47 -1.26 0.85 119.74 127.38 2x60 s LYS 318 Ca -0.03 2.43 -0.26 0.00 -1.56 0.00 0.00 55.97 56.54 2x60 s LYS 318 Cb -0.14 -3.06 -0.12 0.00 -1.46 0.00 0.00 37.83 33.05 2x60 s LYS 318 CO -0.03 -0.49 1.68 1.49 0.16 0.00 0.00 175.35 178.16 2x60 h GLU 319 N 4.54 -0.34 -0.15 4.03 4.81 -1.41 -2.21 114.58 123.84 2x60 h GLU 319 Ca -0.47 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 58.82 2x60 h GLU 319 Cb 1.22 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.67 2x60 h GLU 319 CO 0.75 -0.23 0.32 1.05 -0.73 0.00 0.00 179.01 180.17 2x60 h GLU 320 N -0.36 0.00 -0.11 1.92 4.11 -1.91 0.20 114.58 118.43 2x60 h GLU 320 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2x60 h GLU 320 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2x60 h GLU 320 CO -0.03 0.00 0.00 0.66 0.07 0.00 0.00 179.01 179.71 2x60 n TYR 321 N -3.29 0.13 -0.37 2.06 4.02 -0.83 -4.64 117.16 114.24 2x60 n TYR 321 Ca 0.01 -0.07 0.29 0.00 -0.01 0.00 0.00 57.90 58.13 2x60 n TYR 321 Cb 0.42 0.00 0.59 0.00 -0.02 0.00 0.00 39.34 40.32 2x60 n TYR 321 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2x60 h ALA 322 N 4.23 2.52 -0.55 -0.72 0.00 -0.99 0.56 119.26 124.30 2x60 h ALA 322 Ca 0.00 0.07 0.13 0.00 0.00 0.00 0.00 54.91 55.10 2x60 h ALA 322 Cb 0.54 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2x60 h ALA 322 CO 0.00 -1.00 0.38 1.96 0.00 0.00 0.00 179.25 180.59 2x60 h GLN 323 N 0.24 0.18 0.00 0.00 1.08 -1.84 -3.00 115.11 111.77 2x60 h GLN 323 Ca 0.67 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.86 2x60 h GLN 323 Cb 1.98 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 29.37 2x60 h GLN 323 CO -0.30 0.12 0.00 1.63 -0.95 0.00 0.00 178.83 179.33 2x60 n LYS 324 N -4.43 0.40 0.15 1.46 4.76 0.19 -3.23 118.16 117.46 2x60 n LYS 324 Ca 0.10 0.06 0.18 0.00 -2.87 0.00 0.00 58.31 55.77 2x60 n LYS 324 Cb 0.49 -1.50 0.78 0.00 -1.84 0.00 0.00 35.03 32.96 2x60 n LYS 324 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2x60 h VAL 325 N 0.00 0.49 -0.59 -0.18 2.07 -1.68 0.20 116.25 116.55 2x60 h VAL 325 Ca 0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 2x60 h VAL 325 Cb 0.18 0.77 -0.09 0.00 -1.52 0.00 0.00 31.29 30.64 2x60 h VAL 325 CO 0.00 0.00 0.07 0.03 0.02 0.00 0.00 177.57 177.69 2x60 h ARG 326 N 0.00 0.19 0.00 1.57 3.08 -1.74 -1.52 114.38 115.96 2x60 h ARG 326 Ca 0.13 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2x60 h ARG 326 Cb 0.71 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.71 2x60 h ARG 326 CO -0.00 0.12 -0.11 1.49 -1.07 0.00 0.00 179.97 180.40 2x60 h GLU 327 N 0.19 0.00 -0.17 0.04 4.81 -0.88 0.12 114.58 118.69 2x60 h GLU 327 Ca 0.31 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.52 2x60 h GLU 327 Cb 0.48 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2x60 h GLU 327 CO -0.44 0.11 0.05 0.28 -0.73 0.00 0.00 179.01 178.28 2x60 h VAL 328 N 0.00 1.20 -0.84 0.32 2.07 -1.30 -2.46 116.25 115.24 2x60 h VAL 328 Ca -0.00 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 2x60 h VAL 328 Cb 0.34 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.35 2x60 h VAL 328 CO 0.01 0.19 0.43 0.58 0.02 0.00 0.00 177.57 178.80 2x60 h VAL 329 N 0.09 1.25 0.12 2.57 2.07 -0.74 -0.59 116.25 121.02 2x60 h VAL 329 Ca 0.05 -0.67 0.01 0.00 0.82 0.00 0.00 66.70 66.91 2x60 h VAL 329 Cb 0.25 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 2x60 h VAL 329 CO -0.00 0.30 -0.15 0.11 0.02 0.00 0.00 177.57 177.84 2x60 h LYS 330 N 1.18 -0.31 0.84 1.57 1.79 -1.20 0.48 116.57 120.94 2x60 h LYS 330 Ca 0.29 0.02 -0.04 0.00 -2.18 0.00 0.00 60.65 58.74 2x60 h LYS 330 Cb 0.08 0.07 0.01 0.00 -1.58 0.00 0.00 32.23 30.81 2x60 h LYS 330 CO -0.04 -0.20 -0.41 0.87 -1.08 0.00 0.00 179.45 178.59 2x60 h LYS 331 N -0.32 -1.09 -0.47 3.15 1.57 -1.27 -3.27 116.57 114.87 2x60 h LYS 331 Ca 0.02 0.07 0.05 0.00 -1.87 0.00 0.00 60.65 58.92 2x60 h LYS 331 Cb 0.32 0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.85 2x60 h LYS 331 CO -0.07 -0.72 0.31 1.25 -0.57 0.00 0.00 179.45 179.65 2x60 h LEU 332 N -1.22 0.40 -0.95 2.94 5.85 -1.10 -3.52 115.31 117.71 2x60 h LEU 332 Ca -0.12 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.60 2x60 h LEU 332 Cb 0.88 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.82 2x60 h LEU 332 CO 0.19 0.27 0.00 0.49 -0.34 0.00 0.00 178.44 179.05