#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h84 s GLU 6 N 0.00 4.33 -0.36 5.55 2.02 -1.26 -4.86 118.70 124.13 3h84 s GLU 6 Ca 0.00 1.98 -0.06 0.00 0.02 0.00 0.00 54.97 56.91 3h84 s GLU 6 Cb 0.00 -2.97 -0.21 0.00 0.10 0.00 0.00 34.13 31.05 3h84 s GLU 6 CO 0.00 -0.12 3.25 -0.35 0.02 0.00 0.00 175.26 178.06 3h84 n PRO 7 N 0.67 2.22 -3.89 0.39 -0.04 -1.26 -4.38 135.00 128.71 3h84 n PRO 7 Ca 0.01 -1.19 -0.08 0.00 -0.04 0.00 0.00 63.50 62.20 3h84 n PRO 7 Cb 0.44 -2.14 -0.02 0.00 -0.04 0.00 0.00 33.50 31.74 3h84 n PRO 7 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3h84 s ASN 8 N 2.15 -0.14 -0.29 3.54 2.20 -1.26 -4.37 114.94 116.78 3h84 s ASN 8 Ca 0.62 -0.80 0.11 0.00 -0.94 0.00 0.00 52.86 51.86 3h84 s ASN 8 Cb 0.26 0.72 0.69 0.00 -2.00 0.00 0.00 41.25 40.92 3h84 s ASN 8 CO -0.01 -1.37 1.69 0.18 -2.94 0.00 0.00 177.10 174.65 3h84 n LEU 9 N -0.46 5.43 -0.23 3.54 4.77 0.20 -4.74 117.00 125.50 3h84 n LEU 9 Ca -0.04 -3.23 -0.02 0.00 -0.03 0.00 0.00 56.01 52.69 3h84 n LEU 9 Cb 0.60 -0.69 0.10 0.00 -2.33 0.00 0.00 43.42 41.09 3h84 n LEU 9 CO 0.19 0.82 1.09 -0.74 -1.33 0.00 0.00 177.39 177.42 3h84 h HIS 10 N 2.40 0.68 -0.18 -1.77 2.76 -1.72 0.24 115.15 117.57 3h84 h HIS 10 Ca 0.19 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.31 3h84 h HIS 10 Cb 2.07 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 30.81 3h84 h HIS 10 CO 1.09 0.32 -0.25 0.66 -1.30 0.00 0.00 177.93 178.46 3h84 h SER 11 N 0.68 0.32 -0.08 3.26 4.64 -1.93 -1.99 113.55 118.45 3h84 h SER 11 Ca 0.30 -0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 61.46 3h84 h SER 11 Cb 0.19 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3h84 h SER 11 CO -0.18 0.57 -0.19 0.25 -0.87 0.00 0.00 176.83 176.41 3h84 h LEU 12 N 0.29 0.30 -1.61 5.97 6.46 -1.79 -2.37 115.31 122.56 3h84 h LEU 12 Ca 0.05 -0.58 0.07 0.00 -0.12 0.00 0.00 57.88 57.29 3h84 h LEU 12 Cb 0.60 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 40.41 3h84 h LEU 12 CO 0.04 0.83 0.37 0.40 -0.62 0.00 0.00 178.44 179.46 3h84 h ILE 13 N -0.21 0.96 -0.20 4.05 2.04 -0.79 -2.23 117.51 121.14 3h84 h ILE 13 Ca -0.00 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.70 3h84 h ILE 13 Cb 0.79 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 3h84 h ILE 13 CO 0.04 0.08 0.00 0.35 0.00 0.00 0.00 178.15 178.63 3h84 n THR 14 N -4.47 0.33 -1.97 -0.27 -2.24 -0.76 -4.53 114.28 100.36 3h84 n THR 14 Ca 0.08 -0.66 -0.41 0.00 -2.27 0.00 0.00 64.05 60.78 3h84 n THR 14 Cb 0.28 1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.58 3h84 n THR 14 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3h84 s SER 15 N -1.35 6.60 0.00 3.42 0.15 -0.84 -4.92 113.70 116.77 3h84 s SER 15 Ca 0.27 2.73 0.17 0.00 0.70 0.00 0.00 55.95 59.82 3h84 s SER 15 Cb 0.17 -2.63 0.29 0.00 -1.71 0.00 0.00 66.02 62.13 3h84 s SER 15 CO 0.24 -0.73 1.20 0.35 1.20 0.00 0.00 173.24 175.50 3h84 n THR 16 N 2.08 0.44 -0.10 6.45 -2.24 -1.26 -4.56 114.28 115.09 3h84 n THR 16 Ca 0.06 -0.72 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 3h84 n THR 16 Cb 0.40 0.98 -0.16 0.00 -2.10 0.00 0.00 70.33 69.45 3h84 n THR 16 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3h84 n THR 17 N 1.02 1.36 -2.37 4.28 -2.24 -1.26 -4.96 114.28 110.11 3h84 n THR 17 Ca 0.14 -0.84 -0.42 0.00 -2.27 0.00 0.00 64.05 60.66 3h84 n THR 17 Cb 0.47 -0.49 -0.03 0.00 -2.10 0.00 0.00 70.33 68.19 3h84 n THR 17 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 3h84 s HIS 18 N -2.48 3.32 -0.14 4.78 4.02 -1.03 -4.34 115.29 119.42 3h84 s HIS 18 Ca -0.10 1.19 0.04 0.00 1.02 0.00 0.00 55.06 57.21 3h84 s HIS 18 Cb 0.06 -3.48 -0.04 0.00 -1.02 0.00 0.00 32.58 28.10 3h84 s HIS 18 CO 0.81 -1.56 0.14 0.36 1.02 0.00 0.00 174.74 175.51 3h84 n LYS 19 N 4.22 5.04 -3.74 1.40 2.85 -0.17 -4.69 118.16 123.07 3h84 n LYS 19 Ca 0.10 -0.00 -0.28 0.00 -1.05 0.00 0.00 58.31 57.08 3h84 n LYS 19 Cb 0.45 -0.72 -0.16 0.00 -0.65 0.00 0.00 35.03 33.95 3h84 n LYS 19 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 177.40 175.77 3h84 s TRP 20 N -1.46 1.08 -0.23 5.58 0.52 -0.81 -0.28 118.94 123.33 3h84 s TRP 20 Ca 0.01 -0.88 -0.00 0.00 0.02 0.00 0.00 56.10 55.25 3h84 s TRP 20 Cb 0.03 -1.05 0.03 0.00 -1.15 0.00 0.00 33.47 31.33 3h84 s TRP 20 CO 0.15 -0.61 -0.11 0.42 0.02 0.00 0.00 176.95 176.82 3h84 s ILE 21 N 1.84 2.57 -0.06 2.03 -1.09 -0.11 -2.34 121.20 124.04 3h84 s ILE 21 Ca -0.01 -1.05 -0.12 0.00 -2.23 0.00 0.00 60.65 57.24 3h84 s ILE 21 Cb -0.17 -2.26 -0.05 0.00 -1.58 0.00 0.00 42.46 38.40 3h84 s ILE 21 CO -0.08 0.29 0.30 -0.36 -1.23 0.00 0.00 174.94 173.86 3h84 s PHE 22 N 1.29 3.65 -0.08 3.97 0.08 -0.30 0.53 117.98 127.12 3h84 s PHE 22 Ca 0.01 0.79 0.02 0.00 0.12 0.00 0.00 56.93 57.86 3h84 s PHE 22 Cb -0.16 -2.18 0.02 0.00 -0.57 0.00 0.00 43.02 40.12 3h84 s PHE 22 CO -0.07 0.62 -0.12 0.08 -0.10 0.00 0.00 175.22 175.63 3h84 s VAL 23 N -0.84 1.16 0.05 -0.44 1.01 -0.60 -0.21 120.40 120.53 3h84 s VAL 23 Ca 0.20 -0.46 -0.17 0.00 0.00 0.00 0.00 61.98 61.54 3h84 s VAL 23 Cb -0.15 -1.08 0.03 0.00 0.00 0.00 0.00 36.38 35.19 3h84 s VAL 23 CO 0.09 0.37 0.40 -0.83 0.00 0.00 0.00 175.10 175.13 3h84 s GLY 24 N 0.91 -0.26 0.00 4.51 0.00 -0.80 -2.37 107.32 109.31 3h84 s GLY 24 Ca -0.10 0.25 0.00 0.00 0.00 0.00 0.00 44.72 44.87 3h84 s GLY 24 CO 0.01 -0.00 0.00 0.61 0.00 0.00 0.00 173.10 173.71 3h84 n GLY 25 N 0.46 1.94 3.87 0.20 0.00 -1.26 -0.00 105.19 110.40 3h84 n GLY 25 Ca -0.18 0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 3h84 n GLY 25 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h84 s LYS 26 N 0.00 3.55 0.00 1.61 2.20 -1.26 -4.74 119.74 121.09 3h84 s LYS 26 Ca 0.00 -0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.57 3h84 s LYS 26 Cb 0.00 -3.17 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 3h84 s LYS 26 CO 0.00 0.74 0.00 0.41 -0.36 0.00 0.00 175.35 176.14 3h84 n GLY 27 N 1.74 1.46 2.92 5.54 0.00 -1.26 -4.67 105.19 110.92 3h84 n GLY 27 Ca -0.17 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 3h84 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h84 n GLY 28 N -0.34 -0.90 0.03 -0.02 0.00 -1.26 -4.96 105.19 97.75 3h84 n GLY 28 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.45 3h84 n GLY 28 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 3h84 n VAL 29 N -2.59 0.63 -0.68 1.61 3.14 -1.26 -4.95 118.33 114.23 3h84 n VAL 29 Ca -0.04 -0.82 0.00 0.00 -2.96 0.00 0.00 64.34 60.52 3h84 n VAL 29 Cb 0.57 0.69 0.00 0.00 -1.06 0.00 0.00 33.84 34.04 3h84 n VAL 29 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3h84 n GLY 30 N -0.27 0.58 0.10 7.55 0.00 -1.26 -4.49 105.19 107.39 3h84 n GLY 30 Ca 0.01 -0.71 -0.10 0.00 0.00 0.00 0.00 46.02 45.22 3h84 n GLY 30 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3h84 h LYS 31 N 0.11 0.15 -0.10 1.61 3.64 -1.92 -1.46 116.57 118.59 3h84 h LYS 31 Ca 0.00 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.21 3h84 h LYS 31 Cb 0.00 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 3h84 h LYS 31 CO 0.00 0.10 -0.65 1.79 -2.27 0.00 0.00 179.45 178.42 3h84 h THR 32 N 0.15 1.37 -0.80 1.00 1.35 -1.94 -0.11 112.91 113.92 3h84 h THR 32 Ca 0.07 -2.01 0.01 0.00 -0.55 0.00 0.00 66.41 63.93 3h84 h THR 32 Cb 0.03 2.00 -0.04 0.00 -1.73 0.00 0.00 68.15 68.41 3h84 h THR 32 CO -0.06 0.61 0.53 0.74 -0.25 0.00 0.00 175.52 177.08 3h84 h THR 33 N 0.27 1.18 -0.51 6.82 2.02 -1.90 -1.46 112.91 119.34 3h84 h THR 33 Ca -0.01 -0.37 -0.08 0.00 0.77 0.00 0.00 66.41 66.72 3h84 h THR 33 Cb 1.19 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 3h84 h THR 33 CO 0.11 0.19 -0.00 0.28 0.37 0.00 0.00 175.52 176.47 3h84 h SER 34 N 1.06 0.89 -0.03 4.18 0.02 -0.79 0.13 113.55 119.01 3h84 h SER 34 Ca 0.30 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3h84 h SER 34 Cb -0.09 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.20 3h84 h SER 34 CO -0.08 0.98 -0.02 0.28 -1.14 0.00 0.00 176.83 176.85 3h84 h SER 35 N 0.77 -0.06 -0.77 3.07 0.02 -0.87 -0.46 113.55 115.25 3h84 h SER 35 Ca 0.15 0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 3h84 h SER 35 Cb 0.53 0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.06 3h84 h SER 35 CO 0.03 -0.03 0.46 0.00 -1.14 0.00 0.00 176.83 176.15 3h84 h SER 37 N 1.05 0.76 -0.55 0.00 0.02 -0.50 -0.95 113.55 113.39 3h84 h SER 37 Ca 0.28 -0.32 -0.04 0.00 -0.84 0.00 0.00 61.79 60.86 3h84 h SER 37 Cb -0.03 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.28 3h84 h SER 37 CO -0.05 0.90 0.19 0.40 -1.14 0.00 0.00 176.83 177.12 3h84 h ILE 38 N 0.61 1.23 -0.45 3.27 2.04 -1.03 -1.21 117.51 121.96 3h84 h ILE 38 Ca 0.12 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 3h84 h ILE 38 Cb 0.52 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.28 3h84 h ILE 38 CO 0.03 0.29 0.20 0.00 0.00 0.00 0.00 178.15 178.66 3h84 h ALA 39 N 1.05 0.59 -0.09 1.87 0.00 -1.23 -1.70 119.26 119.74 3h84 h ALA 39 Ca 0.18 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3h84 h ALA 39 Cb 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 3h84 h ALA 39 CO -0.01 0.18 0.02 0.82 0.00 0.00 0.00 179.25 180.26 3h84 h ILE 40 N 0.59 1.19 -0.86 0.00 2.04 -1.08 -1.42 117.51 117.98 3h84 h ILE 40 Ca 0.15 -0.59 0.06 0.00 1.00 0.00 0.00 64.86 65.49 3h84 h ILE 40 Cb 0.16 1.41 -0.06 0.00 -0.74 0.00 0.00 36.82 37.59 3h84 h ILE 40 CO -0.02 0.17 0.53 1.56 0.00 0.00 0.00 178.15 180.39 3h84 h GLN 41 N -0.06 0.93 -0.26 2.37 1.08 -1.15 0.98 115.11 118.99 3h84 h GLN 41 Ca 0.03 -0.06 -0.18 0.00 -1.45 0.00 0.00 58.65 56.99 3h84 h GLN 41 Cb 0.24 -0.21 0.00 0.00 -0.05 0.00 0.00 27.48 27.47 3h84 h GLN 41 CO 0.00 0.61 -0.55 0.52 -0.95 0.00 0.00 178.83 178.47 3h84 h MET 42 N 0.96 0.84 -0.30 1.46 2.86 -1.24 -1.74 114.93 117.76 3h84 h MET 42 Ca 0.38 -0.55 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 3h84 h MET 42 Cb 0.19 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 3h84 h MET 42 CO -0.18 1.18 0.02 0.00 1.06 0.00 0.00 176.91 178.99 3h84 h ALA 43 N 0.65 0.40 -0.46 6.32 0.00 -0.92 -0.82 119.26 124.43 3h84 h ALA 43 Ca 0.01 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.64 3h84 h ALA 43 Cb 1.16 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.82 3h84 h ALA 43 CO 0.12 0.13 0.04 -0.07 0.00 0.00 0.00 179.25 179.47 3h84 h LEU 44 N 0.32 0.68 -0.03 0.00 3.38 -0.85 -3.08 115.31 115.73 3h84 h LEU 44 Ca 0.09 -0.14 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 3h84 h LEU 44 Cb 0.40 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3h84 h LEU 44 CO 0.01 0.73 -0.44 0.28 0.09 0.00 0.00 178.44 179.10 3h84 h SER 45 N 0.69 0.00 -2.19 -0.43 0.02 -1.22 -3.38 113.55 107.04 3h84 h SER 45 Ca 0.14 0.00 -0.58 0.00 -0.84 0.00 0.00 61.79 60.51 3h84 h SER 45 Cb 0.36 0.00 -0.40 0.00 0.14 0.00 0.00 62.40 62.50 3h84 h SER 45 CO 0.01 0.44 -0.84 0.00 -1.14 0.00 0.00 176.83 175.30 3h84 n GLN 46 N -3.22 1.50 0.17 3.45 6.02 -0.32 -4.96 117.38 120.03 3h84 n GLN 46 Ca 0.02 -3.91 0.13 0.00 -0.01 0.00 0.00 57.00 53.23 3h84 n GLN 46 Cb 0.71 -1.76 0.62 0.00 1.02 0.00 0.00 30.24 30.82 3h84 n GLN 46 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.06 175.05 3h84 h PRO 47 N 4.32 0.00 0.00 -1.09 0.13 -1.73 -2.18 132.00 131.45 3h84 h PRO 47 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 3h84 h PRO 47 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3h84 h PRO 47 CO 0.63 0.00 -0.31 0.27 -0.23 0.00 0.00 178.00 178.36 3h84 n ASN 48 N -2.38 0.68 -4.78 1.44 6.94 -1.26 -4.88 115.26 111.02 3h84 n ASN 48 Ca -0.00 0.32 -0.29 0.00 -0.02 0.00 0.00 54.58 54.59 3h84 n ASN 48 Cb 0.13 -0.29 -0.06 0.00 -2.36 0.00 0.00 39.78 37.20 3h84 n ASN 48 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 3h84 s LYS 49 N -3.12 2.88 -0.16 -3.83 -0.14 -0.82 -5.12 119.74 109.44 3h84 s LYS 49 Ca 0.09 -0.76 -0.07 0.00 -1.36 0.00 0.00 55.97 53.88 3h84 s LYS 49 Cb 0.14 -2.70 -0.04 0.00 -1.68 0.00 0.00 37.83 33.55 3h84 s LYS 49 CO 0.65 0.54 0.06 -0.65 -0.76 0.00 0.00 175.35 175.19 3h84 s GLN 50 N -2.65 3.76 0.00 1.68 -1.52 -1.26 -4.91 119.66 114.76 3h84 s GLN 50 Ca 0.30 -0.32 0.08 0.00 -1.95 0.00 0.00 55.36 53.47 3h84 s GLN 50 Cb -0.11 -3.15 -0.02 0.00 -0.22 0.00 0.00 33.01 29.50 3h84 s GLN 50 CO 0.22 0.41 -0.24 -0.06 -0.25 0.00 0.00 175.29 175.38 3h84 s PHE 51 N -0.01 2.40 -0.08 0.91 0.08 -0.34 -0.83 117.98 120.10 3h84 s PHE 51 Ca 0.06 -0.37 0.04 0.00 0.12 0.00 0.00 56.93 56.78 3h84 s PHE 51 Cb -0.12 -1.48 0.00 0.00 -0.57 0.00 0.00 43.02 40.85 3h84 s PHE 51 CO 0.01 0.07 -0.22 -1.17 -0.10 0.00 0.00 175.22 173.81 3h84 s LEU 52 N -0.91 2.00 -0.20 -0.37 1.98 -0.98 -0.78 118.68 119.42 3h84 s LEU 52 Ca 0.11 -0.49 -0.04 0.00 -2.89 0.00 0.00 54.13 50.83 3h84 s LEU 52 Cb -0.10 -1.27 -0.01 0.00 0.66 0.00 0.00 46.19 45.47 3h84 s LEU 52 CO 0.01 0.15 -0.05 -0.22 -1.89 0.00 0.00 176.35 174.35 3h84 s LEU 53 N 0.28 2.96 -0.04 -0.68 2.96 0.73 0.13 118.68 125.02 3h84 s LEU 53 Ca -0.14 -0.33 0.05 0.00 -0.22 0.00 0.00 54.13 53.48 3h84 s LEU 53 Cb -0.16 -1.74 -0.00 0.00 0.50 0.00 0.00 46.19 44.78 3h84 s LEU 53 CO 0.07 0.03 -0.17 -0.51 -1.32 0.00 0.00 176.35 174.44 3h84 s ILE 54 N 1.18 1.43 0.15 6.68 2.07 -0.41 -0.97 121.20 131.33 3h84 s ILE 54 Ca 0.02 -0.73 0.09 0.00 -1.41 0.00 0.00 60.65 58.62 3h84 s ILE 54 Cb -0.14 -1.23 -0.04 0.00 0.13 0.00 0.00 42.46 41.18 3h84 s ILE 54 CO -0.01 0.41 -0.20 -0.55 -1.91 0.00 0.00 174.94 172.68 3h84 s SER 55 N -0.04 2.75 0.00 4.50 0.15 -0.41 -0.70 113.70 119.96 3h84 s SER 55 Ca -0.02 -0.80 0.00 0.00 0.70 0.00 0.00 55.95 55.83 3h84 s SER 55 Cb -0.11 -0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.04 3h84 s SER 55 CO 0.02 0.02 0.97 0.35 1.20 0.00 0.00 173.24 175.80 3h84 n THR 56 N 0.56 0.95 -2.15 6.45 -2.24 -1.26 -1.91 114.28 114.68 3h84 n THR 56 Ca -0.15 -0.96 -0.42 0.00 -2.27 0.00 0.00 64.05 60.24 3h84 n THR 56 Cb 0.56 0.53 -0.03 0.00 -2.10 0.00 0.00 70.33 69.29 3h84 n THR 56 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h84 s ASP 57 N -0.95 6.77 0.61 3.42 2.15 -1.26 -4.77 116.67 122.65 3h84 s ASP 57 Ca 0.00 2.07 0.40 0.00 0.43 0.00 0.00 52.55 55.45 3h84 s ASP 57 Cb 0.00 -2.54 2.05 0.00 -0.30 0.00 0.00 42.92 42.13 3h84 s ASP 57 CO 0.00 -0.85 2.22 1.55 -0.17 0.00 0.00 175.17 177.92 3h84 h PRO 58 N 8.88 0.00 0.00 4.34 0.13 -1.96 -2.05 132.00 141.34 3h84 h PRO 58 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 3h84 h PRO 58 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3h84 h PRO 58 CO 0.95 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.72 3h84 n ALA 59 N -2.06 1.85 -3.38 -0.56 0.00 -1.26 -4.93 120.51 110.16 3h84 n ALA 59 Ca -0.02 -0.07 -0.18 0.00 0.00 0.00 0.00 53.44 53.18 3h84 n ALA 59 Cb 0.14 -1.30 0.04 0.00 0.00 0.00 0.00 19.45 18.33 3h84 n ALA 59 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3h84 n HIS 60 N -1.48 -2.38 0.17 0.00 8.25 -0.77 -4.88 115.22 114.14 3h84 n HIS 60 Ca 0.05 0.79 0.02 0.00 -0.26 0.00 0.00 57.72 58.31 3h84 n HIS 60 Cb 0.21 -3.81 0.34 0.00 1.12 0.00 0.00 29.99 27.84 3h84 n HIS 60 CO 0.00 0.00 0.00 -2.95 0.64 0.00 0.00 176.34 174.03 3h84 h ASN 61 N -0.94 0.02 -0.01 0.41 -1.07 -1.92 -2.49 115.58 109.57 3h84 h ASN 61 Ca -0.49 -0.01 -0.26 0.00 0.07 0.00 0.00 56.30 55.61 3h84 h ASN 61 Cb 1.26 -0.01 0.02 0.00 -2.07 0.00 0.00 38.32 37.52 3h84 h ASN 61 CO 0.42 0.41 -0.99 -0.07 0.07 0.00 0.00 177.43 177.27 3h84 h LEU 62 N 0.02 0.91 -0.72 6.14 3.38 -1.94 -0.78 115.31 122.32 3h84 h LEU 62 Ca -0.00 -0.70 0.02 0.00 0.09 0.00 0.00 57.88 57.29 3h84 h LEU 62 Cb 0.69 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 3h84 h LEU 62 CO 0.05 1.50 0.46 0.28 0.09 0.00 0.00 178.44 180.82 3h84 h SER 63 N 0.42 0.77 -0.39 -0.43 0.02 -1.72 -0.37 113.55 111.84 3h84 h SER 63 Ca -0.11 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.80 3h84 h SER 63 Cb 1.64 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.98 3h84 h SER 63 CO 0.20 0.54 0.13 -0.78 -1.14 0.00 0.00 176.83 175.78 3h84 h ASP 64 N 0.91 0.56 -0.42 3.07 1.82 -1.40 0.50 116.42 121.46 3h84 h ASP 64 Ca 0.28 -0.20 -0.14 0.00 -0.39 0.00 0.00 57.03 56.59 3h84 h ASP 64 Cb -0.03 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 39.83 3h84 h ASP 64 CO -0.09 0.61 -0.27 0.00 -1.61 0.00 0.00 179.24 177.88 3h84 h ALA 65 N 0.98 0.60 0.00 -0.78 0.00 -0.86 -3.24 119.26 115.95 3h84 h ALA 65 Ca 0.13 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3h84 h ALA 65 Cb 0.24 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 3h84 h ALA 65 CO -0.01 0.62 -1.07 1.19 0.00 0.00 0.00 179.25 179.98 3h84 n PHE 66 N -4.13 0.92 -2.22 0.00 3.72 -0.17 -0.14 117.46 115.43 3h84 n PHE 66 Ca -0.01 0.27 -0.04 0.00 -0.05 0.00 0.00 57.45 57.62 3h84 n PHE 66 Cb 0.48 -0.94 0.00 0.00 -0.94 0.00 0.00 39.48 38.09 3h84 n PHE 66 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h84 n GLY 67 N 1.19 0.32 3.23 1.37 0.00 0.14 -4.23 105.19 107.21 3h84 n GLY 67 Ca -0.01 -0.68 -0.10 0.00 0.00 0.00 0.00 46.02 45.23 3h84 n GLY 67 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3h84 s GLU 68 N -4.43 0.84 -0.34 1.61 -1.05 -1.02 -5.05 118.70 109.26 3h84 s GLU 68 Ca 0.02 -0.73 -0.29 0.00 -0.15 0.00 0.00 54.97 53.83 3h84 s GLU 68 Cb -0.01 0.35 0.01 0.00 -0.44 0.00 0.00 34.13 34.04 3h84 s GLU 68 CO 0.03 -0.27 1.19 0.15 0.95 0.00 0.00 175.26 177.31 3h84 s LYS 69 N -3.21 3.93 0.15 -4.83 1.02 -1.26 -4.28 119.74 111.26 3h84 s LYS 69 Ca -0.00 1.05 0.07 0.00 0.02 0.00 0.00 55.97 57.11 3h84 s LYS 69 Cb 0.02 -3.84 -0.04 0.00 -0.52 0.00 0.00 37.83 33.45 3h84 s LYS 69 CO -0.08 -1.10 -0.01 -0.06 -0.92 0.00 0.00 175.35 173.19 3h84 s PHE 70 N 4.16 2.86 0.00 3.18 0.08 -1.26 -5.03 117.98 121.98 3h84 s PHE 70 Ca 0.51 -0.12 0.00 0.00 0.12 0.00 0.00 56.93 57.44 3h84 s PHE 70 Cb -0.13 -1.41 0.00 0.00 -0.57 0.00 0.00 43.02 40.91 3h84 s PHE 70 CO 0.22 0.50 0.00 0.41 -0.10 0.00 0.00 175.22 176.25 3h84 n GLY 71 N 0.06 3.84 0.23 4.36 0.00 -1.26 -4.70 105.19 107.72 3h84 n GLY 71 Ca -0.10 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 45.10 3h84 n GLY 71 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3h84 h LYS 72 N 0.00 0.00 -5.93 1.61 2.10 -1.91 -1.00 116.57 111.44 3h84 h LYS 72 Ca 0.00 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 58.08 3h84 h LYS 72 Cb 0.00 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 31.26 3h84 h LYS 72 CO 0.00 0.21 0.14 -0.51 -2.00 0.00 0.00 179.45 177.29 3h84 s ASP 73 N -6.52 6.91 0.15 7.07 1.01 -1.26 -4.87 116.67 119.16 3h84 s ASP 73 Ca -0.03 1.10 -0.31 0.00 0.71 0.00 0.00 52.55 54.02 3h84 s ASP 73 Cb 0.14 -2.40 -0.10 0.00 1.01 0.00 0.00 42.92 41.57 3h84 s ASP 73 CO 0.65 -0.19 1.60 0.00 0.21 0.00 0.00 175.17 177.44 3h84 s ALA 74 N 1.24 3.78 -0.02 5.23 0.00 -1.26 -4.84 121.76 125.89 3h84 s ALA 74 Ca 0.35 1.36 0.04 0.00 0.00 0.00 0.00 51.96 53.71 3h84 s ALA 74 Cb -0.17 -3.64 -0.00 0.00 0.00 0.00 0.00 23.12 19.30 3h84 s ALA 74 CO 0.15 -0.85 -0.13 1.03 0.00 0.00 0.00 175.76 175.96 3h84 s ARG 75 N 1.43 1.16 0.36 0.00 0.52 -1.14 -4.97 118.95 116.33 3h84 s ARG 75 Ca 0.71 -0.45 -0.28 0.00 -0.52 0.00 0.00 55.73 55.20 3h84 s ARG 75 Cb -0.44 -1.09 -0.11 0.00 0.52 0.00 0.00 34.95 33.84 3h84 s ARG 75 CO 0.32 0.23 1.43 0.15 0.02 0.00 0.00 175.30 177.44 3h84 s LYS 76 N -0.09 4.17 0.09 3.54 -0.14 -1.26 -1.37 119.74 124.67 3h84 s LYS 76 Ca 0.01 2.46 -0.30 0.00 -1.36 0.00 0.00 55.97 56.78 3h84 s LYS 76 Cb -0.07 -2.99 -0.06 0.00 -1.68 0.00 0.00 37.83 33.03 3h84 s LYS 76 CO 0.00 -0.43 1.13 0.14 -0.76 0.00 0.00 175.35 175.43 3h84 s VAL 77 N -1.13 4.13 0.15 3.17 -7.23 -0.42 -4.88 120.40 114.18 3h84 s VAL 77 Ca 0.52 1.61 -0.32 0.00 -1.81 0.00 0.00 61.98 61.98 3h84 s VAL 77 Cb -0.44 -4.03 -0.11 0.00 0.56 0.00 0.00 36.38 32.35 3h84 s VAL 77 CO 0.60 0.17 1.78 0.41 -0.31 0.00 0.00 175.10 177.75 3h84 n THR 78 N 3.44 0.22 0.00 5.32 -1.04 -1.26 -1.25 114.28 119.71 3h84 n THR 78 Ca 0.06 -0.04 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 3h84 n THR 78 Cb 0.47 -2.02 0.00 0.00 -1.82 0.00 0.00 70.33 66.96 3h84 n THR 78 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3h84 n GLY 79 N 4.08 0.88 3.31 3.41 0.00 -1.26 -4.93 105.19 110.68 3h84 n GLY 79 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 3h84 n GLY 79 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3h84 s MET 80 N -0.78 1.84 -0.04 1.61 1.00 -0.38 -5.00 119.30 117.54 3h84 s MET 80 Ca 0.00 -0.99 0.13 0.00 0.00 0.00 0.00 55.69 54.83 3h84 s MET 80 Cb 0.00 -1.90 0.39 0.00 0.00 0.00 0.00 34.83 33.32 3h84 s MET 80 CO 0.00 0.50 1.32 0.27 0.00 0.00 0.00 175.02 177.12 3h84 n ASN 81 N 2.10 3.28 0.00 3.03 6.94 -1.26 -4.46 115.26 124.88 3h84 n ASN 81 Ca -0.16 -2.24 0.00 0.00 -0.02 0.00 0.00 54.58 52.15 3h84 n ASN 81 Cb 0.52 -0.33 0.00 0.00 -2.36 0.00 0.00 39.78 37.61 3h84 n ASN 81 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 3h84 n ASN 82 N 0.37 4.77 -4.23 0.53 5.15 -1.26 -5.02 115.26 115.57 3h84 n ASN 82 Ca 0.15 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.81 3h84 n ASN 82 Cb 0.56 0.75 -0.17 0.00 -0.53 0.00 0.00 39.78 40.39 3h84 n ASN 82 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 3h84 s LEU 83 N -3.28 2.11 0.19 1.20 2.96 -1.26 -1.20 118.68 119.39 3h84 s LEU 83 Ca 0.00 -0.54 0.11 0.00 -0.22 0.00 0.00 54.13 53.47 3h84 s LEU 83 Cb 0.00 -1.41 -0.04 0.00 0.50 0.00 0.00 46.19 45.24 3h84 s LEU 83 CO 0.00 0.17 -0.20 -0.44 -1.32 0.00 0.00 176.35 174.56 3h84 s SER 84 N 0.26 3.65 0.09 3.68 0.01 0.04 -1.31 113.70 120.12 3h84 s SER 84 Ca -0.16 -0.79 0.09 0.00 1.31 0.00 0.00 55.95 56.40 3h84 s SER 84 Cb -0.17 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.65 3h84 s SER 84 CO 0.08 0.12 -0.24 0.00 0.41 0.00 0.00 173.24 173.61 3h84 s MET 86 N -1.65 1.02 -0.17 0.00 -1.94 -0.14 -2.87 119.30 113.54 3h84 s MET 86 Ca 0.10 -0.61 -0.01 0.00 -1.71 0.00 0.00 55.69 53.46 3h84 s MET 86 Cb -0.10 -1.00 0.05 0.00 2.01 0.00 0.00 34.83 35.79 3h84 s MET 86 CO 0.04 0.26 -0.03 -1.21 -0.01 0.00 0.00 175.02 174.07 3h84 s GLU 87 N -0.71 1.20 0.09 2.03 2.02 -0.38 -1.29 118.70 121.66 3h84 s GLU 87 Ca 0.03 -0.50 0.08 0.00 0.02 0.00 0.00 54.97 54.61 3h84 s GLU 87 Cb -0.06 -2.01 -0.03 0.00 0.10 0.00 0.00 34.13 32.12 3h84 s GLU 87 CO 0.00 -0.49 -0.20 0.96 0.02 0.00 0.00 175.26 175.55 3h84 s ILE 88 N 1.69 1.65 -0.49 -1.63 -4.36 -0.80 -2.76 121.20 114.50 3h84 s ILE 88 Ca -0.00 -1.44 -0.17 0.00 -0.26 0.00 0.00 60.65 58.78 3h84 s ILE 88 Cb -0.16 -1.49 0.07 0.00 1.25 0.00 0.00 42.46 42.13 3h84 s ILE 88 CO -0.07 -0.01 0.47 -0.62 0.24 0.00 0.00 174.94 174.95 3h84 s ASP 89 N -1.72 6.17 0.43 4.36 3.68 -1.26 -4.23 116.67 124.09 3h84 s ASP 89 Ca 0.06 -1.20 0.26 0.00 2.13 0.00 0.00 52.55 53.80 3h84 s ASP 89 Cb -0.10 -2.22 0.72 0.00 -1.45 0.00 0.00 42.92 39.87 3h84 s ASP 89 CO 0.04 -0.73 1.74 1.55 0.13 0.00 0.00 175.17 177.89 3h84 h PRO 90 N 8.84 0.00 -0.10 4.34 0.13 -1.91 -3.00 132.00 140.30 3h84 h PRO 90 Ca -0.28 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.75 3h84 h PRO 90 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 3h84 h PRO 90 CO 0.91 0.00 -0.39 1.03 -0.23 0.00 0.00 178.00 179.32 3h84 h SER 91 N 0.00 0.22 -2.69 1.44 0.87 -1.94 -3.46 113.55 107.99 3h84 h SER 91 Ca 0.00 -0.09 -0.56 0.00 -1.23 0.00 0.00 61.79 59.92 3h84 h SER 91 Cb 0.79 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.68 3h84 h SER 91 CO 0.00 0.59 1.10 0.00 -0.53 0.00 0.00 176.83 177.99 3h84 s ALA 92 N -4.19 3.44 0.00 6.23 0.00 -1.14 -5.19 121.76 120.92 3h84 s ALA 92 Ca -0.04 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.60 3h84 s ALA 92 Cb 0.14 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.46 3h84 s ALA 92 CO 0.76 -1.66 0.00 -0.11 0.00 0.00 0.00 175.76 174.75 3h84 n LEU 117 N 7.80 -0.85 0.01 0.00 7.94 -1.26 -5.15 117.00 125.50 3h84 n LEU 117 Ca 0.18 0.00 0.10 0.00 -1.11 0.00 0.00 56.01 55.18 3h84 n LEU 117 Cb 0.44 0.75 0.45 0.00 0.53 0.00 0.00 43.42 45.59 3h84 n LEU 117 CO 0.63 0.00 0.84 0.61 -1.11 0.00 0.00 177.39 178.36 3h84 n GLY 118 N -0.18 -1.25 0.16 -3.96 0.00 -1.26 -3.13 105.19 95.57 3h84 n GLY 118 Ca 0.00 -0.06 0.01 0.00 0.00 0.00 0.00 46.02 45.97 3h84 n GLY 118 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3h84 h SER 119 N 0.00 0.00 0.03 1.61 0.87 -2.05 0.19 113.55 114.20 3h84 h SER 119 Ca 0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 3h84 h SER 119 Cb 0.38 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 3h84 h SER 119 CO 0.00 0.49 -0.34 -0.07 -0.53 0.00 0.00 176.83 176.39 3h84 h LEU 120 N 0.00 0.44 -0.20 2.23 -0.00 -1.97 0.20 115.31 116.02 3h84 h LEU 120 Ca -0.00 -0.17 -0.22 0.00 -0.00 0.00 0.00 57.88 57.49 3h84 h LEU 120 Cb 0.89 -0.12 0.01 0.00 -0.00 0.00 0.00 40.66 41.43 3h84 h LEU 120 CO 0.06 0.75 -0.78 -0.07 -0.00 0.00 0.00 178.44 178.41 3h84 h LEU 121 N 0.37 0.88 -0.83 1.67 4.07 -1.66 -2.20 115.31 117.61 3h84 h LEU 121 Ca 0.04 -0.58 -0.09 0.00 0.08 0.00 0.00 57.88 57.34 3h84 h LEU 121 Cb 0.77 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 42.23 3h84 h LEU 121 CO 0.06 1.37 -0.08 -0.61 -1.08 0.00 0.00 178.44 178.10 3h84 h GLN 122 N 0.50 0.80 0.03 1.13 5.75 -0.73 -2.17 115.11 120.43 3h84 h GLN 122 Ca -0.05 -0.25 -0.21 0.00 -0.15 0.00 0.00 58.65 57.99 3h84 h GLN 122 Cb 1.40 -0.07 0.02 0.00 1.07 0.00 0.00 27.48 29.89 3h84 h GLN 122 CO 0.16 0.85 -0.85 0.78 -2.65 0.00 0.00 178.83 177.12 3h84 h GLY 123 N 0.98 0.58 1.23 2.39 0.00 -0.67 -2.90 103.07 104.68 3h84 h GLY 123 Ca 0.13 -1.08 -0.04 0.00 0.00 0.00 0.00 47.33 46.34 3h84 h GLY 123 CO 0.03 0.95 0.26 -1.33 0.00 0.00 0.00 176.54 176.46 3h84 h GLY 124 N 0.07 1.06 1.23 4.60 0.00 -1.37 0.25 103.07 108.90 3h84 h GLY 124 Ca -0.12 -0.55 -0.12 0.00 0.00 0.00 0.00 47.33 46.54 3h84 h GLY 124 CO 0.17 0.52 -0.20 0.00 0.00 0.00 0.00 176.54 177.03 3h84 h ALA 125 N 1.32 0.81 -0.01 3.60 0.00 -1.50 -2.74 119.26 120.75 3h84 h ALA 125 Ca 0.23 -0.37 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 3h84 h ALA 125 Cb 0.19 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3h84 h ALA 125 CO -0.02 0.65 -0.76 1.25 0.00 0.00 0.00 179.25 180.37 3h84 h LEU 126 N 0.77 0.11 -0.63 0.00 5.85 -1.23 -3.13 115.31 117.06 3h84 h LEU 126 Ca 0.11 -0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.65 3h84 h LEU 126 Cb 0.74 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.71 3h84 h LEU 126 CO 0.06 0.83 -0.01 0.00 -0.34 0.00 0.00 178.44 178.98 3h84 h ALA 127 N 1.17 0.84 0.00 1.25 0.00 -0.49 -2.74 119.26 119.29 3h84 h ALA 127 Ca -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3h84 h ALA 127 Cb 1.34 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3h84 h ALA 127 CO 0.11 0.67 -0.07 0.22 0.00 0.00 0.00 179.25 180.18 3h84 h ASP 128 N 0.97 0.00 1.10 0.00 3.58 -1.44 -2.79 116.42 117.85 3h84 h ASP 128 Ca 0.17 0.00 -0.18 0.00 0.42 0.00 0.00 57.03 57.44 3h84 h ASP 128 Cb 0.57 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.59 3h84 h ASP 128 CO 0.03 0.07 -0.93 -0.07 -2.88 0.00 0.00 179.24 175.47 3h84 h LEU 129 N 0.00 0.00 -1.14 2.28 4.07 -1.44 -3.34 115.31 115.74 3h84 h LEU 129 Ca -0.00 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.92 3h84 h LEU 129 Cb 0.14 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.86 3h84 h LEU 129 CO 0.01 0.81 0.12 0.71 -1.08 0.00 0.00 178.44 179.01 3h84 h THR 130 N 0.00 1.21 -0.00 0.22 1.35 -1.27 0.11 112.91 114.53 3h84 h THR 130 Ca -0.04 -0.74 -0.16 0.00 -0.55 0.00 0.00 66.41 64.92 3h84 h THR 130 Cb 1.65 0.72 -0.02 0.00 -1.73 0.00 0.00 68.15 68.77 3h84 h THR 130 CO 0.10 0.27 -0.75 1.23 -0.25 0.00 0.00 175.52 176.12 3h84 h GLY 131 N 0.90 0.01 0.00 5.82 0.00 -1.67 -3.38 103.07 104.75 3h84 h GLY 131 Ca 0.16 -0.02 -0.16 0.00 0.00 0.00 0.00 47.33 47.31 3h84 h GLY 131 CO -0.00 0.02 -1.83 -1.14 0.00 0.00 0.00 176.54 173.59 3h84 n SER 132 N -3.66 1.69 -4.22 0.19 3.41 -1.11 -4.94 113.62 104.98 3h84 n SER 132 Ca -0.01 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.25 3h84 n SER 132 Cb 0.73 1.14 -0.14 0.00 -0.26 0.00 0.00 64.21 65.67 3h84 n SER 132 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3h84 s ILE 133 N -2.57 2.98 0.19 -1.33 1.01 0.37 -5.09 121.20 116.75 3h84 s ILE 133 Ca -0.06 -0.90 -0.31 0.00 0.00 0.00 0.00 60.65 59.38 3h84 s ILE 133 Cb 0.06 -2.47 -0.10 0.00 0.01 0.00 0.00 42.46 39.96 3h84 s ILE 133 CO 0.57 0.25 1.47 -2.16 0.00 0.00 0.00 174.94 175.07 3h84 s PRO 134 N 1.36 4.26 0.00 2.79 0.04 -1.26 -3.37 135.00 138.82 3h84 s PRO 134 Ca 0.02 2.27 0.00 0.00 0.04 0.00 0.00 61.00 63.32 3h84 s PRO 134 Cb -0.16 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.22 3h84 s PRO 134 CO -0.04 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 176.92 3h84 n GLY 135 N 3.04 2.72 0.07 0.56 0.00 -1.26 -4.76 105.19 105.55 3h84 n GLY 135 Ca 0.10 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 3h84 n GLY 135 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3h84 h ILE 136 N 0.00 1.27 -0.66 -0.61 2.04 -1.89 -0.44 117.51 117.22 3h84 h ILE 136 Ca 0.00 -0.97 0.06 0.00 1.00 0.00 0.00 64.86 64.95 3h84 h ILE 136 Cb 0.00 1.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.94 3h84 h ILE 136 CO 0.00 0.25 0.37 -0.78 0.00 0.00 0.00 178.15 177.98 3h84 h ASP 137 N -0.47 0.54 -0.19 1.72 3.58 -1.81 -1.38 116.42 118.40 3h84 h ASP 137 Ca -0.00 0.03 -0.10 0.00 0.42 0.00 0.00 57.03 57.38 3h84 h ASP 137 Cb 0.44 -0.07 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 3h84 h ASP 137 CO 0.01 0.35 -0.21 -0.33 -2.88 0.00 0.00 179.24 176.18 3h84 h GLU 138 N 0.68 0.64 -0.14 0.28 3.07 -1.90 -1.95 114.58 115.25 3h84 h GLU 138 Ca 0.30 -0.24 -0.03 0.00 -0.50 0.00 0.00 59.36 58.89 3h84 h GLU 138 Cb 0.19 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 28.06 3h84 h GLU 138 CO -0.18 0.80 -0.01 0.00 -1.40 0.00 0.00 179.01 178.21 3h84 h ALA 139 N 1.21 0.19 -0.73 3.43 0.00 -0.59 -1.51 119.26 121.25 3h84 h ALA 139 Ca 0.08 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3h84 h ALA 139 Cb 0.67 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3h84 h ALA 139 CO 0.05 -0.09 0.32 -0.07 0.00 0.00 0.00 179.25 179.46 3h84 h LEU 140 N -0.03 0.97 -0.08 0.00 3.38 -1.24 0.63 115.31 118.95 3h84 h LEU 140 Ca 0.04 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3h84 h LEU 140 Cb 0.41 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3h84 h LEU 140 CO 0.01 0.85 0.01 -1.28 0.09 0.00 0.00 178.44 178.12 3h84 h SER 141 N 1.05 0.13 0.37 -0.43 0.87 -1.32 -2.56 113.55 111.66 3h84 h SER 141 Ca 0.25 -0.28 -0.15 0.00 -1.23 0.00 0.00 61.79 60.38 3h84 h SER 141 Cb 0.16 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.08 3h84 h SER 141 CO -0.03 0.38 -0.62 0.15 -0.53 0.00 0.00 176.83 176.19 3h84 h PHE 142 N -0.12 0.31 -0.67 2.24 3.04 -1.13 -2.49 116.94 118.12 3h84 h PHE 142 Ca 0.02 -0.12 -0.00 0.00 3.98 0.00 0.00 57.97 61.85 3h84 h PHE 142 Cb 0.31 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.73 3h84 h PHE 142 CO 0.02 0.80 0.42 0.52 -2.02 0.00 0.00 178.31 178.05 3h84 h MET 143 N 0.18 0.90 -0.57 1.11 2.86 -0.90 -1.81 114.93 116.70 3h84 h MET 143 Ca -0.01 -0.07 -0.10 0.00 -2.06 0.00 0.00 59.70 57.46 3h84 h MET 143 Cb 1.13 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 3h84 h MET 143 CO 0.10 0.62 -0.03 0.93 1.06 0.00 0.00 176.91 179.58 3h84 h GLU 144 N 0.92 1.03 -0.52 1.72 4.39 -1.11 -1.94 114.58 119.06 3h84 h GLU 144 Ca 0.24 -0.34 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 3h84 h GLU 144 Cb -0.06 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.48 3h84 h GLU 144 CO -0.05 1.02 -0.04 -0.39 -1.16 0.00 0.00 179.01 178.39 3h84 h VAL 145 N 0.93 1.26 -0.32 3.13 -1.51 -1.03 -2.38 116.25 116.33 3h84 h VAL 145 Ca 0.16 -1.14 -0.07 0.00 -1.23 0.00 0.00 66.70 64.42 3h84 h VAL 145 Cb 0.59 0.90 -0.02 0.00 -2.13 0.00 0.00 31.29 30.63 3h84 h VAL 145 CO 0.04 0.40 -0.10 0.24 -1.23 0.00 0.00 177.57 176.92 3h84 h MET 146 N 0.84 0.54 -0.64 5.19 2.86 -1.23 -2.17 114.93 120.32 3h84 h MET 146 Ca 0.15 -0.15 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 3h84 h MET 146 Cb 0.56 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 3h84 h MET 146 CO 0.03 0.64 0.22 0.87 1.06 0.00 0.00 176.91 179.73 3h84 h LYS 147 N 0.50 0.98 -0.64 1.72 1.57 -1.14 -2.67 116.57 116.89 3h84 h LYS 147 Ca 0.09 -0.20 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 3h84 h LYS 147 Cb 0.47 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 32.61 3h84 h LYS 147 CO 0.03 0.85 0.21 0.45 -0.57 0.00 0.00 179.45 180.42 3h84 h HIS 148 N 0.92 0.99 0.70 -1.35 3.86 -1.07 -2.43 115.15 116.77 3h84 h HIS 148 Ca 0.21 -0.08 -0.03 0.00 -1.16 0.00 0.00 60.37 59.30 3h84 h HIS 148 Cb 0.27 -0.29 0.01 0.00 1.06 0.00 0.00 27.41 28.45 3h84 h HIS 148 CO 0.02 0.79 -0.34 0.82 0.86 0.00 0.00 177.93 180.08 3h84 h ILE 149 N 0.94 0.27 0.00 2.45 1.08 -1.23 -2.55 117.51 118.47 3h84 h ILE 149 Ca 0.21 -0.10 -0.03 0.00 -0.39 0.00 0.00 64.86 64.55 3h84 h ILE 149 Cb 0.25 0.31 -0.00 0.00 -3.07 0.00 0.00 36.82 34.31 3h84 h ILE 149 CO -0.01 0.01 -0.14 0.07 -0.69 0.00 0.00 178.15 177.39 3h84 h LYS 150 N -1.01 0.00 -0.46 2.37 2.10 -1.48 -1.50 116.57 116.59 3h84 h LYS 150 Ca -0.10 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.43 3h84 h LYS 150 Cb 0.74 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.06 3h84 h LYS 150 CO 0.16 0.14 -0.21 -0.09 -2.00 0.00 0.00 179.45 177.45 3h84 h ARG 151 N 0.00 0.95 0.00 0.07 2.43 -1.41 -2.09 114.38 114.33 3h84 h ARG 151 Ca -0.00 -0.41 -0.09 0.00 -0.81 0.00 0.00 59.98 58.67 3h84 h ARG 151 Cb 0.33 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3h84 h ARG 151 CO 0.02 1.07 -0.42 1.96 -1.51 0.00 0.00 179.97 181.09 3h84 h GLN 152 N 0.79 0.00 0.04 0.20 1.08 -0.87 -2.97 115.11 113.38 3h84 h GLN 152 Ca 0.10 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.21 3h84 h GLN 152 Cb 0.78 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.22 3h84 h GLN 152 CO 0.06 0.42 -0.38 0.93 -0.95 0.00 0.00 178.83 178.91 3h84 h GLU 153 N 0.00 0.19 -0.38 1.46 5.08 -1.24 -3.05 114.58 116.64 3h84 h GLU 153 Ca -0.00 -0.26 -0.07 0.00 -1.00 0.00 0.00 59.36 58.03 3h84 h GLU 153 Cb 0.84 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 3h84 h GLU 153 CO 0.05 1.04 -0.08 1.96 -1.00 0.00 0.00 179.01 180.99 3h84 h GLN 154 N -0.54 0.64 -2.85 2.33 1.08 -1.45 -2.98 115.11 111.35 3h84 h GLN 154 Ca -0.06 -0.18 -0.73 0.00 -1.45 0.00 0.00 58.65 56.23 3h84 h GLN 154 Cb 1.20 -0.07 -0.11 0.00 -0.05 0.00 0.00 27.48 28.46 3h84 h GLN 154 CO 0.07 0.71 2.57 0.41 -0.95 0.00 0.00 178.83 181.64 3h84 n GLY 155 N -0.62 4.99 3.20 3.46 0.00 -1.12 -4.80 105.19 110.31 3h84 n GLY 155 Ca 0.01 -1.98 -0.19 0.00 0.00 0.00 0.00 46.02 43.86 3h84 n GLY 155 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3h84 n GLU 156 N 2.44 -2.01 -0.03 1.61 4.71 -1.21 -4.92 120.64 121.22 3h84 n GLU 156 Ca 0.61 1.66 -0.04 0.00 -0.01 0.00 0.00 57.16 59.38 3h84 n GLU 156 Cb 0.27 -4.10 -0.03 0.00 -1.01 0.00 0.00 31.44 26.57 3h84 n GLU 156 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3h84 n GLY 157 N -0.59 -0.11 0.00 0.62 0.00 -1.13 -4.94 105.19 99.04 3h84 n GLY 157 Ca -0.01 -0.05 0.07 0.00 0.00 0.00 0.00 46.02 46.03 3h84 n GLY 157 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3h84 n GLU 158 N -2.63 0.94 -3.60 1.61 2.13 -1.26 -4.88 120.64 112.96 3h84 n GLU 158 Ca -0.11 -0.10 -0.02 0.00 0.66 0.00 0.00 57.16 57.59 3h84 n GLU 158 Cb 0.63 -1.28 -0.06 0.00 0.27 0.00 0.00 31.44 31.00 3h84 n GLU 158 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 3h84 s THR 159 N -2.80 -0.21 -0.09 6.31 -1.32 -1.26 -4.29 115.64 111.99 3h84 s THR 159 Ca -0.03 0.00 -0.18 0.00 -1.21 0.00 0.00 61.69 60.28 3h84 s THR 159 Cb 0.09 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 70.04 3h84 s THR 159 CO 0.57 0.00 0.47 -0.36 -2.21 0.00 0.00 174.62 173.09 3h84 s PHE 160 N 1.80 3.56 0.11 9.09 0.08 -1.26 -4.73 117.98 126.63 3h84 s PHE 160 Ca -0.08 0.93 -0.07 0.00 0.12 0.00 0.00 56.93 57.83 3h84 s PHE 160 Cb -0.05 -2.51 -0.16 0.00 -0.57 0.00 0.00 43.02 39.73 3h84 s PHE 160 CO -0.17 0.27 1.25 -0.44 -0.10 0.00 0.00 175.22 176.03 3h84 h ASP 161 N 6.27 0.63 -3.78 1.36 3.32 -1.37 -3.45 116.42 119.40 3h84 h ASP 161 Ca -0.43 -0.53 -0.20 0.00 0.02 0.00 0.00 57.03 55.89 3h84 h ASP 161 Cb 1.19 -0.19 -0.27 0.00 0.22 0.00 0.00 39.33 40.27 3h84 h ASP 161 CO 0.73 1.34 -0.59 0.42 -1.72 0.00 0.00 179.24 179.41 3h84 s THR 162 N -3.19 0.00 -0.17 0.35 -4.23 -1.18 -4.53 115.64 102.69 3h84 s THR 162 Ca -0.07 -0.01 -0.04 0.00 -1.18 0.00 0.00 61.69 60.40 3h84 s THR 162 Cb 0.08 -0.16 -0.02 0.00 1.34 0.00 0.00 72.50 73.74 3h84 s THR 162 CO 0.89 -0.00 -0.04 -0.69 -0.54 0.00 0.00 174.62 174.23 3h84 s VAL 163 N 0.04 3.78 -0.38 2.29 1.01 0.61 -2.33 120.40 125.42 3h84 s VAL 163 Ca -0.00 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.44 3h84 s VAL 163 Cb -0.01 -2.66 0.00 0.00 0.00 0.00 0.00 36.38 33.71 3h84 s VAL 163 CO 0.00 0.48 0.31 -0.63 0.00 0.00 0.00 175.10 175.26 3h84 s ILE 164 N 0.57 5.23 -0.55 2.22 -1.09 0.12 -0.93 121.20 126.77 3h84 s ILE 164 Ca -0.03 -0.38 -0.22 0.00 -2.23 0.00 0.00 60.65 57.79 3h84 s ILE 164 Cb -0.14 -3.87 0.05 0.00 -1.58 0.00 0.00 42.46 36.92 3h84 s ILE 164 CO 0.03 -0.21 0.84 -0.36 -1.23 0.00 0.00 174.94 174.01 3h84 s PHE 165 N 1.81 2.86 -0.82 3.97 0.08 0.19 -1.29 117.98 124.78 3h84 s PHE 165 Ca 0.07 -0.27 -0.26 0.00 0.12 0.00 0.00 56.93 56.60 3h84 s PHE 165 Cb -0.18 -3.93 0.03 0.00 -0.57 0.00 0.00 43.02 38.37 3h84 s PHE 165 CO 0.11 -1.29 1.41 0.34 -0.10 0.00 0.00 175.22 175.69 3h84 s ASP 166 N 2.92 6.14 0.54 1.36 2.15 0.13 -1.56 116.67 128.34 3h84 s ASP 166 Ca 0.24 -0.69 -0.20 0.00 0.43 0.00 0.00 52.55 52.33 3h84 s ASP 166 Cb -0.15 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.85 3h84 s ASP 166 CO 0.15 -1.82 1.15 0.42 -0.17 0.00 0.00 175.17 174.90 3h84 s THR 167 N 5.97 3.05 0.48 1.71 -4.23 -1.00 -4.08 115.64 117.54 3h84 s THR 167 Ca 0.42 0.68 -0.24 0.00 -1.18 0.00 0.00 61.69 61.37 3h84 s THR 167 Cb -0.06 -3.29 -0.07 0.00 1.34 0.00 0.00 72.50 70.42 3h84 s THR 167 CO 0.07 -0.12 1.38 0.00 -0.54 0.00 0.00 174.62 175.42 3h84 s ALA 168 N -1.69 3.08 0.42 3.99 0.00 -1.26 -4.93 121.76 121.37 3h84 s ALA 168 Ca 0.72 1.37 0.13 0.00 0.00 0.00 0.00 51.96 54.18 3h84 s ALA 168 Cb -0.26 -3.56 0.89 0.00 0.00 0.00 0.00 23.12 20.18 3h84 s ALA 168 CO 0.30 -1.19 1.93 -1.00 0.00 0.00 0.00 175.76 175.80 3h84 h PRO 169 N 2.04 0.04 -6.18 0.00 0.13 -1.94 -3.44 132.00 122.66 3h84 h PRO 169 Ca -0.51 -0.01 -0.65 0.00 -0.87 0.00 0.00 66.00 63.96 3h84 h PRO 169 Cb 1.27 -0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.29 3h84 h PRO 169 CO 0.60 0.27 -0.62 0.95 -0.23 0.00 0.00 178.00 178.97 3h84 s THR 170 N -4.53 4.39 0.00 1.56 -4.23 -1.26 -4.82 115.64 106.75 3h84 s THR 170 Ca -0.04 -0.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.75 3h84 s THR 170 Cb 0.15 -3.06 0.00 0.00 1.34 0.00 0.00 72.50 70.93 3h84 s THR 170 CO 0.71 0.21 0.00 0.61 -0.54 0.00 0.00 174.62 175.61 3h84 n GLY 171 N 0.79 -1.02 3.34 3.99 0.00 -1.26 -4.76 105.19 106.27 3h84 n GLY 171 Ca -0.11 -1.61 -0.45 0.00 0.00 0.00 0.00 46.02 43.85 3h84 n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h84 s HIS 172 N -2.83 4.20 0.07 1.61 0.09 -1.26 -4.91 115.29 112.27 3h84 s HIS 172 Ca 0.00 -2.60 0.33 0.00 -0.00 0.00 0.00 55.06 52.79 3h84 s HIS 172 Cb 0.00 -3.85 1.49 0.00 -0.00 0.00 0.00 32.58 30.23 3h84 s HIS 172 CO 0.00 -0.96 1.98 1.79 -0.00 0.00 0.00 174.74 177.55 3h84 h THR 173 N 3.81 0.00 -0.64 1.30 1.35 -1.93 -1.94 112.91 114.86 3h84 h THR 173 Ca 0.17 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.73 3h84 h THR 173 Cb 0.89 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.52 3h84 h THR 173 CO 0.99 0.00 0.00 0.18 -0.25 0.00 0.00 175.52 176.44 3h84 n LEU 174 N -2.84 3.84 0.31 3.87 4.77 -1.26 -4.54 117.00 121.15 3h84 n LEU 174 Ca 0.00 -1.92 0.17 0.00 -0.03 0.00 0.00 56.01 54.23 3h84 n LEU 174 Cb 0.22 -0.48 0.98 0.00 -2.33 0.00 0.00 43.42 41.81 3h84 n LEU 174 CO 0.23 0.84 1.12 -0.09 -1.33 0.00 0.00 177.39 178.15 3h84 h ARG 175 N 3.82 0.00 0.00 3.23 2.43 -1.72 -2.25 114.38 119.89 3h84 h ARG 175 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h84 h ARG 175 Cb 1.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.60 3h84 h ARG 175 CO 0.08 0.02 0.06 0.27 -1.51 0.00 0.00 179.97 178.88 3h84 h PHE 176 N 0.00 0.00 0.00 2.20 -0.00 -1.80 -2.27 116.94 115.07 3h84 h PHE 176 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.97 3h84 h PHE 176 Cb 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.01 3h84 h PHE 176 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 178.31 178.24 3h84 h LEU 177 N 0.00 0.00 -0.81 2.10 3.38 -1.75 -2.10 115.31 116.13 3h84 h LEU 177 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h84 h LEU 177 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3h84 h LEU 177 CO 0.00 0.00 -0.42 0.00 0.09 0.00 0.00 178.44 178.11 3h84 n GLN 178 N -2.93 1.06 -0.04 1.13 6.02 -0.85 -4.60 117.38 117.17 3h84 n GLN 178 Ca 0.00 -0.81 -0.11 0.00 -0.01 0.00 0.00 57.00 56.07 3h84 n GLN 178 Cb 0.25 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 29.98 3h84 n GLN 178 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3h84 h LEU 179 N 1.99 0.23 -1.32 1.08 5.85 -1.48 -0.93 115.31 120.72 3h84 h LEU 179 Ca 0.00 -0.11 0.16 0.00 0.84 0.00 0.00 57.88 58.77 3h84 h LEU 179 Cb 0.67 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 3h84 h LEU 179 CO 0.00 0.28 0.58 1.55 -0.34 0.00 0.00 178.44 180.50 3h84 h PRO 180 N 0.16 0.61 -0.01 5.25 0.13 -1.81 -0.18 132.00 136.14 3h84 h PRO 180 Ca 0.06 -0.04 -0.16 0.00 -0.87 0.00 0.00 66.00 65.00 3h84 h PRO 180 Cb 0.11 -0.14 0.01 0.00 0.13 0.00 0.00 31.00 31.11 3h84 h PRO 180 CO -0.01 0.40 -0.60 -0.97 -0.23 0.00 0.00 178.00 176.59 3h84 h ASN 181 N 0.62 0.55 -0.10 1.44 -0.73 -1.83 -3.08 115.58 112.45 3h84 h ASN 181 Ca 0.46 -0.75 0.02 0.00 1.87 0.00 0.00 56.30 57.91 3h84 h ASN 181 Cb 0.83 -0.17 -0.02 0.00 0.27 0.00 0.00 38.32 39.23 3h84 h ASN 181 CO -0.21 1.22 -0.04 0.74 -0.37 0.00 0.00 177.43 178.77 3h84 h THR 182 N -0.07 0.86 0.00 -3.57 2.02 -0.16 -1.91 112.91 110.08 3h84 h THR 182 Ca -0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.11 3h84 h THR 182 Cb 1.30 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.57 3h84 h THR 182 CO 0.12 0.00 -0.32 0.00 0.37 0.00 0.00 175.52 175.69 3h84 n LEU 183 N -5.17 0.57 0.05 2.58 -0.00 -0.18 -2.07 117.00 112.78 3h84 n LEU 183 Ca -0.04 0.33 -0.12 0.00 -0.00 0.00 0.00 56.01 56.18 3h84 n LEU 183 Cb 0.10 -0.29 -0.13 0.00 -0.00 0.00 0.00 43.42 43.09 3h84 n LEU 183 CO 0.28 -0.05 -0.21 0.77 -0.00 0.00 0.00 177.39 178.17 3h84 h SER 184 N 0.00 0.20 0.36 1.45 4.64 -1.45 -2.48 113.55 116.27 3h84 h SER 184 Ca 0.00 -0.27 -0.10 0.00 -0.47 0.00 0.00 61.79 60.95 3h84 h SER 184 Cb 0.65 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.67 3h84 h SER 184 CO 0.00 1.22 -0.45 0.11 -0.87 0.00 0.00 176.83 176.84 3h84 h LYS 185 N 0.03 0.11 -0.07 4.77 1.57 -1.28 -2.59 116.57 119.11 3h84 h LYS 185 Ca -0.18 -0.05 -0.17 0.00 -1.87 0.00 0.00 60.65 58.38 3h84 h LYS 185 Cb 1.94 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.24 3h84 h LYS 185 CO 0.14 0.54 -0.70 -0.07 -0.57 0.00 0.00 179.45 178.79 3h84 h LEU 186 N 0.09 0.41 -0.97 2.94 4.07 -1.47 -2.90 115.31 117.47 3h84 h LEU 186 Ca 0.00 -0.26 -0.11 0.00 0.08 0.00 0.00 57.88 57.60 3h84 h LEU 186 Cb 0.83 -0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.44 3h84 h LEU 186 CO 0.06 0.98 -0.51 -0.07 -1.08 0.00 0.00 178.44 177.83 3h84 h LEU 187 N 0.24 0.02 -0.19 1.67 3.38 -1.31 -0.98 115.31 118.14 3h84 h LEU 187 Ca -0.02 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.72 3h84 h LEU 187 Cb 1.26 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 42.01 3h84 h LEU 187 CO 0.12 0.52 -0.76 -0.33 0.09 0.00 0.00 178.44 178.08 3h84 h GLU 188 N 0.01 0.79 -0.34 1.13 5.08 -1.47 0.44 114.58 120.22 3h84 h GLU 188 Ca -0.00 -0.63 -0.09 0.00 -1.00 0.00 0.00 59.36 57.64 3h84 h GLU 188 Cb 0.90 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 3h84 h GLU 188 CO 0.07 1.24 -0.16 0.87 -1.00 0.00 0.00 179.01 180.02 3h84 h LYS 189 N 0.54 0.61 -0.58 2.33 1.57 -1.45 -0.16 116.57 119.44 3h84 h LYS 189 Ca -0.05 -0.21 -0.06 0.00 -1.87 0.00 0.00 60.65 58.47 3h84 h LYS 189 Cb 1.38 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.62 3h84 h LYS 189 CO 0.16 0.75 0.12 0.35 -0.57 0.00 0.00 179.45 180.26 3h84 h PHE 190 N 0.56 0.99 -0.00 -1.35 3.04 -1.10 -2.57 116.94 116.50 3h84 h PHE 190 Ca 0.09 -0.12 -0.11 0.00 3.98 0.00 0.00 57.97 61.81 3h84 h PHE 190 Cb 0.59 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.81 3h84 h PHE 190 CO 0.02 0.85 -0.52 0.78 -2.02 0.00 0.00 178.31 177.43 3h84 h GLY 191 N 0.84 0.00 0.67 2.40 0.00 -0.54 -2.18 103.07 104.26 3h84 h GLY 191 Ca 0.18 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.43 3h84 h GLY 191 CO 0.01 0.00 -0.27 0.83 0.00 0.00 0.00 176.54 177.11 3h84 h GLU 192 N 0.00 0.32 -0.01 4.80 5.08 -0.99 -3.30 114.58 120.48 3h84 h GLU 192 Ca -0.01 -0.24 -0.03 0.00 -1.00 0.00 0.00 59.36 58.09 3h84 h GLU 192 Cb 0.91 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.21 3h84 h GLU 192 CO 0.07 0.87 -0.09 0.82 -1.00 0.00 0.00 179.01 179.67 3h84 h ILE 193 N -0.16 1.54 -0.61 3.13 2.04 -1.45 -3.29 117.51 118.70 3h84 h ILE 193 Ca -0.01 -1.72 0.12 0.00 1.00 0.00 0.00 64.86 64.25 3h84 h ILE 193 Cb 0.90 2.65 -0.04 0.00 -0.74 0.00 0.00 36.82 39.60 3h84 h ILE 193 CO 0.06 0.46 0.42 0.71 0.00 0.00 0.00 178.15 179.79 3h84 h THR 194 N -0.58 0.85 0.00 -0.27 1.35 -1.57 -1.92 112.91 110.77 3h84 h THR 194 Ca -0.01 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.74 3h84 h THR 194 Cb 0.80 0.48 0.00 0.00 -1.73 0.00 0.00 68.15 67.70 3h84 h THR 194 CO 0.02 0.06 0.00 0.59 -0.25 0.00 0.00 175.52 175.94 3h84 n ASN 195 N -4.46 0.65 0.03 5.36 3.02 -1.24 -4.26 115.26 114.37 3h84 n ASN 195 Ca 0.11 -1.96 -0.01 0.00 -0.03 0.00 0.00 54.58 52.69 3h84 n ASN 195 Cb 0.44 -0.33 -0.01 0.00 -0.61 0.00 0.00 39.78 39.28 3h84 n ASN 195 CO 0.00 0.00 0.00 0.07 -2.62 0.00 0.00 177.26 174.71 3h84 h LYS 196 N 0.01 -0.08 -3.09 3.52 2.10 -1.51 -3.48 116.57 114.04 3h84 h LYS 196 Ca 0.00 0.01 -0.15 0.00 -2.00 0.00 0.00 60.65 58.51 3h84 h LYS 196 Cb 0.33 0.02 -0.24 0.00 -0.90 0.00 0.00 32.23 31.43 3h84 h LYS 196 CO 0.00 -0.05 -0.38 -0.51 -2.00 0.00 0.00 179.45 176.51 3h84 s LEU 197 N -4.74 0.97 0.00 7.07 1.43 -1.26 -5.17 118.68 116.98 3h84 s LEU 197 Ca -0.01 0.42 0.00 0.00 -1.03 0.00 0.00 54.13 53.51 3h84 s LEU 197 Cb 0.00 0.99 0.00 0.00 0.03 0.00 0.00 46.19 47.21 3h84 s LEU 197 CO 0.04 -0.18 0.00 0.61 0.23 0.00 0.00 176.35 177.04 3h84 n GLY 198 N 2.52 -0.94 1.02 -3.19 0.00 -1.26 -4.40 105.19 98.94 3h84 n GLY 198 Ca -0.15 -0.77 0.03 0.00 0.00 0.00 0.00 46.02 45.13 3h84 n GLY 198 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h84 n PRO 199 N 0.00 2.52 0.26 1.61 -0.04 -1.26 -4.90 135.00 133.19 3h84 n PRO 199 Ca 0.00 -1.28 -0.16 0.00 -0.04 0.00 0.00 63.50 62.02 3h84 n PRO 199 Cb 0.00 -1.76 -0.08 0.00 -0.04 0.00 0.00 33.50 31.62 3h84 n PRO 199 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 3h84 h MET 200 N 1.66 -0.70 -0.03 0.54 4.05 -2.00 -2.16 114.93 116.29 3h84 h MET 200 Ca 0.00 0.05 -0.18 0.00 -0.28 0.00 0.00 59.70 59.29 3h84 h MET 200 Cb 1.04 0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.99 3h84 h MET 200 CO 0.18 -0.46 -0.77 1.25 0.23 0.00 0.00 176.91 177.34 3h84 h LEU 201 N -0.72 0.31 -0.67 3.39 5.85 -1.91 -3.03 115.31 118.54 3h84 h LEU 201 Ca -0.05 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 3h84 h LEU 201 Cb 0.60 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3h84 h LEU 201 CO 0.03 0.97 0.27 0.78 -0.34 0.00 0.00 178.44 180.15 3h84 h ASN 202 N 0.16 0.92 0.78 1.25 2.35 -1.75 -2.77 115.58 116.52 3h84 h ASN 202 Ca -0.03 -0.17 -0.18 0.00 -0.55 0.00 0.00 56.30 55.37 3h84 h ASN 202 Cb 1.35 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 39.46 3h84 h ASN 202 CO 0.12 0.84 -0.83 0.28 -1.65 0.00 0.00 177.43 176.19 3h84 h SER 203 N 0.94 0.04 0.18 5.81 0.02 -1.44 -2.11 113.55 116.99 3h84 h SER 203 Ca 0.22 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.13 3h84 h SER 203 Cb 0.20 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.73 3h84 h SER 203 CO -0.02 0.85 -0.09 0.15 -1.14 0.00 0.00 176.83 176.58 3h84 h PHE 204 N 0.02 -0.23 0.00 3.45 3.57 -1.40 -2.32 116.94 120.03 3h84 h PHE 204 Ca -0.01 -0.01 -0.15 0.00 3.53 0.00 0.00 57.97 61.33 3h84 h PHE 204 Cb 1.45 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.25 3h84 h PHE 204 CO 0.00 0.07 -0.70 0.00 -2.23 0.00 0.00 178.31 175.45 3h84 h MET 205 N -0.53 0.00 -0.82 1.11 -0.00 -1.60 -3.17 114.93 109.92 3h84 h MET 205 Ca -0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 59.70 59.60 3h84 h MET 205 Cb 0.40 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 31.96 3h84 h MET 205 CO 0.04 0.70 0.09 0.41 -0.00 0.00 0.00 176.91 178.15 3h84 n GLY 206 N 0.59 2.59 3.69 -3.00 0.00 -0.79 -4.90 105.19 103.36 3h84 n GLY 206 Ca -0.01 -0.54 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 3h84 n GLY 206 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h84 s ALA 207 N -1.95 3.39 -0.88 4.61 0.00 -0.88 -3.10 121.76 122.96 3h84 s ALA 207 Ca 0.31 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.57 3h84 s ALA 207 Cb 0.24 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 20.02 3h84 s ALA 207 CO 0.08 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.72 3h84 n GLY 208 N 3.15 0.06 3.61 0.00 0.00 -1.26 -4.98 105.19 105.78 3h84 n GLY 208 Ca 0.07 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 3h84 n GLY 208 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3h84 s ASN 209 N -2.58 6.64 -0.05 1.61 3.84 -1.18 -5.00 114.94 118.24 3h84 s ASN 209 Ca 0.00 0.80 -0.30 0.00 0.21 0.00 0.00 52.86 53.58 3h84 s ASN 209 Cb 0.00 -2.54 -0.04 0.00 -0.55 0.00 0.00 41.25 38.11 3h84 s ASN 209 CO 0.00 -1.18 1.38 -0.69 -2.79 0.00 0.00 177.10 173.82 3h84 s VAL 210 N 4.47 3.89 0.05 -5.21 1.01 -1.26 -4.95 120.40 118.39 3h84 s VAL 210 Ca 0.52 1.21 -0.27 0.00 0.00 0.00 0.00 61.98 63.44 3h84 s VAL 210 Cb -0.11 -3.78 -0.17 0.00 0.00 0.00 0.00 36.38 32.32 3h84 s VAL 210 CO 0.27 -0.03 1.50 -0.78 0.00 0.00 0.00 175.10 176.06 3h84 h ASP 211 N 8.05 -0.31 -1.52 3.32 1.82 -1.98 -3.46 116.42 122.35 3h84 h ASP 211 Ca -0.35 -0.10 -0.00 0.00 -0.39 0.00 0.00 57.03 56.19 3h84 h ASP 211 Cb 1.16 0.08 -0.00 0.00 0.68 0.00 0.00 39.33 41.25 3h84 h ASP 211 CO 0.92 -0.09 -0.00 2.30 -1.61 0.00 0.00 179.24 180.76 3h84 n ILE 212 N -5.18 0.00 -0.06 2.25 -6.64 -1.26 -4.77 119.36 103.70 3h84 n ILE 212 Ca -0.10 0.00 -0.15 0.00 -1.77 0.00 0.00 62.75 60.74 3h84 n ILE 212 Cb 0.21 -0.00 -0.04 0.00 -1.44 0.00 0.00 39.64 38.37 3h84 n ILE 212 CO 0.00 0.00 0.00 0.28 -1.77 0.00 0.00 176.55 175.06 3h84 h SER 213 N 0.00 0.94 0.14 7.28 0.02 -1.98 -1.93 113.55 118.02 3h84 h SER 213 Ca -0.00 -0.53 -0.09 0.00 -0.84 0.00 0.00 61.79 60.33 3h84 h SER 213 Cb 0.00 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.26 3h84 h SER 213 CO 0.00 1.32 -0.33 1.23 -1.14 0.00 0.00 176.83 177.91 3h84 h GLY 214 N 0.70 0.30 1.92 -3.77 0.00 -1.99 0.75 103.07 100.99 3h84 h GLY 214 Ca 0.00 -0.25 -0.17 0.00 0.00 0.00 0.00 47.33 46.91 3h84 h GLY 214 CO 0.13 0.23 -0.84 1.70 0.00 0.00 0.00 176.54 177.76 3h84 h LYS 215 N 0.24 0.00 0.21 4.80 1.63 -1.95 -3.00 116.57 118.51 3h84 h LYS 215 Ca 0.03 0.00 -0.31 0.00 -0.85 0.00 0.00 60.65 59.52 3h84 h LYS 215 Cb 0.70 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.36 3h84 h LYS 215 CO 0.05 0.75 -1.45 1.25 -3.45 0.00 0.00 179.45 176.60 3h84 h LEU 216 N 0.00 0.69 -0.94 5.20 6.46 -1.16 -3.14 115.31 122.42 3h84 h LEU 216 Ca -0.02 -0.92 -0.09 0.00 -0.12 0.00 0.00 57.88 56.72 3h84 h LEU 216 Cb 1.61 -0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 41.31 3h84 h LEU 216 CO 0.10 1.68 -0.43 0.78 -0.62 0.00 0.00 178.44 179.95 3h84 h ASN 217 N 0.01 0.00 0.64 1.25 -0.26 -0.96 -1.43 115.58 114.82 3h84 h ASN 217 Ca -0.27 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.29 3h84 h ASN 217 Cb 2.03 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 39.28 3h84 h ASN 217 CO 0.21 0.43 -0.81 1.05 -1.06 0.00 0.00 177.43 177.25 3h84 h GLU 218 N 0.00 0.12 -0.48 0.81 4.11 -1.66 -1.23 114.58 116.26 3h84 h GLU 218 Ca -0.00 -0.13 -0.08 0.00 0.07 0.00 0.00 59.36 59.21 3h84 h GLU 218 Cb 0.91 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.18 3h84 h GLU 218 CO 0.06 0.87 -0.03 1.25 0.07 0.00 0.00 179.01 181.22 3h84 h LEU 219 N 0.07 0.86 -0.84 3.06 5.85 -1.44 0.97 115.31 123.84 3h84 h LEU 219 Ca -0.03 -0.32 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 3h84 h LEU 219 Cb 1.42 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.18 3h84 h LEU 219 CO 0.12 0.97 0.41 0.50 -0.34 0.00 0.00 178.44 180.10 3h84 h LYS 220 N 0.72 1.20 -0.51 1.25 3.64 -1.22 -1.71 116.57 119.94 3h84 h LYS 220 Ca 0.13 -0.17 -0.12 0.00 -1.27 0.00 0.00 60.65 59.21 3h84 h LYS 220 Cb 0.55 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 3h84 h LYS 220 CO 0.03 0.92 -0.16 0.00 -2.27 0.00 0.00 179.45 177.97 3h84 h ALA 221 N 1.22 0.70 -0.73 5.00 0.00 -0.99 -1.75 119.26 122.71 3h84 h ALA 221 Ca 0.29 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3h84 h ALA 221 Cb 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3h84 h ALA 221 CO -0.04 0.65 0.23 -0.91 0.00 0.00 0.00 179.25 179.19 3h84 h ASN 222 N 0.87 1.06 -0.04 0.00 2.35 -0.61 -1.92 115.58 117.29 3h84 h ASN 222 Ca 0.12 -0.20 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 3h84 h ASN 222 Cb 0.73 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.83 3h84 h ASN 222 CO 0.06 0.98 -0.01 0.58 -1.65 0.00 0.00 177.43 177.38 3h84 h VAL 223 N 1.09 1.32 -0.89 2.81 2.07 -1.26 -2.21 116.25 119.18 3h84 h VAL 223 Ca 0.24 -0.98 0.13 0.00 0.82 0.00 0.00 66.70 66.90 3h84 h VAL 223 Cb 0.30 1.91 -0.07 0.00 -1.52 0.00 0.00 31.29 31.91 3h84 h VAL 223 CO -0.01 0.26 0.57 -0.33 0.02 0.00 0.00 177.57 178.09 3h84 h GLU 224 N -0.31 0.75 -0.08 1.57 5.08 -1.24 0.51 114.58 120.86 3h84 h GLU 224 Ca 0.01 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 3h84 h GLU 224 Cb 0.43 -0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 3h84 h GLU 224 CO 0.00 0.49 0.02 1.15 -1.00 0.00 0.00 179.01 179.68 3h84 h THR 225 N 0.77 1.20 -0.80 1.13 2.02 -1.32 -2.91 112.91 112.99 3h84 h THR 225 Ca 0.44 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 67.01 3h84 h THR 225 Cb 0.60 1.45 -0.04 0.00 -1.74 0.00 0.00 68.15 68.42 3h84 h THR 225 CO -0.20 0.17 0.50 0.40 0.37 0.00 0.00 175.52 176.76 3h84 h ILE 226 N -0.09 1.22 -0.70 3.11 2.04 -0.59 -2.72 117.51 119.79 3h84 h ILE 226 Ca 0.02 -0.46 0.12 0.00 1.00 0.00 0.00 64.86 65.54 3h84 h ILE 226 Cb 0.25 0.08 -0.05 0.00 -0.74 0.00 0.00 36.82 36.37 3h84 h ILE 226 CO 0.00 0.22 0.47 0.03 0.00 0.00 0.00 178.15 178.87 3h84 h ARG 227 N 1.10 0.47 -0.38 2.37 3.08 0.02 -0.93 114.38 120.11 3h84 h ARG 227 Ca 0.29 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.31 3h84 h ARG 227 Cb -0.07 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.86 3h84 h ARG 227 CO -0.06 0.31 0.25 1.96 -1.07 0.00 0.00 179.97 181.36 3h84 h GLN 228 N 0.48 0.51 0.07 0.04 4.20 -1.28 -1.33 115.11 117.80 3h84 h GLN 228 Ca 0.33 -0.03 -0.35 0.00 0.06 0.00 0.00 58.65 58.66 3h84 h GLN 228 Cb 0.64 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.27 3h84 h GLN 228 CO -0.11 0.34 -2.00 1.04 -0.67 0.00 0.00 178.83 177.43 3h84 n GLN 229 N -4.47 0.71 0.21 1.46 6.02 -0.72 -4.13 117.38 116.46 3h84 n GLN 229 Ca 0.03 0.24 0.09 0.00 -0.01 0.00 0.00 57.00 57.35 3h84 n GLN 229 Cb 0.07 -1.70 0.29 0.00 1.02 0.00 0.00 30.24 29.92 3h84 n GLN 229 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 3h84 h PHE 230 N 0.04 0.00 -0.39 1.08 -1.00 -1.07 -2.85 116.94 112.75 3h84 h PHE 230 Ca -0.41 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.37 3h84 h PHE 230 Cb 2.03 0.00 0.00 0.00 3.61 0.00 0.00 35.95 41.59 3h84 h PHE 230 CO 0.05 0.21 0.00 0.25 -1.61 0.00 0.00 178.31 177.20 3h84 n THR 231 N -3.22 0.51 -3.34 -1.55 -2.24 -0.51 -4.46 114.28 99.47 3h84 n THR 231 Ca 0.02 -0.67 -0.43 0.00 -2.27 0.00 0.00 64.05 60.70 3h84 n THR 231 Cb 0.52 0.68 -0.09 0.00 -2.10 0.00 0.00 70.33 69.34 3h84 n THR 231 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h84 s ASP 232 N -1.37 6.18 0.47 3.42 -1.08 -1.07 -4.87 116.67 118.34 3h84 s ASP 232 Ca 0.37 -0.77 0.32 0.00 -0.52 0.00 0.00 52.55 51.95 3h84 s ASP 232 Cb 0.21 -2.21 1.58 0.00 -1.46 0.00 0.00 42.92 41.03 3h84 s ASP 232 CO 0.29 -0.58 1.96 1.55 0.52 0.00 0.00 175.17 178.92 3h84 h PRO 233 N 8.73 0.00 0.00 4.34 0.13 -1.86 -0.39 132.00 142.94 3h84 h PRO 233 Ca -0.27 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 3h84 h PRO 233 Cb 1.11 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.24 3h84 h PRO 233 CO 0.80 0.00 -0.43 -0.44 -0.23 0.00 0.00 178.00 177.70 3h84 h ASP 234 N 0.00 0.00 0.00 1.44 3.45 -1.93 -3.37 116.42 116.02 3h84 h ASP 234 Ca 0.00 0.00 -0.33 0.00 0.43 0.00 0.00 57.03 57.13 3h84 h ASP 234 Cb 0.18 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 38.88 3h84 h ASP 234 CO 0.00 0.03 -2.26 0.18 -1.57 0.00 0.00 179.24 175.62 3h84 n LEU 235 N -2.94 0.29 -3.86 1.55 4.77 -0.31 -2.46 117.00 114.04 3h84 n LEU 235 Ca 0.02 -0.01 -0.12 0.00 -0.03 0.00 0.00 56.01 55.87 3h84 n LEU 235 Cb 0.55 0.33 -0.14 0.00 -2.33 0.00 0.00 43.42 41.83 3h84 n LEU 235 CO 0.37 0.49 -0.35 -0.89 -1.33 0.00 0.00 177.39 175.68 3h84 s THR 236 N -2.44 -0.01 0.06 -5.08 2.01 -0.32 -1.00 115.64 108.86 3h84 s THR 236 Ca -0.11 0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.80 3h84 s THR 236 Cb 0.06 -0.02 0.01 0.00 0.01 0.00 0.00 72.50 72.55 3h84 s THR 236 CO 0.73 0.01 0.23 0.28 -0.69 0.00 0.00 174.62 175.18 3h84 s THR 237 N 0.12 0.11 -0.19 -0.82 -1.32 -0.99 -4.30 115.64 108.25 3h84 s THR 237 Ca -0.01 -0.89 -0.00 0.00 -1.21 0.00 0.00 61.69 59.57 3h84 s THR 237 Cb -0.01 -1.04 0.01 0.00 -1.51 0.00 0.00 72.50 69.94 3h84 s THR 237 CO -0.00 -0.49 -0.16 0.12 -2.21 0.00 0.00 174.62 171.88 3h84 s PHE 238 N -2.97 2.82 -0.32 9.09 5.36 -0.36 -1.15 117.98 130.46 3h84 s PHE 238 Ca -0.02 -1.40 -0.15 0.00 -0.96 0.00 0.00 56.93 54.39 3h84 s PHE 238 Cb 0.01 -1.96 -0.02 0.00 -0.34 0.00 0.00 43.02 40.71 3h84 s PHE 238 CO -0.06 -0.71 0.39 0.08 -1.46 0.00 0.00 175.22 173.46 3h84 s VAL 239 N 1.28 5.15 0.30 3.12 1.01 0.71 -4.32 120.40 127.66 3h84 s VAL 239 Ca 0.04 0.28 -0.21 0.00 0.00 0.00 0.00 61.98 62.09 3h84 s VAL 239 Cb -0.14 -3.79 -0.09 0.00 0.00 0.00 0.00 36.38 32.36 3h84 s VAL 239 CO -0.09 -0.02 0.83 0.00 0.00 0.00 0.00 175.10 175.82 3h84 s VAL 241 N -1.74 1.73 0.35 0.00 1.01 1.00 -0.29 120.40 122.47 3h84 s VAL 241 Ca 0.50 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 3h84 s VAL 241 Cb -0.15 -1.50 0.00 0.00 0.00 0.00 0.00 36.38 34.74 3h84 s VAL 241 CO 0.20 0.49 0.49 0.00 0.00 0.00 0.00 175.10 176.27 3h84 s ILE 243 N -2.97 1.80 -1.39 0.00 -4.36 -1.26 -0.26 121.20 112.76 3h84 s ILE 243 Ca 0.30 -2.20 -0.13 0.00 -0.26 0.00 0.00 60.65 58.37 3h84 s ILE 243 Cb -0.01 -2.04 0.08 0.00 1.25 0.00 0.00 42.46 41.74 3h84 s ILE 243 CO 0.21 -0.55 2.07 -0.24 0.24 0.00 0.00 174.94 176.67 3h84 n SER 244 N -0.33 4.33 -3.87 4.36 2.88 -1.26 -4.32 113.62 115.41 3h84 n SER 244 Ca -0.08 -2.93 -0.11 0.00 -1.33 0.00 0.00 58.87 54.42 3h84 n SER 244 Cb 0.60 -1.61 -0.11 0.00 -0.75 0.00 0.00 64.21 62.34 3h84 n SER 244 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 3h84 s GLU 245 N 2.43 0.37 0.20 -1.46 2.02 -1.26 -4.19 118.70 116.81 3h84 s GLU 245 Ca 0.45 -0.26 -0.19 0.00 0.02 0.00 0.00 54.97 55.00 3h84 s GLU 245 Cb 0.12 0.16 0.16 0.00 0.10 0.00 0.00 34.13 34.66 3h84 s GLU 245 CO -0.05 -0.08 1.59 0.35 0.02 0.00 0.00 175.26 177.09 3h84 h PHE 246 N 4.78 -0.84 0.00 1.61 3.57 -1.95 -1.08 116.94 123.03 3h84 h PHE 246 Ca -0.29 0.07 -0.08 0.00 3.53 0.00 0.00 57.97 61.20 3h84 h PHE 246 Cb 1.20 0.46 -0.01 0.00 2.79 0.00 0.00 35.95 40.39 3h84 h PHE 246 CO 0.55 -0.37 -0.37 -0.07 -2.23 0.00 0.00 178.31 175.82 3h84 h LEU 247 N -0.13 0.00 -0.05 0.59 3.38 -1.98 -2.01 115.31 115.11 3h84 h LEU 247 Ca 0.26 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.98 3h84 h LEU 247 Cb 0.55 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.31 3h84 h LEU 247 CO -0.70 0.37 -1.07 -1.28 0.09 0.00 0.00 178.44 175.85 3h84 h SER 248 N 0.00 0.57 -0.68 -0.43 0.87 -1.64 -1.65 113.55 110.59 3h84 h SER 248 Ca -0.00 -0.50 -0.03 0.00 -1.23 0.00 0.00 61.79 60.03 3h84 h SER 248 Cb 0.97 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 62.72 3h84 h SER 248 CO 0.05 1.33 0.33 -0.07 -0.53 0.00 0.00 176.83 177.93 3h84 h LEU 249 N 0.20 0.89 -0.09 2.23 3.38 -1.05 -0.06 115.31 120.82 3h84 h LEU 249 Ca -0.11 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3h84 h LEU 249 Cb 1.73 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 3h84 h LEU 249 CO 0.19 0.78 0.05 0.22 0.09 0.00 0.00 178.44 179.76 3h84 h TYR 250 N 0.95 0.09 -0.30 1.13 3.20 -1.33 -0.25 116.97 120.46 3h84 h TYR 250 Ca 0.23 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.05 3h84 h TYR 250 Cb 0.12 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3h84 h TYR 250 CO 0.00 0.06 -0.05 1.49 -1.64 0.00 0.00 178.16 178.03 3h84 h GLU 251 N 0.11 0.47 -0.18 1.82 4.57 -1.18 -2.34 114.58 117.84 3h84 h GLU 251 Ca 0.03 -0.11 -0.15 0.00 -1.18 0.00 0.00 59.36 57.96 3h84 h GLU 251 Cb -0.00 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.52 3h84 h GLU 251 CO -0.02 0.53 -0.46 1.15 -1.18 0.00 0.00 179.01 179.04 3h84 h THR 252 N 0.45 1.33 -0.93 0.32 2.02 -0.72 -1.64 112.91 113.73 3h84 h THR 252 Ca 0.09 -1.70 -0.01 0.00 0.77 0.00 0.00 66.41 65.56 3h84 h THR 252 Cb 0.37 1.92 -0.04 0.00 -1.74 0.00 0.00 68.15 68.65 3h84 h THR 252 CO 0.02 0.53 0.54 -0.08 0.37 0.00 0.00 175.52 176.89 3h84 h GLU 253 N 0.31 1.28 -0.04 6.66 4.57 -0.89 -1.03 114.58 125.43 3h84 h GLU 253 Ca -0.01 -0.13 -0.17 0.00 -1.18 0.00 0.00 59.36 57.88 3h84 h GLU 253 Cb 1.07 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.39 3h84 h GLU 253 CO 0.10 0.91 -0.71 0.07 -1.18 0.00 0.00 179.01 178.19 3h84 h ARG 254 N 1.29 0.23 -0.37 1.92 0.11 -1.43 -2.46 114.38 113.67 3h84 h ARG 254 Ca 0.33 -0.19 -0.01 0.00 0.10 0.00 0.00 59.98 60.22 3h84 h ARG 254 Cb -0.02 0.04 -0.02 0.00 1.11 0.00 0.00 29.97 31.08 3h84 h ARG 254 CO -0.06 0.85 0.20 1.25 0.10 0.00 0.00 179.97 182.31 3h84 h LEU 255 N 0.15 0.46 -0.62 0.08 6.46 -0.95 -0.95 115.31 119.93 3h84 h LEU 255 Ca -0.02 -0.08 -0.04 0.00 -0.12 0.00 0.00 57.88 57.61 3h84 h LEU 255 Cb 1.27 -0.12 -0.03 0.00 -0.73 0.00 0.00 40.66 41.05 3h84 h LEU 255 CO 0.11 0.41 0.22 0.40 -0.62 0.00 0.00 178.44 178.96 3h84 h ILE 256 N 0.47 1.24 -0.80 4.05 2.04 -1.19 -1.64 117.51 121.68 3h84 h ILE 256 Ca 0.13 -0.78 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 3h84 h ILE 256 Cb 0.05 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 3h84 h ILE 256 CO -0.02 0.30 0.32 1.56 0.00 0.00 0.00 178.15 180.31 3h84 h GLN 257 N 0.88 1.20 -0.86 2.37 1.08 -1.28 -0.76 115.11 117.74 3h84 h GLN 257 Ca 0.20 -0.22 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3h84 h GLN 257 Cb 0.24 -0.19 -0.04 0.00 -0.05 0.00 0.00 27.48 27.44 3h84 h GLN 257 CO -0.01 0.97 0.57 1.49 -0.95 0.00 0.00 178.83 180.89 3h84 h GLU 258 N 1.16 1.12 -0.01 1.46 4.81 -0.90 -2.51 114.58 119.70 3h84 h GLU 258 Ca 0.27 -0.07 -0.17 0.00 -0.13 0.00 0.00 59.36 59.26 3h84 h GLU 258 Cb 0.22 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.33 3h84 h GLU 258 CO -0.02 0.74 -0.75 -0.07 -0.73 0.00 0.00 179.01 178.17 3h84 h LEU 259 N 1.15 0.14 -0.82 1.64 3.38 -0.79 -2.92 115.31 117.09 3h84 h LEU 259 Ca 0.32 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 3h84 h LEU 259 Cb -0.11 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 3h84 h LEU 259 CO -0.08 0.84 -0.14 0.40 0.09 0.00 0.00 178.44 179.55 3h84 h ILE 260 N 0.07 1.26 0.00 1.22 2.04 -1.05 -0.25 117.51 120.81 3h84 h ILE 260 Ca -0.02 -1.20 0.00 0.00 1.00 0.00 0.00 64.86 64.64 3h84 h ILE 260 Cb 1.33 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 3h84 h ILE 260 CO 0.11 0.40 0.00 0.77 0.00 0.00 0.00 178.15 179.43 3h84 h SER 261 N 0.65 0.00 0.32 1.72 4.64 -1.33 -1.66 113.55 117.89 3h84 h SER 261 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3h84 h SER 261 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 3h84 h SER 261 CO 0.04 0.00 -0.28 -1.22 -0.87 0.00 0.00 176.83 174.51 3h84 n TYR 262 N -3.02 0.00 -1.69 4.77 4.01 -1.02 -4.93 117.16 115.28 3h84 n TYR 262 Ca 0.01 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.58 3h84 n TYR 262 Cb 0.30 -0.16 -0.06 0.00 -0.31 0.00 0.00 39.34 39.11 3h84 n TYR 262 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 3h84 n ASP 263 N -0.86 -5.04 -4.70 7.72 8.00 -0.62 -4.88 116.55 116.16 3h84 n ASP 263 Ca 0.11 0.32 -0.42 0.00 0.71 0.00 0.00 54.79 55.51 3h84 n ASP 263 Cb 0.34 -4.06 -0.03 0.00 -0.02 0.00 0.00 41.12 37.35 3h84 n ASP 263 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3h84 s MET 264 N -3.77 4.47 0.11 -1.24 -1.94 -0.13 -4.51 119.30 112.28 3h84 s MET 264 Ca 0.00 1.33 -0.31 0.00 -1.71 0.00 0.00 55.69 55.00 3h84 s MET 264 Cb 0.00 -3.50 -0.10 0.00 2.01 0.00 0.00 34.83 33.24 3h84 s MET 264 CO 0.00 -0.18 1.71 0.34 -0.01 0.00 0.00 175.02 176.88 3h84 s ASP 265 N 1.04 6.52 -0.12 3.03 2.15 -1.26 -4.31 116.67 123.72 3h84 s ASP 265 Ca 0.48 2.63 -0.03 0.00 0.43 0.00 0.00 52.55 56.06 3h84 s ASP 265 Cb -0.19 -2.57 0.05 0.00 -0.30 0.00 0.00 42.92 39.90 3h84 s ASP 265 CO 0.22 -0.92 0.05 0.68 -0.17 0.00 0.00 175.17 175.02 3h84 s VAL 266 N 2.35 0.18 0.00 1.11 -7.23 -1.26 -1.22 120.40 114.32 3h84 s VAL 266 Ca 0.76 -0.07 0.07 0.00 -1.81 0.00 0.00 61.98 60.93 3h84 s VAL 266 Cb -0.43 -0.59 0.11 0.00 0.56 0.00 0.00 36.38 36.03 3h84 s VAL 266 CO 0.33 -0.03 0.99 -0.46 -0.31 0.00 0.00 175.10 175.63 3h84 n ASN 267 N 5.19 0.22 -3.83 4.85 6.94 -1.26 -5.03 115.26 122.34 3h84 n ASN 267 Ca -0.07 -1.90 -0.21 0.00 -0.02 0.00 0.00 54.58 52.39 3h84 n ASN 267 Cb 0.49 -0.18 -0.17 0.00 -2.36 0.00 0.00 39.78 37.56 3h84 n ASN 267 CO 0.00 0.00 0.00 -0.44 -1.03 0.00 0.00 177.26 175.79 3h84 s SER 268 N -1.16 1.15 -0.10 0.53 0.01 -1.26 0.52 113.70 113.39 3h84 s SER 268 Ca 0.09 -0.09 0.01 0.00 1.31 0.00 0.00 55.95 57.27 3h84 s SER 268 Cb 0.10 -0.41 0.02 0.00 0.21 0.00 0.00 66.02 65.94 3h84 s SER 268 CO -0.04 -0.12 -0.13 -0.63 0.41 0.00 0.00 173.24 172.72 3h84 s ILE 269 N 1.39 1.31 -0.25 1.44 1.01 0.41 -1.48 121.20 125.03 3h84 s ILE 269 Ca -0.04 -0.53 -0.13 0.00 0.00 0.00 0.00 60.65 59.95 3h84 s ILE 269 Cb -0.13 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 3h84 s ILE 269 CO -0.03 0.40 0.27 -0.63 0.00 0.00 0.00 174.94 174.96 3h84 s ILE 270 N 1.03 5.27 -0.33 2.92 1.01 0.61 -0.70 121.20 131.00 3h84 s ILE 270 Ca -0.07 0.38 -0.09 0.00 0.00 0.00 0.00 60.65 60.87 3h84 s ILE 270 Cb -0.15 -3.60 0.01 0.00 0.01 0.00 0.00 42.46 38.73 3h84 s ILE 270 CO -0.01 0.25 0.16 -0.69 0.00 0.00 0.00 174.94 174.64 3h84 s VAL 271 N 1.58 4.46 0.43 2.92 1.01 0.14 0.02 120.40 130.96 3h84 s VAL 271 Ca 0.11 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.54 3h84 s VAL 271 Cb -0.15 -3.36 0.01 0.00 0.00 0.00 0.00 36.38 32.88 3h84 s VAL 271 CO 0.08 -0.04 0.55 0.20 0.00 0.00 0.00 175.10 175.90 3h84 s ASN 272 N 1.57 5.49 -1.45 3.32 0.01 0.64 0.00 114.94 124.53 3h84 s ASN 272 Ca 0.03 -0.52 0.00 0.00 -0.71 0.00 0.00 52.86 51.66 3h84 s ASN 272 Cb -0.18 -0.55 0.00 0.00 0.41 0.00 0.00 41.25 40.93 3h84 s ASN 272 CO 0.06 -0.79 0.00 0.00 -1.51 0.00 0.00 177.10 174.85 3h84 n GLN 273 N -1.83 -1.03 -2.30 -0.60 6.02 -1.20 -4.31 117.38 112.13 3h84 n GLN 273 Ca 0.08 0.93 -0.42 0.00 -0.01 0.00 0.00 57.00 57.58 3h84 n GLN 273 Cb 0.60 -5.08 -0.03 0.00 1.02 0.00 0.00 30.24 26.75 3h84 n GLN 273 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3h84 s LEU 274 N -3.47 4.39 0.06 1.08 1.43 -0.95 -4.37 118.68 116.85 3h84 s LEU 274 Ca 0.00 2.21 -0.11 0.00 -1.03 0.00 0.00 54.13 55.20 3h84 s LEU 274 Cb 0.00 -3.59 -0.29 0.00 0.03 0.00 0.00 46.19 42.34 3h84 s LEU 274 CO 0.00 -0.52 1.10 -0.07 0.23 0.00 0.00 176.35 177.09 3h84 h LEU 275 N 6.28 0.72 -2.65 1.79 3.38 -1.93 0.29 115.31 123.19 3h84 h LEU 275 Ca -0.43 -0.72 -0.56 0.00 0.09 0.00 0.00 57.88 56.27 3h84 h LEU 275 Cb 1.21 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.65 3h84 h LEU 275 CO 0.81 1.54 -0.96 0.49 0.09 0.00 0.00 178.44 180.42 3h84 n PHE 276 N -3.69 -1.48 0.26 1.13 3.72 -1.26 -4.85 117.46 111.29 3h84 n PHE 276 Ca -0.13 0.49 0.14 0.00 -0.05 0.00 0.00 57.45 57.90 3h84 n PHE 276 Cb 1.02 -3.14 0.66 0.00 -0.94 0.00 0.00 39.48 37.08 3h84 n PHE 276 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3h84 h ALA 277 N 1.02 1.08 0.00 4.37 0.00 -1.93 -2.76 119.26 121.04 3h84 h ALA 277 Ca -0.67 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.14 3h84 h ALA 277 Cb 1.39 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.16 3h84 h ALA 277 CO 0.61 0.14 0.00 0.39 0.00 0.00 0.00 179.25 180.39 3h84 n GLU 278 N -3.33 0.25 -0.13 0.00 1.02 -1.26 -3.96 120.64 113.24 3h84 n GLU 278 Ca -0.00 0.09 -0.20 0.00 -0.02 0.00 0.00 57.16 57.03 3h84 n GLU 278 Cb 0.32 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.13 3h84 n GLU 278 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3h84 n ASN 279 N -1.32 2.03 -4.67 1.62 3.02 -1.04 -5.01 115.26 109.88 3h84 n ASN 279 Ca 0.09 -0.02 -0.47 0.00 -0.03 0.00 0.00 54.58 54.15 3h84 n ASN 279 Cb 0.18 -0.49 -0.04 0.00 -0.61 0.00 0.00 39.78 38.82 3h84 n ASN 279 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 3h84 n ASP 280 N -3.47 3.23 -4.70 6.41 5.75 -1.25 -4.94 116.55 117.58 3h84 n ASP 280 Ca -0.46 1.03 -0.42 0.00 -0.01 0.00 0.00 54.79 54.93 3h84 n ASP 280 Cb 0.94 -1.39 -0.03 0.00 -1.03 0.00 0.00 41.12 39.61 3h84 n ASP 280 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3h84 s GLN 281 N 2.45 4.30 0.00 0.11 -1.52 -1.26 -2.70 119.66 121.04 3h84 s GLN 281 Ca 0.86 2.03 0.00 0.00 -1.95 0.00 0.00 55.36 56.29 3h84 s GLN 281 Cb -0.69 -3.41 0.00 0.00 -0.22 0.00 0.00 33.01 28.69 3h84 s GLN 281 CO 0.45 -0.50 0.00 -1.91 -0.25 0.00 0.00 175.29 173.08 3h84 n GLU 282 N 4.62 0.00 0.00 2.91 2.13 -1.26 -5.12 120.64 123.92 3h84 n GLU 282 Ca 0.12 0.14 0.00 0.00 0.66 0.00 0.00 57.16 58.08 3h84 n GLU 282 Cb 0.43 -0.98 0.00 0.00 0.27 0.00 0.00 31.44 31.16 3h84 n GLU 282 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 3h84 n HIS 283 N -0.84 0.00 -4.32 4.31 8.25 -1.10 -4.98 115.22 116.55 3h84 n HIS 283 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3h84 n HIS 283 Cb 0.33 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.44 3h84 n HIS 283 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3h84 n ASN 284 N 0.00 -3.02 -2.71 0.41 5.03 -1.26 -5.03 115.26 108.67 3h84 n ASN 284 Ca 0.00 0.00 -0.04 0.00 0.87 0.00 0.00 54.58 55.41 3h84 n ASN 284 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.73 3h84 n ASN 284 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3h84 h LYS 286 N 4.13 0.00 -0.09 0.00 6.56 -1.98 -2.57 116.57 122.62 3h84 h LYS 286 Ca -0.40 0.00 0.03 0.00 -1.06 0.00 0.00 60.65 59.22 3h84 h LYS 286 Cb 0.93 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.55 3h84 h LYS 286 CO 0.02 0.54 -0.12 0.00 -2.06 0.00 0.00 179.45 177.83 3h84 h ARG 287 N 0.00 -0.15 -0.83 3.15 2.47 -1.99 0.19 114.38 117.23 3h84 h ARG 287 Ca -0.01 0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.69 3h84 h ARG 287 Cb 0.99 0.03 -0.04 0.00 -1.65 0.00 0.00 29.97 29.30 3h84 h ARG 287 CO 0.07 -0.10 0.37 0.00 0.56 0.00 0.00 179.97 180.87 3h84 h GLN 289 N 1.19 0.94 -0.29 0.00 5.75 -1.01 -1.34 115.11 120.36 3h84 h GLN 289 Ca 0.28 -0.22 -0.11 0.00 -0.15 0.00 0.00 58.65 58.45 3h84 h GLN 289 Cb 0.17 -0.12 -0.01 0.00 1.07 0.00 0.00 27.48 28.58 3h84 h GLN 289 CO -0.03 0.86 -0.29 0.00 -2.65 0.00 0.00 178.83 176.71 3h84 h ALA 290 N 1.04 0.95 -0.56 3.38 0.00 -0.56 -2.17 119.26 121.33 3h84 h ALA 290 Ca 0.19 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.63 3h84 h ALA 290 Cb 0.34 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3h84 h ALA 290 CO 0.00 0.61 0.01 -0.09 0.00 0.00 0.00 179.25 179.78 3h84 h ARG 291 N 0.51 0.96 0.00 0.00 2.43 -1.07 -2.78 114.38 114.43 3h84 h ARG 291 Ca 0.06 -0.28 -0.10 0.00 -0.81 0.00 0.00 59.98 58.86 3h84 h ARG 291 Cb 0.77 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 3h84 h ARG 291 CO 0.06 0.94 -0.47 2.35 -1.51 0.00 0.00 179.97 181.33 3h84 h TRP 292 N 0.89 0.00 -0.88 2.20 7.01 -1.15 -1.75 115.95 122.28 3h84 h TRP 292 Ca 0.17 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.15 3h84 h TRP 292 Cb 0.50 0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 27.52 3h84 h TRP 292 CO 0.03 0.47 0.50 0.87 -2.79 0.00 0.00 178.44 177.53 3h84 h LYS 293 N 0.00 1.20 -0.23 2.65 1.57 -1.19 0.25 116.57 120.82 3h84 h LYS 293 Ca -0.00 -0.12 -0.16 0.00 -1.87 0.00 0.00 60.65 58.49 3h84 h LYS 293 Cb 1.15 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.21 3h84 h LYS 293 CO 0.06 0.86 -0.48 1.98 -0.57 0.00 0.00 179.45 181.30 3h84 h MET 294 N 1.22 0.73 -0.81 3.15 4.05 -1.31 -2.49 114.93 119.46 3h84 h MET 294 Ca 0.31 -0.48 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 3h84 h MET 294 Cb -0.01 0.06 -0.04 0.00 -0.80 0.00 0.00 31.60 30.81 3h84 h MET 294 CO -0.05 1.10 0.48 1.96 0.23 0.00 0.00 176.91 180.63 3h84 h GLN 295 N 0.46 1.10 -0.36 0.39 4.20 -1.16 -2.33 115.11 117.41 3h84 h GLN 295 Ca 0.00 -0.10 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 3h84 h GLN 295 Cb 1.09 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 3h84 h GLN 295 CO 0.11 0.78 0.05 -0.22 -0.67 0.00 0.00 178.83 178.87 3h84 h LYS 296 N 1.11 0.54 -0.57 1.46 3.64 -0.93 0.01 116.57 121.83 3h84 h LYS 296 Ca 0.29 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.53 3h84 h LYS 296 Cb -0.04 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 3h84 h LYS 296 CO -0.05 0.53 0.18 -0.22 -2.27 0.00 0.00 179.45 177.61 3h84 h LYS 297 N 0.52 0.88 0.00 1.90 3.64 -0.95 -2.46 116.57 120.10 3h84 h LYS 297 Ca 0.12 -0.19 -0.07 0.00 -1.27 0.00 0.00 60.65 59.24 3h84 h LYS 297 Cb 0.26 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3h84 h LYS 297 CO 0.00 0.80 -0.45 1.88 -2.27 0.00 0.00 179.45 179.41 3h84 h TYR 298 N 0.79 0.00 -0.87 1.91 0.05 -1.21 -3.08 116.97 114.56 3h84 h TYR 298 Ca 0.18 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.94 3h84 h TYR 298 Cb 0.28 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 37.98 3h84 h TYR 298 CO 0.02 0.30 0.47 -0.07 -1.05 0.00 0.00 178.16 177.83 3h84 h LEU 299 N 0.00 1.10 -1.05 3.88 3.38 -0.87 -1.08 115.31 120.67 3h84 h LEU 299 Ca -0.02 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3h84 h LEU 299 Cb 1.24 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 3h84 h LEU 299 CO 0.04 0.89 -0.19 0.44 0.09 0.00 0.00 178.44 179.71 3h84 h ASP 300 N 1.23 0.45 -0.38 -0.43 3.32 -1.40 -0.32 116.42 118.89 3h84 h ASP 300 Ca 0.31 -0.13 -0.08 0.00 0.02 0.00 0.00 57.03 57.15 3h84 h ASP 300 Cb 0.04 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.46 3h84 h ASP 300 CO -0.05 0.65 -0.08 1.56 -1.72 0.00 0.00 179.24 179.61 3h84 h GLN 301 N 0.41 0.72 -0.15 3.56 4.20 -1.41 -2.47 115.11 119.96 3h84 h GLN 301 Ca 0.07 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.50 3h84 h GLN 301 Cb 0.57 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.30 3h84 h GLN 301 CO 0.04 0.86 0.06 0.82 -0.67 0.00 0.00 178.83 179.93 3h84 h ILE 302 N 0.52 1.16 -0.76 2.54 2.04 -0.97 0.16 117.51 122.20 3h84 h ILE 302 Ca 0.10 -0.50 0.08 0.00 1.00 0.00 0.00 64.86 65.55 3h84 h ILE 302 Cb 0.58 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.82 3h84 h ILE 302 CO 0.03 0.15 0.50 0.44 0.00 0.00 0.00 178.15 179.28 3h84 h ASP 303 N 0.08 0.65 0.38 1.72 3.32 -1.08 0.17 116.42 121.66 3h84 h ASP 303 Ca 0.05 0.01 -0.32 0.00 0.02 0.00 0.00 57.03 56.79 3h84 h ASP 303 Cb 0.19 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 39.62 3h84 h ASP 303 CO -0.00 0.40 -1.55 -0.08 -1.72 0.00 0.00 179.24 176.29 3h84 h GLU 304 N 0.73 0.34 -0.01 3.56 4.81 -1.29 -3.28 114.58 119.43 3h84 h GLU 304 Ca 0.34 -0.58 -0.25 0.00 -0.13 0.00 0.00 59.36 58.75 3h84 h GLU 304 Cb 0.37 0.22 0.01 0.00 0.63 0.00 0.00 28.75 29.98 3h84 h GLU 304 CO -0.12 1.23 -0.98 1.25 -0.73 0.00 0.00 179.01 179.66 3h84 h LEU 305 N 0.09 0.75 -4.64 1.64 6.46 -0.69 -3.36 115.31 115.56 3h84 h LEU 305 Ca -0.26 -0.59 -0.65 0.00 -0.12 0.00 0.00 57.88 56.26 3h84 h LEU 305 Cb 2.06 -0.23 -0.37 0.00 -0.73 0.00 0.00 40.66 41.39 3h84 h LEU 305 CO 0.19 1.39 -0.16 -1.22 -0.62 0.00 0.00 178.44 178.02 3h84 n TYR 306 N -3.81 3.27 -0.36 1.25 4.02 0.57 -4.84 117.16 117.25 3h84 n TYR 306 Ca -0.09 -2.85 0.08 0.00 -0.01 0.00 0.00 57.90 55.03 3h84 n TYR 306 Cb 0.85 -0.45 0.25 0.00 -0.02 0.00 0.00 39.34 39.98 3h84 n TYR 306 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 3h84 h GLU 307 N 2.69 0.93 -0.57 -0.72 4.81 -1.72 -1.79 114.58 118.22 3h84 h GLU 307 Ca 0.39 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 3h84 h GLU 307 Cb 0.65 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.82 3h84 h GLU 307 CO 1.04 0.62 0.00 -0.40 -0.73 0.00 0.00 179.01 179.54 3h84 n ASP 308 N -4.64 5.36 -4.91 1.04 5.68 -1.26 -4.85 116.55 112.97 3h84 n ASP 308 Ca 0.20 -2.81 -0.31 0.00 -0.50 0.00 0.00 54.79 51.36 3h84 n ASP 308 Cb 0.39 -0.65 -0.04 0.00 -1.14 0.00 0.00 41.12 39.68 3h84 n ASP 308 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 3h84 s PHE 309 N -2.52 3.51 -0.59 2.11 0.40 -0.67 -4.97 117.98 115.25 3h84 s PHE 309 Ca 0.53 0.34 -0.27 0.00 -0.60 0.00 0.00 56.93 56.93 3h84 s PHE 309 Cb 0.39 -1.83 -0.00 0.00 0.51 0.00 0.00 43.02 42.09 3h84 s PHE 309 CO 0.18 0.56 1.60 -1.01 0.70 0.00 0.00 175.22 177.25 3h84 s HIS 310 N -1.53 1.99 -0.49 0.36 3.76 0.19 -4.86 115.29 114.71 3h84 s HIS 310 Ca 0.36 0.53 -0.14 0.00 -0.15 0.00 0.00 55.06 55.66 3h84 s HIS 310 Cb -0.13 -4.29 0.10 0.00 1.11 0.00 0.00 32.58 29.38 3h84 s HIS 310 CO 0.26 -2.21 0.40 0.08 -0.85 0.00 0.00 174.74 172.42 3h84 s VAL 311 N 7.27 4.94 -0.29 -0.90 1.01 -1.26 -0.44 120.40 130.72 3h84 s VAL 311 Ca 0.58 -1.36 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 3h84 s VAL 311 Cb -0.12 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 3h84 s VAL 311 CO 0.23 -0.69 0.19 0.54 0.00 0.00 0.00 175.10 175.36 3h84 s VAL 312 N 1.56 5.13 -0.40 2.92 0.11 0.12 -4.53 120.40 125.31 3h84 s VAL 312 Ca 0.04 -0.01 -0.17 0.00 -2.93 0.00 0.00 61.98 58.91 3h84 s VAL 312 Cb -0.26 -3.50 0.01 0.00 -1.53 0.00 0.00 36.38 31.10 3h84 s VAL 312 CO 0.04 0.18 0.42 -0.54 -3.33 0.00 0.00 175.10 171.87 3h84 s LYS 313 N 1.72 3.20 -0.08 1.54 1.02 -1.26 -0.69 119.74 125.20 3h84 s LYS 313 Ca 0.07 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.38 3h84 s LYS 313 Cb -0.16 -3.93 -0.03 0.00 -0.52 0.00 0.00 37.83 33.19 3h84 s LYS 313 CO 0.10 -0.78 -0.06 -1.64 -0.92 0.00 0.00 175.35 172.04 3h84 s MET 314 N 2.12 2.85 0.40 1.68 -1.94 0.10 -4.50 119.30 120.01 3h84 s MET 314 Ca 0.12 -0.53 -0.24 0.00 -1.71 0.00 0.00 55.69 53.33 3h84 s MET 314 Cb -0.17 -2.64 -0.09 0.00 2.01 0.00 0.00 34.83 33.95 3h84 s MET 314 CO 0.13 0.63 1.05 -1.25 -0.01 0.00 0.00 175.02 175.58 3h84 s PRO 315 N -0.72 4.16 0.32 2.03 0.04 -1.26 -2.24 135.00 137.33 3h84 s PRO 315 Ca 0.11 1.52 -0.29 0.00 0.04 0.00 0.00 61.00 62.38 3h84 s PRO 315 Cb -0.11 -2.54 -0.10 0.00 0.04 0.00 0.00 34.50 31.78 3h84 s PRO 315 CO 0.02 -0.15 1.36 -1.17 0.04 0.00 0.00 177.00 177.10 3h84 s LEU 316 N -2.64 4.40 0.26 -3.56 2.96 0.10 -4.32 118.68 115.89 3h84 s LEU 316 Ca 0.58 2.74 0.10 0.00 -0.22 0.00 0.00 54.13 57.32 3h84 s LEU 316 Cb -0.22 -3.65 -0.04 0.00 0.50 0.00 0.00 46.19 42.78 3h84 s LEU 316 CO 0.28 -0.62 -0.03 0.00 -1.32 0.00 0.00 176.35 174.65 3h84 n ALA 318 N -0.76 -0.27 -3.03 0.00 0.00 -1.26 -4.78 120.51 110.40 3h84 n ALA 318 Ca -0.07 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.16 3h84 n ALA 318 Cb 0.59 0.20 0.06 0.00 0.00 0.00 0.00 19.45 20.30 3h84 n ALA 318 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h84 n GLY 319 N -0.98 1.96 3.76 0.00 0.00 -1.26 -5.09 105.19 103.58 3h84 n GLY 319 Ca 0.00 -2.21 -0.34 0.00 0.00 0.00 0.00 46.02 43.47 3h84 n GLY 319 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3h84 s GLU 320 N -4.28 2.86 -0.29 1.61 1.03 -1.26 -4.99 118.70 113.38 3h84 s GLU 320 Ca 0.53 1.55 -0.13 0.00 0.03 0.00 0.00 54.97 56.95 3h84 s GLU 320 Cb -0.04 -1.94 -0.04 0.00 -0.80 0.00 0.00 34.13 31.31 3h84 s GLU 320 CO 0.34 -1.23 0.29 0.42 -1.33 0.00 0.00 175.26 173.74 3h84 s ILE 321 N -2.06 5.24 0.06 1.83 1.01 -1.26 -5.05 121.20 120.96 3h84 s ILE 321 Ca 0.71 0.30 0.03 0.00 0.00 0.00 0.00 60.65 61.68 3h84 s ILE 321 Cb -0.24 -3.64 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 3h84 s ILE 321 CO 0.37 0.16 -0.09 -0.13 0.00 0.00 0.00 174.94 175.25 3h84 s ARG 322 N 1.91 0.65 0.00 2.79 0.52 -1.26 -4.88 118.95 118.69 3h84 s ARG 322 Ca 0.11 -0.90 0.00 0.00 -0.52 0.00 0.00 55.73 54.42 3h84 s ARG 322 Cb -0.16 -0.42 0.00 0.00 0.52 0.00 0.00 34.95 34.89 3h84 s ARG 322 CO 0.11 0.07 0.00 0.41 0.02 0.00 0.00 175.30 175.91 3h84 n GLY 323 N 1.18 -0.09 0.29 -3.53 0.00 0.80 -4.34 105.19 99.50 3h84 n GLY 323 Ca -0.21 -1.48 0.03 0.00 0.00 0.00 0.00 46.02 44.36 3h84 n GLY 323 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3h84 h LEU 324 N 0.00 0.54 0.42 0.99 6.46 -1.84 -1.17 115.31 120.70 3h84 h LEU 324 Ca 0.00 0.07 -0.02 0.00 -0.12 0.00 0.00 57.88 57.81 3h84 h LEU 324 Cb 0.00 -0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 39.90 3h84 h LEU 324 CO 0.00 0.28 -0.24 0.78 -0.62 0.00 0.00 178.44 178.65 3h84 h ASN 325 N 0.66 -0.58 0.25 1.25 2.35 -1.97 -1.35 115.58 116.19 3h84 h ASN 325 Ca 0.40 0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 56.07 3h84 h ASN 325 Cb 0.45 0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.97 3h84 h ASN 325 CO -0.29 -0.38 -0.42 0.78 -1.65 0.00 0.00 177.43 175.47 3h84 h ASN 326 N -0.61 0.23 -0.48 5.81 2.35 -1.73 -2.84 115.58 118.30 3h84 h ASN 326 Ca -0.05 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.50 3h84 h ASN 326 Cb 0.49 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 3h84 h ASN 326 CO 0.06 0.63 -0.08 -0.07 -1.65 0.00 0.00 177.43 176.32 3h84 h LEU 327 N 0.18 0.93 -0.15 1.61 3.38 -1.06 -2.32 115.31 117.89 3h84 h LEU 327 Ca 0.02 -0.28 -0.23 0.00 0.09 0.00 0.00 57.88 57.47 3h84 h LEU 327 Cb 0.82 -0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.33 3h84 h LEU 327 CO 0.06 1.03 -0.88 0.71 0.09 0.00 0.00 178.44 179.46 3h84 h THR 328 N 0.85 1.31 -0.73 0.22 1.35 -1.17 -0.09 112.91 114.65 3h84 h THR 328 Ca 0.14 -2.14 -0.05 0.00 -0.55 0.00 0.00 66.41 63.81 3h84 h THR 328 Cb 0.61 2.18 -0.03 0.00 -1.73 0.00 0.00 68.15 69.17 3h84 h THR 328 CO 0.04 0.66 0.28 0.11 -0.25 0.00 0.00 175.52 176.36 3h84 h LYS 329 N 0.42 1.10 -0.06 4.72 1.57 -1.51 -2.88 116.57 119.94 3h84 h LYS 329 Ca -0.08 -0.20 -0.18 0.00 -1.87 0.00 0.00 60.65 58.32 3h84 h LYS 329 Cb 1.50 -0.18 0.01 0.00 0.08 0.00 0.00 32.23 33.65 3h84 h LYS 329 CO 0.17 0.91 -0.67 0.35 -0.57 0.00 0.00 179.45 179.63 3h84 h PHE 330 N 1.07 0.79 -0.16 -1.35 3.57 -1.42 -3.30 116.94 116.14 3h84 h PHE 330 Ca 0.24 -0.39 0.05 0.00 3.53 0.00 0.00 57.97 61.40 3h84 h PHE 330 Cb 0.23 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 3h84 h PHE 330 CO 0.02 1.20 0.17 0.66 -2.23 0.00 0.00 178.31 178.12 3h84 h SER 331 N 0.15 0.00 -0.15 0.41 4.64 -0.85 -2.77 113.55 114.97 3h84 h SER 331 Ca -0.07 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.30 3h84 h SER 331 Cb 1.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.43 3h84 h SER 331 CO 0.14 0.00 0.14 0.06 -0.87 0.00 0.00 176.83 176.29 3h84 h GLN 332 N 0.00 0.00 0.00 4.77 3.07 -1.59 -0.76 115.11 120.61 3h84 h GLN 332 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.82 3h84 h GLN 332 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.97 3h84 h GLN 332 CO -0.00 0.00 0.00 1.19 0.09 0.00 0.00 178.83 180.11 3h84 n PHE 333 N -4.12 0.00 0.14 0.06 3.72 -1.05 -1.71 117.46 114.51 3h84 n PHE 333 Ca 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.41 3h84 n PHE 333 Cb 0.26 -0.34 0.14 0.00 -0.94 0.00 0.00 39.48 38.59 3h84 n PHE 333 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 3h84 h LEU 334 N 0.00 0.00 0.01 4.37 3.38 -1.34 -3.36 115.31 118.37 3h84 h LEU 334 Ca 0.00 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.73 3h84 h LEU 334 Cb 0.31 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3h84 h LEU 334 CO 0.00 0.60 -1.31 -1.13 0.09 0.00 0.00 178.44 176.68 3h84 h ASN 335 N 0.00 0.04 -3.16 -0.43 -0.73 -1.45 0.56 115.58 110.40 3h84 h ASN 335 Ca -0.01 -0.55 -0.65 0.00 1.87 0.00 0.00 56.30 56.97 3h84 h ASN 335 Cb 1.22 -0.01 -0.35 0.00 0.27 0.00 0.00 38.32 39.46 3h84 h ASN 335 CO 0.08 1.52 -0.86 -0.75 -0.37 0.00 0.00 177.43 177.05 3h84 s LYS 336 N -2.38 2.80 0.15 6.67 2.20 -0.78 -4.15 119.74 124.26 3h84 s LYS 336 Ca -0.28 -0.77 -0.33 0.00 -0.36 0.00 0.00 55.97 54.23 3h84 s LYS 336 Cb 0.06 -2.35 -0.16 0.00 -1.51 0.00 0.00 37.83 33.87 3h84 s LYS 336 CO 0.61 -0.10 1.10 0.39 -0.36 0.00 0.00 175.35 176.98 3h84 n GLU 337 N 4.33 0.93 -1.70 4.03 4.71 -1.26 -4.10 120.64 127.59 3h84 n GLU 337 Ca -0.20 0.33 -0.43 0.00 -0.01 0.00 0.00 57.16 56.85 3h84 n GLU 337 Cb 0.51 -1.79 -0.03 0.00 -1.01 0.00 0.00 31.44 29.11 3h84 n GLU 337 CO 0.00 0.00 0.00 0.98 0.09 0.00 0.00 177.13 178.20 3h84 n TYR 338 N 1.38 2.60 -3.89 -0.32 9.36 -1.26 -5.00 117.16 120.04 3h84 n TYR 338 Ca 0.16 0.06 -0.35 0.00 3.32 0.00 0.00 57.90 61.08 3h84 n TYR 338 Cb 0.23 -2.65 -0.14 0.00 -0.63 0.00 0.00 39.34 36.15 3h84 n TYR 338 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3h84 s ASN 339 N 1.47 4.74 0.51 2.98 3.84 -1.26 -5.00 114.94 122.23 3h84 s ASN 339 Ca 0.78 -1.02 0.22 0.00 0.21 0.00 0.00 52.86 53.04 3h84 s ASN 339 Cb -0.55 -1.73 1.37 0.00 -0.55 0.00 0.00 41.25 39.79 3h84 s ASN 339 CO 0.35 -0.20 2.11 1.55 -2.79 0.00 0.00 177.10 178.11 3h84 h PRO 340 N 8.06 0.00 -0.58 0.43 0.13 -1.94 0.54 132.00 138.63 3h84 h PRO 340 Ca -0.27 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.80 3h84 h PRO 340 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 3h84 h PRO 340 CO 0.56 0.09 0.14 0.82 -0.23 0.00 0.00 178.00 179.38 3h84 h ILE 341 N 0.00 1.25 0.00 -3.56 1.08 -1.94 -3.27 117.51 111.07 3h84 h ILE 341 Ca -0.00 -0.90 -0.22 0.00 -0.39 0.00 0.00 64.86 63.35 3h84 h ILE 341 Cb 0.19 0.72 -0.04 0.00 -3.07 0.00 0.00 36.82 34.61 3h84 h ILE 341 CO 0.01 0.34 -1.81 0.35 -0.69 0.00 0.00 178.15 176.34 3h84 n THR 342 N -4.37 0.81 1.12 -0.27 -2.24 -0.94 -4.65 114.28 103.75 3h84 n THR 342 Ca 0.03 -0.50 0.12 0.00 -2.27 0.00 0.00 64.05 61.43 3h84 n THR 342 Cb 0.24 -0.69 0.17 0.00 -2.10 0.00 0.00 70.33 67.95 3h84 n THR 342 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3h84 n ASP 343 N -2.45 2.14 -0.28 3.42 8.00 0.18 -4.40 116.55 123.17 3h84 n ASP 343 Ca -0.20 -1.59 0.09 0.00 0.71 0.00 0.00 54.79 53.80 3h84 n ASP 343 Cb 0.88 0.18 0.24 0.00 -0.02 0.00 0.00 41.12 42.40 3h84 n ASP 343 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3h84 h GLY 344 N 4.81 1.26 -0.03 0.44 0.00 -1.69 -1.29 103.07 106.58 3h84 h GLY 344 Ca 0.00 -0.10 0.15 0.00 0.00 0.00 0.00 47.33 47.37 3h84 h GLY 344 CO 0.00 -0.22 0.15 0.50 0.00 0.00 0.00 176.54 176.97 3h84 h LYS 345 N 0.35 0.25 -0.78 4.80 1.57 -1.90 -0.53 116.57 120.33 3h84 h LYS 345 Ca 0.48 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.27 3h84 h LYS 345 Cb 0.85 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 3h84 h LYS 345 CO -0.51 0.16 0.50 0.28 -0.57 0.00 0.00 179.45 179.31 3h84 h VAL 346 N 0.25 1.15 0.05 0.50 2.07 -1.55 -2.97 116.25 115.74 3h84 h VAL 346 Ca 0.39 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.56 3h84 h VAL 346 Cb 0.64 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 3h84 h VAL 346 CO -0.49 0.18 -0.02 0.40 0.02 0.00 0.00 177.57 177.66 3h84 h ILE 347 N 1.00 1.29 0.00 4.57 1.08 -1.28 -2.33 117.51 121.83 3h84 h ILE 347 Ca 0.30 -1.17 0.00 0.00 -0.39 0.00 0.00 64.86 63.60 3h84 h ILE 347 Cb -0.04 2.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.76 3h84 h ILE 347 CO -0.09 0.29 0.00 -1.22 -0.69 0.00 0.00 178.15 176.44 3h84 n TYR 348 N -4.87 0.00 -0.05 1.37 4.01 -0.29 -1.62 117.16 115.70 3h84 n TYR 348 Ca -0.09 -0.28 0.00 0.00 -0.16 0.00 0.00 57.90 57.38 3h84 n TYR 348 Cb 0.27 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.12 3h84 n TYR 348 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 3h84 n GLU 349 N 0.41 0.82 0.08 -0.72 2.13 -1.13 -4.60 120.64 117.63 3h84 n GLU 349 Ca 0.00 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.77 3h84 n GLU 349 Cb 0.35 -0.07 -0.04 0.00 0.27 0.00 0.00 31.44 31.95 3h84 n GLU 349 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3h84 h LEU 350 N 0.00 0.00 0.00 4.31 3.38 -0.73 -3.50 115.31 118.77 3h84 h LEU 350 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h84 h LEU 350 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3h84 h LEU 350 CO 0.00 0.88 0.00 1.21 0.09 0.00 0.00 178.44 180.62