#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 0.80 -0.05 5.55 -2.45 -1.26 -4.48 119.30 117.40 2x60 s MET 2 Ca 0.00 0.47 0.03 0.00 -1.25 0.00 0.00 55.69 54.94 2x60 s MET 2 Cb 0.00 0.38 0.00 0.00 1.25 0.00 0.00 34.83 36.46 2x60 s MET 2 CO 0.00 -0.18 -0.15 0.21 1.05 0.00 0.00 175.02 175.96 2x60 s LYS 3 N -0.43 1.75 -0.23 4.11 2.20 -0.89 -4.82 119.74 121.42 2x60 s LYS 3 Ca -0.06 -0.52 -0.09 0.00 -0.36 0.00 0.00 55.97 54.95 2x60 s LYS 3 Cb -0.03 -1.47 -0.04 0.00 -1.51 0.00 0.00 37.83 34.77 2x60 s LYS 3 CO 0.04 0.14 0.11 0.00 -0.36 0.00 0.00 175.35 175.28 2x60 s ALA 4 N 0.32 3.43 -0.42 3.13 0.00 -0.30 -1.07 121.76 126.85 2x60 s ALA 4 Ca -0.09 -0.94 -0.14 0.00 0.00 0.00 0.00 51.96 50.79 2x60 s ALA 4 Cb -0.13 -2.17 0.04 0.00 0.00 0.00 0.00 23.12 20.86 2x60 s ALA 4 CO 0.03 -0.21 0.30 -1.17 0.00 0.00 0.00 175.76 174.71 2x60 s LEU 5 N 1.10 5.18 -0.37 0.00 2.96 0.80 -0.04 118.68 128.31 2x60 s LEU 5 Ca 0.06 -1.09 -0.19 0.00 -0.22 0.00 0.00 54.13 52.68 2x60 s LEU 5 Cb -0.14 -2.12 0.00 0.00 0.50 0.00 0.00 46.19 44.43 2x60 s LEU 5 CO 0.04 -0.50 0.56 -0.63 -1.32 0.00 0.00 176.35 174.50 2x60 s ILE 6 N 1.62 4.96 -0.67 6.68 1.01 0.27 0.02 121.20 135.09 2x60 s ILE 6 Ca 0.04 0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.77 2x60 s ILE 6 Cb -0.21 -4.03 0.04 0.00 0.01 0.00 0.00 42.46 38.27 2x60 s ILE 6 CO 0.08 -0.31 1.14 -0.76 0.00 0.00 0.00 174.94 175.09 2x60 s LEU 7 N 2.52 3.63 -0.24 2.97 1.43 0.83 -1.89 118.68 127.93 2x60 s LEU 7 Ca 0.20 -0.49 0.12 0.00 -1.03 0.00 0.00 54.13 52.94 2x60 s LEU 7 Cb -0.15 -2.65 0.46 0.00 0.03 0.00 0.00 46.19 43.88 2x60 s LEU 7 CO 0.15 -1.61 1.18 0.00 0.23 0.00 0.00 176.35 176.30 2x60 n ALA 8 N 8.57 4.08 -0.03 4.21 0.00 -0.76 -3.08 120.51 133.49 2x60 n ALA 8 Ca 0.02 -3.39 0.06 0.00 0.00 0.00 0.00 53.44 50.14 2x60 n ALA 8 Cb 0.48 -0.46 0.15 0.00 0.00 0.00 0.00 19.45 19.62 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 -0.69 2.07 3.99 0.00 0.00 -1.12 -4.40 105.19 105.03 2x60 n GLY 9 Ca 0.29 -0.41 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.01 1.77 -0.06 -0.02 0.00 -1.26 -4.36 107.32 102.38 2x60 s GLY 10 Ca 0.24 -1.61 0.00 0.00 0.00 0.00 0.00 44.72 43.35 2x60 s GLY 10 CO 0.17 -1.12 0.60 1.76 0.00 0.00 0.00 173.10 174.52 2x60 h SER 11 N -0.37 0.28 -3.84 1.64 0.02 -1.96 -3.47 113.55 105.84 2x60 h SER 11 Ca -0.38 -0.54 -0.17 0.00 -0.84 0.00 0.00 61.79 59.86 2x60 h SER 11 Cb 1.28 -0.09 0.09 0.00 0.14 0.00 0.00 62.40 63.81 2x60 h SER 11 CO 0.44 1.48 -0.39 0.61 -1.14 0.00 0.00 176.83 177.83 2x60 n GLY 12 N 1.76 0.04 0.31 -3.77 0.00 -1.26 -4.14 105.19 98.13 2x60 n GLY 12 Ca -0.23 -0.19 -0.08 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.96 1.06 0.00 1.61 5.08 -1.94 -3.10 114.58 116.34 2x60 h GLU 13 Ca -0.30 -0.32 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 2x60 h GLU 13 Cb 1.17 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.32 2x60 h GLU 13 CO 0.25 1.02 0.00 0.54 -1.00 0.00 0.00 179.01 179.83 2x60 n ARG 14 N -4.19 0.12 -0.32 2.33 1.74 -1.26 -2.26 116.66 112.83 2x60 n ARG 14 Ca 0.03 0.21 0.10 0.00 -0.77 0.00 0.00 57.85 57.41 2x60 n ARG 14 Cb 0.33 -1.50 0.27 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 -1.28 0.82 -1.62 -1.55 3.01 -1.17 -4.37 117.46 111.30 2x60 n PHE 15 Ca 0.04 -0.50 -0.43 0.00 1.01 0.00 0.00 57.45 57.56 2x60 n PHE 15 Cb 0.07 -0.02 -0.01 0.00 -0.01 0.00 0.00 39.48 39.51 2x60 n PHE 15 CO 0.00 0.00 0.00 1.87 1.01 0.00 0.00 176.76 179.64 2x60 n TRP 16 N 1.26 1.51 0.04 1.38 -0.00 -0.96 -1.44 117.44 119.23 2x60 n TRP 16 Ca 0.20 0.63 0.12 0.00 -0.00 0.00 0.00 57.50 58.45 2x60 n TRP 16 Cb 0.57 -2.29 0.27 0.00 -0.00 0.00 0.00 31.31 29.86 2x60 n TRP 16 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2x60 n PRO 17 N 0.53 2.57 -0.03 5.87 -0.04 -1.26 -4.83 135.00 137.82 2x60 n PRO 17 Ca 0.08 -2.41 -0.13 0.00 -0.04 0.00 0.00 63.50 61.00 2x60 n PRO 17 Cb 0.35 -1.53 -0.11 0.00 -0.04 0.00 0.00 33.50 32.17 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 4.30 0.01 -9.63 1.53 5.85 -1.68 -3.42 115.31 112.27 2x60 h LEU 18 Ca 0.00 -0.64 -0.55 0.00 0.84 0.00 0.00 57.88 57.53 2x60 h LEU 18 Cb 0.97 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.95 2x60 h LEU 18 CO 0.00 0.65 0.10 -0.55 -0.34 0.00 0.00 178.44 178.30 2x60 s SER 19 N -5.86 7.20 0.33 1.25 0.15 -0.52 -4.94 113.70 111.30 2x60 s SER 19 Ca -0.17 1.42 0.03 0.00 0.70 0.00 0.00 55.95 57.94 2x60 s SER 19 Cb 0.00 -2.44 -0.04 0.00 -1.71 0.00 0.00 66.02 61.83 2x60 s SER 19 CO 0.68 0.14 0.13 0.42 1.20 0.00 0.00 173.24 175.81 2x60 s THR 20 N -0.63 0.58 0.32 6.45 -4.23 0.19 -3.63 115.64 114.69 2x60 s THR 20 Ca 0.34 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.88 2x60 s THR 20 Cb -0.21 -2.53 0.17 0.00 1.34 0.00 0.00 72.50 71.27 2x60 s THR 20 CO 0.22 0.00 1.88 -0.65 -0.54 0.00 0.00 174.62 175.53 2x60 h PRO 21 N 2.09 0.65 -0.19 3.99 0.11 -1.94 -1.77 132.00 134.94 2x60 h PRO 21 Ca -0.36 -0.12 -0.14 0.00 0.11 0.00 0.00 66.00 65.49 2x60 h PRO 21 Cb 1.25 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2x60 h PRO 21 CO 0.57 0.61 -0.48 0.93 -0.21 0.00 0.00 178.00 179.42 2x60 h GLU 22 N 0.63 0.50 -2.62 1.05 4.39 -1.96 -3.40 114.58 113.17 2x60 h GLU 22 Ca 0.14 -0.28 -0.59 0.00 0.34 0.00 0.00 59.36 58.97 2x60 h GLU 22 Cb 0.27 0.02 -0.39 0.00 -0.10 0.00 0.00 28.75 28.54 2x60 h GLU 22 CO -0.00 0.87 -0.85 0.99 -1.16 0.00 0.00 179.01 178.86 2x60 s THR 23 N -4.09 0.55 1.20 1.13 2.01 -1.11 -5.10 115.64 110.23 2x60 s THR 23 Ca -0.07 -2.23 -0.17 0.00 0.31 0.00 0.00 61.69 59.53 2x60 s THR 23 Cb 0.12 -1.39 0.28 0.00 0.01 0.00 0.00 72.50 71.52 2x60 s THR 23 CO 0.82 -1.04 1.05 -2.84 -0.69 0.00 0.00 174.62 171.92 2x60 s PRO 24 N 0.56 -1.17 0.22 4.92 0.02 -0.68 -0.64 135.00 138.22 2x60 s PRO 24 Ca 0.22 0.29 -0.05 0.00 0.02 0.00 0.00 61.00 61.48 2x60 s PRO 24 Cb -0.15 -1.57 0.21 0.00 0.02 0.00 0.00 34.50 33.01 2x60 s PRO 24 CO -0.06 -3.75 1.70 1.57 -0.33 0.00 0.00 177.00 176.14 2x60 h LYS 25 N -2.62 0.93 -1.49 5.54 2.10 -1.82 -2.97 116.57 116.23 2x60 h LYS 25 Ca -0.51 -0.27 0.43 0.00 -2.00 0.00 0.00 60.65 58.30 2x60 h LYS 25 Cb 1.32 -0.10 -0.06 0.00 -0.90 0.00 0.00 32.23 32.50 2x60 h LYS 25 CO 0.42 0.92 1.12 -0.56 -2.00 0.00 0.00 179.45 179.36 2x60 h GLN 26 N 0.86 0.00 -0.32 0.07 -0.00 -1.92 0.31 115.11 114.10 2x60 h GLN 26 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.81 2x60 h GLN 26 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.98 2x60 h GLN 26 CO 0.02 0.00 0.00 1.19 -0.00 0.00 0.00 178.83 180.04 2x60 n PHE 27 N -3.97 0.41 -3.12 0.06 3.72 -1.12 -1.84 117.46 111.60 2x60 n PHE 27 Ca 0.33 -0.22 -0.34 0.00 -0.05 0.00 0.00 57.45 57.17 2x60 n PHE 27 Cb 1.59 -0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 40.07 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 -1.51 4.20 -1.24 4.37 1.43 0.10 -4.76 118.68 121.26 2x60 s LEU 28 Ca 0.36 1.34 -0.07 0.00 -1.03 0.00 0.00 54.13 54.73 2x60 s LEU 28 Cb 0.21 -3.84 0.19 0.00 0.03 0.00 0.00 46.19 42.79 2x60 s LEU 28 CO 0.30 -0.09 1.94 0.29 0.23 0.00 0.00 176.35 179.03 2x60 n LYS 29 N 0.17 4.18 -0.20 1.70 5.02 -1.26 -2.65 118.16 125.11 2x60 n LYS 29 Ca 0.01 -3.77 -0.00 0.00 -2.02 0.00 0.00 58.31 52.52 2x60 n LYS 29 Cb 0.52 -2.74 0.23 0.00 -0.02 0.00 0.00 35.03 33.02 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 6.54 0.85 -8.69 -0.35 3.38 -1.92 -3.44 115.31 111.68 2x60 h LEU 30 Ca 0.45 -0.05 -0.33 0.00 0.09 0.00 0.00 57.88 58.04 2x60 h LEU 30 Cb 0.51 -0.21 -0.15 0.00 0.09 0.00 0.00 40.66 40.90 2x60 h LEU 30 CO 1.51 0.67 -0.70 -0.36 0.09 0.00 0.00 178.44 179.64 2x60 s PHE 31 N -5.70 1.30 0.00 1.13 0.08 -1.26 -5.08 117.98 108.45 2x60 s PHE 31 Ca -0.11 -0.83 0.00 0.00 0.12 0.00 0.00 56.93 56.12 2x60 s PHE 31 Cb 0.17 -0.69 0.00 0.00 -0.57 0.00 0.00 43.02 41.93 2x60 s PHE 31 CO 0.79 0.02 0.00 0.41 -0.10 0.00 0.00 175.22 176.33 2x60 n GLY 32 N -0.24 0.67 1.74 4.36 0.00 -1.26 -3.31 105.19 107.16 2x60 n GLY 32 Ca -0.09 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.96 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 -3.74 3.15 -4.12 1.61 5.15 -1.26 -4.95 115.26 111.10 2x60 n ASN 33 Ca 0.00 -3.70 -0.15 0.00 -0.60 0.00 0.00 54.58 50.13 2x60 n ASN 33 Cb 0.00 -0.75 -0.11 0.00 -0.53 0.00 0.00 39.78 38.39 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 -3.28 0.69 0.72 1.20 1.02 -1.21 -5.02 119.74 113.86 2x60 s LYS 34 Ca 0.51 -0.90 -0.11 0.00 0.02 0.00 0.00 55.97 55.49 2x60 s LYS 34 Cb 0.45 -0.52 0.02 0.00 -0.52 0.00 0.00 37.83 37.26 2x60 s LYS 34 CO 0.06 0.10 1.07 -1.54 -0.92 0.00 0.00 175.35 174.12 2x60 s SER 35 N -1.80 5.17 0.19 2.83 1.04 -1.26 -4.42 113.70 115.46 2x60 s SER 35 Ca -0.04 1.55 -0.14 0.00 0.48 0.00 0.00 55.95 57.80 2x60 s SER 35 Cb -0.09 -2.39 0.20 0.00 0.10 0.00 0.00 66.02 63.84 2x60 s SER 35 CO 0.01 -1.57 1.67 -0.07 0.98 0.00 0.00 173.24 174.26 2x60 h LEU 36 N -0.80 -0.31 -0.32 2.42 4.07 -1.47 -1.27 115.31 117.62 2x60 h LEU 36 Ca -0.44 0.14 -0.03 0.00 0.08 0.00 0.00 57.88 57.62 2x60 h LEU 36 Cb 1.22 0.26 -0.01 0.00 1.08 0.00 0.00 40.66 43.21 2x60 h LEU 36 CO 0.57 -0.11 0.09 -0.03 -1.08 0.00 0.00 178.44 177.88 2x60 h MET 37 N 0.08 0.51 -0.51 1.13 4.05 -1.46 -2.78 114.93 115.93 2x60 h MET 37 Ca 0.26 -0.11 0.06 0.00 -0.28 0.00 0.00 59.70 59.63 2x60 h MET 37 Cb 0.41 -0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 31.08 2x60 h MET 37 CO -0.47 0.55 0.21 -0.09 0.23 0.00 0.00 176.91 177.34 2x60 h ARG 38 N 0.36 0.40 -0.97 0.39 9.65 -1.71 -2.16 114.38 120.34 2x60 h ARG 38 Ca 0.10 -0.02 0.05 0.00 -1.10 0.00 0.00 59.98 59.01 2x60 h ARG 38 Cb 0.27 -0.09 -0.06 0.00 -1.39 0.00 0.00 29.97 28.69 2x60 h ARG 38 CO -0.00 0.26 0.62 -1.49 2.80 0.00 0.00 179.97 182.16 2x60 h TRP 39 N 0.41 1.16 -0.65 2.20 4.06 -1.09 -1.35 115.95 120.68 2x60 h TRP 39 Ca 0.24 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 61.16 2x60 h TRP 39 Cb 0.22 -0.38 -0.03 0.00 -1.00 0.00 0.00 29.16 27.97 2x60 h TRP 39 CO -0.14 0.63 0.20 1.15 -3.56 0.00 0.00 178.44 176.71 2x60 h THR 40 N 1.16 1.25 -0.27 1.49 2.02 -1.16 -1.89 112.91 115.51 2x60 h THR 40 Ca 0.41 -0.87 -0.19 0.00 0.77 0.00 0.00 66.41 66.53 2x60 h THR 40 Cb 0.10 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.10 2x60 h THR 40 CO -0.15 0.33 -0.58 0.15 0.37 0.00 0.00 175.52 175.64 2x60 h PHE 41 N 0.95 1.10 -0.41 3.16 3.57 -0.94 -2.12 116.94 122.24 2x60 h PHE 41 Ca 0.21 -0.41 -0.01 0.00 3.53 0.00 0.00 57.97 61.29 2x60 h PHE 41 Cb 0.30 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 2x60 h PHE 41 CO 0.02 1.24 0.21 0.93 -2.23 0.00 0.00 178.31 178.48 2x60 h GLU 42 N 0.65 0.59 -0.89 1.11 5.08 -1.23 0.51 114.58 120.39 2x60 h GLU 42 Ca 0.00 -0.08 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2x60 h GLU 42 Cb 1.19 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 30.28 2x60 h GLU 42 CO 0.13 0.49 0.59 -0.09 -1.00 0.00 0.00 179.01 179.13 2x60 h ARG 43 N 0.53 1.13 -0.10 2.33 2.43 -1.36 -2.40 114.38 116.94 2x60 h ARG 43 Ca 0.14 -0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 2x60 h ARG 43 Cb 0.09 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.38 2x60 h ARG 43 CO -0.02 0.75 -0.20 0.28 -1.51 0.00 0.00 179.97 179.27 2x60 h VAL 44 N 1.16 1.40 -0.15 0.20 2.07 -0.78 -3.23 116.25 116.92 2x60 h VAL 44 Ca 0.34 -1.49 0.04 0.00 0.82 0.00 0.00 66.70 66.41 2x60 h VAL 44 Cb -0.07 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2x60 h VAL 44 CO -0.09 0.43 0.11 -0.07 0.02 0.00 0.00 177.57 177.97 2x60 h LEU 45 N -0.14 0.00 -0.73 2.57 3.38 0.21 -2.78 115.31 117.81 2x60 h LEU 45 Ca 0.00 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.13 2x60 h LEU 45 Cb 0.79 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.40 2x60 h LEU 45 CO 0.04 0.00 -0.16 -0.62 0.09 0.00 0.00 178.44 177.79 2x60 n GLU 46 N -4.47 -0.07 0.00 1.13 -0.58 -0.92 -2.33 120.64 113.40 2x60 n GLU 46 Ca 0.01 1.14 0.02 0.00 -0.42 0.00 0.00 57.16 57.90 2x60 n GLU 46 Cb 0.24 -1.71 -0.01 0.00 -0.57 0.00 0.00 31.44 29.39 2x60 n GLU 46 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2x60 n GLU 47 N -5.17 3.32 -4.26 3.49 -0.58 -1.07 -5.05 120.64 111.31 2x60 n GLU 47 Ca 0.12 -0.29 -0.18 0.00 -0.42 0.00 0.00 57.16 56.39 2x60 n GLU 47 Cb 0.39 -0.83 -0.11 0.00 -0.57 0.00 0.00 31.44 30.32 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 -0.92 1.08 0.52 3.49 -1.94 -0.99 -5.14 119.30 115.39 2x60 s MET 48 Ca 0.03 -1.29 -0.15 0.00 -1.71 0.00 0.00 55.69 52.56 2x60 s MET 48 Cb 0.03 -0.96 -0.07 0.00 2.01 0.00 0.00 34.83 35.84 2x60 s MET 48 CO 0.10 0.18 0.97 -0.51 -0.01 0.00 0.00 175.02 175.75 2x60 s ASP 49 N -2.57 6.57 0.31 3.03 1.11 -1.26 -4.40 116.67 119.45 2x60 s ASP 49 Ca 0.11 1.51 0.01 0.00 0.18 0.00 0.00 52.55 54.35 2x60 s ASP 49 Cb -0.04 -2.48 0.50 0.00 1.07 0.00 0.00 42.92 41.96 2x60 s ASP 49 CO 0.04 -0.60 1.88 -0.65 1.18 0.00 0.00 175.17 177.01 2x60 h PRO 50 N 0.80 0.76 -1.22 8.23 0.11 -1.94 -2.43 132.00 136.32 2x60 h PRO 50 Ca -0.46 -0.13 0.35 0.00 0.11 0.00 0.00 66.00 65.87 2x60 h PRO 50 Cb 1.19 -0.13 -0.09 0.00 0.11 0.00 0.00 31.00 32.08 2x60 h PRO 50 CO 0.62 0.66 0.82 -0.22 -0.21 0.00 0.00 178.00 179.66 2x60 h LYS 51 N 0.75 0.17 -0.06 1.05 3.64 -1.93 0.19 116.57 120.37 2x60 h LYS 51 Ca 0.17 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2x60 h LYS 51 Cb 0.21 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2x60 h LYS 51 CO -0.01 0.11 0.00 -0.25 -2.27 0.00 0.00 179.45 177.03 2x60 n ASP 52 N -4.47 1.42 -4.43 4.20 8.00 -0.91 -4.89 116.55 115.47 2x60 n ASP 52 Ca 0.30 -1.54 -0.35 0.00 0.71 0.00 0.00 54.79 53.91 2x60 n ASP 52 Cb 1.20 -0.04 -0.13 0.00 -0.02 0.00 0.00 41.12 42.14 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 -1.93 3.81 -0.04 2.53 1.01 0.66 -1.15 120.40 125.29 2x60 s VAL 53 Ca 0.36 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 62.04 2x60 s VAL 53 Cb 0.20 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 2x60 s VAL 53 CO 0.31 0.44 -0.24 -0.63 0.00 0.00 0.00 175.10 174.98 2x60 s ILE 54 N 0.94 1.91 -0.25 2.22 -1.09 0.95 -4.82 121.20 121.06 2x60 s ILE 54 Ca 0.01 -1.00 0.02 0.00 -2.23 0.00 0.00 60.65 57.44 2x60 s ILE 54 Cb -0.14 -1.60 0.06 0.00 -1.58 0.00 0.00 42.46 39.19 2x60 s ILE 54 CO 0.01 0.54 -0.09 -0.69 -1.23 0.00 0.00 174.94 173.48 2x60 s VAL 55 N -0.29 1.92 -0.27 2.92 1.01 -0.18 0.98 120.40 126.49 2x60 s VAL 55 Ca 0.01 -1.45 -0.23 0.00 0.00 0.00 0.00 61.98 60.31 2x60 s VAL 55 Cb -0.12 -2.08 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 2x60 s VAL 55 CO 0.02 -0.04 0.78 -0.69 0.00 0.00 0.00 175.10 175.17 2x60 s VAL 56 N 1.22 4.85 0.16 2.92 1.01 -0.79 -0.69 120.40 129.07 2x60 s VAL 56 Ca -0.07 1.34 0.01 0.00 0.00 0.00 0.00 61.98 63.26 2x60 s VAL 56 Cb -0.19 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2x60 s VAL 56 CO -0.06 -0.12 0.02 -0.89 0.00 0.00 0.00 175.10 174.05 2x60 s THR 57 N 2.83 0.50 0.26 3.92 2.01 0.07 -1.84 115.64 123.39 2x60 s THR 57 Ca 0.32 -1.95 -0.29 0.00 0.31 0.00 0.00 61.69 60.08 2x60 s THR 57 Cb -0.15 -2.07 -0.09 0.00 0.01 0.00 0.00 72.50 70.20 2x60 s THR 57 CO 0.09 -0.50 0.96 -2.28 -0.69 0.00 0.00 174.62 172.21 2x60 s HIS 58 N -3.78 3.87 0.53 4.92 2.46 -1.26 0.10 115.29 122.13 2x60 s HIS 58 Ca 0.23 1.86 0.36 0.00 0.47 0.00 0.00 55.06 57.99 2x60 s HIS 58 Cb 0.07 -3.01 1.53 0.00 -0.13 0.00 0.00 32.58 31.03 2x60 s HIS 58 CO 0.03 0.27 1.76 1.57 -2.47 0.00 0.00 174.74 175.90 2x60 h LYS 59 N 3.90 0.04 -0.59 2.88 2.10 -1.38 -1.22 116.57 122.31 2x60 h LYS 59 Ca -0.46 -0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.09 2x60 h LYS 59 Cb 1.20 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 32.50 2x60 h LYS 59 CO 0.67 0.03 -0.04 -0.44 -2.00 0.00 0.00 179.45 177.67 2x60 h ASP 60 N 0.04 1.05 -0.30 7.07 3.32 -1.93 -3.16 116.42 122.52 2x60 h ASP 60 Ca 0.63 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2x60 h ASP 60 Cb 2.41 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 41.67 2x60 h ASP 60 CO -0.06 1.12 0.00 -1.22 -1.72 0.00 0.00 179.24 177.37 2x60 n TYR 61 N -4.16 0.60 0.50 4.55 4.01 -0.46 -4.29 117.16 117.91 2x60 n TYR 61 Ca 0.02 -0.25 -0.20 0.00 -0.16 0.00 0.00 57.90 57.32 2x60 n TYR 61 Cb 0.37 -0.10 -0.09 0.00 -0.31 0.00 0.00 39.34 39.21 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 1.85 0.00 -0.90 -0.72 2.07 -1.62 -0.35 116.25 116.58 2x60 h VAL 62 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 2x60 h VAL 62 Cb 0.68 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.37 2x60 h VAL 62 CO 0.08 0.00 0.52 -0.33 0.02 0.00 0.00 177.57 177.86 2x60 h GLU 63 N -1.27 0.76 -0.31 1.57 4.39 -1.84 0.17 114.58 118.05 2x60 h GLU 63 Ca -0.13 -0.05 0.04 0.00 0.34 0.00 0.00 59.36 59.56 2x60 h GLU 63 Cb 0.98 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 29.42 2x60 h GLU 63 CO 0.21 0.50 0.09 0.00 -1.16 0.00 0.00 179.01 178.65 2x60 h ARG 64 N 0.79 0.21 -0.51 2.33 2.47 -1.80 -3.02 114.38 114.85 2x60 h ARG 64 Ca 0.47 -0.01 0.06 0.00 -1.26 0.00 0.00 59.98 59.24 2x60 h ARG 64 Cb 0.57 -0.05 -0.05 0.00 -1.65 0.00 0.00 29.97 28.79 2x60 h ARG 64 CO -0.31 0.14 0.22 1.15 0.56 0.00 0.00 179.97 181.73 2x60 h THR 65 N 0.22 0.88 -0.08 2.04 2.02 0.11 -1.42 112.91 116.67 2x60 h THR 65 Ca 0.14 -0.15 0.02 0.00 0.77 0.00 0.00 66.41 67.20 2x60 h THR 65 Cb 0.12 0.42 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2x60 h THR 65 CO -0.16 0.08 0.07 0.11 0.37 0.00 0.00 175.52 175.99 2x60 h LYS 66 N 0.43 0.00 0.09 6.66 1.57 -1.16 -2.44 116.57 121.72 2x60 h LYS 66 Ca 0.24 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2x60 h LYS 66 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.53 2x60 h LYS 66 CO -0.21 0.00 -0.04 0.87 -0.57 0.00 0.00 179.45 179.49 2x60 h LYS 67 N 0.00 -0.12 -0.59 3.15 1.79 -1.16 -3.25 116.57 116.39 2x60 h LYS 67 Ca 0.04 0.01 -0.06 0.00 -2.18 0.00 0.00 60.65 58.45 2x60 h LYS 67 Cb 0.18 0.03 -0.03 0.00 -1.58 0.00 0.00 32.23 30.83 2x60 h LYS 67 CO -0.00 0.41 0.11 0.93 -1.08 0.00 0.00 179.45 179.82 2x60 h GLU 68 N -0.84 0.94 -2.29 3.15 4.39 -1.33 -3.31 114.58 115.29 2x60 h GLU 68 Ca -0.01 -0.22 -0.61 0.00 0.34 0.00 0.00 59.36 58.86 2x60 h GLU 68 Cb 0.58 -0.13 -0.41 0.00 -0.10 0.00 0.00 28.75 28.70 2x60 h GLU 68 CO 0.02 0.86 -0.50 1.28 -1.16 0.00 0.00 179.01 179.51 2x60 n LEU 69 N -4.24 4.71 -0.07 1.33 4.77 -0.93 -4.88 117.00 117.69 2x60 n LEU 69 Ca 0.04 -5.66 0.15 0.00 -0.03 0.00 0.00 56.01 50.51 2x60 n LEU 69 Cb 0.26 -0.61 0.56 0.00 -2.33 0.00 0.00 43.42 41.30 2x60 n LEU 69 CO 0.41 2.32 1.19 1.55 -1.33 0.00 0.00 177.39 181.53 2x60 h PRO 70 N 3.12 0.27 0.00 3.23 0.13 -1.65 0.11 132.00 137.21 2x60 h PRO 70 Ca 0.16 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2x60 h PRO 70 Cb 0.49 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.56 2x60 h PRO 70 CO 0.85 0.18 0.00 0.93 -0.23 0.00 0.00 178.00 179.73 2x60 h GLU 71 N 0.27 0.00 -6.56 0.86 3.07 -1.90 -3.43 114.58 106.90 2x60 h GLU 71 Ca 0.28 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.62 2x60 h GLU 71 Cb 0.74 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 28.68 2x60 h GLU 71 CO -0.06 0.00 0.72 -1.17 -1.40 0.00 0.00 179.01 177.10 2x60 s LEU 72 N -5.59 4.37 0.65 1.33 2.96 0.39 -4.83 118.68 117.96 2x60 s LEU 72 Ca 0.02 2.34 -0.18 0.00 -0.22 0.00 0.00 54.13 56.09 2x60 s LEU 72 Cb 0.09 -3.59 -0.01 0.00 0.50 0.00 0.00 46.19 43.19 2x60 s LEU 72 CO 0.48 -0.65 1.26 -2.84 -1.32 0.00 0.00 176.35 173.28 2x60 s PRO 73 N 1.04 2.57 0.26 0.98 0.02 -1.26 -4.93 135.00 133.68 2x60 s PRO 73 Ca 0.64 1.97 -0.05 0.00 0.02 0.00 0.00 61.00 63.58 2x60 s PRO 73 Cb -0.37 -1.86 0.30 0.00 0.02 0.00 0.00 34.50 32.59 2x60 s PRO 73 CO 0.31 -1.56 1.91 -0.44 -0.33 0.00 0.00 177.00 176.89 2x60 h ASP 74 N 0.49 1.07 0.20 2.53 3.32 -1.94 -2.68 116.42 119.41 2x60 h ASP 74 Ca -0.50 -0.06 -0.04 0.00 0.02 0.00 0.00 57.03 56.45 2x60 h ASP 74 Cb 1.32 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 2x60 h ASP 74 CO 0.53 0.82 -0.18 1.05 -1.72 0.00 0.00 179.24 179.73 2x60 h GLU 75 N 1.24 0.00 0.00 3.56 9.09 -2.01 -2.97 114.58 123.49 2x60 h GLU 75 Ca 0.33 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.74 2x60 h GLU 75 Cb -0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.03 2x60 h GLU 75 CO -0.06 0.18 0.00 0.09 0.05 0.00 0.00 179.01 179.27 2x60 n ASN 76 N -4.25 0.00 -4.54 3.06 4.13 -1.01 -4.63 115.26 108.02 2x60 n ASN 76 Ca -0.02 -1.48 -0.37 0.00 1.68 0.00 0.00 54.58 54.39 2x60 n ASN 76 Cb 0.25 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.37 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 4.89 -0.17 2.41 1.01 -1.12 -1.01 121.20 125.21 2x60 s ILE 77 Ca 0.20 0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.81 2x60 s ILE 77 Cb 0.09 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 2x60 s ILE 77 CO 0.16 0.31 0.04 -0.63 0.00 0.00 0.00 174.94 174.81 2x60 s ILE 78 N 1.56 4.58 -0.29 2.92 -1.09 0.13 -4.97 121.20 124.03 2x60 s ILE 78 Ca 0.06 -0.11 -0.08 0.00 -2.23 0.00 0.00 60.65 58.29 2x60 s ILE 78 Cb -0.15 -3.04 -0.01 0.00 -1.58 0.00 0.00 42.46 37.68 2x60 s ILE 78 CO 0.07 0.48 0.10 0.00 -1.23 0.00 0.00 174.94 174.36 2x60 s ALA 79 N 0.28 3.17 0.24 9.38 0.00 -1.26 -0.75 121.76 132.81 2x60 s ALA 79 Ca 0.02 -1.34 -0.14 0.00 0.00 0.00 0.00 51.96 50.50 2x60 s ALA 79 Cb -0.13 -2.21 -0.08 0.00 0.00 0.00 0.00 23.12 20.70 2x60 s ALA 79 CO 0.01 -0.80 0.62 -1.21 0.00 0.00 0.00 175.76 174.39 2x60 s GLU 80 N 1.57 3.96 0.20 0.00 2.02 0.29 -4.72 118.70 122.02 2x60 s GLU 80 Ca 0.04 0.51 0.06 0.00 0.02 0.00 0.00 54.97 55.61 2x60 s GLU 80 Cb -0.17 -2.68 0.11 0.00 0.10 0.00 0.00 34.13 31.49 2x60 s GLU 80 CO 0.04 0.32 1.46 -1.00 0.02 0.00 0.00 175.26 176.10 2x60 h PRO 81 N 2.81 0.10 -2.97 0.39 0.13 -1.88 -0.57 132.00 130.02 2x60 h PRO 81 Ca -0.48 -0.10 -0.11 0.00 -0.87 0.00 0.00 66.00 64.44 2x60 h PRO 81 Cb 1.18 0.03 -0.20 0.00 0.13 0.00 0.00 31.00 32.14 2x60 h PRO 81 CO 0.67 0.83 -0.24 -1.64 -0.23 0.00 0.00 178.00 177.39 2x60 s MET 82 N -3.33 0.71 -0.14 0.86 -1.94 -1.26 -4.91 119.30 109.29 2x60 s MET 82 Ca -0.02 -0.18 -0.20 0.00 -1.71 0.00 0.00 55.69 53.58 2x60 s MET 82 Cb 0.11 0.32 -0.03 0.00 2.01 0.00 0.00 34.83 37.23 2x60 s MET 82 CO 0.80 -0.20 0.59 -1.59 -0.01 0.00 0.00 175.02 174.61 2x60 s LYS 83 N -1.41 4.31 -0.23 2.03 -2.85 -1.26 -4.94 119.74 115.38 2x60 s LYS 83 Ca -0.13 0.61 0.17 0.00 -1.00 0.00 0.00 55.97 55.62 2x60 s LYS 83 Cb -0.05 -3.50 0.48 0.00 -2.06 0.00 0.00 37.83 32.70 2x60 s LYS 83 CO 0.04 -0.03 1.15 1.63 0.10 0.00 0.00 175.35 178.25 2x60 n LYS 84 N 4.26 2.16 -0.77 1.78 4.76 -1.26 -4.98 118.16 124.11 2x60 n LYS 84 Ca -0.03 -3.54 0.10 0.00 -2.87 0.00 0.00 58.31 51.97 2x60 n LYS 84 Cb 0.51 -1.65 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 2x60 n LYS 84 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2x60 n ASN 85 N -0.55 -6.30 0.28 4.39 3.02 -1.26 -2.88 115.26 111.95 2x60 n ASN 85 Ca 0.21 0.83 0.17 0.00 -0.03 0.00 0.00 54.58 55.75 2x60 n ASN 85 Cb 0.89 -2.32 0.80 0.00 -0.61 0.00 0.00 39.78 38.53 2x60 n ASN 85 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2x60 h THR 86 N -0.71 0.21 0.51 3.41 1.35 -1.89 -3.22 112.91 112.57 2x60 h THR 86 Ca 0.02 -0.47 -0.02 0.00 -0.55 0.00 0.00 66.41 65.38 2x60 h THR 86 Cb 0.70 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2x60 h THR 86 CO 0.01 0.06 -0.24 0.00 -0.25 0.00 0.00 175.52 175.09 2x60 h ALA 87 N 1.94 -1.12 -0.82 6.62 0.00 -1.67 -2.18 119.26 122.03 2x60 h ALA 87 Ca -0.00 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2x60 h ALA 87 Cb 0.37 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 2x60 h ALA 87 CO 0.01 -1.07 0.53 -1.00 0.00 0.00 0.00 179.25 177.73 2x60 h PRO 88 N -0.72 1.04 -0.98 0.00 0.13 -1.77 -2.54 132.00 127.16 2x60 h PRO 88 Ca -0.07 -0.06 0.32 0.00 -0.87 0.00 0.00 66.00 65.32 2x60 h PRO 88 Cb 0.52 -0.23 -0.15 0.00 0.13 0.00 0.00 31.00 31.26 2x60 h PRO 88 CO 0.11 0.69 0.48 0.00 -0.23 0.00 0.00 178.00 179.05 2x60 h ALA 89 N 1.32 1.83 -0.13 -0.56 0.00 -1.56 0.27 119.26 120.44 2x60 h ALA 89 Ca 0.31 0.22 -0.14 0.00 0.00 0.00 0.00 54.91 55.30 2x60 h ALA 89 Cb -0.06 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2x60 h ALA 89 CO -0.09 -0.62 -0.54 0.00 0.00 0.00 0.00 179.25 178.00 2x60 h PHE 91 N 0.29 -0.20 -0.84 0.00 3.57 -0.36 -1.64 116.94 117.75 2x60 h PHE 91 Ca 0.01 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 2x60 h PHE 91 Cb 1.05 0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.81 2x60 h PHE 91 CO 0.03 0.16 0.55 -0.84 -2.23 0.00 0.00 178.31 175.99 2x60 h ILE 92 N -0.60 1.17 -0.41 1.41 3.07 -1.62 -2.81 117.51 117.72 2x60 h ILE 92 Ca -0.02 -0.37 -0.11 0.00 1.55 0.00 0.00 64.86 65.90 2x60 h ILE 92 Cb 0.45 -0.00 -0.01 0.00 -0.27 0.00 0.00 36.82 36.99 2x60 h ILE 92 CO 0.04 0.20 -0.18 1.23 -1.05 0.00 0.00 178.15 178.38 2x60 h GLY 93 N 1.08 0.92 2.00 0.16 0.00 -1.53 -3.24 103.07 102.47 2x60 h GLY 93 Ca 0.32 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.76 2x60 h GLY 93 CO -0.08 0.75 -0.34 -0.84 0.00 0.00 0.00 176.54 176.02 2x60 h THR 94 N 0.67 0.88 0.00 4.70 2.02 -1.05 -2.98 112.91 117.15 2x60 h THR 94 Ca 0.09 -1.36 -0.05 0.00 0.77 0.00 0.00 66.41 65.86 2x60 h THR 94 Cb 0.74 1.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.97 2x60 h THR 94 CO 0.06 0.33 -0.25 0.50 0.37 0.00 0.00 175.52 176.53 2x60 h LYS 95 N 0.00 0.00 0.00 6.66 3.64 -1.53 -3.04 116.57 122.30 2x60 h LYS 95 Ca -0.00 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 2x60 h LYS 95 Cb 0.80 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.61 2x60 h LYS 95 CO 0.04 0.25 -0.21 -0.07 -2.27 0.00 0.00 179.45 177.19 2x60 h LEU 96 N 0.00 0.00-10.79 5.20 4.07 -1.66 -3.45 115.31 108.67 2x60 h LEU 96 Ca -0.00 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.51 2x60 h LEU 96 Cb 0.46 0.00 0.16 0.00 1.08 0.00 0.00 40.66 42.35 2x60 h LEU 96 CO 0.03 0.21 0.42 0.00 -1.08 0.00 0.00 178.44 178.03 2x60 s ALA 97 N -3.78 2.28 0.50 1.53 0.00 -1.15 -5.05 121.76 116.09 2x60 s ALA 97 Ca -0.00 -1.12 -0.18 0.00 0.00 0.00 0.00 51.96 50.65 2x60 s ALA 97 Cb 0.11 -2.80 -0.08 0.00 0.00 0.00 0.00 23.12 20.35 2x60 s ALA 97 CO 0.63 -2.34 1.00 -0.51 0.00 0.00 0.00 175.76 174.54 2x60 s ASP 98 N -4.84 6.48 0.27 0.00 1.01 -1.26 -4.96 116.67 113.37 2x60 s ASP 98 Ca 0.72 1.71 0.00 0.00 0.71 0.00 0.00 52.55 55.70 2x60 s ASP 98 Cb -0.05 -2.53 0.59 0.00 1.01 0.00 0.00 42.92 41.94 2x60 s ASP 98 CO 0.52 -0.68 1.74 0.44 0.21 0.00 0.00 175.17 177.41 2x60 h ASP 99 N 1.18 0.47 -0.70 0.27 5.19 -1.93 -0.33 116.42 120.58 2x60 h ASP 99 Ca -0.48 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 2x60 h ASP 99 Cb 1.20 0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.75 2x60 h ASP 99 CO 0.60 0.16 0.00 -0.67 -3.12 0.00 0.00 179.24 176.21 2x60 n ASP 100 N -4.92 3.76 -4.73 6.45 2.03 -1.26 -1.46 116.55 116.42 2x60 n ASP 100 Ca 0.19 -2.00 -0.40 0.00 0.52 0.00 0.00 54.79 53.09 2x60 n ASP 100 Cb 0.50 -0.46 -0.05 0.00 -0.72 0.00 0.00 41.12 40.39 2x60 n ASP 100 CO 0.00 0.00 0.00 -0.70 -1.92 0.00 0.00 177.20 174.58 2x60 s GLU 101 N -1.07 4.51 -0.03 -0.67 2.12 -0.14 -4.86 118.70 118.57 2x60 s GLU 101 Ca 0.47 1.12 -0.30 0.00 0.36 0.00 0.00 54.97 56.62 2x60 s GLU 101 Cb 0.24 -3.40 -0.04 0.00 0.26 0.00 0.00 34.13 31.20 2x60 s GLU 101 CO 0.32 0.16 1.18 -1.25 -0.54 0.00 0.00 175.26 175.13 2x60 s PRO 102 N 0.35 4.38 -0.20 4.30 0.04 -1.26 -2.80 135.00 139.81 2x60 s PRO 102 Ca 0.41 1.66 -0.03 0.00 0.04 0.00 0.00 61.00 63.09 2x60 s PRO 102 Cb -0.20 -3.51 -0.01 0.00 0.04 0.00 0.00 34.50 30.82 2x60 s PRO 102 CO 0.23 -0.38 -0.07 0.08 0.04 0.00 0.00 177.00 176.91 2x60 s VAL 103 N 1.89 3.23 -0.36 -0.36 1.01 0.13 -2.10 120.40 123.84 2x60 s VAL 103 Ca 0.56 -0.55 -0.16 0.00 0.00 0.00 0.00 61.98 61.83 2x60 s VAL 103 Cb -0.25 -2.44 -0.00 0.00 0.00 0.00 0.00 36.38 33.68 2x60 s VAL 103 CO 0.24 0.45 0.40 -0.22 0.00 0.00 0.00 175.10 175.97 2x60 s LEU 104 N 1.23 4.50 -0.33 3.92 2.96 -0.24 -2.32 118.68 128.40 2x60 s LEU 104 Ca 0.03 -0.27 -0.17 0.00 -0.22 0.00 0.00 54.13 53.49 2x60 s LEU 104 Cb -0.14 -2.39 -0.01 0.00 0.50 0.00 0.00 46.19 44.14 2x60 s LEU 104 CO -0.02 -0.41 0.47 -0.69 -1.32 0.00 0.00 176.35 174.37 2x60 s VAL 105 N 2.11 5.07 -0.14 1.68 1.01 0.20 -0.14 120.40 130.19 2x60 s VAL 105 Ca 0.13 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.49 2x60 s VAL 105 Cb -0.16 -3.88 0.02 0.00 0.00 0.00 0.00 36.38 32.35 2x60 s VAL 105 CO 0.12 -0.11 -0.13 -0.76 0.00 0.00 0.00 175.10 174.22 2x60 s LEU 106 N 2.27 1.61 0.54 3.92 1.43 0.10 -1.72 118.68 126.83 2x60 s LEU 106 Ca 0.17 -0.46 -0.22 0.00 -1.03 0.00 0.00 54.13 52.59 2x60 s LEU 106 Cb -0.16 -1.13 -0.05 0.00 0.03 0.00 0.00 46.19 44.88 2x60 s LEU 106 CO 0.12 -0.06 1.35 -2.65 0.23 0.00 0.00 176.35 175.34 2x60 n PRO 107 N 4.78 1.72 -0.05 1.29 -0.02 -1.26 -0.12 135.00 141.34 2x60 n PRO 107 Ca -0.16 0.63 0.12 0.00 -2.02 0.00 0.00 63.50 62.07 2x60 n PRO 107 Cb 0.50 -2.56 0.42 0.00 -0.02 0.00 0.00 33.50 31.84 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 -0.96 2.54 -1.14 3.55 0.00 -1.18 -4.18 120.51 119.14 2x60 n ALA 108 Ca 0.10 -0.52 -0.00 0.00 0.00 0.00 0.00 53.44 53.02 2x60 n ALA 108 Cb 0.44 -1.10 0.26 0.00 0.00 0.00 0.00 19.45 19.05 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 0.36 3.85 -4.88 0.00 5.75 -1.26 -3.82 116.55 116.54 2x60 n ASP 109 Ca 0.17 -3.30 -0.35 0.00 -0.01 0.00 0.00 54.79 51.31 2x60 n ASP 109 Cb 0.36 -0.64 -0.05 0.00 -1.03 0.00 0.00 41.12 39.76 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 -3.01 3.59 -0.29 2.11 3.76 -1.26 -1.27 115.29 118.92 2x60 s HIS 110 Ca 0.48 0.59 0.01 0.00 -0.15 0.00 0.00 55.06 55.99 2x60 s HIS 110 Cb 0.40 -2.00 0.06 0.00 1.11 0.00 0.00 32.58 32.15 2x60 s HIS 110 CO 0.08 0.62 -0.04 0.50 -0.85 0.00 0.00 174.74 175.05 2x60 s ARG 111 N -1.67 2.24 -0.40 1.40 3.52 -0.43 -4.86 118.95 118.76 2x60 s ARG 111 Ca 0.26 -1.38 0.03 0.00 -0.13 0.00 0.00 55.73 54.52 2x60 s ARG 111 Cb -0.13 -3.05 0.11 0.00 -1.56 0.00 0.00 34.95 30.32 2x60 s ARG 111 CO 0.15 -0.64 0.13 0.42 -0.81 0.00 0.00 175.30 174.55 2x60 s ILE 112 N 1.14 2.17 0.20 4.11 1.01 -1.26 -2.32 121.20 126.26 2x60 s ILE 112 Ca -0.05 -2.55 -0.10 0.00 0.00 0.00 0.00 60.65 57.95 2x60 s ILE 112 Cb -0.20 -2.57 0.13 0.00 0.01 0.00 0.00 42.46 39.83 2x60 s ILE 112 CO -0.04 -0.68 1.80 -0.65 0.00 0.00 0.00 174.94 175.37 2x60 h PRO 113 N 7.28 0.62 -4.59 2.79 0.10 -1.98 -3.37 132.00 132.84 2x60 h PRO 113 Ca -0.06 -0.04 -0.72 0.00 0.10 0.00 0.00 66.00 65.28 2x60 h PRO 113 Cb 0.98 -0.14 -0.21 0.00 0.10 0.00 0.00 31.00 31.73 2x60 h PRO 113 CO 0.56 0.41 0.40 0.34 0.10 0.00 0.00 178.00 179.81 2x60 s ASP 114 N -5.57 6.53 0.45 -2.05 -1.08 -1.26 -4.88 116.67 108.81 2x60 s ASP 114 Ca -0.13 -2.03 0.24 0.00 -0.52 0.00 0.00 52.55 50.11 2x60 s ASP 114 Cb 0.16 -2.32 1.04 0.00 -1.46 0.00 0.00 42.92 40.34 2x60 s ASP 114 CO 0.75 -0.95 1.89 0.71 0.52 0.00 0.00 175.17 178.09 2x60 h THR 115 N 5.55 0.65 0.21 1.71 1.35 -1.99 -1.85 112.91 118.55 2x60 h THR 115 Ca -0.00 -1.02 -0.34 0.00 -0.55 0.00 0.00 66.41 64.51 2x60 h THR 115 Cb 1.05 1.66 0.02 0.00 -1.73 0.00 0.00 68.15 69.15 2x60 h THR 115 CO 1.00 0.22 -1.56 0.11 -0.25 0.00 0.00 175.52 175.04 2x60 h LYS 116 N 0.00 0.45 -0.97 4.72 1.57 -1.96 -1.72 116.57 118.66 2x60 h LYS 116 Ca -0.00 -0.77 0.14 0.00 -1.87 0.00 0.00 60.65 58.15 2x60 h LYS 116 Cb 0.64 0.29 -0.09 0.00 0.08 0.00 0.00 32.23 33.14 2x60 h LYS 116 CO 0.03 1.36 0.59 -0.22 -0.57 0.00 0.00 179.45 180.64 2x60 h LYS 117 N 0.12 0.84 0.07 3.15 3.64 -1.95 -1.04 116.57 121.41 2x60 h LYS 117 Ca -0.28 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 2x60 h LYS 117 Cb 2.12 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 33.75 2x60 h LYS 117 CO 0.23 0.56 -0.06 0.35 -2.27 0.00 0.00 179.45 178.25 2x60 h PHE 118 N 0.87 -0.16 -0.10 1.91 3.57 -1.19 -2.19 116.94 119.64 2x60 h PHE 118 Ca 0.51 0.00 -0.12 0.00 3.53 0.00 0.00 57.97 61.89 2x60 h PHE 118 Cb 0.62 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 2x60 h PHE 118 CO -0.02 -0.10 -0.47 -1.49 -2.23 0.00 0.00 178.31 174.00 2x60 h TRP 119 N -0.14 0.30 -0.63 0.41 4.06 -0.74 -0.45 115.95 118.76 2x60 h TRP 119 Ca 0.00 -0.09 0.02 0.00 2.06 0.00 0.00 58.89 60.88 2x60 h TRP 119 Cb 0.14 -0.06 -0.04 0.00 -1.00 0.00 0.00 29.16 28.20 2x60 h TRP 119 CO -0.10 0.68 0.40 0.87 -3.56 0.00 0.00 178.44 176.73 2x60 h LYS 120 N 0.20 0.78 -0.65 0.49 1.57 -1.13 0.41 116.57 118.26 2x60 h LYS 120 Ca 0.01 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.70 2x60 h LYS 120 Cb 0.91 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 33.01 2x60 h LYS 120 CO 0.07 0.52 0.24 1.15 -0.57 0.00 0.00 179.45 180.86 2x60 h THR 121 N 0.81 1.23 0.00 -0.16 2.02 -0.67 -1.38 112.91 114.76 2x60 h THR 121 Ca 0.24 -0.74 -0.13 0.00 0.77 0.00 0.00 66.41 66.55 2x60 h THR 121 Cb -0.04 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 2x60 h THR 121 CO -0.08 0.29 -0.61 0.58 0.37 0.00 0.00 175.52 176.08 2x60 h VAL 122 N 0.94 1.39 0.08 3.16 2.07 -0.72 -1.95 116.25 121.22 2x60 h VAL 122 Ca 0.22 -2.13 -0.00 0.00 0.82 0.00 0.00 66.70 65.61 2x60 h VAL 122 Cb 0.21 2.16 0.00 0.00 -1.52 0.00 0.00 31.29 32.14 2x60 h VAL 122 CO -0.02 0.60 -0.04 0.11 0.02 0.00 0.00 177.57 178.24 2x60 h LYS 123 N 0.00 -0.10 -0.59 1.57 1.57 -0.52 -1.04 116.57 117.46 2x60 h LYS 123 Ca -0.01 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 58.83 2x60 h LYS 123 Cb 1.11 0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.40 2x60 h LYS 123 CO 0.08 0.24 0.31 -0.22 -0.57 0.00 0.00 179.45 179.29 2x60 h LYS 124 N -0.46 0.57 -0.84 3.15 3.64 -1.28 0.31 116.57 121.67 2x60 h LYS 124 Ca -0.01 -0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2x60 h LYS 124 Cb 0.39 -0.13 -0.06 0.00 -0.41 0.00 0.00 32.23 32.02 2x60 h LYS 124 CO 0.02 0.38 0.55 0.00 -2.27 0.00 0.00 179.45 178.13 2x60 h ALA 125 N 1.31 1.69 -0.54 5.00 0.00 -1.34 -1.26 119.26 124.12 2x60 h ALA 125 Ca 0.26 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2x60 h ALA 125 Cb 0.15 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2x60 h ALA 125 CO -0.17 0.14 0.24 -0.07 0.00 0.00 0.00 179.25 179.39 2x60 h LEU 126 N 0.82 0.72 -0.32 0.00 3.38 0.43 -2.26 115.31 118.08 2x60 h LEU 126 Ca 0.39 -0.15 -0.20 0.00 0.09 0.00 0.00 57.88 58.01 2x60 h LEU 126 Cb 0.41 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 2x60 h LEU 126 CO -0.16 0.67 -0.79 0.44 0.09 0.00 0.00 178.44 178.69 2x60 h ASP 127 N 0.73 0.52 -0.44 -0.43 3.32 -0.91 -2.70 116.42 116.51 2x60 h ASP 127 Ca 0.18 -0.36 0.01 0.00 0.02 0.00 0.00 57.03 56.88 2x60 h ASP 127 Cb 0.16 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 2x60 h ASP 127 CO -0.02 1.12 0.28 0.00 -1.72 0.00 0.00 179.24 178.90 2x60 h ALA 128 N 0.86 0.56 -0.13 3.45 0.00 -1.21 -1.05 119.26 121.73 2x60 h ALA 128 Ca -0.05 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.88 2x60 h ALA 128 Cb 1.39 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 2x60 h ALA 128 CO 0.14 -0.02 -0.08 1.25 0.00 0.00 0.00 179.25 180.53 2x60 h LEU 129 N 0.57 -0.27 -0.96 0.00 5.85 -1.33 0.10 115.31 119.26 2x60 h LEU 129 Ca 0.17 0.06 0.08 0.00 0.84 0.00 0.00 57.88 59.02 2x60 h LEU 129 Cb -0.04 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.07 2x60 h LEU 129 CO -0.05 -0.11 0.61 -0.33 -0.34 0.00 0.00 178.44 178.21 2x60 h GLU 130 N -0.09 1.05 -0.02 1.25 4.39 -1.26 0.45 114.58 120.34 2x60 h GLU 130 Ca 0.08 -0.06 -0.26 0.00 0.34 0.00 0.00 59.36 59.46 2x60 h GLU 130 Cb 0.20 -0.24 0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2x60 h GLU 130 CO -0.19 0.69 -0.99 -0.22 -1.16 0.00 0.00 179.01 177.14 2x60 h LYS 131 N 1.08 0.69 0.00 2.33 3.64 -0.41 -3.38 116.57 120.51 2x60 h LYS 131 Ca 0.43 -0.71 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 2x60 h LYS 131 Cb 0.24 0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2x60 h LYS 131 CO -0.19 1.30 0.00 0.66 -2.27 0.00 0.00 179.45 178.94 2x60 n TYR 132 N -3.86 0.00 -2.91 1.91 4.02 0.28 -5.09 117.16 111.51 2x60 n TYR 132 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.79 2x60 n TYR 132 Cb 0.86 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.18 2x60 n TYR 132 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2x60 n ASP 133 N -0.68 0.00 0.00 7.72 9.92 0.16 -5.01 116.55 128.65 2x60 n ASP 133 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2x60 n ASP 133 Cb 0.01 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.49 2x60 n ASP 133 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2x60 n GLY 134 N 0.00 -2.23 3.30 0.44 0.00 -1.26 -4.72 105.19 100.72 2x60 n GLY 134 Ca 0.00 -1.51 -0.34 0.00 0.00 0.00 0.00 46.02 44.16 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 0.00 2.79 -0.04 0.99 1.43 0.07 -4.72 118.68 119.19 2x60 s LEU 135 Ca 0.00 -0.41 -0.08 0.00 -1.03 0.00 0.00 54.13 52.62 2x60 s LEU 135 Cb 0.00 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.48 2x60 s LEU 135 CO 0.00 0.01 0.24 -0.36 0.23 0.00 0.00 176.35 176.47 2x60 s PHE 136 N 1.29 3.61 0.22 0.29 0.40 -0.59 -0.68 117.98 122.52 2x60 s PHE 136 Ca 0.03 0.61 0.10 0.00 -0.60 0.00 0.00 56.93 57.07 2x60 s PHE 136 Cb -0.14 -2.01 -0.05 0.00 0.51 0.00 0.00 43.02 41.33 2x60 s PHE 136 CO -0.03 0.66 -0.19 0.95 0.70 0.00 0.00 175.22 177.31 2x60 s THR 137 N -1.17 2.13 -0.35 0.64 -4.23 -0.75 -1.83 115.64 110.07 2x60 s THR 137 Ca 0.23 -2.16 -0.07 0.00 -1.18 0.00 0.00 61.69 58.51 2x60 s THR 137 Cb -0.13 -2.09 0.04 0.00 1.34 0.00 0.00 72.50 71.66 2x60 s THR 137 CO 0.12 -0.35 0.13 -0.36 -0.54 0.00 0.00 174.62 173.61 2x60 s PHE 138 N -2.29 3.27 -0.24 3.99 0.40 -1.20 -1.44 117.98 120.46 2x60 s PHE 138 Ca 0.23 -1.42 -0.17 0.00 -0.60 0.00 0.00 56.93 54.96 2x60 s PHE 138 Cb -0.05 -2.36 -0.03 0.00 0.51 0.00 0.00 43.02 41.09 2x60 s PHE 138 CO 0.10 -0.74 0.48 0.20 0.70 0.00 0.00 175.22 175.97 2x60 s GLY 139 N 1.48 1.92 0.25 4.36 0.00 0.30 -2.66 107.32 112.97 2x60 s GLY 139 Ca -0.01 -0.58 -0.22 0.00 0.00 0.00 0.00 44.72 43.91 2x60 s GLY 139 CO 0.03 1.13 0.80 -0.42 0.00 0.00 0.00 173.10 174.63 2x60 s ILE 140 N 2.04 4.44 -0.01 0.90 -1.09 -0.35 -0.21 121.20 126.92 2x60 s ILE 140 Ca 0.21 1.48 -0.30 0.00 -2.23 0.00 0.00 60.65 59.81 2x60 s ILE 140 Cb -0.15 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.76 2x60 s ILE 140 CO 0.09 0.21 1.19 -0.69 -1.23 0.00 0.00 174.94 174.51 2x60 s VAL 141 N -1.53 4.20 0.24 2.92 1.01 -1.15 -0.80 120.40 125.28 2x60 s VAL 141 Ca 0.45 1.55 -0.30 0.00 0.00 0.00 0.00 61.98 63.68 2x60 s VAL 141 Cb -0.18 -4.00 -0.09 0.00 0.00 0.00 0.00 36.38 32.12 2x60 s VAL 141 CO 0.22 0.05 1.30 -2.84 0.00 0.00 0.00 175.10 173.83 2x60 s PRO 142 N 1.72 4.40 0.00 2.72 0.02 -1.26 -4.90 135.00 137.69 2x60 s PRO 142 Ca 0.57 2.08 0.16 0.00 0.02 0.00 0.00 61.00 63.83 2x60 s PRO 142 Cb -0.26 -3.16 -0.14 0.00 0.02 0.00 0.00 34.50 30.95 2x60 s PRO 142 CO 0.25 -0.21 0.72 0.25 -0.33 0.00 0.00 177.00 177.68 2x60 n THR 143 N 2.10 0.00 -3.93 0.99 -2.24 -1.26 -5.04 114.28 104.89 2x60 n THR 143 Ca 0.04 -0.16 -0.09 0.00 -2.27 0.00 0.00 64.05 61.58 2x60 n THR 143 Cb 0.43 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.66 2x60 n THR 143 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2x60 s ARG 144 N -2.42 1.72 -1.14 -0.78 1.70 -1.26 -5.08 118.95 111.70 2x60 s ARG 144 Ca 0.08 -1.20 -0.03 0.00 -0.47 0.00 0.00 55.73 54.10 2x60 s ARG 144 Cb 0.12 0.54 0.20 0.00 -0.57 0.00 0.00 34.95 35.24 2x60 s ARG 144 CO 0.62 -0.76 2.18 -0.35 -1.08 0.00 0.00 175.30 175.91 2x60 n PRO 145 N -0.44 4.74 -2.17 3.89 -0.04 -1.26 -4.99 135.00 134.73 2x60 n PRO 145 Ca -0.03 -3.87 -0.42 0.00 -0.04 0.00 0.00 63.50 59.14 2x60 n PRO 145 Cb 0.61 -2.53 -0.03 0.00 -0.04 0.00 0.00 33.50 31.51 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 -2.53 4.26 1.27 0.54 2.02 -1.26 -4.68 118.70 118.32 2x60 s GLU 146 Ca 0.48 2.02 -0.17 0.00 0.02 0.00 0.00 54.97 57.33 2x60 s GLU 146 Cb 0.21 -3.62 0.32 0.00 0.10 0.00 0.00 34.13 31.14 2x60 s GLU 146 CO -0.13 -0.63 0.99 0.95 0.02 0.00 0.00 175.26 176.46 2x60 s THR 147 N 2.63 1.68 -1.48 3.63 -4.23 -1.26 -3.82 115.64 112.79 2x60 s THR 147 Ca 0.66 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 61.10 2x60 s THR 147 Cb -0.32 -2.09 0.02 0.00 1.34 0.00 0.00 72.50 71.45 2x60 s THR 147 CO 0.27 0.00 0.81 0.61 -0.54 0.00 0.00 174.62 175.76 2x60 n GLY 148 N 0.95 -0.53 3.02 3.99 0.00 -1.26 -5.01 105.19 106.34 2x60 n GLY 148 Ca 0.07 0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.21 0.99 0.68 1.61 2.02 -1.25 -5.04 117.35 113.15 2x60 s TYR 149 Ca 0.43 -0.24 -0.14 0.00 -0.37 0.00 0.00 57.07 56.75 2x60 s TYR 149 Cb -0.19 -0.69 0.01 0.00 -0.40 0.00 0.00 41.96 40.69 2x60 s TYR 149 CO 0.53 -0.08 1.09 0.20 -1.57 0.00 0.00 175.55 175.71 2x60 s GLY 150 N 0.08 1.98 0.22 0.71 0.00 -1.26 -4.10 107.32 104.94 2x60 s GLY 150 Ca -0.01 0.40 0.07 0.00 0.00 0.00 0.00 44.72 45.18 2x60 s GLY 150 CO 0.00 0.74 -0.11 -0.19 0.00 0.00 0.00 173.10 173.54 2x60 s TYR 151 N -2.57 1.75 -0.15 1.90 1.51 -0.53 -0.32 117.35 118.93 2x60 s TYR 151 Ca 0.64 -0.63 -0.00 0.00 -1.01 0.00 0.00 57.07 56.07 2x60 s TYR 151 Cb -0.18 -0.87 0.03 0.00 -0.11 0.00 0.00 41.96 40.83 2x60 s TYR 151 CO 0.45 0.31 -0.09 0.42 -1.11 0.00 0.00 175.55 175.53 2x60 s ILE 152 N -3.02 1.29 0.19 2.71 1.01 0.16 -1.80 121.20 121.73 2x60 s ILE 152 Ca 0.24 -0.58 -0.22 0.00 0.00 0.00 0.00 60.65 60.10 2x60 s ILE 152 Cb 0.01 -1.33 -0.08 0.00 0.01 0.00 0.00 42.46 41.07 2x60 s ILE 152 CO 0.08 0.30 0.72 -0.70 0.00 0.00 0.00 174.94 175.35 2x60 s GLU 153 N 1.58 4.35 -0.11 2.79 2.12 0.37 -0.95 118.70 128.86 2x60 s GLU 153 Ca 0.03 0.95 -0.24 0.00 0.36 0.00 0.00 54.97 56.07 2x60 s GLU 153 Cb -0.14 -3.05 -0.03 0.00 0.26 0.00 0.00 34.13 31.17 2x60 s GLU 153 CO -0.09 0.48 0.74 0.42 -0.54 0.00 0.00 175.26 176.27 2x60 s ILE 154 N -1.35 4.99 0.00 -3.70 1.01 -1.17 -0.71 121.20 120.27 2x60 s ILE 154 Ca 0.39 1.49 0.00 0.00 0.00 0.00 0.00 60.65 62.53 2x60 s ILE 154 Cb -0.19 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.21 2x60 s ILE 154 CO 0.22 0.17 0.00 0.61 0.00 0.00 0.00 174.94 175.94 2x60 n GLY 155 N 3.28 1.25 3.75 6.18 0.00 0.44 -4.35 105.19 115.73 2x60 n GLY 155 Ca 0.01 -1.73 -0.41 0.00 0.00 0.00 0.00 46.02 43.88 2x60 n GLY 155 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2x60 s GLU 156 N 1.94 4.26 0.38 1.61 -1.05 -1.26 -4.52 118.70 120.05 2x60 s GLU 156 Ca 0.00 2.32 -0.28 0.00 -0.15 0.00 0.00 54.97 56.86 2x60 s GLU 156 Cb 0.00 -3.10 -0.11 0.00 -0.44 0.00 0.00 34.13 30.48 2x60 s GLU 156 CO 0.00 -0.43 1.50 -1.91 0.95 0.00 0.00 175.26 175.37 2x60 n GLU 157 N 2.26 2.71 -0.11 -4.83 2.13 -1.26 -1.88 120.64 119.67 2x60 n GLU 157 Ca 0.07 0.95 -0.17 0.00 0.66 0.00 0.00 57.16 58.66 2x60 n GLU 157 Cb 0.40 -2.69 -0.06 0.00 0.27 0.00 0.00 31.44 29.36 2x60 n GLU 157 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2x60 n LEU 158 N 0.44 1.92 -3.96 4.31 4.77 0.46 -4.91 117.00 120.03 2x60 n LEU 158 Ca 0.01 0.39 -0.09 0.00 -0.03 0.00 0.00 56.01 56.29 2x60 n LEU 158 Cb 0.39 -0.82 -0.08 0.00 -2.33 0.00 0.00 43.42 40.58 2x60 n LEU 158 CO 0.64 0.07 -0.16 -0.70 -1.33 0.00 0.00 177.39 175.91 2x60 s GLU 159 N -2.60 0.88 -0.22 3.23 2.12 -1.08 -5.04 118.70 116.00 2x60 s GLU 159 Ca -0.30 -1.12 -0.42 0.00 0.36 0.00 0.00 54.97 53.48 2x60 s GLU 159 Cb 0.08 0.31 -0.19 0.00 0.26 0.00 0.00 34.13 34.59 2x60 s GLU 159 CO 0.44 -0.27 1.38 -0.85 -0.54 0.00 0.00 175.26 175.42 2x60 n GLU 160 N -0.07 0.24 -0.90 4.30 0.28 -1.26 -0.56 120.64 122.68 2x60 n GLU 160 Ca -0.12 0.09 0.00 0.00 -0.16 0.00 0.00 57.16 56.97 2x60 n GLU 160 Cb 0.62 -1.62 0.00 0.00 1.43 0.00 0.00 31.44 31.87 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 2.87 0.47 2.98 -1.84 0.00 -1.26 -4.98 105.19 103.43 2x60 n GLY 161 Ca 0.25 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.27 1.25 0.09 1.61 1.01 0.28 -2.23 120.40 120.14 2x60 s VAL 162 Ca 0.00 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.54 2x60 s VAL 162 Cb 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 2x60 s VAL 162 CO 0.00 0.40 -0.07 -1.00 0.00 0.00 0.00 175.10 174.43 2x60 s HIS 163 N 1.34 0.88 0.49 5.22 3.76 -0.92 -0.40 115.29 125.65 2x60 s HIS 163 Ca -0.01 -0.88 -0.20 0.00 -0.15 0.00 0.00 55.06 53.83 2x60 s HIS 163 Cb -0.14 -0.51 -0.08 0.00 1.11 0.00 0.00 32.58 32.96 2x60 s HIS 163 CO -0.05 -0.14 1.04 0.15 -0.85 0.00 0.00 174.74 174.88 2x60 s LYS 164 N -3.64 3.77 -0.82 1.40 1.02 -0.79 -0.92 119.74 119.76 2x60 s LYS 164 Ca 0.10 1.34 -0.25 0.00 0.02 0.00 0.00 55.97 57.18 2x60 s LYS 164 Cb 0.04 -2.09 0.01 0.00 -0.52 0.00 0.00 37.83 35.27 2x60 s LYS 164 CO -0.04 -0.46 1.55 0.08 -0.92 0.00 0.00 175.35 175.56 2x60 s VAL 165 N -2.03 3.66 0.25 3.17 1.01 -0.33 0.17 120.40 126.29 2x60 s VAL 165 Ca 0.67 -0.08 -0.05 0.00 0.00 0.00 0.00 61.98 62.51 2x60 s VAL 165 Cb -0.16 -4.63 0.25 0.00 0.00 0.00 0.00 36.38 31.84 2x60 s VAL 165 CO 0.21 -1.56 1.91 0.00 0.00 0.00 0.00 175.10 175.66 2x60 h ALA 166 N 11.13 1.27 -2.02 5.51 0.00 -1.12 -3.44 119.26 130.58 2x60 h ALA 166 Ca -0.08 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 2x60 h ALA 166 Cb 1.05 -0.36 -0.21 0.00 0.00 0.00 0.00 17.79 18.27 2x60 h ALA 166 CO 1.30 0.55 0.08 -1.14 0.00 0.00 0.00 179.25 180.04 2x60 s GLN 167 N -6.10 0.78 -0.40 0.00 2.00 -1.15 -4.90 119.66 109.90 2x60 s GLN 167 Ca -0.13 1.06 -0.03 0.00 -2.00 0.00 0.00 55.36 54.27 2x60 s GLN 167 Cb 0.18 0.31 0.10 0.00 0.80 0.00 0.00 33.01 34.41 2x60 s GLN 167 CO 0.81 -0.12 0.18 0.12 -0.50 0.00 0.00 175.29 175.79 2x60 s PHE 168 N 0.79 3.57 0.34 1.67 2.19 -1.26 0.14 117.98 125.42 2x60 s PHE 168 Ca -0.03 -2.38 0.07 0.00 0.33 0.00 0.00 56.93 54.91 2x60 s PHE 168 Cb -0.05 -3.12 -0.02 0.00 -1.31 0.00 0.00 43.02 38.52 2x60 s PHE 168 CO -0.06 -0.96 0.39 1.03 1.83 0.00 0.00 175.22 177.46 2x60 s ARG 169 N 1.14 2.93 0.14 10.12 1.81 -0.75 -4.97 118.95 129.38 2x60 s ARG 169 Ca 0.07 -1.15 -0.07 0.00 -1.72 0.00 0.00 55.73 52.86 2x60 s ARG 169 Cb -0.22 -2.66 -0.02 0.00 -0.45 0.00 0.00 34.95 31.60 2x60 s ARG 169 CO -0.04 0.07 0.21 -1.21 -0.68 0.00 0.00 175.30 173.65 2x60 s GLU 170 N -4.10 1.05 -0.58 3.54 0.41 -1.26 -1.45 118.70 116.31 2x60 s GLU 170 Ca 0.43 -1.20 -0.18 0.00 -0.41 0.00 0.00 54.97 53.61 2x60 s GLU 170 Cb -0.08 0.34 0.03 0.00 -1.78 0.00 0.00 34.13 32.64 2x60 s GLU 170 CO 0.29 -0.36 0.64 1.63 -0.49 0.00 0.00 175.26 176.97 2x60 n LYS 171 N -0.16 -1.85 -3.03 1.61 4.76 -1.26 -4.93 118.16 113.31 2x60 n LYS 171 Ca -0.08 1.44 -0.40 0.00 -2.87 0.00 0.00 58.31 56.40 2x60 n LYS 171 Cb 0.63 -3.55 -0.05 0.00 -1.84 0.00 0.00 35.03 30.22 2x60 n LYS 171 CO 0.00 0.00 0.00 -2.14 -1.37 0.00 0.00 177.40 173.89 2x60 s PRO 172 N -3.18 4.45 0.83 1.97 0.02 -1.26 -5.03 135.00 132.80 2x60 s PRO 172 Ca 0.20 0.94 -0.11 0.00 0.02 0.00 0.00 61.00 62.05 2x60 s PRO 172 Cb -0.03 -3.43 0.09 0.00 0.02 0.00 0.00 34.50 31.16 2x60 s PRO 172 CO 0.84 0.12 1.12 0.34 -0.33 0.00 0.00 177.00 179.09 2x60 s ASP 173 N 0.59 3.81 0.26 2.53 2.15 -1.26 -4.47 116.67 120.27 2x60 s ASP 173 Ca 0.38 2.03 -0.02 0.00 0.43 0.00 0.00 52.55 55.36 2x60 s ASP 173 Cb -0.18 -2.55 0.52 0.00 -0.30 0.00 0.00 42.92 40.41 2x60 s ASP 173 CO 0.20 -2.51 1.73 0.25 -0.17 0.00 0.00 175.17 174.67 2x60 h LEU 174 N -1.36 0.33 -0.21 -1.34 5.85 -1.97 -0.14 115.31 116.47 2x60 h LEU 174 Ca -0.44 0.11 -0.22 0.00 0.84 0.00 0.00 57.88 58.18 2x60 h LEU 174 Cb 1.25 0.08 0.01 0.00 0.37 0.00 0.00 40.66 42.37 2x60 h LEU 174 CO 0.47 0.11 -0.75 -0.08 -0.34 0.00 0.00 178.44 177.84 2x60 h GLU 175 N 0.47 0.75 0.00 1.25 4.57 -1.97 -2.88 114.58 116.76 2x60 h GLU 175 Ca 0.45 -0.60 -0.01 0.00 -1.18 0.00 0.00 59.36 58.02 2x60 h GLU 175 Cb 0.71 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.41 2x60 h GLU 175 CO -0.42 1.21 -0.04 1.15 -1.18 0.00 0.00 179.01 179.73 2x60 h THR 176 N 0.52 0.62 0.00 0.32 2.02 -1.49 0.28 112.91 115.17 2x60 h THR 176 Ca -0.04 -0.15 -0.18 0.00 0.77 0.00 0.00 66.41 66.81 2x60 h THR 176 Cb 1.37 1.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.85 2x60 h THR 176 CO 0.15 0.04 -0.88 0.00 0.37 0.00 0.00 175.52 175.20 2x60 h ALA 177 N 1.96 0.46 -0.22 6.16 0.00 -1.02 -2.56 119.26 124.04 2x60 h ALA 177 Ca -0.00 -0.79 -0.16 0.00 0.00 0.00 0.00 54.91 53.96 2x60 h ALA 177 Cb 0.09 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.77 2x60 h ALA 177 CO 0.00 1.07 -0.47 0.87 0.00 0.00 0.00 179.25 180.72 2x60 h LYS 178 N 0.00 0.71 -0.43 0.00 1.57 -0.89 -2.92 116.57 114.61 2x60 h LYS 178 Ca -0.02 -0.47 0.08 0.00 -1.87 0.00 0.00 60.65 58.38 2x60 h LYS 178 Cb 1.66 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 33.96 2x60 h LYS 178 CO 0.11 1.09 -0.02 0.87 -0.57 0.00 0.00 179.45 180.93 2x60 h LYS 179 N 0.43 0.09 -0.04 3.15 1.57 -0.59 -2.64 116.57 118.54 2x60 h LYS 179 Ca 0.00 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.81 2x60 h LYS 179 Cb 1.08 -0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.34 2x60 h LYS 179 CO 0.10 0.06 -0.15 0.74 -0.57 0.00 0.00 179.45 179.63 2x60 h PHE 180 N 0.09 -0.39 0.49 -1.35 0.04 -1.41 -3.24 116.94 111.18 2x60 h PHE 180 Ca 0.21 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.98 2x60 h PHE 180 Cb 0.32 0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.65 2x60 h PHE 180 CO -0.30 -0.22 -0.24 0.28 -0.60 0.00 0.00 178.31 177.23 2x60 h VAL 181 N -0.23 0.47 -0.52 -0.55 2.07 -1.41 -3.17 116.25 112.91 2x60 h VAL 181 Ca 0.06 -0.28 0.08 0.00 0.82 0.00 0.00 66.70 67.38 2x60 h VAL 181 Cb 0.32 0.59 -0.08 0.00 -1.52 0.00 0.00 31.29 30.59 2x60 h VAL 181 CO -0.17 0.05 -0.21 -0.62 0.02 0.00 0.00 177.57 176.63 2x60 n GLU 182 N -5.31 -0.13 -0.31 1.57 -0.58 -1.00 -1.76 120.64 113.12 2x60 n GLU 182 Ca -0.11 0.80 0.13 0.00 -0.42 0.00 0.00 57.16 57.55 2x60 n GLU 182 Cb 0.31 -1.19 0.27 0.00 -0.57 0.00 0.00 31.44 30.26 2x60 n GLU 182 CO 0.00 0.00 0.00 0.77 -0.48 0.00 0.00 177.13 177.42 2x60 h SER 183 N 0.00 -0.31 0.00 1.62 0.02 -1.57 -3.46 113.55 109.85 2x60 h SER 183 Ca 0.17 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.36 2x60 h SER 183 Cb 0.30 0.40 0.00 0.00 0.14 0.00 0.00 62.40 63.24 2x60 h SER 183 CO -0.52 -0.27 0.00 0.61 -1.14 0.00 0.00 176.83 175.51 2x60 n GLY 184 N -1.44 3.35 2.56 -3.77 0.00 -0.72 -4.93 105.19 100.24 2x60 n GLY 184 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 2x60 n GLY 184 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2x60 n ARG 185 N -1.41 2.56 -3.87 1.61 1.85 -1.26 -4.97 116.66 111.18 2x60 n ARG 185 Ca 0.00 -4.07 -0.26 0.00 -1.00 0.00 0.00 57.85 52.52 2x60 n ARG 185 Cb 0.00 -1.89 -0.17 0.00 -1.05 0.00 0.00 32.46 29.35 2x60 n ARG 185 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 2x60 s PHE 186 N -3.35 1.32 0.21 2.89 0.40 -1.26 -3.06 117.98 115.13 2x60 s PHE 186 Ca 0.41 -0.67 0.05 0.00 -0.60 0.00 0.00 56.93 56.12 2x60 s PHE 186 Cb 0.41 -1.14 -0.03 0.00 0.51 0.00 0.00 43.02 42.76 2x60 s PHE 186 CO -0.11 -0.49 0.24 -0.51 0.70 0.00 0.00 175.22 175.05 2x60 s LEU 187 N 1.76 4.04 0.07 -0.37 1.43 -0.12 -4.61 118.68 120.88 2x60 s LEU 187 Ca 0.04 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 2x60 s LEU 187 Cb -0.13 -2.60 -0.05 0.00 0.03 0.00 0.00 46.19 43.45 2x60 s LEU 187 CO -0.07 -0.01 1.04 0.26 0.23 0.00 0.00 176.35 177.79 2x60 s TRP 188 N -1.95 3.64 -0.66 0.29 0.51 0.02 0.35 118.94 121.15 2x60 s TRP 188 Ca 0.33 1.63 -0.26 0.00 -2.12 0.00 0.00 56.10 55.68 2x60 s TRP 188 Cb -0.09 -3.19 -0.02 0.00 -0.81 0.00 0.00 33.47 29.36 2x60 s TRP 188 CO 0.26 -0.30 1.86 1.21 -0.51 0.00 0.00 176.95 179.47 2x60 s ASN 189 N 0.61 5.28 0.25 2.95 2.47 0.56 -1.21 114.94 125.84 2x60 s ASN 189 Ca 0.52 0.16 -0.04 0.00 0.42 0.00 0.00 52.86 53.92 2x60 s ASN 189 Cb -0.24 -2.53 0.44 0.00 -1.45 0.00 0.00 41.25 37.46 2x60 s ASN 189 CO 0.30 -2.41 1.76 -1.28 -3.72 0.00 0.00 177.10 171.75 2x60 h SER 190 N 14.29 0.45 0.00 -4.21 0.87 -1.83 -3.42 113.55 119.70 2x60 h SER 190 Ca -0.21 0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2x60 h SER 190 Cb 1.14 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2x60 h SER 190 CO 1.22 0.21 0.00 0.61 -0.53 0.00 0.00 176.83 178.34 2x60 n GLY 191 N -1.32 0.54 3.89 5.77 0.00 -1.26 -5.01 105.19 107.80 2x60 n GLY 191 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.93 3.69 0.05 1.61 -1.94 -1.26 -4.43 119.30 116.08 2x60 s MET 192 Ca 0.00 0.05 -0.08 0.00 -1.71 0.00 0.00 55.69 53.96 2x60 s MET 192 Cb 0.00 -2.77 -0.00 0.00 2.01 0.00 0.00 34.83 34.07 2x60 s MET 192 CO 0.00 0.40 0.15 -0.06 -0.01 0.00 0.00 175.02 175.51 2x60 s PHE 193 N -1.73 0.14 -0.03 -0.03 0.08 -0.70 -3.24 117.98 112.48 2x60 s PHE 193 Ca 0.44 -0.45 0.01 0.00 0.12 0.00 0.00 56.93 57.05 2x60 s PHE 193 Cb -0.12 -0.09 0.02 0.00 -0.57 0.00 0.00 43.02 42.27 2x60 s PHE 193 CO 0.23 -0.43 -0.03 -1.17 -0.10 0.00 0.00 175.22 173.73 2x60 s LEU 194 N -2.30 1.37 0.19 -0.37 2.96 -0.76 0.61 118.68 120.38 2x60 s LEU 194 Ca -0.02 -0.08 -0.20 0.00 -0.22 0.00 0.00 54.13 53.61 2x60 s LEU 194 Cb 0.01 -0.32 0.04 0.00 0.50 0.00 0.00 46.19 46.42 2x60 s LEU 194 CO -0.06 -0.06 0.57 -1.66 -1.32 0.00 0.00 176.35 173.83 2x60 s TRP 195 N 0.80 -0.26 -0.03 5.38 -2.14 -0.98 -1.54 118.94 120.16 2x60 s TRP 195 Ca -0.09 -0.06 -0.18 0.00 2.66 0.00 0.00 56.10 58.43 2x60 s TRP 195 Cb -0.12 0.49 -0.05 0.00 -3.10 0.00 0.00 33.47 30.68 2x60 s TRP 195 CO -0.01 -0.94 0.50 0.15 -2.66 0.00 0.00 176.95 173.99 2x60 s LYS 196 N -3.84 4.20 0.20 3.25 1.02 -1.26 0.19 119.74 123.50 2x60 s LYS 196 Ca 0.07 0.54 -0.18 0.00 0.02 0.00 0.00 55.97 56.42 2x60 s LYS 196 Cb -0.02 -3.33 0.19 0.00 -0.52 0.00 0.00 37.83 34.16 2x60 s LYS 196 CO -0.05 0.42 1.59 0.00 -0.92 0.00 0.00 175.35 176.40 2x60 h ALA 197 N 5.60 0.14 -0.38 5.17 0.00 -1.55 -2.27 119.26 125.97 2x60 h ALA 197 Ca -0.46 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.65 2x60 h ALA 197 Cb 1.20 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 19.70 2x60 h ALA 197 CO 0.69 -0.59 0.18 -0.09 0.00 0.00 0.00 179.25 179.43 2x60 h ARG 198 N -0.10 0.55 -0.77 0.00 2.43 -1.54 -1.82 114.38 113.13 2x60 h ARG 198 Ca 0.28 -0.08 -0.05 0.00 -0.81 0.00 0.00 59.98 59.31 2x60 h ARG 198 Cb 0.55 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 2x60 h ARG 198 CO -0.73 0.49 0.27 1.49 -1.51 0.00 0.00 179.97 179.99 2x60 h GLU 199 N 0.47 1.17 0.21 0.20 4.81 -1.69 -1.90 114.58 117.85 2x60 h GLU 199 Ca 0.13 -0.23 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 2x60 h GLU 199 Cb 0.13 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.33 2x60 h GLU 199 CO -0.02 0.97 -0.10 0.35 -0.73 0.00 0.00 179.01 179.48 2x60 h PHE 200 N 1.13 -0.26 0.00 0.92 3.57 -1.19 -1.56 116.94 119.54 2x60 h PHE 200 Ca 0.25 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 2x60 h PHE 200 Cb 0.26 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.09 2x60 h PHE 200 CO 0.02 -0.07 -0.04 0.82 -2.23 0.00 0.00 178.31 176.82 2x60 h ILE 201 N -0.40 1.00 -0.23 1.41 2.04 -1.25 -1.08 117.51 119.00 2x60 h ILE 201 Ca -0.03 -0.13 -0.12 0.00 1.00 0.00 0.00 64.86 65.59 2x60 h ILE 201 Cb 0.31 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 2x60 h ILE 201 CO 0.05 0.04 -0.33 -0.08 0.00 0.00 0.00 178.15 177.83 2x60 h GLU 202 N 0.00 0.63 -0.06 2.37 4.81 -1.13 -3.03 114.58 118.17 2x60 h GLU 202 Ca -0.00 -0.37 -0.08 0.00 -0.13 0.00 0.00 59.36 58.78 2x60 h GLU 202 Cb 0.07 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2x60 h GLU 202 CO 0.00 0.98 -0.33 0.93 -0.73 0.00 0.00 179.01 179.86 2x60 h GLU 203 N 0.33 0.11 -0.45 1.92 4.39 -0.27 -2.95 114.58 117.67 2x60 h GLU 203 Ca 0.03 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 2x60 h GLU 203 Cb 0.91 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.53 2x60 h GLU 203 CO 0.08 0.44 0.14 0.28 -1.16 0.00 0.00 179.01 178.78 2x60 h VAL 204 N 0.10 1.22 -0.90 3.13 2.07 -1.22 0.55 116.25 121.21 2x60 h VAL 204 Ca 0.01 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.78 2x60 h VAL 204 Cb 0.64 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 31.23 2x60 h VAL 204 CO 0.05 0.27 0.56 0.07 0.02 0.00 0.00 177.57 178.53 2x60 h LYS 205 N 0.59 1.20 0.38 1.57 2.10 -1.44 2.78 116.57 123.75 2x60 h LYS 205 Ca 0.14 -0.10 -0.02 0.00 -2.00 0.00 0.00 60.65 58.68 2x60 h LYS 205 Cb 0.28 -0.26 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 2x60 h LYS 205 CO -0.00 0.83 -0.18 0.28 -2.00 0.00 0.00 179.45 178.37 2x60 h VAL 206 N 1.23 0.36 -0.27 0.07 2.07 -1.29 -3.16 116.25 115.26 2x60 h VAL 206 Ca 0.32 -0.66 -0.09 0.00 0.82 0.00 0.00 66.70 67.09 2x60 h VAL 206 Cb -0.08 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 2x60 h VAL 206 CO -0.06 0.08 -0.18 0.00 0.02 0.00 0.00 177.57 177.42 2x60 s GLU 208 N -4.48 0.94 0.20 0.00 0.41 0.93 -4.94 118.70 111.76 2x60 s GLU 208 Ca -0.13 -1.75 -0.11 0.00 -0.41 0.00 0.00 54.97 52.57 2x60 s GLU 208 Cb 0.08 -0.98 0.13 0.00 -1.78 0.00 0.00 34.13 31.58 2x60 s GLU 208 CO 0.80 -1.36 1.84 -1.00 -0.49 0.00 0.00 175.26 175.04 2x60 h PRO 209 N 5.50 0.94 -0.76 0.39 0.13 -1.48 -0.58 132.00 136.15 2x60 h PRO 209 Ca 0.20 -0.08 0.28 0.00 -0.87 0.00 0.00 66.00 65.52 2x60 h PRO 209 Cb 0.98 -0.20 -0.14 0.00 0.13 0.00 0.00 31.00 31.77 2x60 h PRO 209 CO 0.26 0.67 0.25 0.43 -0.23 0.00 0.00 178.00 179.38 2x60 n SER 210 N -4.55 0.13 0.15 1.44 7.64 -1.26 0.63 113.62 117.79 2x60 n SER 210 Ca 0.06 1.27 -0.09 0.00 1.01 0.00 0.00 58.87 61.12 2x60 n SER 210 Cb 0.05 -0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 62.64 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 0.29 0.11 0.44 1.08 -1.45 -3.37 117.51 114.60 2x60 h ILE 211 Ca 0.57 -0.75 -0.00 0.00 -0.39 0.00 0.00 64.86 64.29 2x60 h ILE 211 Cb 1.41 0.47 -0.01 0.00 -3.07 0.00 0.00 36.82 35.62 2x60 h ILE 211 CO -0.64 0.07 -0.15 0.22 -0.69 0.00 0.00 178.15 176.97 2x60 h TYR 212 N -1.04 -0.41 -0.83 1.37 3.20 0.74 -2.96 116.97 117.04 2x60 h TYR 212 Ca -0.05 0.01 0.19 0.00 3.14 0.00 0.00 58.73 62.02 2x60 h TYR 212 Cb 0.46 0.16 -0.05 0.00 1.54 0.00 0.00 36.73 38.84 2x60 h TYR 212 CO 0.03 -0.18 0.56 0.93 -1.64 0.00 0.00 178.16 177.85 2x60 h GLU 213 N -0.26 0.30 -0.00 1.82 4.39 -1.62 0.27 114.58 119.48 2x60 h GLU 213 Ca -0.01 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2x60 h GLU 213 Cb 0.24 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2x60 h GLU 213 CO -0.04 0.20 -0.19 0.09 -1.16 0.00 0.00 179.01 177.91 2x60 n ASN 214 N -4.45 0.55 0.00 1.42 3.02 -1.21 -4.09 115.26 110.50 2x60 n ASN 214 Ca 0.17 -0.48 0.00 0.00 -0.03 0.00 0.00 54.58 54.24 2x60 n ASN 214 Cb 0.68 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.83 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 -1.03 0.72 -0.11 3.41 4.77 0.59 -4.76 117.00 120.59 2x60 n LEU 215 Ca 0.12 -0.72 -0.13 0.00 -0.03 0.00 0.00 56.01 55.25 2x60 n LEU 215 Cb 0.31 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.37 2x60 n LEU 215 CO 0.26 0.18 0.60 0.07 -1.33 0.00 0.00 177.39 177.18 2x60 h LYS 216 N 0.00 0.77 -0.58 3.23 2.10 -0.78 -3.23 116.57 118.09 2x60 h LYS 216 Ca 0.00 -0.38 -0.35 0.00 -2.00 0.00 0.00 60.65 57.92 2x60 h LYS 216 Cb 0.35 -0.00 -0.21 0.00 -0.90 0.00 0.00 32.23 31.47 2x60 h LYS 216 CO 0.00 1.00 -0.01 -0.25 -2.00 0.00 0.00 179.45 178.19 2x60 n ASP 217 N -4.24 3.74 -4.33 7.07 8.00 -1.26 -4.95 116.55 120.58 2x60 n ASP 217 Ca -0.03 -3.77 -0.34 0.00 0.71 0.00 0.00 54.79 51.36 2x60 n ASP 217 Cb 0.46 -0.65 -0.14 0.00 -0.02 0.00 0.00 41.12 40.76 2x60 n ASP 217 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2x60 s VAL 218 N -3.72 3.18 -0.08 2.53 1.01 -1.22 -5.09 120.40 117.00 2x60 s VAL 218 Ca 0.50 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.60 2x60 s VAL 218 Cb 0.43 -2.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.39 2x60 s VAL 218 CO 0.01 0.48 1.16 -0.62 0.00 0.00 0.00 175.10 176.13 2x60 s ASP 219 N 0.96 7.09 0.35 3.32 2.15 -1.26 -4.95 116.67 124.33 2x60 s ASP 219 Ca -0.01 1.72 0.07 0.00 0.43 0.00 0.00 52.55 54.77 2x60 s ASP 219 Cb -0.15 -2.56 0.77 0.00 -0.30 0.00 0.00 42.92 40.69 2x60 s ASP 219 CO -0.00 -0.57 1.90 -0.65 -0.17 0.00 0.00 175.17 175.67 2x60 h PRO 220 N 7.44 0.71 -0.02 4.34 0.11 -1.96 -2.51 132.00 140.12 2x60 h PRO 220 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2x60 h PRO 220 Cb 1.15 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.10 2x60 h PRO 220 CO 0.89 0.47 0.00 0.54 -0.21 0.00 0.00 178.00 179.69 2x60 n ARG 221 N -4.53 1.45 -2.85 1.05 1.74 -1.26 -4.55 116.66 107.72 2x60 n ARG 221 Ca 0.15 -0.66 -0.43 0.00 -0.77 0.00 0.00 57.85 56.14 2x60 n ARG 221 Cb 0.38 -1.47 -0.03 0.00 -1.02 0.00 0.00 32.46 30.31 2x60 n ARG 221 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2x60 s ASN 222 N -1.94 6.35 0.22 0.55 -0.87 -0.94 -4.92 114.94 113.38 2x60 s ASN 222 Ca 0.40 -1.35 -0.08 0.00 -1.57 0.00 0.00 52.86 50.26 2x60 s ASN 222 Cb 0.21 -2.43 0.27 0.00 -0.02 0.00 0.00 41.25 39.28 2x60 s ASN 222 CO 0.33 -1.34 1.82 0.15 -2.57 0.00 0.00 177.10 175.50 2x60 h PHE 223 N 9.37 0.78 0.00 2.20 3.57 -1.86 -0.17 116.94 130.83 2x60 h PHE 223 Ca -0.10 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.31 2x60 h PHE 223 Cb 1.05 -0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.53 2x60 h PHE 223 CO 1.06 0.38 -0.52 1.49 -2.23 0.00 0.00 178.31 178.50 2x60 h GLU 224 N 0.78 0.00 0.31 1.11 4.57 -1.96 0.31 114.58 119.69 2x60 h GLU 224 Ca 0.32 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.49 2x60 h GLU 224 Cb 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 2x60 h GLU 224 CO -0.18 0.52 -0.15 0.93 -1.18 0.00 0.00 179.01 178.95 2x60 h GLU 225 N 0.00 -0.40 -0.78 1.92 5.08 -1.82 -2.86 114.58 115.72 2x60 h GLU 225 Ca -0.01 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.57 2x60 h GLU 225 Cb 0.99 0.09 -0.13 0.00 0.50 0.00 0.00 28.75 30.20 2x60 h GLU 225 CO 0.07 -0.13 0.12 1.25 -1.00 0.00 0.00 179.01 179.32 2x60 h LEU 226 N -1.02 -0.14 0.09 1.33 5.85 -0.95 0.28 115.31 120.75 2x60 h LEU 226 Ca -0.04 0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.88 2x60 h LEU 226 Cb 0.45 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 2x60 h LEU 226 CO 0.07 -0.13 -0.48 0.50 -0.34 0.00 0.00 178.44 178.06 2x60 h LYS 227 N 0.18 -0.67 -0.68 1.25 3.64 -1.04 0.60 116.57 119.86 2x60 h LYS 227 Ca 0.45 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.95 2x60 h LYS 227 Cb 0.83 0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.76 2x60 h LYS 227 CO -0.61 -0.45 0.45 0.87 -2.27 0.00 0.00 179.45 177.44 2x60 h LYS 228 N -0.69 0.64 0.03 1.90 1.57 -0.28 -2.58 116.57 117.15 2x60 h LYS 228 Ca 0.01 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.67 2x60 h LYS 228 Cb 0.72 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 32.90 2x60 h LYS 228 CO -0.29 0.42 -0.34 0.00 -0.57 0.00 0.00 179.45 178.68 2x60 h ALA 229 N 1.64 -0.00 0.00 3.86 0.00 -0.76 -3.30 119.26 120.70 2x60 h ALA 229 Ca 0.30 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2x60 h ALA 229 Cb 0.31 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2x60 h ALA 229 CO -0.10 0.15 0.23 1.88 0.00 0.00 0.00 179.25 181.41 2x60 h TYR 230 N -0.56 0.00 0.00 0.00 -1.99 -0.50 0.20 116.97 114.12 2x60 h TYR 230 Ca -0.05 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.66 2x60 h TYR 230 Cb 1.17 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.89 2x60 h TYR 230 CO 0.20 0.00 -0.08 0.93 -0.00 0.00 0.00 178.16 179.22 2x60 h GLU 231 N 0.00 0.00 -0.01 4.88 5.08 -1.57 -2.99 114.58 119.97 2x60 h GLU 231 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2x60 h GLU 231 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 2x60 h GLU 231 CO 0.00 0.08 -0.26 1.63 -1.00 0.00 0.00 179.01 179.46 2x60 n LYS 232 N -3.62 1.84 -2.87 2.33 5.02 0.70 -5.01 118.16 116.55 2x60 n LYS 232 Ca -0.02 -0.73 -0.40 0.00 -2.02 0.00 0.00 58.31 55.14 2x60 n LYS 232 Cb 0.19 -1.18 -0.05 0.00 -0.02 0.00 0.00 35.03 33.97 2x60 n LYS 232 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2x60 s VAL 233 N -1.60 4.40 0.38 -0.18 1.01 -1.13 -4.93 120.40 118.34 2x60 s VAL 233 Ca 0.11 1.87 -0.24 0.00 0.00 0.00 0.00 61.98 63.72 2x60 s VAL 233 Cb 0.10 -4.22 -0.10 0.00 0.00 0.00 0.00 36.38 32.16 2x60 s VAL 233 CO 0.32 0.44 0.99 -2.16 0.00 0.00 0.00 175.10 174.69 2x60 s PRO 234 N -0.66 4.33 -0.75 2.72 0.04 -1.26 -4.98 135.00 134.44 2x60 s PRO 234 Ca 0.40 1.36 -0.21 0.00 0.04 0.00 0.00 61.00 62.59 2x60 s PRO 234 Cb -0.23 -2.56 0.09 0.00 0.04 0.00 0.00 34.50 31.84 2x60 s PRO 234 CO 0.28 0.04 1.00 0.45 0.04 0.00 0.00 177.00 178.81 2x60 s SER 235 N -1.71 6.33 0.04 6.66 0.15 -1.26 -4.80 113.70 119.11 2x60 s SER 235 Ca 0.56 -1.40 -0.01 0.00 0.70 0.00 0.00 55.95 55.81 2x60 s SER 235 Cb -0.18 -2.40 -0.03 0.00 -1.71 0.00 0.00 66.02 61.69 2x60 s SER 235 CO 0.23 -1.29 -0.03 -0.51 1.20 0.00 0.00 173.24 172.84 2x60 s ILE 236 N 3.48 0.18 0.82 6.45 2.07 -1.14 -4.91 121.20 128.16 2x60 s ILE 236 Ca 0.25 -1.49 -0.12 0.00 -1.41 0.00 0.00 60.65 57.88 2x60 s ILE 236 Cb -0.13 -1.08 0.09 0.00 0.13 0.00 0.00 42.46 41.47 2x60 s ILE 236 CO 0.03 -0.82 1.16 -0.94 -1.91 0.00 0.00 174.94 172.45 2x60 s SER 237 N -2.41 4.37 0.27 4.50 1.04 -1.26 -2.77 113.70 117.44 2x60 s SER 237 Ca -0.01 0.87 -0.04 0.00 0.48 0.00 0.00 55.95 57.25 2x60 s SER 237 Cb 0.02 -1.42 0.35 0.00 0.10 0.00 0.00 66.02 65.06 2x60 s SER 237 CO -0.07 -2.00 1.94 0.58 0.98 0.00 0.00 173.24 174.67 2x60 h VAL 238 N -1.12 1.24 0.13 5.02 2.07 -1.89 -2.42 116.25 119.27 2x60 h VAL 238 Ca -0.47 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 2x60 h VAL 238 Cb 1.32 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 2x60 h VAL 238 CO 0.65 0.23 -0.06 0.44 0.02 0.00 0.00 177.57 178.85 2x60 h ASP 239 N 1.23 -0.15 -0.70 0.57 5.19 -1.94 0.23 116.42 120.85 2x60 h ASP 239 Ca 0.33 -0.40 -0.07 0.00 -0.62 0.00 0.00 57.03 56.27 2x60 h ASP 239 Cb -0.12 0.04 -0.03 0.00 0.18 0.00 0.00 39.33 39.40 2x60 h ASP 239 CO -0.07 0.43 0.18 1.88 -3.12 0.00 0.00 179.24 178.54 2x60 h TYR 240 N -0.84 1.17 -0.04 4.55 0.05 -1.96 0.40 116.97 120.29 2x60 h TYR 240 Ca -0.02 -0.13 -0.01 0.00 0.05 0.00 0.00 58.73 58.62 2x60 h TYR 240 Cb 0.54 -0.33 -0.00 0.00 1.01 0.00 0.00 36.73 37.95 2x60 h TYR 240 CO 0.10 0.94 -0.01 0.00 -1.05 0.00 0.00 178.16 178.13 2x60 h ALA 241 N 1.13 0.06 0.00 3.88 0.00 -1.42 -3.43 119.26 119.49 2x60 h ALA 241 Ca 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2x60 h ALA 241 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2x60 h ALA 241 CO -0.00 -0.22 0.00 0.28 0.00 0.00 0.00 179.25 179.31 2x60 n VAL 242 N -4.84 1.00 0.27 0.00 0.31 0.76 -4.60 118.33 111.23 2x60 n VAL 242 Ca -0.07 0.33 0.18 0.00 -0.01 0.00 0.00 64.34 64.77 2x60 n VAL 242 Cb 0.23 -1.45 0.96 0.00 -0.91 0.00 0.00 33.84 32.67 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 0.00 0.00 0.00 5.55 2.86 -0.92 -0.76 114.93 121.66 2x60 h MET 243 Ca 0.00 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 2x60 h MET 243 Cb 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.66 2x60 h MET 243 CO 0.00 0.00 -0.26 0.93 1.06 0.00 0.00 176.91 178.64 2x60 h GLU 244 N 0.00 0.00 -0.13 1.72 5.08 -1.20 -3.40 114.58 116.65 2x60 h GLU 244 Ca 0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2x60 h GLU 244 Cb 0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2x60 h GLU 244 CO 0.00 0.29 -0.26 0.87 -1.00 0.00 0.00 179.01 178.92 2x60 h LYS 245 N -1.00 0.23 -6.73 2.33 1.57 -1.66 -3.46 116.57 107.85 2x60 h LYS 245 Ca -0.04 -0.08 -0.52 0.00 -1.87 0.00 0.00 60.65 58.15 2x60 h LYS 245 Cb 0.45 -0.02 0.03 0.00 0.08 0.00 0.00 32.23 32.78 2x60 h LYS 245 CO -0.02 0.48 0.61 0.45 -0.57 0.00 0.00 179.45 180.40 2x60 s SER 246 N -6.88 6.95 0.00 0.86 0.15 -0.35 -4.94 113.70 109.49 2x60 s SER 246 Ca -0.05 2.42 0.26 0.00 0.70 0.00 0.00 55.95 59.27 2x60 s SER 246 Cb 0.14 -2.62 1.05 0.00 -1.71 0.00 0.00 66.02 62.88 2x60 s SER 246 CO 0.75 -0.46 1.73 0.29 1.20 0.00 0.00 173.24 176.75 2x60 n LYS 247 N 2.08 1.58 -3.08 5.44 5.02 -1.26 -3.86 118.16 124.08 2x60 n LYS 247 Ca 0.04 -0.85 -0.24 0.00 -2.02 0.00 0.00 58.31 55.24 2x60 n LYS 247 Cb 0.43 -1.44 -0.04 0.00 -0.02 0.00 0.00 35.03 33.95 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 0.05 2.25 -3.96 1.97 5.02 -1.26 -5.05 118.16 117.18 2x60 n LYS 248 Ca 0.18 -4.25 -0.35 0.00 -2.02 0.00 0.00 58.31 51.88 2x60 n LYS 248 Cb 0.31 -2.00 -0.10 0.00 -0.02 0.00 0.00 35.03 33.21 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 -3.40 4.73 0.34 -0.18 1.01 -1.25 -0.76 120.40 120.90 2x60 s VAL 249 Ca 0.44 -0.05 0.09 0.00 0.00 0.00 0.00 61.98 62.46 2x60 s VAL 249 Cb 0.29 -3.15 -0.05 0.00 0.00 0.00 0.00 36.38 33.46 2x60 s VAL 249 CO -0.11 0.43 -0.00 -0.13 0.00 0.00 0.00 175.10 175.30 2x60 s ARG 250 N 0.60 2.05 -0.05 2.72 1.81 0.15 -1.19 118.95 125.04 2x60 s ARG 250 Ca 0.03 -1.76 0.00 0.00 -1.72 0.00 0.00 55.73 52.29 2x60 s ARG 250 Cb -0.13 -1.91 0.02 0.00 -0.45 0.00 0.00 34.95 32.48 2x60 s ARG 250 CO 0.01 0.14 -0.03 0.08 -0.68 0.00 0.00 175.30 174.83 2x60 s VAL 251 N -2.52 0.49 -0.02 3.52 1.01 -0.10 -1.82 120.40 120.97 2x60 s VAL 251 Ca 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 2x60 s VAL 251 Cb -0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 2x60 s VAL 251 CO 0.19 0.23 0.06 -0.69 0.00 0.00 0.00 175.10 174.89 2x60 s VAL 252 N 1.19 4.62 -0.24 2.92 1.01 -0.52 -2.17 120.40 127.21 2x60 s VAL 252 Ca -0.07 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.22 2x60 s VAL 252 Cb -0.14 -3.08 0.01 0.00 0.00 0.00 0.00 36.38 33.17 2x60 s VAL 252 CO -0.02 0.39 1.09 -0.75 0.00 0.00 0.00 175.10 175.82 2x60 s LYS 253 N -1.58 4.21 -0.62 2.72 2.20 -0.95 -0.54 119.74 125.19 2x60 s LYS 253 Ca 0.21 1.35 -0.15 0.00 -0.36 0.00 0.00 55.97 57.02 2x60 s LYS 253 Cb -0.12 -3.68 0.15 0.00 -1.51 0.00 0.00 37.83 32.67 2x60 s LYS 253 CO 0.12 -0.70 0.57 0.00 -0.36 0.00 0.00 175.35 174.97 2x60 s ALA 254 N 3.36 3.76 -1.20 3.13 0.00 0.71 -4.90 121.76 126.61 2x60 s ALA 254 Ca 0.46 -2.77 -0.09 0.00 0.00 0.00 0.00 51.96 49.57 2x60 s ALA 254 Cb -0.16 -3.31 0.22 0.00 0.00 0.00 0.00 23.12 19.87 2x60 s ALA 254 CO 0.09 -2.09 1.62 -3.47 0.00 0.00 0.00 175.76 171.92 2x60 n ASP 255 N 4.85 5.51 -3.78 0.00 2.03 -1.26 -2.93 116.55 120.97 2x60 n ASP 255 Ca -0.06 -3.16 -0.10 0.00 0.52 0.00 0.00 54.79 52.00 2x60 n ASP 255 Cb 0.42 -1.43 -0.05 0.00 -0.72 0.00 0.00 41.12 39.34 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 -0.42 0.01 0.08 -0.67 -0.12 -1.26 -5.04 117.98 110.57 2x60 s PHE 256 Ca 0.37 -0.35 -0.31 0.00 -0.05 0.00 0.00 56.93 56.59 2x60 s PHE 256 Cb 0.04 0.24 -0.08 0.00 -0.63 0.00 0.00 43.02 42.60 2x60 s PHE 256 CO 0.02 -0.82 1.47 -2.00 -0.05 0.00 0.00 175.22 173.84 2x60 s GLU 257 N -3.89 4.27 -0.15 1.99 2.56 -1.26 -4.80 118.70 117.43 2x60 s GLU 257 Ca 0.10 2.14 -0.14 0.00 0.00 0.00 0.00 54.97 57.07 2x60 s GLU 257 Cb 0.01 -3.39 0.04 0.00 2.00 0.00 0.00 34.13 32.78 2x60 s GLU 257 CO -0.04 -0.56 0.40 -0.46 -0.56 0.00 0.00 175.26 174.04 2x60 s TRP 258 N 1.77 -0.44 0.00 5.30 -0.00 -1.26 -4.13 118.94 120.18 2x60 s TRP 258 Ca 0.67 1.07 -0.04 0.00 -0.00 0.00 0.00 56.10 57.80 2x60 s TRP 258 Cb -0.37 0.15 -0.01 0.00 -0.00 0.00 0.00 33.47 33.25 2x60 s TRP 258 CO 0.30 -0.21 0.06 0.45 -0.00 0.00 0.00 176.95 177.55 2x60 s SER 259 N 0.24 0.09 -0.29 5.86 0.15 -0.98 -5.00 113.70 113.77 2x60 s SER 259 Ca -0.00 -0.26 -0.06 0.00 0.70 0.00 0.00 55.95 56.32 2x60 s SER 259 Cb -0.03 0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2x60 s SER 259 CO 0.00 -0.29 0.07 -0.62 1.20 0.00 0.00 173.24 173.60 2x60 s ASP 260 N -1.18 5.06 -0.53 5.45 2.15 -1.26 -1.32 116.67 125.04 2x60 s ASP 260 Ca -0.13 -0.77 -0.14 0.00 0.43 0.00 0.00 52.55 51.94 2x60 s ASP 260 Cb -0.07 -1.86 -0.13 0.00 -0.30 0.00 0.00 42.92 40.56 2x60 s ASP 260 CO 0.00 -0.20 1.74 0.18 -0.17 0.00 0.00 175.17 176.73 2x60 n LEU 261 N 4.84 3.02 -0.01 -1.34 7.99 -0.40 -4.48 117.00 126.62 2x60 n LEU 261 Ca -0.15 -2.29 -0.01 0.00 -0.01 0.00 0.00 56.01 53.56 2x60 n LEU 261 Cb 0.47 -0.88 -0.01 0.00 -0.11 0.00 0.00 43.42 42.90 2x60 n LEU 261 CO 0.31 -0.52 0.03 1.23 -1.51 0.00 0.00 177.39 176.93 2x60 h GLY 262 N 12.13 -0.07 -1.91 -0.72 0.00 -1.95 -3.49 103.07 107.06 2x60 h GLY 262 Ca 0.34 0.03 -0.44 0.00 0.00 0.00 0.00 47.33 47.25 2x60 h GLY 262 CO 1.64 -0.03 -0.54 0.54 0.00 0.00 0.00 176.54 178.15 2x60 s ASN 263 N -5.09 1.71 0.60 0.19 2.20 -1.26 -4.71 114.94 108.59 2x60 s ASN 263 Ca -0.01 -1.61 0.33 0.00 -0.94 0.00 0.00 52.86 50.63 2x60 s ASN 263 Cb 0.00 0.44 1.94 0.00 -2.00 0.00 0.00 41.25 41.62 2x60 s ASN 263 CO 0.03 -0.93 2.28 -0.50 -2.94 0.00 0.00 177.10 175.04 2x60 h TRP 264 N 2.15 0.00 -0.05 1.54 4.06 -1.83 -0.40 115.95 121.42 2x60 h TRP 264 Ca -0.32 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.61 2x60 h TRP 264 Cb 1.25 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.41 2x60 h TRP 264 CO 1.21 0.00 -0.05 1.03 -3.56 0.00 0.00 178.44 177.08 2x60 h SER 265 N 0.00 0.06 -0.44 -3.49 0.87 -1.93 -2.72 113.55 105.91 2x60 h SER 265 Ca -0.00 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.48 2x60 h SER 265 Cb 0.01 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2x60 h SER 265 CO 0.00 0.12 -0.02 0.28 -0.53 0.00 0.00 176.83 176.68 2x60 h SER 266 N 0.07 0.77 -0.52 6.23 0.02 -1.37 -2.00 113.55 116.74 2x60 h SER 266 Ca 0.02 -0.32 -0.02 0.00 -0.84 0.00 0.00 61.79 60.62 2x60 h SER 266 Cb 0.13 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.44 2x60 h SER 266 CO 0.01 0.90 0.23 0.58 -1.14 0.00 0.00 176.83 177.41 2x60 h VAL 267 N 0.62 1.21 -0.34 2.27 2.07 -1.61 -2.54 116.25 117.93 2x60 h VAL 267 Ca 0.12 -0.62 0.07 0.00 0.82 0.00 0.00 66.70 67.10 2x60 h VAL 267 Cb 0.52 0.65 -0.07 0.00 -1.52 0.00 0.00 31.29 30.87 2x60 h VAL 267 CO 0.03 0.24 -0.13 -0.09 0.02 0.00 0.00 177.57 177.64 2x60 h ARG 268 N 0.69 -0.06 0.00 1.57 1.12 -1.41 -0.90 114.38 115.39 2x60 h ARG 268 Ca 0.18 0.00 -0.00 0.00 -1.11 0.00 0.00 59.98 59.05 2x60 h ARG 268 Cb 0.16 0.01 -0.00 0.00 -0.01 0.00 0.00 29.97 30.13 2x60 h ARG 268 CO -0.02 -0.04 -0.00 0.93 -3.11 0.00 0.00 179.97 177.73 2x60 h GLU 269 N -0.06 0.00 0.03 0.20 4.39 -1.00 2.41 114.58 120.55 2x60 h GLU 269 Ca 0.17 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.87 2x60 h GLU 269 Cb 0.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 2x60 h GLU 269 CO -0.38 0.00 -0.02 0.82 -1.16 0.00 0.00 179.01 178.27 2x60 h ILE 270 N 0.00 0.63 -0.00 3.13 1.08 -0.78 -3.39 117.51 118.17 2x60 h ILE 270 Ca -0.00 -1.41 0.00 0.00 -0.39 0.00 0.00 64.86 63.06 2x60 h ILE 270 Cb 0.01 1.17 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 2x60 h ILE 270 CO 0.00 0.21 -0.83 -1.84 -0.69 0.00 0.00 178.15 174.99 2x60 n GLU 271 N -4.76 0.32 0.00 2.37 0.28 -0.88 -5.08 120.64 112.89 2x60 n GLU 271 Ca -0.04 -0.26 0.00 0.00 -0.16 0.00 0.00 57.16 56.70 2x60 n GLU 271 Cb 0.18 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.56 2x60 n GLU 271 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2x60 n GLY 272 N 1.48 -0.48 3.77 -1.84 0.00 0.81 -4.91 105.19 104.02 2x60 n GLY 272 Ca 0.06 -1.76 -0.40 0.00 0.00 0.00 0.00 46.02 43.91 2x60 n GLY 272 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2x60 n TYR 273 N -0.50 2.82 -2.54 1.61 4.01 -1.26 -4.84 117.16 116.46 2x60 n TYR 273 Ca 0.00 0.44 -0.41 0.00 -0.16 0.00 0.00 57.90 57.77 2x60 n TYR 273 Cb 0.00 -2.49 -0.04 0.00 -0.31 0.00 0.00 39.34 36.50 2x60 n TYR 273 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2x60 s THR 274 N -1.17 3.92 0.21 -0.72 2.01 0.17 -4.97 115.64 115.10 2x60 s THR 274 Ca 0.59 1.67 -0.06 0.00 0.31 0.00 0.00 61.69 64.20 2x60 s THR 274 Cb -0.45 -4.07 -0.06 0.00 0.01 0.00 0.00 72.50 67.93 2x60 s THR 274 CO 0.59 0.29 0.48 -1.61 -0.69 0.00 0.00 174.62 173.68 2x60 s GLU 275 N -0.39 3.68 0.41 4.92 2.02 -1.26 -4.63 118.70 123.45 2x60 s GLU 275 Ca 0.49 0.04 -0.26 0.00 0.02 0.00 0.00 54.97 55.26 2x60 s GLU 275 Cb -0.29 -2.73 -0.10 0.00 0.10 0.00 0.00 34.13 31.11 2x60 s GLU 275 CO 0.34 0.35 1.31 -1.91 0.02 0.00 0.00 175.26 175.38 2x60 n GLU 276 N -0.29 2.06 -1.93 1.61 2.13 -1.26 -4.86 120.64 118.10 2x60 n GLU 276 Ca -0.01 0.73 -0.03 0.00 0.66 0.00 0.00 57.16 58.51 2x60 n GLU 276 Cb 0.53 -2.43 0.01 0.00 0.27 0.00 0.00 31.44 29.81 2x60 n GLU 276 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2x60 n SER 277 N 0.24 -0.75 -0.20 4.31 3.41 -0.36 -4.97 113.62 115.30 2x60 n SER 277 Ca 0.06 -1.53 0.13 0.00 -0.26 0.00 0.00 58.87 57.27 2x60 n SER 277 Cb 0.39 1.25 0.45 0.00 -0.26 0.00 0.00 64.21 66.04 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 0.65 0.50 0.14 4.04 5.19 -2.02 -2.90 116.42 122.03 2x60 h ASP 278 Ca -0.11 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.33 2x60 h ASP 278 Cb 0.41 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.84 2x60 h ASP 278 CO 0.14 0.27 -1.12 -0.62 -3.12 0.00 0.00 179.24 174.78 2x60 n GLU 279 N -4.51 0.17 -3.88 3.56 1.02 -1.26 -4.78 120.64 110.96 2x60 n GLU 279 Ca 0.15 -0.03 -0.30 0.00 -0.02 0.00 0.00 57.16 56.95 2x60 n GLU 279 Cb 0.48 -1.52 -0.15 0.00 -0.02 0.00 0.00 31.44 30.22 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 -3.13 1.46 -0.18 2.62 1.01 -1.10 -0.05 120.40 121.03 2x60 s VAL 280 Ca 0.05 -1.53 -0.07 0.00 0.00 0.00 0.00 61.98 60.43 2x60 s VAL 280 Cb 0.15 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2x60 s VAL 280 CO 0.85 -0.42 0.05 -0.63 0.00 0.00 0.00 175.10 174.95 2x60 s ILE 281 N 1.37 4.63 -0.04 2.22 -1.09 -0.22 -1.23 121.20 126.84 2x60 s ILE 281 Ca 0.04 -0.09 0.06 0.00 -2.23 0.00 0.00 60.65 58.43 2x60 s ILE 281 Cb -0.18 -3.08 -0.01 0.00 -1.58 0.00 0.00 42.46 37.60 2x60 s ILE 281 CO -0.13 0.46 -0.22 -0.76 -1.23 0.00 0.00 174.94 173.06 2x60 s LEU 282 N 0.41 2.02 -0.07 2.97 1.43 -1.26 -1.63 118.68 122.55 2x60 s LEU 282 Ca 0.02 -0.42 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2x60 s LEU 282 Cb -0.13 -1.17 0.04 0.00 0.03 0.00 0.00 46.19 44.96 2x60 s LEU 282 CO 0.01 0.23 0.14 -0.69 0.23 0.00 0.00 176.35 176.27 2x60 s VAL 283 N -0.27 -0.16 -0.62 -1.59 1.01 -0.95 -4.88 120.40 112.94 2x60 s VAL 283 Ca 0.02 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.17 2x60 s VAL 283 Cb -0.11 -0.25 0.02 0.00 0.00 0.00 0.00 36.38 36.04 2x60 s VAL 283 CO 0.01 0.12 0.39 0.47 0.00 0.00 0.00 175.10 176.09 2x60 n ASP 284 N 4.83 -2.65 -3.56 3.32 8.00 -1.26 -1.79 116.55 123.44 2x60 n ASP 284 Ca -0.14 -0.70 -0.03 0.00 0.71 0.00 0.00 54.79 54.63 2x60 n ASP 284 Cb 0.51 -0.95 -0.05 0.00 -0.02 0.00 0.00 41.12 40.60 2x60 n ASP 284 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 2x60 s SER 285 N -3.39 -0.85 0.21 -2.24 1.04 -1.26 -0.98 113.70 106.22 2x60 s SER 285 Ca 0.16 1.22 0.06 0.00 0.48 0.00 0.00 55.95 57.88 2x60 s SER 285 Cb -0.09 1.95 -0.04 0.00 0.10 0.00 0.00 66.02 67.94 2x60 s SER 285 CO 0.57 -0.23 0.12 -1.81 0.98 0.00 0.00 173.24 172.87 2x60 s ASP 286 N 2.79 5.32 -0.70 7.02 1.01 -1.25 -4.84 116.67 126.03 2x60 s ASP 286 Ca 0.00 -0.26 -0.06 0.00 0.71 0.00 0.00 52.55 52.95 2x60 s ASP 286 Cb -0.13 -1.31 0.01 0.00 1.01 0.00 0.00 42.92 42.50 2x60 s ASP 286 CO -0.17 0.03 0.65 0.54 0.21 0.00 0.00 175.17 176.43 2x60 n ARG 287 N -0.66 -1.59 -4.95 8.23 1.74 -1.26 -2.12 116.66 116.05 2x60 n ARG 287 Ca -0.08 1.37 -0.27 0.00 -0.77 0.00 0.00 57.85 58.10 2x60 n ARG 287 Cb 0.56 -4.42 -0.16 0.00 -1.02 0.00 0.00 32.46 27.43 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 -2.81 1.56 -0.36 1.55 1.01 -1.26 -0.65 120.40 119.44 2x60 s VAL 288 Ca 0.07 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.24 2x60 s VAL 288 Cb -0.01 -1.31 0.10 0.00 0.00 0.00 0.00 36.38 35.15 2x60 s VAL 288 CO 0.81 0.44 0.10 0.12 0.00 0.00 0.00 175.10 176.57 2x60 s PHE 289 N -0.29 3.69 0.01 5.22 5.36 -0.82 0.43 117.98 131.57 2x60 s PHE 289 Ca 0.03 -2.77 0.01 0.00 -0.96 0.00 0.00 56.93 53.25 2x60 s PHE 289 Cb -0.09 -2.99 -0.04 0.00 -0.34 0.00 0.00 43.02 39.56 2x60 s PHE 289 CO 0.00 -0.95 0.04 0.08 -1.46 0.00 0.00 175.22 172.93 2x60 s VAL 290 N 1.00 4.44 -0.17 3.12 1.01 -1.26 -0.70 120.40 127.84 2x60 s VAL 290 Ca 0.09 -0.54 -0.01 0.00 0.00 0.00 0.00 61.98 61.52 2x60 s VAL 290 Cb -0.20 -3.02 0.05 0.00 0.00 0.00 0.00 36.38 33.20 2x60 s VAL 290 CO -0.06 0.33 -0.02 -0.75 0.00 0.00 0.00 175.10 174.60 2x60 s LYS 291 N -1.74 1.08 0.61 2.72 2.20 0.96 -4.90 119.74 120.68 2x60 s LYS 291 Ca 0.22 -0.44 -0.02 0.00 -0.36 0.00 0.00 55.97 55.38 2x60 s LYS 291 Cb -0.12 -1.94 0.04 0.00 -1.51 0.00 0.00 37.83 34.30 2x60 s LYS 291 CO 0.13 -0.49 0.87 0.95 -0.36 0.00 0.00 175.35 176.44 2x60 s THR 292 N 1.73 2.52 -0.45 3.43 -4.23 -1.26 -1.51 115.64 115.87 2x60 s THR 292 Ca 0.00 -0.52 0.07 0.00 -1.18 0.00 0.00 61.69 60.06 2x60 s THR 292 Cb -0.16 -3.00 0.24 0.00 1.34 0.00 0.00 72.50 70.93 2x60 s THR 292 CO -0.07 0.00 0.72 1.57 -0.54 0.00 0.00 174.62 176.29 2x60 n HIS 293 N -2.56 -2.05 -1.85 3.99 -0.00 -1.26 -4.83 115.22 106.66 2x60 n HIS 293 Ca 0.08 -2.54 -0.20 0.00 0.46 0.00 0.00 57.72 55.52 2x60 n HIS 293 Cb 0.60 0.73 -0.06 0.00 -0.12 0.00 0.00 29.99 31.13 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 1.62 -5.58 -3.59 0.26 3.02 -1.26 -4.98 115.26 104.74 2x60 n ASN 294 Ca 0.15 0.34 -0.16 0.00 -0.03 0.00 0.00 54.58 54.88 2x60 n ASN 294 Cb 0.58 -4.79 -0.07 0.00 -0.61 0.00 0.00 39.78 34.90 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 -4.15 0.95 0.59 3.52 -2.85 -1.26 -5.17 119.74 111.37 2x60 s LYS 295 Ca 0.00 0.04 -0.15 0.00 -1.00 0.00 0.00 55.97 54.85 2x60 s LYS 295 Cb 0.00 0.44 -0.04 0.00 -2.06 0.00 0.00 37.83 36.17 2x60 s LYS 295 CO 0.00 -0.30 1.04 -1.25 0.10 0.00 0.00 175.35 174.94 2x60 s PRO 296 N -1.50 3.42 -0.10 1.78 0.04 -1.26 -4.92 135.00 132.46 2x60 s PRO 296 Ca -0.10 1.12 0.02 0.00 0.04 0.00 0.00 61.00 62.07 2x60 s PRO 296 Cb -0.02 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.49 2x60 s PRO 296 CO 0.06 -0.72 -0.14 0.42 0.04 0.00 0.00 177.00 176.65 2x60 s ILE 297 N -2.56 1.42 -0.18 0.56 1.01 0.93 -5.00 121.20 117.39 2x60 s ILE 297 Ca 0.62 -0.59 -0.07 0.00 0.00 0.00 0.00 60.65 60.61 2x60 s ILE 297 Cb -0.14 -1.30 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2x60 s ILE 297 CO 0.38 0.42 0.05 0.00 0.00 0.00 0.00 174.94 175.79 2x60 s ALA 298 N 1.01 3.36 -0.17 9.38 0.00 -1.26 -1.06 121.76 133.03 2x60 s ALA 298 Ca -0.06 -0.75 -0.04 0.00 0.00 0.00 0.00 51.96 51.11 2x60 s ALA 298 Cb -0.15 -1.87 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 2x60 s ALA 298 CO -0.02 0.19 -0.03 0.08 0.00 0.00 0.00 175.76 175.99 2x60 s VAL 299 N 0.34 3.88 -0.12 0.00 1.01 -0.65 -4.97 120.40 119.88 2x60 s VAL 299 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.65 2x60 s VAL 299 Cb -0.12 -2.71 0.02 0.00 0.00 0.00 0.00 36.38 33.57 2x60 s VAL 299 CO 0.00 0.48 -0.11 -0.69 0.00 0.00 0.00 175.10 174.78 2x60 s VAL 300 N 0.53 1.26 -0.15 2.92 1.01 -1.26 -2.23 120.40 122.47 2x60 s VAL 300 Ca -0.03 -0.44 0.00 0.00 0.00 0.00 0.00 61.98 61.51 2x60 s VAL 300 Cb -0.14 -1.22 0.00 0.00 0.00 0.00 0.00 36.38 35.02 2x60 s VAL 300 CO 0.03 0.40 0.00 0.61 0.00 0.00 0.00 175.10 176.14 2x60 n GLY 301 N 4.76 0.47 3.00 4.51 0.00 -0.16 -5.00 105.19 112.78 2x60 n GLY 301 Ca -0.15 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.34 1.83 0.01 0.99 1.43 -1.19 -4.96 118.68 116.44 2x60 s LEU 302 Ca 0.00 -0.18 0.04 0.00 -1.03 0.00 0.00 54.13 52.96 2x60 s LEU 302 Cb 0.00 -0.53 -0.01 0.00 0.03 0.00 0.00 46.19 45.67 2x60 s LEU 302 CO 0.00 0.07 -0.13 -0.44 0.23 0.00 0.00 176.35 176.08 2x60 s SER 303 N 0.12 1.55 -0.36 2.29 0.01 -1.26 -3.76 113.70 112.30 2x60 s SER 303 Ca -0.02 -0.32 -0.01 0.00 1.31 0.00 0.00 55.95 56.91 2x60 s SER 303 Cb -0.08 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.01 2x60 s SER 303 CO 0.00 0.11 0.31 0.47 0.41 0.00 0.00 173.24 174.53 2x60 n ASP 304 N 2.42 -2.71 -4.41 2.44 9.92 0.17 -4.92 116.55 119.47 2x60 n ASP 304 Ca -0.16 -0.16 -0.29 0.00 -0.53 0.00 0.00 54.79 53.66 2x60 n ASP 304 Cb 0.55 -1.76 -0.13 0.00 -0.64 0.00 0.00 41.12 39.15 2x60 n ASP 304 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 2x60 s VAL 305 N -3.09 2.37 -0.16 2.53 -7.23 -1.21 0.16 120.40 113.76 2x60 s VAL 305 Ca 0.09 -1.70 -0.08 0.00 -1.81 0.00 0.00 61.98 58.49 2x60 s VAL 305 Cb -0.04 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.80 2x60 s VAL 305 CO 0.20 0.10 0.11 -0.63 -0.31 0.00 0.00 175.10 174.57 2x60 s ILE 306 N -1.07 5.25 -0.11 -0.62 -1.09 0.23 -1.94 121.20 121.85 2x60 s ILE 306 Ca 0.15 0.12 -0.00 0.00 -2.23 0.00 0.00 60.65 58.69 2x60 s ILE 306 Cb -0.10 -3.34 0.02 0.00 -1.58 0.00 0.00 42.46 37.46 2x60 s ILE 306 CO 0.07 0.52 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.53 2x60 s VAL 307 N -0.19 1.00 -0.15 2.92 1.01 0.12 -0.62 120.40 124.50 2x60 s VAL 307 Ca 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 2x60 s VAL 307 Cb -0.12 -1.02 0.04 0.00 0.00 0.00 0.00 36.38 35.29 2x60 s VAL 307 CO 0.01 0.36 -0.04 -0.63 0.00 0.00 0.00 175.10 174.80 2x60 s ILE 308 N 1.63 0.92 -0.20 2.22 -1.09 -0.15 -0.03 121.20 124.50 2x60 s ILE 308 Ca 0.03 -0.47 -0.10 0.00 -2.23 0.00 0.00 60.65 57.88 2x60 s ILE 308 Cb -0.13 -1.12 -0.05 0.00 -1.58 0.00 0.00 42.46 39.59 2x60 s ILE 308 CO -0.07 0.13 0.13 -0.62 -1.23 0.00 0.00 174.94 173.28 2x60 s ASP 309 N 1.72 6.17 0.08 3.58 2.15 -0.57 -1.22 116.67 128.58 2x60 s ASP 309 Ca 0.02 0.22 -0.10 0.00 0.43 0.00 0.00 52.55 53.12 2x60 s ASP 309 Cb -0.15 -2.08 0.00 0.00 -0.30 0.00 0.00 42.92 40.39 2x60 s ASP 309 CO -0.07 0.18 0.21 -0.89 -0.17 0.00 0.00 175.17 174.43 2x60 s THR 310 N 0.35 0.13 0.43 1.71 2.01 -0.27 -4.46 115.64 115.54 2x60 s THR 310 Ca 0.08 -1.06 0.12 0.00 0.31 0.00 0.00 61.69 61.14 2x60 s THR 310 Cb -0.11 -1.22 0.21 0.00 0.01 0.00 0.00 72.50 71.38 2x60 s THR 310 CO -0.02 -0.58 2.01 -0.65 -0.69 0.00 0.00 174.62 174.68 2x60 h PRO 311 N 2.89 0.19 0.00 4.92 0.11 -1.98 -2.18 132.00 135.95 2x60 h PRO 311 Ca -0.34 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2x60 h PRO 311 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2x60 h PRO 311 CO 0.54 0.25 0.00 -0.91 -0.21 0.00 0.00 178.00 177.67 2x60 h ASN 312 N 0.18 0.00 -2.92 -2.05 2.35 -1.96 -3.49 115.58 107.69 2x60 h ASN 312 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2x60 h ASN 312 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2x60 h ASN 312 CO 0.01 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.40 2x60 n GLY 313 N -0.43 -0.02 3.35 2.83 0.00 -0.82 -4.99 105.19 105.11 2x60 n GLY 313 Ca 0.00 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.33 2.71 -0.15 -0.61 1.01 -1.26 -1.11 121.20 120.46 2x60 s ILE 314 Ca 0.00 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 59.79 2x60 s ILE 314 Cb 0.00 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 2x60 s ILE 314 CO 0.00 0.55 0.03 -0.22 0.00 0.00 0.00 174.94 175.30 2x60 s LEU 315 N 0.06 3.70 -0.21 2.97 2.96 -0.36 -4.97 118.68 122.82 2x60 s LEU 315 Ca -0.07 0.09 0.00 0.00 -0.22 0.00 0.00 54.13 53.94 2x60 s LEU 315 Cb -0.15 -1.90 0.05 0.00 0.50 0.00 0.00 46.19 44.69 2x60 s LEU 315 CO 0.05 0.25 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.65 2x60 s ILE 316 N -0.10 1.37 -0.03 6.68 1.01 -1.26 -0.97 121.20 127.89 2x60 s ILE 316 Ca 0.05 -1.00 -0.01 0.00 0.00 0.00 0.00 60.65 59.69 2x60 s ILE 316 Cb -0.12 -1.61 0.03 0.00 0.01 0.00 0.00 42.46 40.77 2x60 s ILE 316 CO 0.02 -0.02 0.03 0.00 0.00 0.00 0.00 174.94 174.97 2x60 s LYS 318 N 1.54 4.25 0.10 0.00 2.47 -1.26 0.74 119.74 127.57 2x60 s LYS 318 Ca -0.03 2.33 -0.25 0.00 -1.56 0.00 0.00 55.97 56.46 2x60 s LYS 318 Cb -0.13 -3.12 -0.11 0.00 -1.46 0.00 0.00 37.83 33.02 2x60 s LYS 318 CO -0.03 -0.48 1.69 1.49 0.16 0.00 0.00 175.35 178.18 2x60 h GLU 319 N 5.46 -0.25 -1.36 4.03 4.81 -0.63 0.51 114.58 127.15 2x60 h GLU 319 Ca -0.45 0.02 0.41 0.00 -0.13 0.00 0.00 59.36 59.21 2x60 h GLU 319 Cb 1.21 0.06 -0.10 0.00 0.63 0.00 0.00 28.75 30.55 2x60 h GLU 319 CO 0.81 -0.17 0.92 0.93 -0.73 0.00 0.00 179.01 180.78 2x60 h GLU 320 N -0.26 0.11 -0.01 1.92 5.08 -1.91 -1.09 114.58 118.41 2x60 h GLU 320 Ca 0.02 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2x60 h GLU 320 Cb 0.27 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2x60 h GLU 320 CO -0.06 0.07 -0.05 0.66 -1.00 0.00 0.00 179.01 178.62 2x60 n TYR 321 N -4.45 0.00 -0.27 4.33 4.02 0.16 -4.54 117.16 116.42 2x60 n TYR 321 Ca 0.34 0.00 0.33 0.00 -0.01 0.00 0.00 57.90 58.56 2x60 n TYR 321 Cb 1.40 -0.02 0.72 0.00 -0.02 0.00 0.00 39.34 41.42 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 2.99 0.00 -0.72 0.00 -1.13 0.39 119.26 125.02 2x60 h ALA 322 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2x60 h ALA 322 Cb 0.52 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2x60 h ALA 322 CO 0.00 -1.43 -0.29 0.37 0.00 0.00 0.00 179.25 177.91 2x60 h GLN 323 N 0.00 0.00 0.00 0.00 5.75 -1.83 -3.11 115.11 115.92 2x60 h GLN 323 Ca 0.52 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 59.02 2x60 h GLN 323 Cb 2.24 0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.79 2x60 h GLN 323 CO -0.01 0.29 0.00 1.63 -2.65 0.00 0.00 178.83 178.09 2x60 n LYS 324 N -3.88 0.99 0.25 1.69 4.76 0.14 -3.82 118.16 118.29 2x60 n LYS 324 Ca -0.02 0.00 0.18 0.00 -2.87 0.00 0.00 58.31 55.60 2x60 n LYS 324 Cb 0.37 -1.40 0.88 0.00 -1.84 0.00 0.00 35.03 33.03 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 0.26 -0.44 -0.18 2.07 -1.70 -0.21 116.25 116.05 2x60 h VAL 325 Ca 0.00 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.60 2x60 h VAL 325 Cb 0.00 0.79 -0.09 0.00 -1.52 0.00 0.00 31.29 30.47 2x60 h VAL 325 CO 0.00 0.00 -0.40 0.03 0.02 0.00 0.00 177.57 177.22 2x60 h ARG 326 N 0.00 -0.28 -0.92 1.57 3.08 -1.79 -2.24 114.38 113.80 2x60 h ARG 326 Ca 0.06 0.02 0.26 0.00 0.07 0.00 0.00 59.98 60.40 2x60 h ARG 326 Cb 0.54 0.06 -0.16 0.00 0.08 0.00 0.00 29.97 30.50 2x60 h ARG 326 CO -0.00 -0.19 0.21 0.93 -1.07 0.00 0.00 179.97 179.86 2x60 h GLU 327 N -0.29 0.13 0.21 0.04 5.08 -1.35 0.25 114.58 118.64 2x60 h GLU 327 Ca 0.16 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.52 2x60 h GLU 327 Cb 0.57 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 2x60 h GLU 327 CO -0.59 0.09 -0.30 0.28 -1.00 0.00 0.00 179.01 177.49 2x60 h VAL 328 N 0.13 0.36 -0.17 3.13 2.07 -1.54 0.31 116.25 120.54 2x60 h VAL 328 Ca 0.60 0.00 0.04 0.00 0.82 0.00 0.00 66.70 68.15 2x60 h VAL 328 Cb 1.27 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 2x60 h VAL 328 CO -0.74 0.00 -0.06 0.58 0.02 0.00 0.00 177.57 177.37 2x60 h VAL 329 N -0.57 0.79 -0.40 2.57 2.07 -0.45 0.32 116.25 120.58 2x60 h VAL 329 Ca 0.01 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.60 2x60 h VAL 329 Cb 0.56 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.06 2x60 h VAL 329 CO -0.12 0.00 0.04 0.11 0.02 0.00 0.00 177.57 177.62 2x60 h LYS 330 N -0.03 0.15 0.63 1.57 1.79 -0.42 0.94 116.57 121.20 2x60 h LYS 330 Ca 0.09 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.52 2x60 h LYS 330 Cb 0.16 -0.03 0.01 0.00 -1.58 0.00 0.00 32.23 30.78 2x60 h LYS 330 CO -0.19 0.10 -0.30 0.87 -1.08 0.00 0.00 179.45 178.84 2x60 h LYS 331 N 0.15 -0.81 -0.44 3.15 1.57 -0.70 -3.27 116.57 116.22 2x60 h LYS 331 Ca 0.19 0.06 0.05 0.00 -1.87 0.00 0.00 60.65 59.08 2x60 h LYS 331 Cb 0.26 0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.70 2x60 h LYS 331 CO -0.29 -0.50 0.17 1.25 -0.57 0.00 0.00 179.45 179.52 2x60 h LEU 332 N -1.05 0.20 -1.72 2.94 5.85 0.05 -3.51 115.31 118.06 2x60 h LEU 332 Ca -0.09 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 2x60 h LEU 332 Cb 0.69 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.74 2x60 h LEU 332 CO 0.14 0.15 0.00 0.49 -0.34 0.00 0.00 178.44 178.88