#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a8h n ASP 2 N 0.00 8.31 -4.78 6.12 8.00 -1.26 -4.87 116.55 128.06 3a8h n ASP 2 Ca 0.00 -2.73 -0.24 0.00 0.71 0.00 0.00 54.79 52.53 3a8h n ASP 2 Cb 0.00 -1.49 0.08 0.00 -0.02 0.00 0.00 41.12 39.69 3a8h n ASP 2 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3a8h s GLY 3 N 1.64 1.77 0.48 0.44 0.00 -1.26 -4.97 107.32 105.41 3a8h s GLY 3 Ca 0.65 -1.40 0.33 0.00 0.00 0.00 0.00 44.72 44.30 3a8h s GLY 3 CO -0.07 -0.94 1.98 -0.39 0.00 0.00 0.00 173.10 173.68 3a8h h VAL 4 N -0.44 0.00 0.00 1.40 -1.51 -1.91 -2.15 116.25 111.64 3a8h h VAL 4 Ca -0.40 -0.20 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 3a8h h VAL 4 Cb 1.28 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.48 3a8h h VAL 4 CO 0.48 0.00 0.00 1.12 -1.23 0.00 0.00 177.57 177.94 3a8h h HIS 5 N 0.00 0.00 -1.88 5.19 2.07 -1.93 -3.36 115.15 115.24 3a8h h HIS 5 Ca 0.00 0.00 -0.73 0.00 -2.85 0.00 0.00 60.37 56.79 3a8h h HIS 5 Cb 0.23 0.00 -0.16 0.00 2.57 0.00 0.00 27.41 30.05 3a8h h HIS 5 CO 0.00 0.00 1.55 -3.47 -3.07 0.00 0.00 177.93 172.94 3a8h n ASP 6 N -2.57 5.16 0.08 3.10 -0.08 -0.81 -4.76 116.55 116.67 3a8h n ASP 6 Ca 0.00 -2.97 0.09 0.00 -1.51 0.00 0.00 54.79 50.40 3a8h n ASP 6 Cb 0.17 -1.61 -0.03 0.00 2.34 0.00 0.00 41.12 41.99 3a8h n ASP 6 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 3a8h n LEU 7 N 6.16 0.79 -4.65 -2.67 4.77 -1.26 -4.86 117.00 115.28 3a8h n LEU 7 Ca 0.39 0.32 -0.50 0.00 -0.03 0.00 0.00 56.01 56.20 3a8h n LEU 7 Cb 0.43 -0.02 -0.05 0.00 -2.33 0.00 0.00 43.42 41.45 3a8h n LEU 7 CO 0.66 -0.10 1.16 0.00 -1.33 0.00 0.00 177.39 177.78 3a8h n ALA 8 N -2.24 0.37 0.00 -1.18 0.00 -1.26 -0.99 120.51 115.21 3a8h n ALA 8 Ca -0.03 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.85 3a8h n ALA 8 Cb 0.62 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.80 3a8h n ALA 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8h n GLY 9 N 3.37 2.00 3.76 0.00 0.00 -1.26 -4.78 105.19 108.27 3a8h n GLY 9 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 3a8h n GLY 9 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a8h s VAL 10 N -2.45 2.03 0.09 1.61 1.01 -0.16 -5.00 120.40 117.53 3a8h s VAL 10 Ca 0.00 0.03 0.05 0.00 0.00 0.00 0.00 61.98 62.06 3a8h s VAL 10 Cb 0.00 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 3a8h s VAL 10 CO 0.00 0.01 0.01 -1.10 0.00 0.00 0.00 175.10 174.01 3a8h s GLN 11 N -0.84 2.58 0.00 2.72 -0.21 -1.26 -4.66 119.66 118.00 3a8h s GLN 11 Ca 0.61 -0.82 0.00 0.00 0.02 0.00 0.00 55.36 55.17 3a8h s GLN 11 Cb -0.48 -2.56 0.00 0.00 1.00 0.00 0.00 33.01 30.97 3a8h s GLN 11 CO 0.51 0.54 0.00 0.41 -2.12 0.00 0.00 175.29 174.64 3a8h n GLY 12 N 0.56 1.53 3.78 3.09 0.00 -1.26 -5.11 105.19 107.78 3a8h n GLY 12 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 3a8h n GLY 12 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a8h s PHE 13 N -2.05 2.75 0.00 1.61 0.08 -1.26 -5.06 117.98 114.05 3a8h s PHE 13 Ca 0.00 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.60 3a8h s PHE 13 Cb 0.00 -3.19 0.00 0.00 -0.57 0.00 0.00 43.02 39.26 3a8h s PHE 13 CO 0.00 -1.41 0.00 0.41 -0.10 0.00 0.00 175.22 174.12 3a8h n GLY 14 N -0.18 0.79 3.77 4.36 0.00 -1.26 -5.04 105.19 107.62 3a8h n GLY 14 Ca 0.11 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 44.03 3a8h n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a8h s LYS 15 N 1.31 4.10 0.19 1.61 1.02 -1.26 -4.97 119.74 121.74 3a8h s LYS 15 Ca 0.00 2.03 -0.32 0.00 0.02 0.00 0.00 55.97 57.71 3a8h s LYS 15 Cb 0.00 -2.80 -0.11 0.00 -0.52 0.00 0.00 37.83 34.40 3a8h s LYS 15 CO 0.00 -0.34 1.62 0.08 -0.92 0.00 0.00 175.35 175.79 3a8h s VAL 16 N -1.29 2.37 -1.49 3.17 1.01 -1.26 -4.88 120.40 118.03 3a8h s VAL 16 Ca 0.55 0.27 -0.12 0.00 0.00 0.00 0.00 61.98 62.67 3a8h s VAL 16 Cb -0.35 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 3a8h s VAL 16 CO 0.45 0.02 2.51 -0.81 0.00 0.00 0.00 175.10 177.28 3a8h n PRO 17 N 3.75 3.12 -3.63 2.72 -0.04 -1.26 -4.77 135.00 134.90 3a8h n PRO 17 Ca 0.14 -2.38 -0.10 0.00 -0.04 0.00 0.00 63.50 61.12 3a8h n PRO 17 Cb 0.37 -3.06 -0.07 0.00 -0.04 0.00 0.00 33.50 30.71 3a8h n PRO 17 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3a8h s HIS 18 N 2.87 -0.46 0.03 0.54 5.04 -1.26 -5.15 115.29 116.89 3a8h s HIS 18 Ca 0.56 1.07 0.05 0.00 -1.54 0.00 0.00 55.06 55.21 3a8h s HIS 18 Cb 0.15 0.38 -0.03 0.00 0.04 0.00 0.00 32.58 33.12 3a8h s HIS 18 CO -0.07 -0.25 -0.12 0.95 -2.34 0.00 0.00 174.74 172.91 3a8h s THR 19 N -0.01 3.26 0.26 0.89 -4.23 -1.26 -5.08 115.64 109.46 3a8h s THR 19 Ca 0.02 -0.99 -0.31 0.00 -1.18 0.00 0.00 61.69 59.24 3a8h s THR 19 Cb -0.04 -2.41 -0.13 0.00 1.34 0.00 0.00 72.50 71.26 3a8h s THR 19 CO -0.05 0.35 1.39 1.33 -0.54 0.00 0.00 174.62 177.10 3a8h n VAL 20 N 1.49 1.14 -0.99 2.29 0.24 -1.26 -1.75 118.33 119.49 3a8h n VAL 20 Ca -0.15 -0.29 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 3a8h n VAL 20 Cb 0.52 -1.50 0.00 0.00 -1.47 0.00 0.00 33.84 31.39 3a8h n VAL 20 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 3a8h n ASN 21 N 1.91 -4.97 -4.76 -1.34 5.03 -1.26 -4.98 115.26 104.90 3a8h n ASN 21 Ca 0.10 0.00 -0.38 0.00 0.87 0.00 0.00 54.58 55.17 3a8h n ASN 21 Cb 0.32 -2.56 0.00 0.00 -1.02 0.00 0.00 39.78 36.52 3a8h n ASN 21 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3a8h s ALA 22 N -1.32 3.07 0.01 5.41 0.00 -0.72 -4.92 121.76 123.29 3a8h s ALA 22 Ca 0.00 1.15 -0.33 0.00 0.00 0.00 0.00 51.96 52.79 3a8h s ALA 22 Cb 0.00 -3.47 -0.11 0.00 0.00 0.00 0.00 23.12 19.54 3a8h s ALA 22 CO 0.00 -0.88 1.86 -3.47 0.00 0.00 0.00 175.76 173.27 3a8h n ASP 23 N -0.31 3.66 -1.03 0.00 2.03 -1.26 -4.88 116.55 114.76 3a8h n ASP 23 Ca 0.06 0.97 0.11 0.00 0.52 0.00 0.00 54.79 56.46 3a8h n ASP 23 Cb 0.45 -1.44 0.25 0.00 -0.72 0.00 0.00 41.12 39.66 3a8h n ASP 23 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 3a8h n ILE 24 N 4.94 0.47 -4.38 5.18 -5.35 -1.26 -5.08 119.36 113.89 3a8h n ILE 24 Ca 0.21 -0.67 0.00 0.00 -0.27 0.00 0.00 62.75 62.01 3a8h n ILE 24 Cb 0.33 0.80 0.00 0.00 -1.74 0.00 0.00 39.64 39.03 3a8h n ILE 24 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3a8h n GLY 25 N 1.43 -1.32 3.72 3.28 0.00 -1.26 -4.88 105.19 106.16 3a8h n GLY 25 Ca 0.19 -1.22 -0.30 0.00 0.00 0.00 0.00 46.02 44.68 3a8h n GLY 25 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a8h s PRO 26 N 0.00 1.48 0.21 1.61 0.04 -1.26 -4.93 135.00 132.14 3a8h s PRO 26 Ca 0.00 1.10 -0.10 0.00 0.04 0.00 0.00 61.00 62.04 3a8h s PRO 26 Cb 0.00 -1.81 0.28 0.00 0.04 0.00 0.00 34.50 33.00 3a8h s PRO 26 CO 0.00 -2.17 1.73 1.15 0.04 0.00 0.00 177.00 177.76 3a8h h THR 27 N -1.51 0.74 -3.28 1.26 2.02 -2.03 -3.39 112.91 106.72 3a8h h THR 27 Ca -0.47 -0.12 -0.67 0.00 0.77 0.00 0.00 66.41 65.92 3a8h h THR 27 Cb 1.26 0.35 -0.31 0.00 -1.74 0.00 0.00 68.15 67.71 3a8h h THR 27 CO 0.51 0.07 -0.82 -0.36 0.37 0.00 0.00 175.52 175.28 3a8h s PHE 28 N -6.10 2.74 -2.48 3.16 0.08 -1.26 -5.00 117.98 109.13 3a8h s PHE 28 Ca -0.13 -1.05 0.25 0.00 0.12 0.00 0.00 56.93 56.13 3a8h s PHE 28 Cb 0.17 -1.85 0.53 0.00 -0.57 0.00 0.00 43.02 41.29 3a8h s PHE 28 CO 0.74 -0.46 1.44 0.72 -0.10 0.00 0.00 175.22 177.56 3a8h n HIS 29 N 3.94 0.00 -3.76 0.36 8.25 -1.26 -4.89 115.22 117.86 3a8h n HIS 29 Ca -0.19 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.16 3a8h n HIS 29 Cb 0.52 -0.02 -0.07 0.00 1.12 0.00 0.00 29.99 31.54 3a8h n HIS 29 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3a8h s ALA 30 N -2.16 -0.63 -0.48 -1.41 0.00 -1.26 -5.06 121.76 110.76 3a8h s ALA 30 Ca 0.29 -0.12 0.22 0.00 0.00 0.00 0.00 51.96 52.36 3a8h s ALA 30 Cb 0.20 0.40 0.97 0.00 0.00 0.00 0.00 23.12 24.69 3a8h s ALA 30 CO 0.39 -0.46 1.68 0.39 0.00 0.00 0.00 175.76 177.76 3a8h n GLU 31 N 0.35 0.17 0.00 0.00 -0.58 -1.26 -2.16 120.64 117.17 3a8h n GLU 31 Ca -0.18 0.45 0.11 0.00 -0.42 0.00 0.00 57.16 57.12 3a8h n GLU 31 Cb 0.61 -1.86 -0.00 0.00 -0.57 0.00 0.00 31.44 29.62 3a8h n GLU 31 CO 0.00 0.00 0.00 -2.67 -0.48 0.00 0.00 177.13 173.98 3a8h n TRP 32 N -2.19 0.03 0.29 -0.32 4.27 -1.26 -4.63 117.44 113.63 3a8h n TRP 32 Ca 0.02 0.01 0.17 0.00 -3.89 0.00 0.00 57.50 53.81 3a8h n TRP 32 Cb 0.19 -0.13 0.84 0.00 -1.36 0.00 0.00 31.31 30.86 3a8h n TRP 32 CO 0.00 0.00 0.00 0.93 -2.29 0.00 0.00 177.69 176.33 3a8h h GLU 33 N 0.00 0.00 0.00 -2.67 5.08 -1.85 -0.64 114.58 114.50 3a8h h GLU 33 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3a8h h GLU 33 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3a8h h GLU 33 CO 0.00 0.04 0.00 -2.39 -1.00 0.00 0.00 179.01 175.66 3a8h n HIS 34 N -3.24 0.69 -0.05 4.33 1.44 -1.26 -4.14 115.22 113.00 3a8h n HIS 34 Ca -0.01 0.23 -0.11 0.00 -2.01 0.00 0.00 57.72 55.81 3a8h n HIS 34 Cb 0.23 -0.87 -0.06 0.00 0.12 0.00 0.00 29.99 29.41 3a8h n HIS 34 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 3a8h h LEU 35 N 0.00 0.26 -0.51 2.39 3.38 -1.44 -2.49 115.31 116.90 3a8h h LEU 35 Ca 0.00 -0.27 0.09 0.00 0.09 0.00 0.00 57.88 57.79 3a8h h LEU 35 Cb 0.55 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.16 3a8h h LEU 35 CO 0.00 0.46 0.10 1.55 0.09 0.00 0.00 178.44 180.65 3a8h h PRO 36 N 0.05 0.23 -0.30 1.13 0.13 -1.76 0.17 132.00 131.65 3a8h h PRO 36 Ca 0.05 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 65.11 3a8h h PRO 36 Cb 0.32 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 31.38 3a8h h PRO 36 CO 0.00 0.15 -0.04 1.88 -0.23 0.00 0.00 178.00 179.77 3a8h h TYR 37 N 0.24 0.61 -0.18 1.56 0.05 -1.82 -0.31 116.97 117.13 3a8h h TYR 37 Ca 0.26 -0.12 0.02 0.00 0.05 0.00 0.00 58.73 58.94 3a8h h TYR 37 Cb 0.35 -0.15 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 3a8h h TYR 37 CO -0.23 0.71 0.05 0.77 -1.05 0.00 0.00 178.16 178.42 3a8h h SER 38 N 0.33 0.05 0.70 3.88 0.02 -1.05 -0.88 113.55 116.61 3a8h h SER 38 Ca 0.08 0.02 -0.11 0.00 -0.84 0.00 0.00 61.79 60.94 3a8h h SER 38 Cb 0.50 0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 3a8h h SER 38 CO 0.02 0.06 -0.51 -0.07 -1.14 0.00 0.00 176.83 175.18 3a8h h LEU 39 N 0.13 0.00 -0.30 5.07 3.38 -0.67 -0.91 115.31 122.01 3a8h h LEU 39 Ca 0.08 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3a8h h LEU 39 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3a8h h LEU 39 CO -0.08 0.51 0.19 -0.03 0.09 0.00 0.00 178.44 179.11 3a8h h MET 40 N 0.00 0.41 -0.54 1.13 4.05 -0.65 -1.34 114.93 117.99 3a8h h MET 40 Ca -0.01 -0.03 -0.08 0.00 -0.28 0.00 0.00 59.70 59.30 3a8h h MET 40 Cb 1.00 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 31.69 3a8h h MET 40 CO 0.07 0.31 0.03 0.74 0.23 0.00 0.00 176.91 178.28 3a8h h PHE 41 N 0.39 0.95 -0.20 1.39 0.05 -0.82 0.62 116.94 119.33 3a8h h PHE 41 Ca 0.11 -0.13 0.05 0.00 3.82 0.00 0.00 57.97 61.82 3a8h h PHE 41 Cb 0.00 -0.26 -0.05 0.00 2.00 0.00 0.00 35.95 37.64 3a8h h PHE 41 CO -0.04 0.85 -0.15 0.00 -0.18 0.00 0.00 178.31 178.79 3a8h h ALA 42 N 1.19 -0.01 -0.65 2.45 0.00 -1.03 0.42 119.26 121.64 3a8h h ALA 42 Ca 0.16 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3a8h h ALA 42 Cb 0.45 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3a8h h ALA 42 CO 0.02 -0.58 0.42 0.78 0.00 0.00 0.00 179.25 179.89 3a8h h GLY 43 N -0.15 0.92 0.14 0.00 0.00 -0.74 0.71 103.07 103.94 3a8h h GLY 43 Ca 0.12 -0.36 -0.00 0.00 0.00 0.00 0.00 47.33 47.09 3a8h h GLY 43 CO -0.29 0.35 -0.03 -2.08 0.00 0.00 0.00 176.54 174.49 3a8h h VAL 44 N 0.88 0.96 0.05 4.60 2.07 -0.61 0.55 116.25 124.75 3a8h h VAL 44 Ca 0.23 -1.51 -0.33 0.00 0.82 0.00 0.00 66.70 65.91 3a8h h VAL 44 Cb -0.08 1.74 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 3a8h h VAL 44 CO -0.05 0.30 -1.93 0.00 0.02 0.00 0.00 177.57 175.91 3a8h n ALA 45 N -2.64 1.23 -0.10 1.67 0.00 0.15 -2.81 120.51 118.01 3a8h n ALA 45 Ca -0.06 -0.75 -0.23 0.00 0.00 0.00 0.00 53.44 52.39 3a8h n ALA 45 Cb 0.27 -0.69 -0.11 0.00 0.00 0.00 0.00 19.45 18.92 3a8h n ALA 45 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3a8h n GLU 46 N -3.22 0.59 0.05 0.00 -0.58 -0.63 -4.55 120.64 112.30 3a8h n GLU 46 Ca -0.26 0.49 -0.03 0.00 -0.42 0.00 0.00 57.16 56.94 3a8h n GLU 46 Cb 1.05 -1.70 -0.08 0.00 -0.57 0.00 0.00 31.44 30.15 3a8h n GLU 46 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 3a8h h LEU 47 N -0.91 0.00 2.33 -4.62 3.38 -0.99 -3.48 115.31 111.02 3a8h h LEU 47 Ca -0.42 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.18 3a8h h LEU 47 Cb 1.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.17 3a8h h LEU 47 CO -0.23 0.75 -0.49 0.61 0.09 0.00 0.00 178.44 179.17 3a8h n GLY 48 N 1.39 -0.40 0.08 0.83 0.00 -0.56 -4.91 105.19 101.61 3a8h n GLY 48 Ca -0.07 -0.08 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 3a8h n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a8h h ALA 49 N 0.89 0.50 -2.89 4.61 0.00 -1.16 -3.48 119.26 117.73 3a8h h ALA 49 Ca -0.45 -0.86 0.07 0.00 0.00 0.00 0.00 54.91 53.68 3a8h h ALA 49 Cb 1.33 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 3a8h h ALA 49 CO 0.52 1.11 0.27 -0.59 0.00 0.00 0.00 179.25 180.56 3a8h s PHE 50 N -2.77 -0.23 0.45 0.00 -0.12 -1.24 -5.02 117.98 109.04 3a8h s PHE 50 Ca 0.01 -0.17 0.02 0.00 -0.05 0.00 0.00 56.93 56.75 3a8h s PHE 50 Cb 0.09 0.68 0.00 0.00 -0.63 0.00 0.00 43.02 43.16 3a8h s PHE 50 CO 0.80 -1.11 0.65 -1.54 -0.05 0.00 0.00 175.22 173.96 3a8h s SER 51 N -2.89 5.72 0.35 1.98 1.04 -1.26 -4.17 113.70 114.47 3a8h s SER 51 Ca 0.10 0.07 0.03 0.00 0.48 0.00 0.00 55.95 56.62 3a8h s SER 51 Cb -0.05 -1.26 0.64 0.00 0.10 0.00 0.00 66.02 65.45 3a8h s SER 51 CO 0.03 -0.75 1.99 0.58 0.98 0.00 0.00 173.24 176.08 3a8h h VAL 52 N 0.44 1.16 -0.83 5.02 2.07 -1.95 -2.48 116.25 119.69 3a8h h VAL 52 Ca -0.45 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.71 3a8h h VAL 52 Cb 1.27 0.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 3a8h h VAL 52 CO 0.54 0.17 0.49 0.44 0.02 0.00 0.00 177.57 179.24 3a8h h ASP 53 N 0.80 0.99 -0.34 0.57 3.32 -1.94 -0.87 116.42 118.96 3a8h h ASP 53 Ca 0.21 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.17 3a8h h ASP 53 Cb -0.04 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.24 3a8h h ASP 53 CO -0.04 0.76 0.12 -0.33 -1.72 0.00 0.00 179.24 178.04 3a8h h GLU 54 N 1.14 0.58 -0.35 3.56 5.08 -1.60 -1.17 114.58 121.82 3a8h h GLU 54 Ca 0.30 -0.09 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 3a8h h GLU 54 Cb -0.04 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3a8h h GLU 54 CO -0.06 0.52 0.07 0.28 -1.00 0.00 0.00 179.01 178.82 3a8h h VAL 55 N 0.58 1.23 -0.55 3.13 2.07 -1.02 -0.04 116.25 121.65 3a8h h VAL 55 Ca 0.14 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.85 3a8h h VAL 55 Cb 0.18 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 3a8h h VAL 55 CO -0.01 0.28 0.36 0.03 0.02 0.00 0.00 177.57 178.25 3a8h h ARG 56 N 0.42 0.71 -0.45 1.57 3.08 -0.90 -2.26 114.38 116.56 3a8h h ARG 56 Ca 0.11 -0.04 -0.11 0.00 0.07 0.00 0.00 59.98 60.00 3a8h h ARG 56 Cb 0.34 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 3a8h h ARG 56 CO 0.01 0.47 -0.16 -0.92 -1.07 0.00 0.00 179.97 178.30 3a8h h TYR 57 N 0.73 1.02 -0.34 3.04 3.20 -1.04 -1.81 116.97 121.77 3a8h h TYR 57 Ca 0.21 -0.24 -0.03 0.00 3.14 0.00 0.00 58.73 61.81 3a8h h TYR 57 Cb -0.07 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 37.94 3a8h h TYR 57 CO -0.04 1.02 0.06 -0.24 -1.64 0.00 0.00 178.16 177.32 3a8h h VAL 58 N 0.73 1.17 -0.52 1.81 3.04 -0.85 -0.42 116.25 121.21 3a8h h VAL 58 Ca 0.11 -0.61 -0.10 0.00 -1.01 0.00 0.00 66.70 65.09 3a8h h VAL 58 Cb 0.72 0.84 -0.02 0.00 -2.01 0.00 0.00 31.29 30.82 3a8h h VAL 58 CO 0.05 0.22 -0.05 0.58 -1.01 0.00 0.00 177.57 177.36 3a8h h VAL 59 N 0.49 1.27 -0.04 1.51 2.07 -1.20 -2.24 116.25 118.11 3a8h h VAL 59 Ca 0.11 -1.17 0.01 0.00 0.82 0.00 0.00 66.70 66.47 3a8h h VAL 59 Cb 0.22 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.97 3a8h h VAL 59 CO -0.00 0.41 0.03 -0.33 0.02 0.00 0.00 177.57 177.71 3a8h h GLU 60 N 0.82 0.00 -0.01 1.57 5.08 -0.42 -1.60 114.58 120.01 3a8h h GLU 60 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3a8h h GLU 60 Cb 0.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3a8h h GLU 60 CO 0.04 0.00 -0.01 0.54 -1.00 0.00 0.00 179.01 178.58 3a8h n ARG 61 N -4.05 1.26 -1.71 2.33 1.74 -0.26 -4.87 116.66 111.10 3a8h n ARG 61 Ca -0.02 -0.44 -0.42 0.00 -0.77 0.00 0.00 57.85 56.20 3a8h n ARG 61 Cb 0.13 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 3a8h n ARG 61 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3a8h n MET 62 N -0.48 2.09 -1.64 5.56 2.81 -0.61 -1.20 117.12 123.65 3a8h n MET 62 Ca 0.21 0.74 -0.45 0.00 -1.81 0.00 0.00 57.70 56.39 3a8h n MET 62 Cb 0.23 -2.38 -0.02 0.00 -0.71 0.00 0.00 33.22 30.34 3a8h n MET 62 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 3a8h n GLU 63 N 0.30 1.74 -0.17 0.03 0.00 -1.26 -4.65 120.64 116.63 3a8h n GLU 63 Ca 0.05 0.61 -0.03 0.00 0.00 0.00 0.00 57.16 57.80 3a8h n GLU 63 Cb 0.38 -2.15 0.07 0.00 0.00 0.00 0.00 31.44 29.74 3a8h n GLU 63 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.13 175.78 3a8h h PRO 64 N 3.12 0.39 -0.68 5.31 0.11 -1.93 0.29 132.00 138.61 3a8h h PRO 64 Ca -0.44 -0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.67 3a8h h PRO 64 Cb 1.31 -0.09 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 3a8h h PRO 64 CO 0.68 0.26 0.44 0.00 -0.21 0.00 0.00 178.00 179.17 3a8h h ARG 65 N 0.40 0.86 -0.43 1.05 3.08 -1.99 -1.58 114.38 115.77 3a8h h ARG 65 Ca 0.25 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.28 3a8h h ARG 65 Cb 0.25 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 3a8h h ARG 65 CO -0.24 0.57 0.22 1.25 -1.07 0.00 0.00 179.97 180.70 3a8h h HIS 66 N 0.88 0.42 -0.52 3.04 2.76 -1.54 -1.81 115.15 118.38 3a8h h HIS 66 Ca 0.26 0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.51 3a8h h HIS 66 Cb -0.05 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 28.73 3a8h h HIS 66 CO -0.03 0.22 0.21 -0.92 -1.30 0.00 0.00 177.93 176.11 3a8h h TYR 67 N 0.45 0.38 0.00 5.26 5.03 -0.64 -2.64 116.97 124.81 3a8h h TYR 67 Ca 0.18 0.02 -0.05 0.00 2.58 0.00 0.00 58.73 61.47 3a8h h TYR 67 Cb 0.07 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.25 3a8h h TYR 67 CO -0.09 0.14 -0.24 0.52 -1.32 0.00 0.00 178.16 177.17 3a8h h MET 68 N 0.41 0.00 -0.05 1.82 0.00 -0.51 -2.77 114.93 113.84 3a8h h MET 68 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.94 3a8h h MET 68 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.83 3a8h h MET 68 CO -0.22 0.24 0.00 0.00 0.00 0.00 0.00 176.91 176.93 3a8h n MET 69 N -3.47 2.30 -3.86 1.72 0.00 -0.77 -4.95 117.12 108.10 3a8h n MET 69 Ca -0.00 -1.90 -0.36 0.00 0.00 0.00 0.00 57.70 55.44 3a8h n MET 69 Cb 0.41 -1.46 -0.11 0.00 0.00 0.00 0.00 33.22 32.06 3a8h n MET 69 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 175.97 176.96 3a8h s THR 70 N -1.97 4.67 0.66 3.17 2.01 -1.02 -5.08 115.64 118.08 3a8h s THR 70 Ca 0.29 -0.06 -0.17 0.00 0.31 0.00 0.00 61.69 62.06 3a8h s THR 70 Cb 0.20 -3.15 -0.01 0.00 0.01 0.00 0.00 72.50 69.54 3a8h s THR 70 CO 0.30 0.38 1.12 -2.65 -0.69 0.00 0.00 174.62 173.09 3a8h n PRO 71 N 4.30 0.88 -0.24 4.92 -0.02 -1.26 -4.74 135.00 138.83 3a8h n PRO 71 Ca -0.16 0.35 -0.10 0.00 -2.02 0.00 0.00 63.50 61.58 3a8h n PRO 71 Cb 0.52 -2.36 -0.08 0.00 -0.02 0.00 0.00 33.50 31.56 3a8h n PRO 71 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 3a8h h TYR 72 N 0.28 -1.45 -0.30 6.00 3.20 -1.98 -1.86 116.97 120.86 3a8h h TYR 72 Ca -0.49 0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.44 3a8h h TYR 72 Cb 1.35 0.71 -0.02 0.00 1.54 0.00 0.00 36.73 40.31 3a8h h TYR 72 CO 0.40 -0.33 0.09 1.88 -1.64 0.00 0.00 178.16 178.55 3a8h h TYR 73 N -0.13 0.43 -0.45 -3.82 0.05 -1.96 -0.64 116.97 110.46 3a8h h TYR 73 Ca 0.10 -0.02 -0.06 0.00 0.05 0.00 0.00 58.73 58.80 3a8h h TYR 73 Cb 0.38 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 3a8h h TYR 73 CO -0.89 0.37 0.04 1.49 -1.05 0.00 0.00 178.16 178.12 3a8h h GLU 74 N 0.43 0.71 -0.77 4.88 4.81 -1.73 -2.18 114.58 120.72 3a8h h GLU 74 Ca 0.10 -0.16 0.06 0.00 -0.13 0.00 0.00 59.36 59.23 3a8h h GLU 74 Cb 0.14 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 29.38 3a8h h GLU 74 CO -0.01 0.70 0.51 0.00 -0.73 0.00 0.00 179.01 179.48 3a8h h ARG 75 N 0.67 0.82 0.01 1.92 3.08 -0.35 -1.19 114.38 119.34 3a8h h ARG 75 Ca 0.14 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 59.95 3a8h h ARG 75 Cb 0.36 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 3a8h h ARG 75 CO 0.01 0.54 -0.89 1.88 -1.07 0.00 0.00 179.97 180.44 3a8h h TYR 76 N 0.84 0.15 -0.10 3.04 0.05 -1.33 0.14 116.97 119.75 3a8h h TYR 76 Ca 0.33 -0.09 0.01 0.00 0.05 0.00 0.00 58.73 59.03 3a8h h TYR 76 Cb 0.22 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 3a8h h TYR 76 CO -0.00 0.93 0.04 0.28 -1.05 0.00 0.00 178.16 178.36 3a8h h VAL 77 N 0.05 0.98 -0.48 -2.88 2.07 -0.99 -0.10 116.25 114.90 3a8h h VAL 77 Ca -0.03 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 3a8h h VAL 77 Cb 1.54 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 3a8h h VAL 77 CO 0.13 0.02 0.26 0.40 0.02 0.00 0.00 177.57 178.39 3a8h h ILE 78 N 0.09 1.17 -0.14 4.57 2.04 -1.10 -1.72 117.51 122.42 3a8h h ILE 78 Ca 0.04 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 3a8h h ILE 78 Cb 0.02 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 3a8h h ILE 78 CO -0.04 0.18 0.04 1.23 0.00 0.00 0.00 178.15 179.56 3a8h h GLY 79 N 0.63 0.24 0.92 5.37 0.00 -0.57 -0.03 103.07 109.64 3a8h h GLY 79 Ca 0.17 -0.15 -0.04 0.00 0.00 0.00 0.00 47.33 47.31 3a8h h GLY 79 CO -0.03 0.14 0.07 -2.08 0.00 0.00 0.00 176.54 174.64 3a8h h VAL 80 N 0.04 1.24 -0.68 4.60 2.07 -1.04 -0.77 116.25 121.70 3a8h h VAL 80 Ca 0.04 -0.83 0.08 0.00 0.82 0.00 0.00 66.70 66.81 3a8h h VAL 80 Cb 0.24 1.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.01 3a8h h VAL 80 CO -0.00 0.28 0.35 0.00 0.02 0.00 0.00 177.57 178.22 3a8h h ALA 81 N 0.92 0.93 -0.48 1.67 0.00 -1.22 -1.11 119.26 119.96 3a8h h ALA 81 Ca 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 3a8h h ALA 81 Cb 0.35 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3a8h h ALA 81 CO 0.01 -0.03 0.26 1.15 0.00 0.00 0.00 179.25 180.63 3a8h h THR 82 N 0.61 1.17 -0.61 0.00 2.02 -0.41 -1.57 112.91 114.13 3a8h h THR 82 Ca 0.33 -0.44 -0.02 0.00 0.77 0.00 0.00 66.41 67.05 3a8h h THR 82 Cb 0.31 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 67.28 3a8h h THR 82 CO -0.24 0.18 0.29 -0.07 0.37 0.00 0.00 175.52 176.05 3a8h h LEU 83 N 0.63 0.80 -1.29 2.58 3.38 -0.60 0.71 115.31 121.54 3a8h h LEU 83 Ca 0.17 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3a8h h LEU 83 Cb 0.06 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3a8h h LEU 83 CO -0.03 0.72 0.41 0.24 0.09 0.00 0.00 178.44 179.87 3a8h h MET 84 N 0.84 0.89 -0.11 1.13 2.86 -0.84 0.99 114.93 120.69 3a8h h MET 84 Ca 0.21 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.72 3a8h h MET 84 Cb 0.13 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 3a8h h MET 84 CO -0.03 0.62 -0.17 0.28 1.06 0.00 0.00 176.91 178.67 3a8h h VAL 85 N 0.91 1.38 -0.31 -2.22 2.07 -0.74 -0.03 116.25 117.32 3a8h h VAL 85 Ca 0.24 -1.41 -0.03 0.00 0.82 0.00 0.00 66.70 66.32 3a8h h VAL 85 Cb -0.05 2.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 3a8h h VAL 85 CO -0.05 0.41 0.07 -0.33 0.02 0.00 0.00 177.57 177.69 3a8h h GLU 86 N -0.11 0.44 -0.01 1.57 5.08 -0.39 -1.84 114.58 119.32 3a8h h GLU 86 Ca 0.01 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 3a8h h GLU 86 Cb 0.74 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.91 3a8h h GLU 86 CO 0.04 0.41 -0.01 1.63 -1.00 0.00 0.00 179.01 180.08 3a8h n LYS 87 N -4.37 1.24 -1.03 2.33 4.76 0.30 -4.92 118.16 116.47 3a8h n LYS 87 Ca 0.01 -0.40 -0.01 0.00 -2.87 0.00 0.00 58.31 55.04 3a8h n LYS 87 Cb 0.17 -1.49 -0.01 0.00 -1.84 0.00 0.00 35.03 31.86 3a8h n LYS 87 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3a8h n GLY 88 N 1.09 0.50 0.14 0.72 0.00 -0.69 -4.92 105.19 102.02 3a8h n GLY 88 Ca 0.21 -0.50 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 3a8h n GLY 88 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3a8h h ILE 89 N 0.00 1.05 -2.24 -0.61 2.04 -1.26 -3.47 117.51 113.01 3a8h h ILE 89 Ca -0.02 -2.53 -0.56 0.00 1.00 0.00 0.00 64.86 62.74 3a8h h ILE 89 Cb 0.13 2.83 -0.14 0.00 -0.74 0.00 0.00 36.82 38.91 3a8h h ILE 89 CO 0.04 0.82 -0.66 -0.76 0.00 0.00 0.00 178.15 177.58 3a8h s LEU 90 N -7.43 2.61 0.14 1.44 1.43 -0.61 -5.00 118.68 111.27 3a8h s LEU 90 Ca -0.15 -1.23 0.08 0.00 -1.03 0.00 0.00 54.13 51.80 3a8h s LEU 90 Cb 0.05 -0.80 -0.04 0.00 0.03 0.00 0.00 46.19 45.42 3a8h s LEU 90 CO 0.86 -0.32 -0.09 0.42 0.23 0.00 0.00 176.35 177.45 3a8h s THR 91 N -2.83 3.28 0.34 5.49 -4.23 -1.26 -4.06 115.64 112.37 3a8h s THR 91 Ca 0.32 -1.47 0.04 0.00 -1.18 0.00 0.00 61.69 59.40 3a8h s THR 91 Cb 0.04 -2.58 0.16 0.00 1.34 0.00 0.00 72.50 71.46 3a8h s THR 91 CO 0.15 -0.01 1.88 -0.61 -0.54 0.00 0.00 174.62 175.49 3a8h h GLN 92 N 3.23 0.55 -0.38 3.99 4.15 -1.96 -2.74 115.11 121.95 3a8h h GLN 92 Ca -0.48 -0.11 0.07 0.00 0.77 0.00 0.00 58.65 58.90 3a8h h GLN 92 Cb 1.19 -0.08 -0.07 0.00 0.21 0.00 0.00 27.48 28.73 3a8h h GLN 92 CO 0.53 0.56 -0.03 0.22 -1.93 0.00 0.00 178.83 178.18 3a8h h ASP 93 N 0.53 -0.21 -0.06 -0.69 1.82 -1.99 -0.88 116.42 114.94 3a8h h ASP 93 Ca 0.11 0.10 -0.14 0.00 -0.39 0.00 0.00 57.03 56.71 3a8h h ASP 93 Cb 0.31 0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.49 3a8h h ASP 93 CO 0.01 -0.07 -0.42 1.05 -1.61 0.00 0.00 179.24 178.20 3a8h h GLU 94 N 0.07 0.59 -0.50 0.28 4.11 -1.91 -0.14 114.58 117.08 3a8h h GLU 94 Ca 0.19 -0.31 0.01 0.00 0.07 0.00 0.00 59.36 59.32 3a8h h GLU 94 Cb 0.27 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 3a8h h GLU 94 CO -0.34 0.90 0.32 -0.07 0.07 0.00 0.00 179.01 179.89 3a8h h LEU 95 N 0.48 0.54 -0.48 3.06 3.38 -1.19 -0.73 115.31 120.37 3a8h h LEU 95 Ca 0.04 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 3a8h h LEU 95 Cb 0.94 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 3a8h h LEU 95 CO 0.08 0.39 -0.59 -0.33 0.09 0.00 0.00 178.44 178.08 3a8h h GLU 96 N 0.65 0.54 -0.09 1.13 5.08 -0.94 0.58 114.58 121.53 3a8h h GLU 96 Ca 0.19 -0.36 0.01 0.00 -1.00 0.00 0.00 59.36 58.20 3a8h h GLU 96 Cb -0.04 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3a8h h GLU 96 CO -0.06 0.98 0.01 0.77 -1.00 0.00 0.00 179.01 179.71 3a8h h SER 97 N 0.41 -0.01 -0.15 1.42 0.02 -0.86 0.14 113.55 114.51 3a8h h SER 97 Ca -0.00 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.84 3a8h h SER 97 Cb 1.15 0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 3a8h h SER 97 CO 0.11 0.01 -0.32 -0.07 -1.14 0.00 0.00 176.83 175.42 3a8h h LEU 98 N 0.05 0.67 -0.91 5.07 3.38 -1.03 -2.87 115.31 119.67 3a8h h LEU 98 Ca 0.04 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 3a8h h LEU 98 Cb 0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 3a8h h LEU 98 CO -0.06 0.95 -0.21 0.00 0.09 0.00 0.00 178.44 179.22 3a8h h ALA 99 N 1.09 0.97 -0.71 1.53 0.00 -0.73 -3.47 119.26 117.95 3a8h h ALA 99 Ca 0.06 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.66 3a8h h ALA 99 Cb 0.82 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 3a8h h ALA 99 CO 0.07 0.26 -0.14 0.41 0.00 0.00 0.00 179.25 179.84 3a8h n GLY 100 N 0.37 0.31 0.00 0.00 0.00 0.44 -4.96 105.19 101.34 3a8h n GLY 100 Ca 0.01 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3a8h n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a8h n GLY 101 N -1.33 -1.48 3.77 -0.02 0.00 -0.98 -5.05 105.19 100.09 3a8h n GLY 101 Ca -0.07 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 3a8h n GLY 101 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3a8h s PRO 102 N -1.21 4.13 -0.44 1.61 0.02 -1.26 -4.52 135.00 133.33 3a8h s PRO 102 Ca 0.00 2.55 0.08 0.00 0.02 0.00 0.00 61.00 63.65 3a8h s PRO 102 Cb 0.00 -2.99 0.25 0.00 0.02 0.00 0.00 34.50 31.78 3a8h s PRO 102 CO 0.00 -0.54 0.57 0.34 -0.33 0.00 0.00 177.00 177.04 3a8h n PHE 103 N 1.00 0.44 -1.97 6.54 -0.00 -1.26 -5.03 117.46 117.18 3a8h n PHE 103 Ca 0.03 -3.68 -0.39 0.00 -0.00 0.00 0.00 57.45 53.41 3a8h n PHE 103 Cb 0.39 -0.39 0.01 0.00 -0.00 0.00 0.00 39.48 39.49 3a8h n PHE 103 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.76 175.51 3a8h s PRO 104 N -1.46 3.58 0.52 -7.13 0.04 -1.26 -4.96 135.00 124.32 3a8h s PRO 104 Ca 0.36 2.13 0.05 0.00 0.04 0.00 0.00 61.00 63.58 3a8h s PRO 104 Cb 0.17 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 32.25 3a8h s PRO 104 CO -0.09 -0.80 0.28 -0.51 0.04 0.00 0.00 177.00 175.92 3a8h s LEU 105 N -3.01 2.66 0.80 -3.56 1.43 -1.26 -4.97 118.68 110.78 3a8h s LEU 105 Ca 0.64 -1.31 -0.11 0.00 -1.03 0.00 0.00 54.13 52.32 3a8h s LEU 105 Cb -0.37 -1.13 0.07 0.00 0.03 0.00 0.00 46.19 44.79 3a8h s LEU 105 CO 0.46 -0.97 1.11 -0.44 0.23 0.00 0.00 176.35 176.74 3a8h s SER 106 N -4.14 4.12 0.54 2.29 0.01 -1.26 -4.73 113.70 110.52 3a8h s SER 106 Ca 0.28 1.96 -0.17 0.00 1.31 0.00 0.00 55.95 59.33 3a8h s SER 106 Cb -0.01 -2.54 -0.06 0.00 0.21 0.00 0.00 66.02 63.62 3a8h s SER 106 CO 0.17 -2.30 1.03 -0.13 0.41 0.00 0.00 173.24 172.42 3a8h s ARG 107 N -4.73 3.65 0.64 12.44 0.52 -0.34 -4.95 118.95 126.19 3a8h s ARG 107 Ca 0.64 1.15 -0.18 0.00 -0.52 0.00 0.00 55.73 56.82 3a8h s ARG 107 Cb -0.19 -2.08 -0.02 0.00 0.52 0.00 0.00 34.95 33.17 3a8h s ARG 107 CO 0.55 -0.53 1.17 -2.30 0.02 0.00 0.00 175.30 174.21 3a8h n PRO 108 N -1.62 1.00 -2.00 3.54 -0.02 -1.26 -4.84 135.00 129.79 3a8h n PRO 108 Ca 0.08 0.39 -0.41 0.00 -2.02 0.00 0.00 63.50 61.55 3a8h n PRO 108 Cb 0.53 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.59 3a8h n PRO 108 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3a8h s SER 109 N -1.37 6.62 -0.02 2.55 0.15 -1.26 -4.92 113.70 115.46 3a8h s SER 109 Ca 0.80 2.79 0.20 0.00 0.70 0.00 0.00 55.95 60.45 3a8h s SER 109 Cb -0.39 -2.65 0.60 0.00 -1.71 0.00 0.00 66.02 61.87 3a8h s SER 109 CO 0.43 -0.66 1.50 -0.62 1.20 0.00 0.00 173.24 175.09 3a8h n GLU 110 N 1.00 2.89 -3.87 5.44 1.02 -1.26 -4.94 120.64 120.93 3a8h n GLU 110 Ca 0.02 -2.60 -0.12 0.00 -0.02 0.00 0.00 57.16 54.44 3a8h n GLU 110 Cb 0.41 -1.57 -0.13 0.00 -0.02 0.00 0.00 31.44 30.13 3a8h n GLU 110 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3a8h s SER 111 N -1.00 -0.02 0.00 1.62 0.15 -1.26 -4.97 113.70 108.22 3a8h s SER 111 Ca 0.45 0.03 0.30 0.00 0.70 0.00 0.00 55.95 57.43 3a8h s SER 111 Cb 0.24 0.08 1.56 0.00 -1.71 0.00 0.00 66.02 66.19 3a8h s SER 111 CO 0.29 -0.04 2.03 -0.62 1.20 0.00 0.00 173.24 176.10 3a8h n GLU 112 N 2.94 1.23 0.00 5.44 1.02 -1.26 -4.90 120.64 125.12 3a8h n GLU 112 Ca -0.13 -0.34 0.00 0.00 -0.02 0.00 0.00 57.16 56.67 3a8h n GLU 112 Cb 0.59 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 3a8h n GLU 112 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3a8h n GLY 113 N 1.05 -2.30 3.17 0.62 0.00 -1.26 -4.91 105.19 101.56 3a8h n GLY 113 Ca 0.22 -1.69 -0.12 0.00 0.00 0.00 0.00 46.02 44.42 3a8h n GLY 113 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3a8h s ARG 114 N -0.31 0.58 0.79 1.61 1.70 -0.96 -5.02 118.95 117.33 3a8h s ARG 114 Ca 0.00 -0.35 -0.11 0.00 -0.47 0.00 0.00 55.73 54.80 3a8h s ARG 114 Cb 0.00 0.25 0.06 0.00 -0.57 0.00 0.00 34.95 34.69 3a8h s ARG 114 CO 0.00 -0.15 1.08 -1.25 -1.08 0.00 0.00 175.30 173.90 3a8h s PRO 115 N -1.51 2.18 0.24 3.89 0.04 -1.26 -2.90 135.00 135.69 3a8h s PRO 115 Ca -0.13 0.86 -0.31 0.00 0.04 0.00 0.00 61.00 61.45 3a8h s PRO 115 Cb -0.06 -1.91 -0.12 0.00 0.04 0.00 0.00 34.50 32.45 3a8h s PRO 115 CO 0.02 -1.61 1.61 0.00 0.04 0.00 0.00 177.00 177.06 3a8h n ALA 116 N -3.46 2.29 -1.77 8.56 0.00 -0.86 -4.88 120.51 120.40 3a8h n ALA 116 Ca 0.08 0.40 -0.40 0.00 0.00 0.00 0.00 53.44 53.51 3a8h n ALA 116 Cb 0.55 -2.44 -0.00 0.00 0.00 0.00 0.00 19.45 17.55 3a8h n ALA 116 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3a8h s PRO 117 N 0.18 4.02 0.19 0.00 0.04 -1.26 -4.92 135.00 133.26 3a8h s PRO 117 Ca 0.70 2.27 0.05 0.00 0.04 0.00 0.00 61.00 64.06 3a8h s PRO 117 Cb -0.54 -2.84 0.08 0.00 0.04 0.00 0.00 34.50 31.24 3a8h s PRO 117 CO 0.42 -0.49 1.44 -0.24 0.04 0.00 0.00 177.00 178.18 3a8h h VAL 118 N 2.63 1.48 -3.50 -0.36 3.04 -2.01 -3.42 116.25 114.12 3a8h h VAL 118 Ca -0.50 -2.48 -0.72 0.00 -1.01 0.00 0.00 66.70 61.99 3a8h h VAL 118 Cb 1.24 2.35 -0.24 0.00 -2.01 0.00 0.00 31.29 32.64 3a8h h VAL 118 CO 0.63 0.72 -0.46 -1.61 -1.01 0.00 0.00 177.57 175.84 3a8h s GLU 119 N -3.34 2.84 0.27 4.17 2.02 -1.26 -5.04 118.70 118.36 3a8h s GLU 119 Ca -0.02 -1.18 0.03 0.00 0.02 0.00 0.00 54.97 53.81 3a8h s GLU 119 Cb 0.11 -3.86 -0.04 0.00 0.10 0.00 0.00 34.13 30.44 3a8h s GLU 119 CO 0.81 -0.81 0.18 0.95 0.02 0.00 0.00 175.26 176.41 3a8h s THR 120 N 1.57 0.13 -0.03 3.63 -4.23 -1.26 -5.02 115.64 110.43 3a8h s THR 120 Ca 0.03 -2.00 0.07 0.00 -1.18 0.00 0.00 61.69 58.61 3a8h s THR 120 Cb -0.21 -2.51 -0.02 0.00 1.34 0.00 0.00 72.50 71.11 3a8h s THR 120 CO 0.07 0.00 -0.23 -0.89 -0.54 0.00 0.00 174.62 173.03 3a8h s THR 121 N -3.78 1.80 -0.35 3.99 2.01 -1.26 -5.10 115.64 112.94 3a8h s THR 121 Ca 0.38 -0.96 -0.25 0.00 0.31 0.00 0.00 61.69 61.17 3a8h s THR 121 Cb 0.05 -1.50 0.01 0.00 0.01 0.00 0.00 72.50 71.07 3a8h s THR 121 CO 0.18 0.51 0.90 -0.89 -0.69 0.00 0.00 174.62 174.63 3a8h s THR 122 N -0.42 4.63 0.24 -0.82 2.01 -1.26 -5.00 115.64 115.02 3a8h s THR 122 Ca 0.06 1.23 0.01 0.00 0.31 0.00 0.00 61.69 63.30 3a8h s THR 122 Cb -0.10 -4.29 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 3a8h s THR 122 CO 0.00 -0.46 0.40 -0.36 -0.69 0.00 0.00 174.62 173.51 3a8h s PHE 123 N 3.36 3.48 0.20 4.92 0.08 -1.26 -5.12 117.98 123.63 3a8h s PHE 123 Ca 0.37 0.22 0.11 0.00 0.12 0.00 0.00 56.93 57.75 3a8h s PHE 123 Cb -0.13 -1.76 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 3a8h s PHE 123 CO 0.17 0.36 -0.18 -1.21 -0.10 0.00 0.00 175.22 174.25 3a8h s GLU 124 N -3.70 1.74 0.08 0.44 0.41 -1.26 -4.91 118.70 111.50 3a8h s GLU 124 Ca 0.37 -1.45 -0.36 0.00 -0.41 0.00 0.00 54.97 53.12 3a8h s GLU 124 Cb -0.10 -1.96 -0.15 0.00 -1.78 0.00 0.00 34.13 30.14 3a8h s GLU 124 CO 0.30 0.41 1.51 0.28 -0.49 0.00 0.00 175.26 177.27 3a8h n VAL 125 N 0.09 0.06 0.00 2.63 0.31 -1.26 -1.74 118.33 118.42 3a8h n VAL 125 Ca -0.11 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.21 3a8h n VAL 125 Cb 0.56 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.26 3a8h n VAL 125 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3a8h n GLY 126 N 3.15 2.63 3.77 2.92 0.00 0.54 -4.97 105.19 113.24 3a8h n GLY 126 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 3a8h n GLY 126 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a8h s GLN 127 N -0.96 3.82 -0.08 1.61 -0.21 -0.71 -4.67 119.66 118.46 3a8h s GLN 127 Ca 0.00 1.76 -0.18 0.00 0.02 0.00 0.00 55.36 56.96 3a8h s GLN 127 Cb 0.00 -2.44 -0.05 0.00 1.00 0.00 0.00 33.01 31.52 3a8h s GLN 127 CO 0.00 -0.50 0.50 1.03 -2.12 0.00 0.00 175.29 174.20 3a8h s ARG 128 N -2.65 4.29 0.13 2.91 0.52 -1.26 -1.04 118.95 121.86 3a8h s ARG 128 Ca 0.62 0.52 0.06 0.00 -0.52 0.00 0.00 55.73 56.41 3a8h s ARG 128 Cb -0.28 -3.40 -0.04 0.00 0.52 0.00 0.00 34.95 31.75 3a8h s ARG 128 CO 0.34 0.25 -0.13 0.14 0.02 0.00 0.00 175.30 175.93 3a8h s VAL 129 N 0.29 1.30 -0.02 3.52 -7.23 -0.05 -2.32 120.40 115.89 3a8h s VAL 129 Ca 0.27 -1.84 0.05 0.00 -1.81 0.00 0.00 61.98 58.65 3a8h s VAL 129 Cb -0.16 -1.64 -0.03 0.00 0.56 0.00 0.00 36.38 35.11 3a8h s VAL 129 CO 0.12 -0.52 -0.17 -0.60 -0.31 0.00 0.00 175.10 173.62 3a8h s ARG 130 N -3.03 2.31 -0.10 4.82 3.52 -0.04 -1.22 118.95 125.22 3a8h s ARG 130 Ca 0.12 -0.82 -0.30 0.00 -0.13 0.00 0.00 55.73 54.60 3a8h s ARG 130 Cb -0.03 -2.26 -0.02 0.00 -1.56 0.00 0.00 34.95 31.08 3a8h s ARG 130 CO 0.03 0.59 1.12 0.08 -0.81 0.00 0.00 175.30 176.30 3a8h s VAL 131 N -0.77 4.49 0.05 7.11 1.01 -0.14 -1.34 120.40 130.82 3a8h s VAL 131 Ca 0.12 1.79 -0.36 0.00 0.00 0.00 0.00 61.98 63.53 3a8h s VAL 131 Cb -0.10 -4.15 -0.16 0.00 0.00 0.00 0.00 36.38 31.97 3a8h s VAL 131 CO 0.02 -0.03 1.46 0.54 0.00 0.00 0.00 175.10 177.09 3a8h n ARG 132 N 5.37 1.40 -2.33 2.72 1.74 0.18 -1.20 116.66 124.55 3a8h n ARG 132 Ca 0.11 0.51 -0.43 0.00 -0.77 0.00 0.00 57.85 57.27 3a8h n ARG 132 Cb 0.47 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.72 3a8h n ARG 132 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3a8h n ASP 133 N 3.22 4.64 -4.18 0.55 4.64 -1.26 -4.17 116.55 119.98 3a8h n ASP 133 Ca 0.19 -2.91 -0.19 0.00 -1.38 0.00 0.00 54.79 50.50 3a8h n ASP 133 Cb 0.21 -1.68 -0.12 0.00 -1.04 0.00 0.00 41.12 38.49 3a8h n ASP 133 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 3a8h s GLU 134 N 3.32 0.86 -0.17 -0.67 2.02 -1.26 -5.02 118.70 117.78 3a8h s GLU 134 Ca 0.49 -0.95 0.00 0.00 0.02 0.00 0.00 54.97 54.54 3a8h s GLU 134 Cb 0.07 -0.89 0.00 0.00 0.10 0.00 0.00 34.13 33.41 3a8h s GLU 134 CO 0.01 0.20 -0.16 0.71 0.02 0.00 0.00 175.26 176.05 3a8h s TYR 135 N -1.21 2.79 -0.22 1.61 1.51 -1.26 -5.03 117.35 115.53 3a8h s TYR 135 Ca -0.01 -1.20 0.02 0.00 -1.01 0.00 0.00 57.07 54.87 3a8h s TYR 135 Cb -0.10 -1.92 0.04 0.00 -0.11 0.00 0.00 41.96 39.88 3a8h s TYR 135 CO 0.02 -0.57 -0.15 0.08 -1.11 0.00 0.00 175.55 173.82 3a8h s VAL 136 N 1.01 2.14 0.11 0.71 1.01 -1.26 -5.01 120.40 119.10 3a8h s VAL 136 Ca -0.02 -1.29 0.18 0.00 0.00 0.00 0.00 61.98 60.86 3a8h s VAL 136 Cb -0.15 -2.08 0.12 0.00 0.00 0.00 0.00 36.38 34.27 3a8h s VAL 136 CO -0.04 0.25 1.68 1.55 0.00 0.00 0.00 175.10 178.54 3a8h h PRO 137 N 7.86 0.00 0.00 2.72 0.13 -1.97 -1.62 132.00 139.12 3a8h h PRO 137 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3a8h h PRO 137 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3a8h h PRO 137 CO 0.55 0.40 0.00 0.41 -0.23 0.00 0.00 178.00 179.13 3a8h n GLY 138 N 0.42 0.66 3.75 1.56 0.00 -1.26 -4.15 105.19 106.17 3a8h n GLY 138 Ca 0.00 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 3a8h n GLY 138 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3a8h s HIS 139 N 1.06 3.00 -0.11 1.61 5.65 -1.26 -0.20 115.29 125.04 3a8h s HIS 139 Ca 0.00 1.04 -0.15 0.00 0.25 0.00 0.00 55.06 56.20 3a8h s HIS 139 Cb 0.00 -3.83 0.04 0.00 -1.18 0.00 0.00 32.58 27.61 3a8h s HIS 139 CO 0.00 -2.67 0.39 -1.50 -0.65 0.00 0.00 174.74 170.31 3a8h s ILE 140 N -0.09 0.01 -0.62 0.89 2.07 -1.26 -3.87 121.20 118.33 3a8h s ILE 140 Ca 0.59 -0.11 -0.01 0.00 -1.41 0.00 0.00 60.65 59.71 3a8h s ILE 140 Cb -0.42 -0.59 0.46 0.00 0.13 0.00 0.00 42.46 42.04 3a8h s ILE 140 CO 0.44 -0.06 1.95 0.54 -1.91 0.00 0.00 174.94 175.90 3a8h n ARG 141 N 2.42 2.77 -4.05 3.50 5.12 -1.26 -4.68 116.66 120.48 3a8h n ARG 141 Ca -0.15 -3.37 -0.33 0.00 -1.93 0.00 0.00 57.85 52.07 3a8h n ARG 141 Cb 0.57 -2.28 -0.15 0.00 -1.16 0.00 0.00 32.46 29.44 3a8h n ARG 141 CO 0.00 0.00 0.00 1.41 -1.93 0.00 0.00 177.63 177.11 3a8h s MET 142 N -3.79 2.42 0.36 5.56 1.75 -1.26 -4.84 119.30 119.51 3a8h s MET 142 Ca 0.63 -1.23 -0.27 0.00 -1.25 0.00 0.00 55.69 53.56 3a8h s MET 142 Cb 0.50 -2.89 -0.10 0.00 2.84 0.00 0.00 34.83 35.19 3a8h s MET 142 CO -0.00 -0.51 1.28 -1.25 -0.65 0.00 0.00 175.02 173.89 3a8h s PRO 143 N 1.16 4.20 0.55 4.11 0.04 -1.26 -4.91 135.00 138.89 3a8h s PRO 143 Ca -0.06 2.14 0.24 0.00 0.04 0.00 0.00 61.00 63.37 3a8h s PRO 143 Cb -0.19 -2.93 1.48 0.00 0.04 0.00 0.00 34.50 32.91 3a8h s PRO 143 CO -0.06 -0.29 2.10 0.00 0.04 0.00 0.00 177.00 178.79 3a8h h ALA 144 N 3.07 2.02 0.00 8.56 0.00 -1.93 -2.42 119.26 128.57 3a8h h ALA 144 Ca -0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3a8h h ALA 144 Cb 1.23 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3a8h h ALA 144 CO 0.64 -0.27 -0.00 0.10 0.00 0.00 0.00 179.25 179.73 3a8h h TYR 145 N 0.00 0.00 -0.02 0.00 -0.00 -1.91 -1.86 116.97 113.18 3a8h h TYR 145 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.82 3a8h h TYR 145 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.15 3a8h h TYR 145 CO 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 178.16 178.02 3a8h n ARG 147 N 0.75 2.65 -0.91 0.00 0.63 -0.70 -1.56 116.66 117.52 3a8h n ARG 147 Ca 0.11 0.96 0.00 0.00 -0.92 0.00 0.00 57.85 57.99 3a8h n ARG 147 Cb 0.48 -2.80 0.00 0.00 0.45 0.00 0.00 32.46 30.59 3a8h n ARG 147 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3a8h n GLY 148 N 3.93 0.39 3.93 5.14 0.00 -0.34 -4.98 105.19 113.25 3a8h n GLY 148 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.93 3a8h n GLY 148 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a8h s ARG 149 N -0.70 3.53 -0.11 1.61 1.81 -0.60 -4.71 118.95 119.77 3a8h s ARG 149 Ca 0.00 -0.14 0.00 0.00 -1.72 0.00 0.00 55.73 53.87 3a8h s ARG 149 Cb 0.00 -2.59 -0.02 0.00 -0.45 0.00 0.00 34.95 31.89 3a8h s ARG 149 CO 0.00 0.07 -0.10 0.14 -0.68 0.00 0.00 175.30 174.73 3a8h s VAL 150 N -2.38 3.33 0.17 3.52 -7.23 -1.26 -0.96 120.40 115.59 3a8h s VAL 150 Ca 0.42 -0.58 -0.01 0.00 -1.81 0.00 0.00 61.98 60.00 3a8h s VAL 150 Cb -0.10 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.46 3a8h s VAL 150 CO 0.37 0.55 0.24 0.61 -0.31 0.00 0.00 175.10 176.56 3a8h n GLY 151 N 3.03 2.58 3.36 2.32 0.00 -0.35 -4.72 105.19 111.40 3a8h n GLY 151 Ca -0.18 -1.47 -0.31 0.00 0.00 0.00 0.00 46.02 44.06 3a8h n GLY 151 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3a8h s THR 152 N -2.61 2.31 -0.03 2.61 -1.32 -0.02 -0.88 115.64 115.70 3a8h s THR 152 Ca 0.14 -1.04 -0.30 0.00 -1.21 0.00 0.00 61.69 59.28 3a8h s THR 152 Cb -0.01 -1.84 -0.05 0.00 -1.51 0.00 0.00 72.50 69.09 3a8h s THR 152 CO 0.10 0.56 1.49 -0.63 -2.21 0.00 0.00 174.62 173.93 3a8h s ILE 153 N -0.66 3.67 -0.05 5.08 -1.09 -0.20 -0.51 121.20 127.44 3a8h s ILE 153 Ca 0.11 0.96 0.20 0.00 -2.23 0.00 0.00 60.65 59.68 3a8h s ILE 153 Cb -0.10 -3.62 -0.30 0.00 -1.58 0.00 0.00 42.46 36.86 3a8h s ILE 153 CO -0.00 -0.04 0.37 -1.20 -1.23 0.00 0.00 174.94 172.84 3a8h n SER 154 N 6.14 0.41 -3.64 3.58 7.64 0.51 -0.34 113.62 127.92 3a8h n SER 154 Ca 0.15 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.93 3a8h n SER 154 Cb 0.43 1.75 -0.07 0.00 -1.01 0.00 0.00 64.21 65.31 3a8h n SER 154 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3a8h s HIS 155 N -3.23 -0.64 -0.14 1.43 5.65 -1.23 -4.95 115.29 112.18 3a8h s HIS 155 Ca -0.08 1.47 -0.01 0.00 0.25 0.00 0.00 55.06 56.70 3a8h s HIS 155 Cb 0.12 0.36 -0.01 0.00 -1.18 0.00 0.00 32.58 31.86 3a8h s HIS 155 CO 0.82 -0.31 -0.11 0.50 -0.65 0.00 0.00 174.74 174.99 3a8h s ARG 156 N 0.56 3.40 0.50 2.88 3.52 -1.26 -1.35 118.95 127.20 3a8h s ARG 156 Ca -0.01 -0.67 -0.22 0.00 -0.13 0.00 0.00 55.73 54.70 3a8h s ARG 156 Cb -0.05 -2.70 -0.06 0.00 -1.56 0.00 0.00 34.95 30.58 3a8h s ARG 156 CO -0.07 0.15 1.28 0.95 -0.81 0.00 0.00 175.30 176.80 3a8h s THR 157 N 0.52 2.52 -2.34 4.11 -4.23 -0.54 -4.92 115.64 110.77 3a8h s THR 157 Ca -0.08 0.39 0.28 0.00 -1.18 0.00 0.00 61.69 61.11 3a8h s THR 157 Cb -0.15 -3.20 0.63 0.00 1.34 0.00 0.00 72.50 71.12 3a8h s THR 157 CO 0.04 -0.00 1.85 0.35 -0.54 0.00 0.00 174.62 176.31 3a8h n THR 158 N -0.75 0.02 -4.51 3.99 -2.24 -1.26 -4.76 114.28 104.76 3a8h n THR 158 Ca 0.09 -0.19 -0.24 0.00 -2.27 0.00 0.00 64.05 61.44 3a8h n THR 158 Cb 0.46 0.21 -0.11 0.00 -2.10 0.00 0.00 70.33 68.80 3a8h n THR 158 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3a8h s GLU 159 N -1.98 1.75 0.08 -0.78 0.41 -1.26 -5.15 118.70 111.76 3a8h s GLU 159 Ca 0.40 -1.93 0.05 0.00 -0.41 0.00 0.00 54.97 53.08 3a8h s GLU 159 Cb 0.21 -1.42 -0.03 0.00 -1.78 0.00 0.00 34.13 31.11 3a8h s GLU 159 CO 0.33 0.02 -0.14 0.15 -0.49 0.00 0.00 175.26 175.14 3a8h s LYS 160 N -3.70 0.83 0.08 1.61 1.02 -1.26 -4.35 119.74 113.97 3a8h s LYS 160 Ca 0.33 -0.98 0.01 0.00 0.02 0.00 0.00 55.97 55.34 3a8h s LYS 160 Cb 0.05 -0.81 -0.04 0.00 -0.52 0.00 0.00 37.83 36.51 3a8h s LYS 160 CO 0.15 0.18 -0.05 -1.58 -0.92 0.00 0.00 175.35 173.13 3a8h s TRP 161 N -1.39 0.77 0.45 3.18 0.51 0.33 -4.79 118.94 117.99 3a8h s TRP 161 Ca -0.01 -0.97 -0.25 0.00 -2.12 0.00 0.00 56.10 52.75 3a8h s TRP 161 Cb -0.09 -0.47 -0.08 0.00 -0.81 0.00 0.00 33.47 32.01 3a8h s TRP 161 CO 0.02 -0.23 1.42 -1.25 -0.51 0.00 0.00 176.95 176.40 3a8h s PRO 162 N -3.87 3.70 0.01 4.98 0.04 -1.25 -0.99 135.00 137.62 3a8h s PRO 162 Ca 0.10 2.39 -0.30 0.00 0.04 0.00 0.00 61.00 63.24 3a8h s PRO 162 Cb 0.06 -2.65 -0.08 0.00 0.04 0.00 0.00 34.50 31.87 3a8h s PRO 162 CO -0.06 -0.80 1.81 0.12 0.04 0.00 0.00 177.00 178.11 3a8h s PHE 163 N -1.21 1.68 0.45 0.56 5.36 -0.26 -4.88 117.98 119.68 3a8h s PHE 163 Ca 0.61 -0.12 0.13 0.00 -0.96 0.00 0.00 56.93 56.58 3a8h s PHE 163 Cb -0.43 -4.09 1.05 0.00 -0.34 0.00 0.00 43.02 39.21 3a8h s PHE 163 CO 0.55 -4.73 2.05 -1.35 -1.46 0.00 0.00 175.22 170.29 3a8h h PRO 164 N 9.92 0.32 0.00 10.12 0.11 -1.91 -1.53 132.00 149.03 3a8h h PRO 164 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3a8h h PRO 164 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3a8h h PRO 164 CO 0.95 0.21 0.00 -0.44 -0.21 0.00 0.00 178.00 178.51 3a8h h ASP 165 N 0.33 0.00 0.00 -2.05 5.19 -1.85 0.12 116.42 118.17 3a8h h ASP 165 Ca 0.16 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.38 3a8h h ASP 165 Cb 0.22 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.70 3a8h h ASP 165 CO -0.04 0.00 -1.57 0.00 -3.12 0.00 0.00 179.24 174.52 3a8h n ALA 166 N -1.94 1.21 0.24 3.45 0.00 -0.65 -2.26 120.51 120.56 3a8h n ALA 166 Ca -0.00 -0.86 0.11 0.00 0.00 0.00 0.00 53.44 52.68 3a8h n ALA 166 Cb 0.17 0.10 0.61 0.00 0.00 0.00 0.00 19.45 20.34 3a8h n ALA 166 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 3a8h h ILE 167 N -0.91 0.66 0.00 0.00 6.09 -1.33 -1.30 117.51 120.72 3a8h h ILE 167 Ca -0.28 -0.77 0.00 0.00 -1.37 0.00 0.00 64.86 62.44 3a8h h ILE 167 Cb 1.19 1.49 0.00 0.00 0.47 0.00 0.00 36.82 39.97 3a8h h ILE 167 CO -0.17 0.17 0.00 0.61 -3.07 0.00 0.00 178.15 175.69 3a8h n GLY 168 N -0.46 -1.04 0.48 8.18 0.00 0.42 -1.40 105.19 111.36 3a8h n GLY 168 Ca -0.01 0.08 0.04 0.00 0.00 0.00 0.00 46.02 46.13 3a8h n GLY 168 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3a8h n HIS 169 N -2.02 0.36 -1.85 1.61 8.25 -0.56 -4.09 115.22 116.92 3a8h n HIS 169 Ca 0.01 -0.52 -0.13 0.00 -0.26 0.00 0.00 57.72 56.82 3a8h n HIS 169 Cb 0.15 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 31.18 3a8h n HIS 169 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3a8h n GLY 170 N 0.19 0.53 3.84 -1.41 0.00 -0.50 -5.01 105.19 102.84 3a8h n GLY 170 Ca 0.09 -0.39 -0.31 0.00 0.00 0.00 0.00 46.02 45.41 3a8h n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a8h s ARG 171 N -3.93 3.27 0.00 1.61 0.52 -0.78 -4.97 118.95 114.67 3a8h s ARG 171 Ca 0.00 0.91 0.28 0.00 -0.52 0.00 0.00 55.73 56.41 3a8h s ARG 171 Cb 0.00 -2.03 1.22 0.00 0.52 0.00 0.00 34.95 34.66 3a8h s ARG 171 CO 0.00 -0.83 1.84 0.27 0.02 0.00 0.00 175.30 176.60 3a8h n ASN 172 N -2.78 1.16 -1.55 0.23 2.04 -1.26 -4.40 115.26 108.70 3a8h n ASN 172 Ca 0.07 -1.40 -0.12 0.00 -0.44 0.00 0.00 54.58 52.69 3a8h n ASN 172 Cb 0.54 -0.01 0.09 0.00 -2.53 0.00 0.00 39.78 37.87 3a8h n ASN 172 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 3a8h n ASP 173 N -0.09 3.62 0.09 0.53 5.68 -1.26 -4.70 116.55 120.42 3a8h n ASP 173 Ca 0.20 -3.71 0.13 0.00 -0.50 0.00 0.00 54.79 50.91 3a8h n ASP 173 Cb 0.30 -0.41 0.39 0.00 -1.14 0.00 0.00 41.12 40.25 3a8h n ASP 173 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3a8h n ALA 174 N -0.82 2.40 -0.40 2.12 0.00 -1.26 -2.03 120.51 120.51 3a8h n ALA 174 Ca 0.33 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.70 3a8h n ALA 174 Cb 0.87 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.90 3a8h n ALA 174 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8h n GLY 175 N 1.33 1.91 3.50 0.00 0.00 -1.26 -1.10 105.19 109.57 3a8h n GLY 175 Ca 0.05 -0.33 -0.14 0.00 0.00 0.00 0.00 46.02 45.61 3a8h n GLY 175 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3a8h s GLU 176 N 0.00 0.71 0.02 1.61 -1.05 -1.26 -3.87 118.70 114.85 3a8h s GLU 176 Ca 0.00 0.81 -0.03 0.00 -0.15 0.00 0.00 54.97 55.60 3a8h s GLU 176 Cb 0.00 0.34 -0.01 0.00 -0.44 0.00 0.00 34.13 34.02 3a8h s GLU 176 CO 0.00 -0.09 0.04 -1.21 0.95 0.00 0.00 175.26 174.95 3a8h s GLU 177 N 0.26 0.40 0.78 -4.83 2.02 -0.16 -4.85 118.70 112.32 3a8h s GLU 177 Ca -0.00 -0.55 -0.12 0.00 0.02 0.00 0.00 54.97 54.32 3a8h s GLU 177 Cb -0.04 0.15 0.06 0.00 0.10 0.00 0.00 34.13 34.40 3a8h s GLU 177 CO 0.01 -0.08 1.15 -1.25 0.02 0.00 0.00 175.26 175.11 3a8h s PRO 178 N -1.53 2.21 0.37 0.39 0.04 -1.26 -0.52 135.00 134.70 3a8h s PRO 178 Ca -0.15 0.18 0.08 0.00 0.04 0.00 0.00 61.00 61.15 3a8h s PRO 178 Cb -0.08 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 3a8h s PRO 178 CO -0.00 -1.43 0.13 0.95 0.04 0.00 0.00 177.00 176.69 3a8h s THR 179 N -3.50 2.62 -0.04 1.26 -4.23 -1.26 -2.12 115.64 108.36 3a8h s THR 179 Ca 0.61 -1.76 0.03 0.00 -1.18 0.00 0.00 61.69 59.39 3a8h s THR 179 Cb -0.11 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.79 3a8h s THR 179 CO 0.49 -0.11 -0.11 -0.31 -0.54 0.00 0.00 174.62 174.04 3a8h s TYR 180 N -2.52 1.24 -0.44 3.99 1.51 0.75 -1.46 117.35 120.42 3a8h s TYR 180 Ca 0.39 -0.37 -0.28 0.00 -1.01 0.00 0.00 57.07 55.79 3a8h s TYR 180 Cb 0.01 -0.89 0.03 0.00 -0.11 0.00 0.00 41.96 41.00 3a8h s TYR 180 CO 0.22 -0.17 1.08 -1.01 -1.11 0.00 0.00 175.55 174.56 3a8h s HIS 181 N 0.33 2.91 -0.22 2.71 3.76 -0.46 -0.27 115.29 124.06 3a8h s HIS 181 Ca -0.07 0.76 -0.06 0.00 -0.15 0.00 0.00 55.06 55.54 3a8h s HIS 181 Cb -0.12 -4.17 -0.02 0.00 1.11 0.00 0.00 32.58 29.38 3a8h s HIS 181 CO 0.02 -1.12 0.01 0.08 -0.85 0.00 0.00 174.74 172.88 3a8h s VAL 182 N 4.13 3.91 -0.23 -0.90 1.01 0.10 -0.37 120.40 128.05 3a8h s VAL 182 Ca 0.45 -0.31 -0.15 0.00 0.00 0.00 0.00 61.98 61.96 3a8h s VAL 182 Cb -0.09 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 3a8h s VAL 182 CO 0.27 0.39 0.38 -0.75 0.00 0.00 0.00 175.10 175.39 3a8h s LYS 183 N 1.36 4.10 -0.07 2.72 2.20 0.33 -1.12 119.74 129.26 3a8h s LYS 183 Ca 0.05 0.12 0.01 0.00 -0.36 0.00 0.00 55.97 55.78 3a8h s LYS 183 Cb -0.15 -3.59 -0.03 0.00 -1.51 0.00 0.00 37.83 32.56 3a8h s LYS 183 CO 0.01 -0.15 -0.09 -0.06 -0.36 0.00 0.00 175.35 174.70 3a8h s PHE 184 N 1.66 2.87 0.40 4.03 0.40 0.26 -0.84 117.98 126.76 3a8h s PHE 184 Ca 0.17 -0.09 -0.26 0.00 -0.60 0.00 0.00 56.93 56.15 3a8h s PHE 184 Cb -0.15 -1.71 -0.09 0.00 0.51 0.00 0.00 43.02 41.58 3a8h s PHE 184 CO 0.09 0.24 1.33 0.00 0.70 0.00 0.00 175.22 177.58 3a8h s ALA 185 N -0.65 3.32 0.27 5.36 0.00 -1.26 -0.84 121.76 127.95 3a8h s ALA 185 Ca 0.10 1.30 -0.00 0.00 0.00 0.00 0.00 51.96 53.35 3a8h s ALA 185 Cb -0.11 -3.51 0.53 0.00 0.00 0.00 0.00 23.12 20.03 3a8h s ALA 185 CO 0.01 -0.86 1.80 0.00 0.00 0.00 0.00 175.76 176.71 3a8h h ALA 186 N 2.76 1.39 0.00 0.00 0.00 -1.39 -0.45 119.26 121.57 3a8h h ALA 186 Ca -0.50 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 3a8h h ALA 186 Cb 1.24 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 3a8h h ALA 186 CO 0.63 0.08 -0.11 1.05 0.00 0.00 0.00 179.25 180.90 3a8h h GLU 187 N 0.82 0.00 -0.19 0.00 9.09 -1.83 -0.52 114.58 121.95 3a8h h GLU 187 Ca 0.47 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.80 3a8h h GLU 187 Cb 0.56 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.64 3a8h h GLU 187 CO -0.30 0.11 -0.26 1.49 0.05 0.00 0.00 179.01 180.10 3a8h h GLU 188 N 0.00 0.35 0.09 1.06 4.57 -1.38 -1.32 114.58 117.95 3a8h h GLU 188 Ca -0.00 -0.12 -0.35 0.00 -1.18 0.00 0.00 59.36 57.70 3a8h h GLU 188 Cb 0.44 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.98 3a8h h GLU 188 CO 0.01 0.59 -1.97 1.28 -1.18 0.00 0.00 179.01 177.74 3a8h n LEU 189 N -4.13 2.20 -0.23 1.64 4.77 -0.71 -4.62 117.00 115.91 3a8h n LEU 189 Ca -0.01 0.23 0.03 0.00 -0.03 0.00 0.00 56.01 56.24 3a8h n LEU 189 Cb 0.39 -0.78 0.04 0.00 -2.33 0.00 0.00 43.42 40.74 3a8h n LEU 189 CO 0.41 0.75 0.38 0.49 -1.33 0.00 0.00 177.39 178.08 3a8h n PHE 190 N -3.35 0.00 -2.13 -1.77 3.72 -0.29 -5.00 117.46 108.65 3a8h n PHE 190 Ca -0.29 -0.37 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 3a8h n PHE 190 Cb 1.05 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 39.51 3a8h n PHE 190 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3a8h n GLY 191 N -0.51 2.83 0.00 1.37 0.00 -0.50 -1.13 105.19 107.25 3a8h n GLY 191 Ca 0.05 -0.23 0.13 0.00 0.00 0.00 0.00 46.02 45.97 3a8h n GLY 191 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3a8h n SER 192 N 1.64 0.00 -3.64 1.61 3.41 -1.26 -4.15 113.62 111.23 3a8h n SER 192 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.20 3a8h n SER 192 Cb 0.00 -0.32 0.02 0.00 -0.26 0.00 0.00 64.21 63.65 3a8h n SER 192 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3a8h n ASP 193 N -1.32 7.38 -3.51 4.04 2.03 -0.28 -4.89 116.55 119.99 3a8h n ASP 193 Ca 0.12 -3.65 -0.16 0.00 0.52 0.00 0.00 54.79 51.62 3a8h n ASP 193 Cb 0.23 -1.19 -0.05 0.00 -0.72 0.00 0.00 41.12 39.39 3a8h n ASP 193 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3a8h s THR 194 N -4.08 0.00 -0.78 5.18 -1.32 -1.26 -4.89 115.64 108.49 3a8h s THR 194 Ca 0.40 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.96 3a8h s THR 194 Cb 0.18 -1.00 0.22 0.00 -1.51 0.00 0.00 72.50 70.40 3a8h s THR 194 CO -0.12 0.00 1.15 -0.90 -2.21 0.00 0.00 174.62 172.54 3a8h n ASP 195 N 0.65 2.61 -3.06 8.08 5.68 -1.26 -5.04 116.55 124.22 3a8h n ASP 195 Ca -0.17 -1.92 -0.12 0.00 -0.50 0.00 0.00 54.79 52.07 3a8h n ASP 195 Cb 0.59 -0.16 0.07 0.00 -1.14 0.00 0.00 41.12 40.47 3a8h n ASP 195 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3a8h n GLY 196 N 0.33 -0.06 0.68 6.12 0.00 -1.26 -5.08 105.19 105.92 3a8h n GLY 196 Ca 0.09 -1.87 -0.02 0.00 0.00 0.00 0.00 46.02 44.21 3a8h n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a8h n GLY 197 N 1.28 -0.17 3.15 -0.02 0.00 -1.26 -4.77 105.19 103.41 3a8h n GLY 197 Ca 0.08 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 3a8h n GLY 197 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3a8h s SER 198 N -5.39 0.32 -0.05 1.61 1.04 -1.26 -1.04 113.70 108.93 3a8h s SER 198 Ca -0.06 -0.90 0.01 0.00 0.48 0.00 0.00 55.95 55.48 3a8h s SER 198 Cb 0.01 0.27 0.02 0.00 0.10 0.00 0.00 66.02 66.42 3a8h s SER 198 CO 0.09 -0.68 -0.07 -0.69 0.98 0.00 0.00 173.24 172.87 3a8h s VAL 199 N -3.92 0.74 -0.23 5.02 1.01 -0.02 -4.82 120.40 118.17 3a8h s VAL 199 Ca 0.09 -0.23 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 3a8h s VAL 199 Cb 0.07 -0.73 -0.02 0.00 0.00 0.00 0.00 36.38 35.70 3a8h s VAL 199 CO -0.08 0.27 0.02 -0.69 0.00 0.00 0.00 175.10 174.62 3a8h s VAL 200 N 0.89 3.93 -0.11 2.92 1.01 -1.26 -0.57 120.40 127.21 3a8h s VAL 200 Ca -0.11 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.55 3a8h s VAL 200 Cb -0.15 -2.81 -0.03 0.00 0.00 0.00 0.00 36.38 33.39 3a8h s VAL 200 CO 0.01 0.38 -0.04 -0.69 0.00 0.00 0.00 175.10 174.76 3a8h s VAL 201 N 1.48 3.95 -0.64 2.92 1.01 -0.28 -4.89 120.40 123.96 3a8h s VAL 201 Ca 0.06 -0.36 -0.19 0.00 0.00 0.00 0.00 61.98 61.48 3a8h s VAL 201 Cb -0.15 -2.68 0.11 0.00 0.00 0.00 0.00 36.38 33.66 3a8h s VAL 201 CO 0.01 0.56 0.79 -0.62 0.00 0.00 0.00 175.10 175.83 3a8h s ASP 202 N -0.33 6.24 -0.14 3.32 2.15 -1.26 -0.72 116.67 125.94 3a8h s ASP 202 Ca 0.06 -1.46 -0.01 0.00 0.43 0.00 0.00 52.55 51.56 3a8h s ASP 202 Cb -0.12 -2.33 -0.02 0.00 -0.30 0.00 0.00 42.92 40.15 3a8h s ASP 202 CO 0.02 -1.15 -0.09 -0.76 -0.17 0.00 0.00 175.17 173.02 3a8h s LEU 203 N 2.82 2.94 0.56 -1.34 1.43 0.63 -4.83 118.68 120.88 3a8h s LEU 203 Ca 0.15 -0.24 -0.21 0.00 -1.03 0.00 0.00 54.13 52.80 3a8h s LEU 203 Cb -0.21 -1.68 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 3a8h s LEU 203 CO 0.05 0.17 1.23 0.49 0.23 0.00 0.00 176.35 178.52 3a8h n PHE 204 N 3.47 1.81 -0.32 0.29 3.01 -1.26 -0.18 117.46 124.29 3a8h n PHE 204 Ca -0.18 0.44 0.13 0.00 1.01 0.00 0.00 57.45 58.85 3a8h n PHE 204 Cb 0.53 -2.29 0.35 0.00 -0.01 0.00 0.00 39.48 38.06 3a8h n PHE 204 CO 0.00 0.00 0.00 1.49 1.01 0.00 0.00 176.76 179.26 3a8h h GLU 205 N 1.14 0.71 0.00 -1.08 4.81 -1.77 -1.42 114.58 116.97 3a8h h GLU 205 Ca -0.50 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3a8h h GLU 205 Cb 1.32 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.54 3a8h h GLU 205 CO 0.55 0.47 0.00 0.41 -0.73 0.00 0.00 179.01 179.71 3a8h n GLY 206 N -1.39 -0.88 0.57 1.92 0.00 -1.26 -1.72 105.19 102.43 3a8h n GLY 206 Ca 0.20 -0.09 0.13 0.00 0.00 0.00 0.00 46.02 46.27 3a8h n GLY 206 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3a8h n TYR 207 N -1.27 0.00 -4.43 1.61 4.01 -0.53 -4.93 117.16 111.61 3a8h n TYR 207 Ca 0.09 0.00 -0.22 0.00 -0.16 0.00 0.00 57.90 57.61 3a8h n TYR 207 Cb 0.14 -0.01 -0.10 0.00 -0.31 0.00 0.00 39.34 39.06 3a8h n TYR 207 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3a8h s LEU 208 N -2.08 2.58 0.05 7.72 1.43 -0.70 -0.64 118.68 127.04 3a8h s LEU 208 Ca 0.33 -1.05 -0.14 0.00 -1.03 0.00 0.00 54.13 52.25 3a8h s LEU 208 Cb 0.20 -0.93 0.02 0.00 0.03 0.00 0.00 46.19 45.51 3a8h s LEU 208 CO 0.36 -0.06 0.31 -1.83 0.23 0.00 0.00 176.35 175.36 3a8h s GLU 209 N -3.57 0.83 0.36 1.70 -1.05 -0.45 -4.77 118.70 111.74 3a8h s GLU 209 Ca 0.28 -0.53 -0.27 0.00 -0.15 0.00 0.00 54.97 54.30 3a8h s GLU 209 Cb -0.03 0.36 -0.12 0.00 -0.44 0.00 0.00 34.13 33.90 3a8h s GLU 209 CO 0.12 -0.27 1.17 -2.30 0.95 0.00 0.00 175.26 174.93 3a8h n PRO 210 N 0.52 1.77 0.00 -4.83 -0.02 -1.26 -0.86 135.00 130.32 3a8h n PRO 210 Ca -0.18 0.62 0.05 0.00 -2.02 0.00 0.00 63.50 61.97 3a8h n PRO 210 Cb 0.60 -2.17 0.27 0.00 -0.02 0.00 0.00 33.50 32.18 3a8h n PRO 210 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48