#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1j n GLY 20 N 0.00 0.00 3.37 -1.23 0.00 -1.26 -4.68 105.19 101.40 3h1j n GLY 20 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3h1j n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1j s ALA 21 N 0.00 2.83 0.00 4.61 0.00 -1.26 -4.93 121.76 123.01 3h1j s ALA 21 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 51.96 50.93 3h1j s ALA 21 Cb 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 23.12 21.53 3h1j s ALA 21 CO 0.00 -0.14 0.00 0.39 0.00 0.00 0.00 175.76 176.01 3h1j n GLU 22 N 4.25 2.34 -3.86 0.00 1.02 -1.26 -5.12 120.64 118.01 3h1j n GLU 22 Ca -0.18 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.85 3h1j n GLU 22 Cb 0.52 0.00 -0.09 0.00 -0.02 0.00 0.00 31.44 31.84 3h1j n GLU 22 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3h1j s ASP 23 N -1.00 0.03 -0.80 1.62 1.01 -1.26 -5.10 116.67 111.17 3h1j s ASP 23 Ca 0.00 -0.26 -0.23 0.00 0.71 0.00 0.00 52.55 52.77 3h1j s ASP 23 Cb 0.00 0.24 0.07 0.00 1.01 0.00 0.00 42.92 44.24 3h1j s ASP 23 CO 0.00 -0.44 1.14 -0.22 0.21 0.00 0.00 175.17 175.86 3h1j s LEU 24 N -1.65 4.15 1.00 1.23 2.96 -1.26 -4.64 118.68 120.47 3h1j s LEU 24 Ca -0.11 -1.20 -0.17 0.00 -0.22 0.00 0.00 54.13 52.43 3h1j s LEU 24 Cb -0.05 -2.47 0.22 0.00 0.50 0.00 0.00 46.19 44.39 3h1j s LEU 24 CO -0.00 -1.45 1.29 -1.61 -1.32 0.00 0.00 176.35 173.27 3h1j s GLU 25 N 4.23 0.33 -0.33 1.98 2.02 -1.22 -4.94 118.70 120.77 3h1j s GLU 25 Ca 0.31 -0.37 -0.05 0.00 0.02 0.00 0.00 54.97 54.88 3h1j s GLU 25 Cb -0.10 -1.81 0.24 0.00 0.10 0.00 0.00 34.13 32.57 3h1j s GLU 25 CO 0.03 -2.63 1.17 1.51 0.02 0.00 0.00 175.26 175.36 3h1j n ILE 26 N -3.93 0.00 -1.44 -1.63 3.06 -1.25 -3.29 119.36 110.87 3h1j n ILE 26 Ca 0.15 -0.36 -0.33 0.00 -2.50 0.00 0.00 62.75 59.71 3h1j n ILE 26 Cb 0.59 0.78 0.09 0.00 0.54 0.00 0.00 39.64 41.64 3h1j n ILE 26 CO 0.00 0.00 0.00 -0.89 -2.50 0.00 0.00 176.55 173.16 3h1j s THR 27 N 0.63 2.58 -0.24 9.51 2.01 -0.27 -4.81 115.64 125.05 3h1j s THR 27 Ca 0.24 0.27 0.16 0.00 0.31 0.00 0.00 61.69 62.67 3h1j s THR 27 Cb 0.16 -2.77 0.48 0.00 0.01 0.00 0.00 72.50 70.38 3h1j s THR 27 CO -0.10 -0.17 1.16 1.17 -0.69 0.00 0.00 174.62 175.99 3h1j n LYS 28 N -2.82 2.24 0.00 4.92 4.81 -1.26 -1.63 118.16 124.43 3h1j n LYS 28 Ca 0.12 -3.58 0.00 0.00 -0.87 0.00 0.00 58.31 53.98 3h1j n LYS 28 Cb 0.51 -1.69 0.00 0.00 0.02 0.00 0.00 35.03 33.86 3h1j n LYS 28 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3h1j n LEU 29 N -0.57 0.00 0.00 3.14 4.77 -1.23 -4.60 117.00 118.51 3h1j n LEU 29 Ca 0.22 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 3h1j n LEU 29 Cb 0.89 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 3h1j n LEU 29 CO 0.17 0.00 0.18 -0.81 -1.33 0.00 0.00 177.39 175.60 3h1j n PRO 30 N 0.00 0.00 -0.43 3.23 -0.04 -1.26 -2.28 135.00 134.21 3h1j n PRO 30 Ca 0.00 0.36 0.36 0.00 -0.04 0.00 0.00 63.50 64.19 3h1j n PRO 30 Cb 0.00 -0.86 0.56 0.00 -0.04 0.00 0.00 33.50 33.16 3h1j n PRO 30 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3h1j n ASN 31 N -0.73 0.00 0.00 3.54 2.04 -1.26 -4.66 115.26 114.19 3h1j n ASN 31 Ca 0.00 0.75 0.00 0.00 -0.44 0.00 0.00 54.58 54.89 3h1j n ASN 31 Cb 0.00 -0.34 0.00 0.00 -2.53 0.00 0.00 39.78 36.91 3h1j n ASN 31 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3h1j n GLY 32 N -1.68 0.92 3.65 4.83 0.00 -0.97 -4.21 105.19 107.73 3h1j n GLY 32 Ca 0.30 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.90 3h1j n GLY 32 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h1j s LEU 33 N 0.00 4.15 0.29 0.99 2.96 -0.76 -4.42 118.68 121.89 3h1j s LEU 33 Ca 0.00 1.96 -0.14 0.00 -0.22 0.00 0.00 54.13 55.73 3h1j s LEU 33 Cb 0.00 -3.53 -0.09 0.00 0.50 0.00 0.00 46.19 43.07 3h1j s LEU 33 CO 0.00 -1.04 0.69 -0.63 -1.32 0.00 0.00 176.35 174.06 3h1j s ILE 34 N 4.44 4.72 -0.14 6.68 1.01 -1.12 -3.47 121.20 133.33 3h1j s ILE 34 Ca 0.71 0.88 -0.04 0.00 0.00 0.00 0.00 60.65 62.20 3h1j s ILE 34 Cb -0.29 -3.63 0.05 0.00 0.01 0.00 0.00 42.46 38.60 3h1j s ILE 34 CO 0.28 -0.12 0.06 -0.63 0.00 0.00 0.00 174.94 174.53 3h1j s ILE 35 N -1.90 0.10 -0.11 2.92 1.01 -0.64 -0.25 121.20 122.32 3h1j s ILE 35 Ca 0.52 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 61.04 3h1j s ILE 35 Cb -0.11 -0.61 0.02 0.00 0.01 0.00 0.00 42.46 41.77 3h1j s ILE 35 CO 0.18 -0.13 -0.11 0.00 0.00 0.00 0.00 174.94 174.89 3h1j s ALA 36 N 2.06 1.49 0.48 9.38 0.00 -1.16 -1.11 121.76 132.90 3h1j s ALA 36 Ca 0.02 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.35 3h1j s ALA 36 Cb -0.15 -0.89 -0.00 0.00 0.00 0.00 0.00 23.12 22.07 3h1j s ALA 36 CO -0.07 -0.30 0.04 -1.13 0.00 0.00 0.00 175.76 174.30 3h1j n SER 37 N 4.67 2.83 -3.15 0.00 3.41 -1.21 -1.41 113.62 118.76 3h1j n SER 37 Ca -0.16 -3.23 0.06 0.00 -0.26 0.00 0.00 58.87 55.28 3h1j n SER 37 Cb 0.50 0.54 -0.00 0.00 -0.26 0.00 0.00 64.21 64.99 3h1j n SER 37 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3h1j s LEU 38 N 0.00 -0.38 -0.21 1.04 2.96 -1.19 -3.45 118.68 117.45 3h1j s LEU 38 Ca 0.06 0.07 -0.29 0.00 -0.22 0.00 0.00 54.13 53.75 3h1j s LEU 38 Cb 0.00 1.25 -0.01 0.00 0.50 0.00 0.00 46.19 47.93 3h1j s LEU 38 CO 0.04 -0.07 1.33 -0.70 -1.32 0.00 0.00 176.35 175.63 3h1j s GLU 39 N 2.96 4.08 -0.07 1.98 2.56 -0.91 -1.90 118.70 127.40 3h1j s GLU 39 Ca 0.23 1.55 0.10 0.00 0.00 0.00 0.00 54.97 56.84 3h1j s GLU 39 Cb -0.03 -3.84 0.15 0.00 2.00 0.00 0.00 34.13 32.41 3h1j s GLU 39 CO -0.21 -0.91 1.08 0.27 -0.56 0.00 0.00 175.26 174.94 3h1j n ASN 40 N 7.16 2.21 -0.68 -1.70 6.94 -1.26 -4.44 115.26 123.48 3h1j n ASN 40 Ca 0.15 -2.55 -0.05 0.00 -0.02 0.00 0.00 54.58 52.10 3h1j n ASN 40 Cb 0.45 -0.22 -0.02 0.00 -2.36 0.00 0.00 39.78 37.63 3h1j n ASN 40 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 3h1j n PHE 41 N -0.95 -0.27 -1.75 -2.53 3.01 -1.26 -4.90 117.46 108.81 3h1j n PHE 41 Ca 0.08 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.15 3h1j n PHE 41 Cb 0.45 -1.75 0.03 0.00 -0.01 0.00 0.00 39.48 38.21 3h1j n PHE 41 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 3h1j n SER 42 N 0.42 3.00 0.00 4.37 2.88 -1.26 -4.81 113.62 118.22 3h1j n SER 42 Ca -0.05 1.05 0.05 0.00 -1.33 0.00 0.00 58.87 58.58 3h1j n SER 42 Cb 0.29 -1.59 0.26 0.00 -0.75 0.00 0.00 64.21 62.42 3h1j n SER 42 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3h1j n PRO 43 N -0.62 0.24 -4.22 -1.46 -0.04 -1.26 -4.60 135.00 123.03 3h1j n PRO 43 Ca 0.08 0.06 -0.18 0.00 -0.04 0.00 0.00 63.50 63.42 3h1j n PRO 43 Cb 0.43 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.24 3h1j n PRO 43 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h1j s ALA 44 N -2.16 0.59 0.22 0.55 0.00 -1.26 -2.09 121.76 117.62 3h1j s ALA 44 Ca 0.12 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.91 3h1j s ALA 44 Cb 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 3h1j s ALA 44 CO 0.11 0.10 0.35 -1.12 0.00 0.00 0.00 175.76 175.21 3h1j s SER 45 N 0.16 6.33 -0.35 0.00 0.01 -0.29 -4.61 113.70 114.95 3h1j s SER 45 Ca -0.02 0.13 0.03 0.00 1.31 0.00 0.00 55.95 57.40 3h1j s SER 45 Cb -0.06 -1.89 0.16 0.00 0.21 0.00 0.00 66.02 64.43 3h1j s SER 45 CO -0.00 -0.05 0.39 -0.60 0.41 0.00 0.00 173.24 173.39 3h1j s ARG 46 N -3.79 0.58 0.58 12.44 3.52 -0.92 -1.91 118.95 129.44 3h1j s ARG 46 Ca 0.35 -0.54 -0.06 0.00 -0.13 0.00 0.00 55.73 55.34 3h1j s ARG 46 Cb -0.10 -0.57 0.00 0.00 -1.56 0.00 0.00 34.95 32.73 3h1j s ARG 46 CO 0.29 -1.15 0.90 0.42 -0.81 0.00 0.00 175.30 174.96 3h1j s ILE 47 N 1.78 3.88 -0.30 4.11 1.09 -1.12 -2.78 121.20 127.86 3h1j s ILE 47 Ca 0.15 0.10 -0.16 0.00 -1.10 0.00 0.00 60.65 59.63 3h1j s ILE 47 Cb -0.14 -3.53 0.19 0.00 -1.06 0.00 0.00 42.46 37.93 3h1j s ILE 47 CO -0.12 -0.56 1.19 -0.83 -0.10 0.00 0.00 174.94 174.52 3h1j s GLY 48 N -4.27 0.47 -0.69 6.18 0.00 -0.53 -2.14 107.32 106.34 3h1j s GLY 48 Ca 0.53 3.67 -0.21 0.00 0.00 0.00 0.00 44.72 48.71 3h1j s GLY 48 CO 0.46 2.74 0.94 0.14 0.00 0.00 0.00 173.10 177.38 3h1j s VAL 49 N 1.14 4.50 0.02 1.40 1.01 0.04 -1.55 120.40 126.96 3h1j s VAL 49 Ca -0.08 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 60.91 3h1j s VAL 49 Cb -0.03 -4.66 -0.04 0.00 0.00 0.00 0.00 36.38 31.65 3h1j s VAL 49 CO -0.11 -1.40 0.89 -0.36 0.00 0.00 0.00 175.10 174.12 3h1j s PHE 50 N 3.53 3.69 0.14 5.22 0.40 0.39 -2.33 117.98 129.02 3h1j s PHE 50 Ca 0.22 1.61 0.08 0.00 -0.60 0.00 0.00 56.93 58.24 3h1j s PHE 50 Cb -0.16 -3.00 -0.04 0.00 0.51 0.00 0.00 43.02 40.33 3h1j s PHE 50 CO 0.06 0.11 -0.19 0.42 0.70 0.00 0.00 175.22 176.31 3h1j s ILE 51 N 0.55 1.78 -0.37 0.64 1.01 0.10 -1.00 121.20 123.93 3h1j s ILE 51 Ca 0.46 -1.78 -0.02 0.00 0.00 0.00 0.00 60.65 59.31 3h1j s ILE 51 Cb -0.21 -1.74 0.13 0.00 0.01 0.00 0.00 42.46 40.65 3h1j s ILE 51 CO 0.26 -0.22 2.42 0.29 0.00 0.00 0.00 174.94 177.68 3h1j n LYS 52 N 0.58 2.08 -3.19 2.79 5.02 -0.30 -2.14 118.16 123.00 3h1j n LYS 52 Ca -0.15 -1.90 -0.20 0.00 -2.02 0.00 0.00 58.31 54.04 3h1j n LYS 52 Cb 0.56 -1.87 0.02 0.00 -0.02 0.00 0.00 35.03 33.73 3h1j n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h1j s ALA 53 N -1.67 4.54 0.00 7.82 0.00 -1.26 -4.89 121.76 126.29 3h1j s ALA 53 Ca 0.45 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.55 3h1j s ALA 53 Cb 0.31 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 22.06 3h1j s ALA 53 CO -0.10 -0.54 0.00 0.41 0.00 0.00 0.00 175.76 175.53 3h1j n GLY 54 N -1.97 2.52 0.26 0.00 0.00 -1.26 -0.46 105.19 104.29 3h1j n GLY 54 Ca 0.10 -1.22 0.18 0.00 0.00 0.00 0.00 46.02 45.07 3h1j n GLY 54 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h1j h SER 55 N 0.00 0.00 1.12 1.61 4.64 -1.51 -2.55 113.55 116.86 3h1j h SER 55 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 3h1j h SER 55 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3h1j h SER 55 CO 0.00 0.00 -0.20 0.08 -0.87 0.00 0.00 176.83 175.84 3h1j h ARG 56 N 0.00 0.00 -0.00 4.77 0.11 -1.25 -2.65 114.38 115.36 3h1j h ARG 56 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3h1j h ARG 56 Cb 0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.16 3h1j h ARG 56 CO 0.00 0.20 -0.01 0.66 0.10 0.00 0.00 179.97 180.92 3h1j n TYR 57 N -3.29 0.00 -1.77 4.08 4.02 -0.96 -4.28 117.16 114.95 3h1j n TYR 57 Ca 0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.59 3h1j n TYR 57 Cb 0.46 -0.18 0.03 0.00 -0.02 0.00 0.00 39.34 39.63 3h1j n TYR 57 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3h1j s GLU 58 N -2.36 3.25 0.31 -0.72 2.02 -1.00 -5.02 118.70 115.18 3h1j s GLU 58 Ca 0.35 0.92 0.06 0.00 0.02 0.00 0.00 54.97 56.32 3h1j s GLU 58 Cb 0.21 -2.03 -0.06 0.00 0.10 0.00 0.00 34.13 32.34 3h1j s GLU 58 CO 0.43 -0.85 -0.02 0.99 0.02 0.00 0.00 175.26 175.83 3h1j s THR 59 N -3.00 1.61 0.39 3.63 2.01 -1.26 -4.82 115.64 114.20 3h1j s THR 59 Ca 0.58 -2.08 0.18 0.00 0.31 0.00 0.00 61.69 60.67 3h1j s THR 59 Cb -0.13 -2.62 0.38 0.00 0.01 0.00 0.00 72.50 70.14 3h1j s THR 59 CO 0.51 -0.18 1.78 0.00 -0.69 0.00 0.00 174.62 176.05 3h1j h THR 60 N 2.15 0.55 -0.68 -0.82 1.03 -1.99 -1.06 112.91 112.09 3h1j h THR 60 Ca -0.41 -0.14 0.04 0.00 -0.01 0.00 0.00 66.41 65.88 3h1j h THR 60 Cb 1.24 0.10 -0.05 0.00 -1.07 0.00 0.00 68.15 68.37 3h1j h THR 60 CO 0.70 0.08 0.42 0.00 -0.01 0.00 0.00 175.52 176.70 3h1j h ALA 61 N 1.62 0.89 -0.04 0.00 0.00 -2.02 -3.25 119.26 116.46 3h1j h ALA 61 Ca 0.58 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.47 3h1j h ALA 61 Cb 1.44 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3h1j h ALA 61 CO -0.29 0.17 -0.05 0.27 0.00 0.00 0.00 179.25 179.35 3h1j n ASN 62 N -4.70 2.51 -3.82 0.00 6.94 -0.56 -5.07 115.26 110.57 3h1j n ASN 62 Ca 0.07 -3.17 -0.51 0.00 -0.02 0.00 0.00 54.58 50.95 3h1j n ASN 62 Cb 0.10 -0.46 -0.07 0.00 -2.36 0.00 0.00 39.78 36.99 3h1j n ASN 62 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3h1j n LEU 63 N -1.28 0.15 0.00 -4.53 4.77 -0.51 -0.80 117.00 114.80 3h1j n LEU 63 Ca 0.17 0.98 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 3h1j n LEU 63 Cb 0.69 -0.77 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3h1j n LEU 63 CO 0.03 -1.47 0.00 0.61 -1.33 0.00 0.00 177.39 175.23 3h1j n GLY 64 N 1.58 3.12 0.38 -0.72 0.00 -1.26 -4.71 105.19 103.58 3h1j n GLY 64 Ca 0.18 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.40 3h1j n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1j h THR 65 N 0.00 0.55 -0.70 2.61 1.03 -1.38 0.21 112.91 115.23 3h1j h THR 65 Ca 0.00 -0.17 0.06 0.00 -0.01 0.00 0.00 66.41 66.29 3h1j h THR 65 Cb 0.00 0.01 -0.05 0.00 -1.07 0.00 0.00 68.15 67.03 3h1j h THR 65 CO 0.00 0.09 0.41 0.00 -0.01 0.00 0.00 175.52 176.01 3h1j h ALA 66 N 1.66 0.94 0.44 0.00 0.00 -1.90 0.41 119.26 120.82 3h1j h ALA 66 Ca 0.61 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.50 3h1j h ALA 66 Cb 1.34 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3h1j h ALA 66 CO -0.36 0.10 -0.21 1.25 0.00 0.00 0.00 179.25 180.03 3h1j h HIS 67 N 0.75 -0.55 0.00 0.00 6.17 -0.86 -2.33 115.15 118.33 3h1j h HIS 67 Ca 0.31 -0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.37 3h1j h HIS 67 Cb 0.17 0.18 -0.00 0.00 2.52 0.00 0.00 27.41 30.28 3h1j h HIS 67 CO -0.07 -0.30 -0.01 1.25 0.71 0.00 0.00 177.93 179.51 3h1j h LEU 68 N -0.68 0.00 -0.63 0.26 5.85 -1.11 0.61 115.31 119.61 3h1j h LEU 68 Ca -0.06 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.52 3h1j h LEU 68 Cb 0.50 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 3h1j h LEU 68 CO 0.10 0.01 -0.40 0.25 -0.34 0.00 0.00 178.44 178.06 3h1j h LEU 69 N 0.00 0.66 -1.50 2.25 5.85 -0.72 -2.50 115.31 119.36 3h1j h LEU 69 Ca -0.00 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.43 3h1j h LEU 69 Cb 0.03 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3h1j h LEU 69 CO 0.00 0.99 0.33 -0.09 -0.34 0.00 0.00 178.44 179.32 3h1j h ARG 70 N 0.51 0.66 -0.23 1.25 2.43 -0.32 -1.21 114.38 117.47 3h1j h ARG 70 Ca 0.04 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3h1j h ARG 70 Cb 0.92 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 3h1j h ARG 70 CO 0.08 0.44 0.00 1.28 -1.51 0.00 0.00 179.97 180.27 3h1j n LEU 71 N -4.46 2.28 0.02 3.80 4.77 -1.07 -3.90 117.00 118.45 3h1j n LEU 71 Ca 0.04 -0.96 0.12 0.00 -0.03 0.00 0.00 56.01 55.19 3h1j n LEU 71 Cb 0.06 -0.15 0.21 0.00 -2.33 0.00 0.00 43.42 41.21 3h1j n LEU 71 CO 0.36 0.48 0.39 0.00 -1.33 0.00 0.00 177.39 177.28 3h1j n ALA 72 N 0.73 3.31 -0.41 -1.18 0.00 -0.46 -4.37 120.51 118.14 3h1j n ALA 72 Ca 0.17 -0.32 0.35 0.00 0.00 0.00 0.00 53.44 53.64 3h1j n ALA 72 Cb 0.43 -1.13 0.60 0.00 0.00 0.00 0.00 19.45 19.35 3h1j n ALA 72 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3h1j n SER 73 N -1.74 0.21 -0.76 0.00 3.41 -1.24 0.26 113.62 113.76 3h1j n SER 73 Ca 0.04 1.28 0.10 0.00 -0.26 0.00 0.00 58.87 60.04 3h1j n SER 73 Cb 0.38 -0.63 0.30 0.00 -0.26 0.00 0.00 64.21 64.00 3h1j n SER 73 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 3h1j n PRO 74 N -4.57 1.99 -1.93 4.33 -0.04 -1.26 -4.92 135.00 128.59 3h1j n PRO 74 Ca 0.36 -1.50 -0.31 0.00 -0.04 0.00 0.00 63.50 62.00 3h1j n PRO 74 Cb 1.38 -1.42 0.01 0.00 -0.04 0.00 0.00 33.50 33.43 3h1j n PRO 74 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3h1j s LEU 75 N -1.45 3.32 0.55 1.53 1.43 0.14 -4.45 118.68 119.75 3h1j s LEU 75 Ca 0.33 1.54 -0.20 0.00 -1.03 0.00 0.00 54.13 54.78 3h1j s LEU 75 Cb 0.18 -4.49 -0.06 0.00 0.03 0.00 0.00 46.19 41.85 3h1j s LEU 75 CO 0.27 -0.98 1.02 0.35 0.23 0.00 0.00 176.35 177.24 3h1j n THR 76 N -2.51 3.40 -4.45 5.49 -2.24 -1.26 -4.58 114.28 108.13 3h1j n THR 76 Ca 0.07 -0.50 -0.22 0.00 -2.27 0.00 0.00 64.05 61.13 3h1j n THR 76 Cb 0.54 -1.22 -0.10 0.00 -2.10 0.00 0.00 70.33 67.44 3h1j n THR 76 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3h1j s THR 77 N -1.43 1.86 -0.13 4.28 -4.23 0.72 -2.71 115.64 113.99 3h1j s THR 77 Ca 0.72 -2.18 0.14 0.00 -1.18 0.00 0.00 61.69 59.19 3h1j s THR 77 Cb -0.45 -2.43 0.14 0.00 1.34 0.00 0.00 72.50 71.10 3h1j s THR 77 CO 0.50 -0.32 1.34 0.29 -0.54 0.00 0.00 174.62 175.88 3h1j n LYS 78 N -0.61 0.09 0.00 3.99 5.02 0.26 -2.36 118.16 124.55 3h1j n LYS 78 Ca -0.06 0.56 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 3h1j n LYS 78 Cb 0.63 -2.00 0.00 0.00 -0.02 0.00 0.00 35.03 33.63 3h1j n LYS 78 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h1j n GLY 79 N -1.29 0.88 2.83 0.72 0.00 -1.26 -5.04 105.19 102.03 3h1j n GLY 79 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 3h1j n GLY 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1j s ALA 80 N -0.55 -0.06 0.62 4.61 0.00 -1.00 -5.11 121.76 120.27 3h1j s ALA 80 Ca 0.00 0.47 -0.14 0.00 0.00 0.00 0.00 51.96 52.28 3h1j s ALA 80 Cb 0.00 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.67 3h1j s ALA 80 CO 0.00 -0.21 1.05 -1.54 0.00 0.00 0.00 175.76 175.06 3h1j s SER 81 N 1.36 5.69 0.23 0.00 1.04 -1.26 -0.20 113.70 120.55 3h1j s SER 81 Ca -0.06 1.74 -0.11 0.00 0.48 0.00 0.00 55.95 57.99 3h1j s SER 81 Cb -0.12 -2.52 0.31 0.00 0.10 0.00 0.00 66.02 63.79 3h1j s SER 81 CO -0.04 -1.23 1.62 -1.28 0.98 0.00 0.00 173.24 173.28 3h1j h SER 82 N 0.09 -0.59 0.48 7.02 0.87 -1.81 0.16 113.55 119.77 3h1j h SER 82 Ca -0.46 0.21 -0.01 0.00 -1.23 0.00 0.00 61.79 60.29 3h1j h SER 82 Cb 1.22 0.42 -0.02 0.00 -0.44 0.00 0.00 62.40 63.57 3h1j h SER 82 CO 0.57 -0.22 -0.46 0.15 -0.53 0.00 0.00 176.83 176.34 3h1j h PHE 83 N 0.02 -1.28 -0.23 2.24 3.57 -1.91 -2.89 116.94 116.47 3h1j h PHE 83 Ca 0.35 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.87 3h1j h PHE 83 Cb 0.56 0.49 -0.01 0.00 2.79 0.00 0.00 35.95 39.78 3h1j h PHE 83 CO -0.53 -0.62 0.15 -0.09 -2.23 0.00 0.00 178.31 174.99 3h1j h ARG 84 N -0.94 0.25 0.39 1.11 2.43 -1.67 0.52 114.38 116.47 3h1j h ARG 84 Ca -0.06 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.08 3h1j h ARG 84 Cb 0.81 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 3h1j h ARG 84 CO -0.05 0.16 -0.19 0.82 -1.51 0.00 0.00 179.97 179.21 3h1j h ILE 85 N 0.26 0.62 -0.17 1.20 2.04 -0.52 0.82 117.51 121.75 3h1j h ILE 85 Ca 0.09 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.87 3h1j h ILE 85 Cb 0.04 0.62 -0.00 0.00 -0.74 0.00 0.00 36.82 36.74 3h1j h ILE 85 CO -0.02 0.00 -0.20 0.74 0.00 0.00 0.00 178.15 178.67 3h1j h THR 86 N -0.52 1.34 -0.53 -0.27 2.02 -1.29 -2.49 112.91 111.17 3h1j h THR 86 Ca -0.05 -1.38 -0.05 0.00 0.77 0.00 0.00 66.41 65.69 3h1j h THR 86 Cb 0.40 1.86 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 3h1j h THR 86 CO 0.09 0.41 0.15 0.03 0.37 0.00 0.00 175.52 176.57 3h1j h ARG 87 N 0.07 0.84 0.13 6.66 2.47 -0.87 -2.24 114.38 121.44 3h1j h ARG 87 Ca 0.02 -0.19 0.01 0.00 -1.26 0.00 0.00 59.98 58.56 3h1j h ARG 87 Cb 0.75 -0.12 -0.03 0.00 -1.65 0.00 0.00 29.97 28.93 3h1j h ARG 87 CO 0.05 0.79 -0.24 0.78 0.56 0.00 0.00 179.97 181.91 3h1j h GLY 88 N 0.74 -0.45 0.95 0.04 0.00 0.66 -0.19 103.07 104.83 3h1j h GLY 88 Ca 0.17 0.28 -0.00 0.00 0.00 0.00 0.00 47.33 47.78 3h1j h GLY 88 CO -0.00 -0.21 0.09 -2.22 0.00 0.00 0.00 176.54 174.20 3h1j h ILE 89 N -0.45 1.08 0.00 2.60 2.04 -1.45 -2.74 117.51 118.60 3h1j h ILE 89 Ca 0.02 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.64 3h1j h ILE 89 Cb 0.46 0.95 -0.00 0.00 -0.74 0.00 0.00 36.82 37.49 3h1j h ILE 89 CO -0.12 0.08 -0.11 -0.33 0.00 0.00 0.00 178.15 177.66 3h1j h GLU 90 N 0.16 0.00 -0.22 2.37 5.08 -1.31 -0.01 114.58 120.66 3h1j h GLU 90 Ca 0.05 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.46 3h1j h GLU 90 Cb 0.05 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3h1j h GLU 90 CO -0.01 0.11 0.15 0.00 -1.00 0.00 0.00 179.01 178.27 3h1j h ALA 91 N 1.89 2.10 -0.18 3.43 0.00 -0.70 -2.24 119.26 123.55 3h1j h ALA 91 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h1j h ALA 91 Cb 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3h1j h ALA 91 CO 0.01 -0.14 0.00 1.33 0.00 0.00 0.00 179.25 180.45 3h1j n VAL 92 N -4.49 0.39 -2.14 0.00 0.24 -0.91 -4.96 118.33 106.46 3h1j n VAL 92 Ca 0.02 -0.69 -0.03 0.00 -2.04 0.00 0.00 64.34 61.60 3h1j n VAL 92 Cb 0.23 0.99 0.00 0.00 -1.47 0.00 0.00 33.84 33.59 3h1j n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3h1j n GLY 93 N 0.79 0.34 4.00 7.63 0.00 -0.84 -4.72 105.19 112.40 3h1j n GLY 93 Ca 0.11 -0.75 -0.21 0.00 0.00 0.00 0.00 46.02 45.17 3h1j n GLY 93 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h1j s GLY 94 N -2.91 1.78 0.06 -0.02 0.00 -0.06 -4.70 107.32 101.47 3h1j s GLY 94 Ca 0.01 -1.78 -0.03 0.00 0.00 0.00 0.00 44.72 42.92 3h1j s GLY 94 CO 0.01 -1.34 0.03 -1.35 0.00 0.00 0.00 173.10 170.45 3h1j s SER 95 N -4.62 0.38 -0.05 1.64 1.04 -0.71 -4.44 113.70 106.95 3h1j s SER 95 Ca 0.62 -0.89 -0.02 0.00 0.48 0.00 0.00 55.95 56.15 3h1j s SER 95 Cb -0.07 0.23 0.04 0.00 0.10 0.00 0.00 66.02 66.32 3h1j s SER 95 CO 0.40 -0.62 0.10 -0.22 0.98 0.00 0.00 173.24 173.88 3h1j s LEU 96 N -2.83 0.60 0.07 2.42 2.96 -1.26 -2.65 118.68 118.00 3h1j s LEU 96 Ca 0.05 0.19 -0.02 0.00 -0.22 0.00 0.00 54.13 54.13 3h1j s LEU 96 Cb 0.06 0.13 -0.04 0.00 0.50 0.00 0.00 46.19 46.85 3h1j s LEU 96 CO -0.10 -0.18 0.01 -0.44 -1.32 0.00 0.00 176.35 174.33 3h1j s SER 97 N 1.49 0.42 -0.08 3.68 0.01 -1.02 -5.03 113.70 113.17 3h1j s SER 97 Ca -0.05 -0.99 -0.02 0.00 1.31 0.00 0.00 55.95 56.20 3h1j s SER 97 Cb -0.12 0.23 0.04 0.00 0.21 0.00 0.00 66.02 66.37 3h1j s SER 97 CO -0.05 -0.63 0.04 -0.69 0.41 0.00 0.00 173.24 172.32 3h1j s VAL 98 N -3.93 0.14 0.13 3.43 1.01 -1.26 -2.12 120.40 117.79 3h1j s VAL 98 Ca 0.09 0.14 0.08 0.00 0.00 0.00 0.00 61.98 62.29 3h1j s VAL 98 Cb 0.08 -0.43 -0.04 0.00 0.00 0.00 0.00 36.38 35.98 3h1j s VAL 98 CO -0.09 0.12 -0.10 -0.31 0.00 0.00 0.00 175.10 174.72 3h1j s TYR 99 N 2.06 2.70 -0.27 5.22 1.51 -0.78 -4.95 117.35 122.84 3h1j s TYR 99 Ca 0.04 -0.18 -0.21 0.00 -1.01 0.00 0.00 57.07 55.71 3h1j s TYR 99 Cb -0.13 -1.39 0.07 0.00 -0.11 0.00 0.00 41.96 40.40 3h1j s TYR 99 CO -0.05 0.45 0.69 -1.54 -1.11 0.00 0.00 175.55 173.99 3h1j s SER 100 N -2.39 -0.82 0.45 2.29 1.04 -1.26 0.28 113.70 113.29 3h1j s SER 100 Ca 0.22 1.44 0.07 0.00 0.48 0.00 0.00 55.95 58.17 3h1j s SER 100 Cb -0.10 1.40 0.07 0.00 0.10 0.00 0.00 66.02 67.49 3h1j s SER 100 CO 0.14 -0.24 0.60 0.35 0.98 0.00 0.00 173.24 175.07 3h1j n THR 101 N 3.41 0.00 0.32 2.02 -2.24 0.59 -4.94 114.28 113.44 3h1j n THR 101 Ca -0.17 -1.53 0.19 0.00 -2.27 0.00 0.00 64.05 60.27 3h1j n THR 101 Cb 0.57 -0.58 1.00 0.00 -2.10 0.00 0.00 70.33 69.22 3h1j n THR 101 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3h1j h ARG 102 N 0.00 0.00 0.00 -0.78 -0.00 -1.96 -3.11 114.38 108.53 3h1j h ARG 102 Ca -0.22 0.00 -0.16 0.00 -0.50 0.00 0.00 59.98 59.11 3h1j h ARG 102 Cb 0.98 0.00 -0.32 0.00 0.00 0.00 0.00 29.97 30.63 3h1j h ARG 102 CO 0.31 0.00 -0.88 -0.85 0.00 0.00 0.00 179.97 178.56 3h1j n GLU 103 N -3.11 0.00 -3.66 0.04 0.28 -1.26 -1.32 120.64 111.61 3h1j n GLU 103 Ca -0.02 -1.76 -0.07 0.00 -0.16 0.00 0.00 57.16 55.16 3h1j n GLU 103 Cb 0.23 0.04 -0.08 0.00 1.43 0.00 0.00 31.44 33.06 3h1j n GLU 103 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 177.13 177.18 3h1j s LYS 104 N 0.00 0.50 -0.12 3.44 2.20 0.40 -4.34 119.74 121.81 3h1j s LYS 104 Ca 0.26 1.14 0.02 0.00 -0.36 0.00 0.00 55.97 57.03 3h1j s LYS 104 Cb 0.30 0.34 -0.00 0.00 -1.51 0.00 0.00 37.83 36.96 3h1j s LYS 104 CO -0.13 -0.19 -0.19 -1.64 -0.36 0.00 0.00 175.35 172.84 3h1j s MET 105 N 2.16 3.17 -0.33 4.03 -1.94 -0.91 -0.30 119.30 125.18 3h1j s MET 105 Ca -0.07 -0.80 0.02 0.00 -1.71 0.00 0.00 55.69 53.14 3h1j s MET 105 Cb -0.09 -2.47 0.10 0.00 2.01 0.00 0.00 34.83 34.38 3h1j s MET 105 CO -0.16 0.13 0.07 0.99 -0.01 0.00 0.00 175.02 176.03 3h1j s THR 106 N 0.50 1.76 0.34 2.05 2.01 0.14 0.02 115.64 122.46 3h1j s THR 106 Ca -0.13 -1.99 -0.18 0.00 0.31 0.00 0.00 61.69 59.71 3h1j s THR 106 Cb -0.17 -2.31 -0.09 0.00 0.01 0.00 0.00 72.50 69.94 3h1j s THR 106 CO 0.05 -0.62 0.80 -0.31 -0.69 0.00 0.00 174.62 173.85 3h1j s TYR 107 N 1.17 3.41 -0.30 4.92 1.51 -0.98 -1.87 117.35 125.20 3h1j s TYR 107 Ca 0.10 1.37 -0.20 0.00 -1.01 0.00 0.00 57.07 57.33 3h1j s TYR 107 Cb -0.18 -2.65 0.20 0.00 -0.11 0.00 0.00 41.96 39.22 3h1j s TYR 107 CO -0.14 0.08 1.34 0.00 -1.11 0.00 0.00 175.55 175.71 3h1j s VAL 109 N 0.61 2.45 -0.28 0.00 -7.23 -0.91 -2.43 120.40 112.61 3h1j s VAL 109 Ca -0.02 -1.05 -0.20 0.00 -1.81 0.00 0.00 61.98 58.91 3h1j s VAL 109 Cb -0.03 -2.49 0.09 0.00 0.56 0.00 0.00 36.38 34.51 3h1j s VAL 109 CO -0.12 0.00 0.80 -0.70 -0.31 0.00 0.00 175.10 174.77 3h1j s GLU 110 N -4.51 0.66 0.15 4.82 2.12 -1.08 -2.78 118.70 118.08 3h1j s GLU 110 Ca 0.57 0.97 -0.25 0.00 0.36 0.00 0.00 54.97 56.62 3h1j s GLU 110 Cb -0.07 0.22 0.07 0.00 0.26 0.00 0.00 34.13 34.61 3h1j s GLU 110 CO 0.35 -0.11 0.97 0.00 -0.54 0.00 0.00 175.26 175.94 3h1j n LEU 112 N -0.48 5.64 -0.27 0.00 4.77 -1.26 -1.13 117.00 124.27 3h1j n LEU 112 Ca -0.06 0.90 -0.09 0.00 -0.03 0.00 0.00 56.01 56.73 3h1j n LEU 112 Cb 0.61 -1.55 -0.08 0.00 -2.33 0.00 0.00 43.42 40.07 3h1j n LEU 112 CO 0.14 -0.87 0.49 0.03 -1.33 0.00 0.00 177.39 175.85 3h1j h ARG 113 N 0.94 -0.08 0.00 3.23 3.08 -1.74 -2.15 114.38 117.66 3h1j h ARG 113 Ca -0.51 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.55 3h1j h ARG 113 Cb 1.33 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.39 3h1j h ARG 113 CO 0.55 -0.05 0.00 -0.25 -1.07 0.00 0.00 179.97 179.15 3h1j n ASP 114 N -4.74 0.00 0.00 7.04 8.00 -1.26 -1.64 116.55 123.94 3h1j n ASP 114 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 3h1j n ASP 114 Cb 0.22 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 3h1j n ASP 114 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3h1j n HIS 115 N -0.41 0.00 -0.44 1.24 8.25 -0.81 -4.84 115.22 118.21 3h1j n HIS 115 Ca 0.00 0.00 0.38 0.00 -0.26 0.00 0.00 57.72 57.84 3h1j n HIS 115 Cb 0.00 0.00 0.72 0.00 1.12 0.00 0.00 29.99 31.83 3h1j n HIS 115 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3h1j h VAL 116 N 0.40 0.26 0.78 1.59 2.07 -1.43 0.09 116.25 120.02 3h1j h VAL 116 Ca 0.00 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 3h1j h VAL 116 Cb 0.20 0.18 0.01 0.00 -1.52 0.00 0.00 31.29 30.16 3h1j h VAL 116 CO 0.00 0.01 -0.38 0.44 0.02 0.00 0.00 177.57 177.67 3h1j h ASP 117 N 0.07 -0.89 -0.53 0.57 3.32 -1.88 -1.40 116.42 115.68 3h1j h ASP 117 Ca 0.72 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.84 3h1j h ASP 117 Cb 2.60 0.23 -0.07 0.00 0.22 0.00 0.00 39.33 42.32 3h1j h ASP 117 CO -0.13 -0.53 -0.33 0.74 -1.72 0.00 0.00 179.24 177.26 3h1j h THR 118 N -1.26 0.00 0.00 0.35 2.02 -1.35 0.81 112.91 113.48 3h1j h THR 118 Ca -0.11 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 3h1j h THR 118 Cb 0.81 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.22 3h1j h THR 118 CO 0.18 0.00 -0.03 -0.37 0.37 0.00 0.00 175.52 175.67 3h1j h VAL 119 N -0.03 0.24 -0.19 3.16 -1.51 -1.55 -3.07 116.25 113.31 3h1j h VAL 119 Ca 0.09 -0.21 -0.02 0.00 -1.23 0.00 0.00 66.70 65.33 3h1j h VAL 119 Cb 0.25 1.16 -0.01 0.00 -2.13 0.00 0.00 31.29 30.56 3h1j h VAL 119 CO -0.51 0.03 0.04 -0.03 -1.23 0.00 0.00 177.57 175.87 3h1j h MET 120 N 0.00 0.30 -0.66 5.19 -1.53 0.33 -1.49 114.93 117.07 3h1j h MET 120 Ca -0.00 -0.08 0.14 0.00 -3.44 0.00 0.00 59.70 56.32 3h1j h MET 120 Cb 0.16 -0.04 -0.10 0.00 -0.55 0.00 0.00 31.60 31.07 3h1j h MET 120 CO 0.00 0.45 0.13 1.49 0.14 0.00 0.00 176.91 179.12 3h1j h GLU 121 N 0.10 0.23 -0.20 0.39 4.81 -1.42 0.57 114.58 119.06 3h1j h GLU 121 Ca 0.06 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 3h1j h GLU 121 Cb 0.29 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3h1j h GLU 121 CO 0.00 0.15 -0.01 1.88 -0.73 0.00 0.00 179.01 180.30 3h1j h TYR 122 N 0.24 0.40 -0.49 0.92 0.99 -1.66 0.57 116.97 117.94 3h1j h TYR 122 Ca 0.36 -0.07 0.02 0.00 2.00 0.00 0.00 58.73 61.04 3h1j h TYR 122 Cb 0.58 -0.10 -0.03 0.00 1.00 0.00 0.00 36.73 38.17 3h1j h TYR 122 CO -0.28 0.57 0.29 1.25 -0.00 0.00 0.00 178.16 180.00 3h1j h LEU 123 N 0.11 0.47 0.75 3.88 5.85 -0.14 0.82 115.31 127.04 3h1j h LEU 123 Ca 0.06 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 3h1j h LEU 123 Cb 0.42 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.37 3h1j h LEU 123 CO 0.01 0.33 -0.36 0.25 -0.34 0.00 0.00 178.44 178.34 3h1j h LEU 124 N 0.58 -0.85 -0.97 2.25 5.85 0.26 -2.48 115.31 119.95 3h1j h LEU 124 Ca 0.20 0.03 0.27 0.00 0.84 0.00 0.00 57.88 59.22 3h1j h LEU 124 Cb 0.03 0.22 -0.14 0.00 0.37 0.00 0.00 40.66 41.14 3h1j h LEU 124 CO -0.09 -0.56 0.49 0.78 -0.34 0.00 0.00 178.44 178.72 3h1j h ASN 125 N -1.10 0.44 -0.15 1.25 2.35 0.31 -0.41 115.58 118.26 3h1j h ASN 125 Ca -0.10 0.17 -0.01 0.00 -0.55 0.00 0.00 56.30 55.81 3h1j h ASN 125 Cb 0.77 0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.27 3h1j h ASN 125 CO 0.17 -0.06 0.04 0.58 -1.65 0.00 0.00 177.43 176.51 3h1j h VAL 126 N 0.38 1.19 0.00 2.81 2.07 -0.75 0.49 116.25 122.44 3h1j h VAL 126 Ca 0.66 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.58 3h1j h VAL 126 Cb 1.38 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 32.45 3h1j h VAL 126 CO -0.57 0.18 -0.12 0.71 0.02 0.00 0.00 177.57 177.79 3h1j h THR 127 N 0.05 0.00 0.00 2.57 1.35 -0.77 -3.37 112.91 112.75 3h1j h THR 127 Ca 0.05 -0.62 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 3h1j h THR 127 Cb 0.24 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.21 3h1j h THR 127 CO -0.00 0.00 -0.60 0.35 -0.25 0.00 0.00 175.52 175.02 3h1j n THR 128 N -2.45 0.00 -1.50 6.82 -2.24 -0.28 -4.85 114.28 109.77 3h1j n THR 128 Ca 0.05 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.79 3h1j n THR 128 Cb 0.46 0.24 0.20 0.00 -2.10 0.00 0.00 70.33 69.12 3h1j n THR 128 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h1j n ALA 129 N -0.94 4.26 -1.61 6.98 0.00 0.17 -4.97 120.51 124.40 3h1j n ALA 129 Ca 0.00 -3.21 -0.35 0.00 0.00 0.00 0.00 53.44 49.88 3h1j n ALA 129 Cb 0.02 -0.67 0.06 0.00 0.00 0.00 0.00 19.45 18.86 3h1j n ALA 129 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3h1j s PRO 130 N -3.27 2.64 -0.05 0.00 0.04 -1.19 0.92 135.00 134.09 3h1j s PRO 130 Ca 0.44 1.81 0.06 0.00 0.04 0.00 0.00 61.00 63.35 3h1j s PRO 130 Cb 0.40 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.96 3h1j s PRO 130 CO -0.02 -1.46 0.07 0.39 0.04 0.00 0.00 177.00 176.02 3h1j n GLU 131 N -2.05 1.99 -3.88 4.56 1.02 -1.10 -4.64 120.64 116.55 3h1j n GLU 131 Ca 0.14 -0.02 -0.33 0.00 -0.02 0.00 0.00 57.16 56.93 3h1j n GLU 131 Cb 0.50 -1.17 0.01 0.00 -0.02 0.00 0.00 31.44 30.76 3h1j n GLU 131 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3h1j n PHE 132 N -2.07 -1.69 -1.86 -0.32 0.99 -1.26 -4.84 117.46 106.41 3h1j n PHE 132 Ca -0.08 0.48 -0.42 0.00 -0.00 0.00 0.00 57.45 57.43 3h1j n PHE 132 Cb 0.53 -3.38 -0.03 0.00 -1.00 0.00 0.00 39.48 35.61 3h1j n PHE 132 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 3h1j s ARG 133 N -6.51 4.18 0.17 -1.08 0.52 -1.26 -4.80 118.95 110.16 3h1j s ARG 133 Ca 0.31 2.42 -0.15 0.00 -0.52 0.00 0.00 55.73 57.79 3h1j s ARG 133 Cb -0.13 -3.48 0.15 0.00 0.52 0.00 0.00 34.95 32.01 3h1j s ARG 133 CO 0.90 -0.74 1.17 -2.30 0.02 0.00 0.00 175.30 174.35 3h1j n PRO 134 N 5.21 -0.20 0.39 3.54 -0.02 -1.26 -0.72 135.00 141.93 3h1j n PRO 134 Ca 0.16 1.16 -0.17 0.00 -2.02 0.00 0.00 63.50 62.63 3h1j n PRO 134 Cb 0.39 -1.72 -0.08 0.00 -0.02 0.00 0.00 33.50 32.06 3h1j n PRO 134 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3h1j h TRP 135 N 0.00 -0.93 -1.13 6.00 0.09 -1.99 0.92 115.95 118.92 3h1j h TRP 135 Ca 0.24 -0.02 0.31 0.00 0.09 0.00 0.00 58.89 59.52 3h1j h TRP 135 Cb 0.43 0.31 -0.09 0.00 0.08 0.00 0.00 29.16 29.89 3h1j h TRP 135 CO -0.68 -0.56 0.74 0.93 0.09 0.00 0.00 178.44 178.97 3h1j h GLU 136 N -1.15 0.25 0.19 0.12 5.08 -1.60 0.29 114.58 117.75 3h1j h GLU 136 Ca -0.10 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.23 3h1j h GLU 136 Cb 0.79 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.98 3h1j h GLU 136 CO 0.17 0.17 -0.09 0.28 -1.00 0.00 0.00 179.01 178.54 3h1j h VAL 137 N 0.26 0.00 -0.73 3.13 2.07 -0.58 -2.76 116.25 117.64 3h1j h VAL 137 Ca 0.63 -0.32 0.19 0.00 0.82 0.00 0.00 66.70 68.03 3h1j h VAL 137 Cb 1.86 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.60 3h1j h VAL 137 CO -0.26 0.00 0.51 0.71 0.02 0.00 0.00 177.57 178.55 3h1j h THR 138 N -0.57 0.69 -0.21 2.57 1.35 -0.31 0.69 112.91 117.12 3h1j h THR 138 Ca -0.03 -0.05 -0.05 0.00 -0.55 0.00 0.00 66.41 65.74 3h1j h THR 138 Cb 0.19 0.53 -0.01 0.00 -1.73 0.00 0.00 68.15 67.12 3h1j h THR 138 CO 0.04 0.03 -0.07 0.44 -0.25 0.00 0.00 175.52 175.71 3h1j h ASP 139 N 0.15 0.31 0.26 5.36 3.32 -0.50 -3.22 116.42 122.10 3h1j h ASP 139 Ca 0.36 -0.06 -0.34 0.00 0.02 0.00 0.00 57.03 57.01 3h1j h ASP 139 Cb 1.19 -0.08 0.04 0.00 0.22 0.00 0.00 39.33 40.70 3h1j h ASP 139 CO -0.06 0.42 -1.50 0.25 -1.72 0.00 0.00 179.24 176.64 3h1j h LEU 140 N 0.31 0.85 -1.44 1.55 5.85 0.67 -3.37 115.31 119.73 3h1j h LEU 140 Ca 0.07 -0.92 0.29 0.00 0.84 0.00 0.00 57.88 58.16 3h1j h LEU 140 Cb 0.33 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.04 3h1j h LEU 140 CO 0.02 1.72 1.03 1.56 -0.34 0.00 0.00 178.44 182.43 3h1j h GLN 141 N 0.14 0.00 0.00 1.25 4.20 -1.34 0.62 115.11 119.99 3h1j h GLN 141 Ca -0.26 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.45 3h1j h GLN 141 Cb 2.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.95 3h1j h GLN 141 CO 0.28 0.00 0.00 -1.35 -0.67 0.00 0.00 178.83 177.09 3h1j h PRO 142 N 0.00 0.00 0.00 1.46 0.11 -1.77 -1.97 132.00 129.83 3h1j h PRO 142 Ca 0.47 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.55 3h1j h PRO 142 Cb 2.54 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 33.64 3h1j h PRO 142 CO -0.00 0.00 -0.14 0.37 -0.21 0.00 0.00 178.00 178.01 3h1j h GLN 143 N 0.00 0.00 -0.04 1.05 5.75 -0.04 -1.32 115.11 120.51 3h1j h GLN 143 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3h1j h GLN 143 Cb 0.39 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.94 3h1j h GLN 143 CO 0.00 0.14 0.01 -0.07 -2.65 0.00 0.00 178.83 176.27 3h1j h LEU 144 N 0.00 0.02 -0.58 -2.39 3.38 -1.51 0.81 115.31 115.04 3h1j h LEU 144 Ca -0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.03 3h1j h LEU 144 Cb 0.38 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.05 3h1j h LEU 144 CO 0.02 0.02 -0.50 0.50 0.09 0.00 0.00 178.44 178.56 3h1j h LYS 145 N 0.03 -0.20 0.57 1.13 1.63 -1.35 -0.38 116.57 117.99 3h1j h LYS 145 Ca 0.02 0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.80 3h1j h LYS 145 Cb 0.01 0.04 0.01 0.00 -0.60 0.00 0.00 32.23 31.69 3h1j h LYS 145 CO -0.02 -0.13 -0.27 0.28 -3.45 0.00 0.00 179.45 175.86 3h1j h VAL 146 N -0.20 0.00 -0.98 2.00 2.07 -1.31 -2.43 116.25 115.40 3h1j h VAL 146 Ca 0.10 -0.04 0.34 0.00 0.82 0.00 0.00 66.70 67.92 3h1j h VAL 146 Cb 0.46 0.00 -0.17 0.00 -1.52 0.00 0.00 31.29 30.05 3h1j h VAL 146 CO -0.65 0.00 0.34 -0.78 0.02 0.00 0.00 177.57 176.50 3h1j h ASP 147 N -0.80 0.04 -0.08 0.57 3.58 0.75 0.22 116.42 120.70 3h1j h ASP 147 Ca -0.08 0.25 -0.02 0.00 0.42 0.00 0.00 57.03 57.61 3h1j h ASP 147 Cb 0.58 0.33 -0.00 0.00 1.72 0.00 0.00 39.33 41.96 3h1j h ASP 147 CO 0.13 -0.35 -0.02 0.50 -2.88 0.00 0.00 179.24 176.62 3h1j h LYS 148 N 0.06 0.15 -0.82 0.28 3.64 -1.04 -2.75 116.57 116.09 3h1j h LYS 148 Ca 0.72 -0.06 0.15 0.00 -1.27 0.00 0.00 60.65 60.19 3h1j h LYS 148 Cb 1.73 -0.01 -0.10 0.00 -0.41 0.00 0.00 32.23 33.44 3h1j h LYS 148 CO -0.79 0.47 0.39 0.00 -2.27 0.00 0.00 179.45 177.25 3h1j h ALA 149 N 0.68 1.22 0.07 5.00 0.00 -0.07 0.39 119.26 126.55 3h1j h ALA 149 Ca 0.02 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3h1j h ALA 149 Cb 0.41 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3h1j h ALA 149 CO 0.01 -0.14 -0.04 -0.39 0.00 0.00 0.00 179.25 178.70 3h1j h VAL 150 N 0.56 1.19 -0.42 0.00 -1.51 -1.43 -3.12 116.25 111.52 3h1j h VAL 150 Ca 0.45 -1.07 0.09 0.00 -1.23 0.00 0.00 66.70 64.94 3h1j h VAL 150 Cb 0.66 1.87 -0.09 0.00 -2.13 0.00 0.00 31.29 31.60 3h1j h VAL 150 CO -0.38 0.26 -0.19 0.00 -1.23 0.00 0.00 177.57 176.03 3h1j h ALA 151 N 0.26 0.13 0.00 5.19 0.00 -1.14 0.14 119.26 123.84 3h1j h ALA 151 Ca -0.01 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h1j h ALA 151 Cb 0.50 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.75 3h1j h ALA 151 CO 0.02 -0.54 0.00 1.19 0.00 0.00 0.00 179.25 179.91 3h1j n PHE 152 N -5.37 0.00 0.25 0.00 3.01 0.09 -2.67 117.46 112.75 3h1j n PHE 152 Ca 0.03 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.60 3h1j n PHE 152 Cb 0.28 0.00 0.63 0.00 -0.01 0.00 0.00 39.48 40.38 3h1j n PHE 152 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 3h1j h GLN 153 N 0.00 0.00 -4.60 -1.08 4.20 -0.66 -3.39 115.11 109.58 3h1j h GLN 153 Ca 0.00 0.00 -0.70 0.00 0.06 0.00 0.00 58.65 58.01 3h1j h GLN 153 Cb 0.00 0.00 -0.22 0.00 0.30 0.00 0.00 27.48 27.56 3h1j h GLN 153 CO 0.00 0.17 -0.49 -1.54 -0.67 0.00 0.00 178.83 176.31 3h1j s SER 154 N -6.25 5.88 0.46 1.46 1.04 -1.09 -4.94 113.70 110.26 3h1j s SER 154 Ca -0.02 -0.83 0.30 0.00 0.48 0.00 0.00 55.95 55.87 3h1j s SER 154 Cb 0.13 -2.08 1.38 0.00 0.10 0.00 0.00 66.02 65.54 3h1j s SER 154 CO 0.61 -0.37 1.72 -0.65 0.98 0.00 0.00 173.24 175.53 3h1j h PRO 155 N 8.50 0.16 -0.86 4.02 0.11 -1.90 0.67 132.00 142.70 3h1j h PRO 155 Ca -0.28 -0.01 0.14 0.00 0.11 0.00 0.00 66.00 65.96 3h1j h PRO 155 Cb 1.12 -0.04 -0.14 0.00 0.11 0.00 0.00 31.00 32.06 3h1j h PRO 155 CO 0.68 0.10 -0.32 0.94 -0.21 0.00 0.00 178.00 179.19 3h1j n GLN 156 N -4.47 -0.19 -0.08 1.05 7.27 -1.26 -1.16 117.38 118.54 3h1j n GLN 156 Ca 0.31 1.32 -0.15 0.00 0.07 0.00 0.00 57.00 58.55 3h1j n GLN 156 Cb 1.25 -1.96 -0.04 0.00 2.41 0.00 0.00 30.24 31.89 3h1j n GLN 156 CO 0.00 0.00 0.00 -0.24 0.07 0.00 0.00 177.06 176.89 3h1j h VAL 157 N 0.00 1.27 -0.06 1.69 3.04 -1.18 -3.18 116.25 117.84 3h1j h VAL 157 Ca 0.31 -1.70 0.03 0.00 -1.01 0.00 0.00 66.70 64.33 3h1j h VAL 157 Cb 0.52 1.60 -0.04 0.00 -2.01 0.00 0.00 31.29 31.37 3h1j h VAL 157 CO -0.85 0.56 -0.16 1.23 -1.01 0.00 0.00 177.57 177.33 3h1j h GLY 158 N 0.67 -0.17 1.00 3.17 0.00 -1.21 -2.41 103.07 104.12 3h1j h GLY 158 Ca 0.02 0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.51 3h1j h GLY 158 CO 0.12 -0.16 0.26 -0.39 0.00 0.00 0.00 176.54 176.37 3h1j h VAL 159 N -0.24 1.23 -0.54 4.60 -1.51 -1.59 -2.58 116.25 115.62 3h1j h VAL 159 Ca 0.07 -0.69 0.04 0.00 -1.23 0.00 0.00 66.70 64.89 3h1j h VAL 159 Cb 0.34 0.53 -0.03 0.00 -2.13 0.00 0.00 31.29 30.00 3h1j h VAL 159 CO -0.20 0.27 0.36 -0.07 -1.23 0.00 0.00 177.57 176.70 3h1j h LEU 160 N 0.86 0.50 0.02 4.19 3.38 -1.49 0.69 115.31 123.45 3h1j h LEU 160 Ca 0.21 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 3h1j h LEU 160 Cb 0.18 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.82 3h1j h LEU 160 CO -0.02 0.34 -0.01 -0.33 0.09 0.00 0.00 178.44 178.51 3h1j h GLU 161 N 0.57 -0.02 -0.60 1.13 4.39 -1.04 -2.30 114.58 116.72 3h1j h GLU 161 Ca 0.22 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.87 3h1j h GLU 161 Cb 0.17 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.79 3h1j h GLU 161 CO -0.06 0.10 0.15 -0.91 -1.16 0.00 0.00 179.01 177.13 3h1j h ASN 162 N -0.14 0.86 0.11 1.42 2.35 -1.03 -2.47 115.58 116.68 3h1j h ASN 162 Ca -0.00 -0.16 -0.00 0.00 -0.55 0.00 0.00 56.30 55.59 3h1j h ASN 162 Cb 0.13 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 3h1j h ASN 162 CO 0.00 0.83 -0.15 0.25 -1.65 0.00 0.00 177.43 176.72 3h1j h LEU 163 N 0.88 -0.43 -1.33 1.61 5.85 0.64 -0.58 115.31 121.96 3h1j h LEU 163 Ca 0.19 0.04 0.39 0.00 0.84 0.00 0.00 57.88 59.34 3h1j h LEU 163 Cb 0.31 0.15 -0.13 0.00 0.37 0.00 0.00 40.66 41.36 3h1j h LEU 163 CO -0.00 -0.18 0.77 0.45 -0.34 0.00 0.00 178.44 179.13 3h1j h HIS 164 N -0.27 0.61 -0.37 1.25 3.86 -1.37 1.04 115.15 119.90 3h1j h HIS 164 Ca -0.01 0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 59.16 3h1j h HIS 164 Cb 0.24 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.54 3h1j h HIS 164 CO -0.20 -0.16 -0.02 0.00 0.86 0.00 0.00 177.93 178.40 3h1j h ALA 165 N 1.65 1.26 0.12 2.45 0.00 -0.77 -1.83 119.26 122.15 3h1j h ALA 165 Ca 0.77 -0.23 -0.31 0.00 0.00 0.00 0.00 54.91 55.14 3h1j h ALA 165 Cb 2.24 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.87 3h1j h ALA 165 CO -0.43 0.49 -1.58 0.00 0.00 0.00 0.00 179.25 177.72 3h1j h ALA 166 N 1.41 0.23 -0.30 0.00 0.00 0.23 -3.36 119.26 117.46 3h1j h ALA 166 Ca 0.12 -1.16 -0.01 0.00 0.00 0.00 0.00 54.91 53.85 3h1j h ALA 166 Cb 0.40 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 3h1j h ALA 166 CO 0.02 0.95 0.14 0.00 0.00 0.00 0.00 179.25 180.35 3h1j h ALA 167 N -0.02 1.67 -0.89 0.00 0.00 -0.06 0.98 119.26 120.94 3h1j h ALA 167 Ca -0.34 -0.08 -0.64 0.00 0.00 0.00 0.00 54.91 53.86 3h1j h ALA 167 Cb 1.85 -0.13 -0.13 0.00 0.00 0.00 0.00 17.79 19.38 3h1j h ALA 167 CO 0.07 0.27 -0.54 0.71 0.00 0.00 0.00 179.25 179.77 3h1j s TYR 168 N -5.25 1.98 -0.01 0.00 1.51 -0.69 -1.66 117.35 113.23 3h1j s TYR 168 Ca -0.07 -0.96 0.04 0.00 -1.01 0.00 0.00 57.07 55.07 3h1j s TYR 168 Cb 0.17 -1.55 -0.06 0.00 -0.11 0.00 0.00 41.96 40.41 3h1j s TYR 168 CO 0.73 0.18 0.08 1.63 -1.11 0.00 0.00 175.55 177.05 3h1j n LYS 169 N -1.12 0.13 -3.42 -0.62 5.02 -0.47 -4.47 118.16 113.21 3h1j n LYS 169 Ca -0.14 -0.03 -0.09 0.00 -2.02 0.00 0.00 58.31 56.03 3h1j n LYS 169 Cb 0.67 -1.09 0.00 0.00 -0.02 0.00 0.00 35.03 34.59 3h1j n LYS 169 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3h1j n THR 170 N -1.63 0.00 0.00 -0.18 -2.24 -1.26 -4.89 114.28 104.07 3h1j n THR 170 Ca -0.01 -1.09 0.00 0.00 -2.27 0.00 0.00 64.05 60.68 3h1j n THR 170 Cb 0.10 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.19 3h1j n THR 170 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h1j n ALA 171 N -1.01 0.00 1.03 6.98 0.00 -1.26 -0.10 120.51 126.16 3h1j n ALA 171 Ca -0.13 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.45 3h1j n ALA 171 Cb 0.49 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.57 3h1j n ALA 171 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h1j n LEU 172 N 0.00 0.00 0.02 0.00 4.77 -1.26 -2.80 117.00 117.73 3h1j n LEU 172 Ca 0.00 0.47 0.13 0.00 -0.03 0.00 0.00 56.01 56.59 3h1j n LEU 172 Cb 0.00 -0.47 0.51 0.00 -2.33 0.00 0.00 43.42 41.12 3h1j n LEU 172 CO 0.00 -0.01 0.85 0.00 -1.33 0.00 0.00 177.39 176.90 3h1j n ALA 173 N -1.47 2.52 -1.76 -1.18 0.00 0.86 -4.68 120.51 114.79 3h1j n ALA 173 Ca 0.08 -0.13 -0.40 0.00 0.00 0.00 0.00 53.44 52.99 3h1j n ALA 173 Cb 0.32 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.33 3h1j n ALA 173 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3h1j s ASN 174 N -3.35 6.96 0.59 0.00 0.01 -1.12 -4.17 114.94 113.86 3h1j s ASN 174 Ca 0.13 2.48 -0.17 0.00 -0.71 0.00 0.00 52.86 54.58 3h1j s ASN 174 Cb 0.17 -2.64 -0.03 0.00 0.41 0.00 0.00 41.25 39.16 3h1j s ASN 174 CO 0.58 -0.38 1.11 -2.16 -1.51 0.00 0.00 177.10 174.74 3h1j s PRO 175 N -1.69 3.14 0.36 -0.60 0.04 -1.26 -4.88 135.00 130.10 3h1j s PRO 175 Ca 0.48 1.49 0.21 0.00 0.04 0.00 0.00 61.00 63.22 3h1j s PRO 175 Cb -0.36 -1.99 0.21 0.00 0.04 0.00 0.00 34.50 32.41 3h1j s PRO 175 CO 0.46 -1.00 1.46 1.25 0.04 0.00 0.00 177.00 179.21 3h1j h LEU 176 N 0.68 0.00 -8.61 -3.56 5.85 -1.94 -3.44 115.31 104.29 3h1j h LEU 176 Ca -0.48 0.00 -0.65 0.00 0.84 0.00 0.00 57.88 57.58 3h1j h LEU 176 Cb 1.25 0.00 -0.26 0.00 0.37 0.00 0.00 40.66 42.02 3h1j h LEU 176 CO 0.56 0.12 -0.73 -0.31 -0.34 0.00 0.00 178.44 177.73 3h1j s TYR 177 N -3.17 2.89 -0.16 1.25 1.51 -1.26 -4.63 117.35 113.77 3h1j s TYR 177 Ca 0.05 -0.64 -0.41 0.00 -1.01 0.00 0.00 57.07 55.05 3h1j s TYR 177 Cb 0.06 -1.93 -0.19 0.00 -0.11 0.00 0.00 41.96 39.80 3h1j s TYR 177 CO 0.71 -0.25 1.35 0.00 -1.11 0.00 0.00 175.55 176.25 3h1j n PRO 179 N 2.86 1.21 0.06 0.00 -0.04 -1.26 -4.84 135.00 132.98 3h1j n PRO 179 Ca 0.24 0.46 -0.12 0.00 -0.04 0.00 0.00 63.50 64.04 3h1j n PRO 179 Cb 0.06 -2.50 -0.05 0.00 -0.04 0.00 0.00 33.50 30.98 3h1j n PRO 179 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3h1j h ASP 180 N 0.71 -0.95 -0.05 3.54 3.32 -1.98 -2.00 116.42 119.01 3h1j h ASP 180 Ca -0.51 0.12 0.02 0.00 0.02 0.00 0.00 57.03 56.68 3h1j h ASP 180 Cb 1.34 0.38 -0.00 0.00 0.22 0.00 0.00 39.33 41.27 3h1j h ASP 180 CO 0.54 -0.38 0.39 0.10 -1.72 0.00 0.00 179.24 178.16 3h1j h TYR 181 N -0.46 0.00 -0.03 4.55 -0.00 -2.02 0.15 116.97 119.16 3h1j h TYR 181 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.79 3h1j h TYR 181 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.28 3h1j h TYR 181 CO -0.34 0.00 -0.03 0.54 -0.00 0.00 0.00 178.16 178.32 3h1j n ARG 182 N -2.97 2.10 -1.88 0.10 1.74 -0.76 -4.79 116.66 110.20 3h1j n ARG 182 Ca -0.01 -1.79 -0.42 0.00 -0.77 0.00 0.00 57.85 54.86 3h1j n ARG 182 Cb 0.45 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.42 3h1j n ARG 182 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3h1j s ILE 183 N -1.94 3.17 0.00 0.55 -1.09 0.52 -1.64 121.20 120.78 3h1j s ILE 183 Ca 0.26 0.43 0.00 0.00 -2.23 0.00 0.00 60.65 59.11 3h1j s ILE 183 Cb 0.19 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.79 3h1j s ILE 183 CO 0.30 -0.02 0.00 0.61 -1.23 0.00 0.00 174.94 174.60 3h1j n GLY 184 N 4.17 0.90 0.60 6.18 0.00 -1.26 -4.90 105.19 110.89 3h1j n GLY 184 Ca 0.17 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.25 3h1j n GLY 184 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h1j n LYS 185 N -2.00 2.07 -2.79 1.61 5.02 -0.65 -4.94 118.16 116.47 3h1j n LYS 185 Ca 0.00 -1.77 -0.43 0.00 -2.02 0.00 0.00 58.31 54.10 3h1j n LYS 185 Cb 0.00 -1.26 -0.04 0.00 -0.02 0.00 0.00 35.03 33.71 3h1j n LYS 185 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3h1j s ILE 186 N -0.99 4.57 0.69 -0.18 1.01 -1.25 -5.04 121.20 120.02 3h1j s ILE 186 Ca 0.21 1.22 -0.08 0.00 0.00 0.00 0.00 60.65 61.99 3h1j s ILE 186 Cb 0.12 -4.34 0.05 0.00 0.01 0.00 0.00 42.46 38.29 3h1j s ILE 186 CO 0.16 -0.55 1.02 0.42 0.00 0.00 0.00 174.94 176.00 3h1j s THR 187 N 3.50 2.71 0.24 2.92 -4.23 -1.26 -4.92 115.64 114.61 3h1j s THR 187 Ca 0.39 -0.07 -0.02 0.00 -1.18 0.00 0.00 61.69 60.81 3h1j s THR 187 Cb -0.12 -3.17 0.07 0.00 1.34 0.00 0.00 72.50 70.62 3h1j s THR 187 CO 0.19 -0.19 1.70 0.28 -0.54 0.00 0.00 174.62 176.05 3h1j h SER 188 N -0.58 0.71 0.14 3.99 0.02 -1.95 -2.64 113.55 113.24 3h1j h SER 188 Ca -0.45 -0.22 0.01 0.00 -0.84 0.00 0.00 61.79 60.29 3h1j h SER 188 Cb 1.30 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.62 3h1j h SER 188 CO 0.62 0.87 -0.21 -0.33 -1.14 0.00 0.00 176.83 176.64 3h1j h GLU 189 N 0.65 -0.40 -0.95 3.45 3.07 -1.94 0.28 114.58 118.75 3h1j h GLU 189 Ca 0.11 0.03 0.17 0.00 -0.50 0.00 0.00 59.36 59.16 3h1j h GLU 189 Cb 0.62 0.09 -0.08 0.00 -0.84 0.00 0.00 28.75 28.53 3h1j h GLU 189 CO 0.04 -0.26 0.60 1.96 -1.40 0.00 0.00 179.01 179.95 3h1j h GLN 190 N -0.41 0.67 -0.00 2.33 4.20 -1.90 0.20 115.11 120.20 3h1j h GLN 190 Ca 0.02 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.69 3h1j h GLN 190 Cb 0.42 -0.15 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 3h1j h GLN 190 CO -0.10 0.44 -0.00 -0.07 -0.67 0.00 0.00 178.83 178.43 3h1j h LEU 191 N 0.69 0.01 0.60 1.46 3.38 -0.95 -1.74 115.31 118.76 3h1j h LEU 191 Ca 0.50 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3h1j h LEU 191 Cb 0.85 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.59 3h1j h LEU 191 CO -0.26 0.40 -0.42 0.45 0.09 0.00 0.00 178.44 178.69 3h1j h HIS 192 N -0.38 -1.14 -1.01 1.13 3.86 0.23 -1.54 115.15 116.31 3h1j h HIS 192 Ca 0.00 -0.01 0.24 0.00 -1.16 0.00 0.00 60.37 59.45 3h1j h HIS 192 Cb 0.39 0.42 -0.10 0.00 1.06 0.00 0.00 27.41 29.18 3h1j h HIS 192 CO 0.06 -0.61 0.64 0.45 0.86 0.00 0.00 177.93 179.33 3h1j h HIS 193 N -0.97 0.80 -0.09 2.45 3.86 -0.74 0.28 115.15 120.75 3h1j h HIS 193 Ca -0.08 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3h1j h HIS 193 Cb 0.80 -0.24 -0.00 0.00 1.06 0.00 0.00 27.41 29.03 3h1j h HIS 193 CO -0.12 0.11 0.04 0.35 0.86 0.00 0.00 177.93 179.17 3h1j h PHE 194 N 0.51 0.12 -0.03 2.45 3.57 -0.86 0.51 116.94 123.21 3h1j h PHE 194 Ca 0.59 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 62.08 3h1j h PHE 194 Cb 1.29 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 3h1j h PHE 194 CO -0.00 0.19 0.02 0.28 -2.23 0.00 0.00 178.31 176.57 3h1j h VAL 195 N 0.02 1.08 -0.59 1.41 2.07 0.40 -1.73 116.25 118.90 3h1j h VAL 195 Ca 0.03 -0.23 0.04 0.00 0.82 0.00 0.00 66.70 67.37 3h1j h VAL 195 Cb 0.11 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 31.02 3h1j h VAL 195 CO -0.00 0.06 0.33 1.56 0.02 0.00 0.00 177.57 179.54 3h1j h GLN 196 N -0.05 0.62 -0.00 1.57 4.20 -0.55 0.48 115.11 121.38 3h1j h GLN 196 Ca 0.01 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.68 3h1j h GLN 196 Cb 0.09 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.73 3h1j h GLN 196 CO -0.00 0.41 -0.05 0.09 -0.67 0.00 0.00 178.83 178.61 3h1j n ASN 197 N -4.80 0.23 0.00 1.46 3.02 0.16 -4.42 115.26 110.91 3h1j n ASN 197 Ca 0.06 -0.50 0.00 0.00 -0.03 0.00 0.00 54.58 54.11 3h1j n ASN 197 Cb 0.13 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 3h1j n ASN 197 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3h1j n ASN 198 N -1.06 1.26 -3.38 6.41 3.02 -0.66 -1.74 115.26 119.09 3h1j n ASN 198 Ca 0.16 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.32 3h1j n ASN 198 Cb 0.24 0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.47 3h1j n ASN 198 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3h1j n PHE 199 N -1.25 2.51 -3.78 3.10 3.01 0.17 -4.69 117.46 116.53 3h1j n PHE 199 Ca 0.00 -3.00 -0.37 0.00 1.01 0.00 0.00 57.45 55.09 3h1j n PHE 199 Cb 0.14 -2.27 -0.06 0.00 -0.01 0.00 0.00 39.48 37.27 3h1j n PHE 199 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3h1j s THR 200 N 1.06 5.38 0.54 4.37 -4.23 -1.26 -4.83 115.64 116.66 3h1j s THR 200 Ca 0.64 0.38 0.42 0.00 -1.18 0.00 0.00 61.69 61.95 3h1j s THR 200 Cb 0.18 -3.49 0.64 0.00 1.34 0.00 0.00 72.50 71.17 3h1j s THR 200 CO -0.07 0.61 1.67 0.77 -0.54 0.00 0.00 174.62 177.06 3h1j h SER 201 N 4.92 0.04 0.97 3.99 4.64 -0.08 0.88 113.55 128.91 3h1j h SER 201 Ca -0.54 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.80 3h1j h SER 201 Cb 1.23 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3h1j h SER 201 CO 0.59 -0.02 -0.18 0.00 -0.87 0.00 0.00 176.83 176.35 3h1j n ALA 202 N -2.81 2.66 0.34 5.18 0.00 -1.26 -1.83 120.51 122.78 3h1j n ALA 202 Ca 0.36 -0.16 0.07 0.00 0.00 0.00 0.00 53.44 53.71 3h1j n ALA 202 Cb 1.64 -1.36 0.09 0.00 0.00 0.00 0.00 19.45 19.82 3h1j n ALA 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3h1j n ARG 203 N -1.73 1.40 -4.19 0.00 1.74 0.30 -4.88 116.66 109.29 3h1j n ARG 203 Ca 0.06 -1.53 -0.25 0.00 -0.77 0.00 0.00 57.85 55.36 3h1j n ARG 203 Cb 0.37 -1.27 -0.07 0.00 -1.02 0.00 0.00 32.46 30.47 3h1j n ARG 203 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3h1j s MET 204 N -1.07 2.52 -0.11 5.56 -1.94 -0.80 -1.15 119.30 122.30 3h1j s MET 204 Ca 0.19 -1.11 -0.04 0.00 -1.71 0.00 0.00 55.69 53.01 3h1j s MET 204 Cb 0.12 -2.39 0.05 0.00 2.01 0.00 0.00 34.83 34.62 3h1j s MET 204 CO 0.17 0.44 0.22 0.00 -0.01 0.00 0.00 175.02 175.84 3h1j s ALA 205 N -1.87 -0.42 -0.83 3.03 0.00 -0.17 -2.78 121.76 118.73 3h1j s ALA 205 Ca 0.29 0.81 -0.15 0.00 0.00 0.00 0.00 51.96 52.91 3h1j s ALA 205 Cb -0.09 -0.86 0.19 0.00 0.00 0.00 0.00 23.12 22.36 3h1j s ALA 205 CO 0.20 -0.52 0.84 -1.17 0.00 0.00 0.00 175.76 175.11 3h1j s LEU 206 N 2.13 6.31 0.40 0.00 2.96 0.65 -0.46 118.68 130.66 3h1j s LEU 206 Ca -0.00 -2.47 -0.03 0.00 -0.22 0.00 0.00 54.13 51.40 3h1j s LEU 206 Cb -0.12 -2.26 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 3h1j s LEU 206 CO -0.08 -0.71 0.67 -0.69 -1.32 0.00 0.00 176.35 174.22 3h1j s VAL 207 N 0.88 4.99 0.12 1.68 1.01 -0.59 -2.99 120.40 125.50 3h1j s VAL 207 Ca 0.21 -0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.90 3h1j s VAL 207 Cb -0.10 -3.84 0.08 0.00 0.00 0.00 0.00 36.38 32.52 3h1j s VAL 207 CO -0.08 -0.66 0.68 -0.83 0.00 0.00 0.00 175.10 174.21 3h1j s GLY 208 N -3.91 -0.57 0.02 4.51 0.00 -0.50 -1.45 107.32 105.41 3h1j s GLY 208 Ca 0.44 0.62 -0.00 0.00 0.00 0.00 0.00 44.72 45.77 3h1j s GLY 208 CO 0.39 0.20 -0.02 -0.42 0.00 0.00 0.00 173.10 173.25 3h1j s ILE 209 N -3.58 0.10 -0.98 0.90 1.01 -1.12 -3.15 121.20 114.37 3h1j s ILE 209 Ca 0.02 -0.79 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 3h1j s ILE 209 Cb -0.01 -0.24 0.00 0.00 0.01 0.00 0.00 42.46 42.22 3h1j s ILE 209 CO -0.12 -0.43 0.11 0.61 0.00 0.00 0.00 174.94 175.11 3h1j n GLY 210 N 1.77 -0.09 3.17 6.18 0.00 -0.80 -2.16 105.19 113.27 3h1j n GLY 210 Ca -0.22 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.37 3h1j n GLY 210 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h1j s VAL 211 N -2.69 0.16 -0.11 1.61 -7.23 -1.26 -4.64 120.40 106.25 3h1j s VAL 211 Ca 0.06 -1.45 -0.11 0.00 -1.81 0.00 0.00 61.98 58.66 3h1j s VAL 211 Cb -0.02 -1.48 -0.05 0.00 0.56 0.00 0.00 36.38 35.39 3h1j s VAL 211 CO 0.07 -0.73 0.25 -0.75 -0.31 0.00 0.00 175.10 173.64 3h1j s LYS 212 N -3.90 3.87 0.36 4.82 2.36 -1.26 -2.14 119.74 123.85 3h1j s LYS 212 Ca 0.08 0.07 0.13 0.00 -2.55 0.00 0.00 55.97 53.70 3h1j s LYS 212 Cb 0.06 -3.29 0.96 0.00 -1.05 0.00 0.00 37.83 34.52 3h1j s LYS 212 CO -0.09 0.55 1.78 1.25 1.55 0.00 0.00 175.35 180.39 3h1j h HIS 213 N 5.56 0.82 -0.79 4.03 -0.00 -1.95 -0.60 115.15 122.22 3h1j h HIS 213 Ca -0.49 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 59.94 3h1j h HIS 213 Cb 1.20 -0.24 -0.04 0.00 -0.00 0.00 0.00 27.41 28.33 3h1j h HIS 213 CO 0.68 0.12 0.52 0.66 -0.00 0.00 0.00 177.93 179.91 3h1j h SER 214 N 0.53 0.84 0.11 3.26 4.64 -1.99 0.80 113.55 121.75 3h1j h SER 214 Ca 0.58 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.89 3h1j h SER 214 Cb 1.25 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3h1j h SER 214 CO -0.34 0.58 -0.05 0.44 -0.87 0.00 0.00 176.83 176.59 3h1j h ASP 215 N 0.98 -0.13 -0.81 4.97 3.32 -1.53 -2.34 116.42 120.87 3h1j h ASP 215 Ca 0.31 -0.36 0.12 0.00 0.02 0.00 0.00 57.03 57.12 3h1j h ASP 215 Cb 0.03 0.03 -0.06 0.00 0.22 0.00 0.00 39.33 39.55 3h1j h ASP 215 CO -0.09 0.49 0.53 0.25 -1.72 0.00 0.00 179.24 178.70 3h1j h LEU 216 N -0.94 0.60 0.23 1.55 5.85 -1.37 -1.74 115.31 119.48 3h1j h LEU 216 Ca -0.02 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3h1j h LEU 216 Cb 0.48 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.42 3h1j h LEU 216 CO 0.03 0.33 -0.11 0.50 -0.34 0.00 0.00 178.44 178.85 3h1j h LYS 217 N 0.65 -0.30 -0.92 1.25 3.64 -0.92 -2.78 116.57 117.21 3h1j h LYS 217 Ca 0.39 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.91 3h1j h LYS 217 Cb 0.61 0.07 -0.14 0.00 -0.41 0.00 0.00 32.23 32.36 3h1j h LYS 217 CO -0.16 0.04 -0.46 0.37 -2.27 0.00 0.00 179.45 176.98 3h1j h GLN 218 N -0.70 -0.04 0.05 1.90 4.15 -0.75 -0.75 115.11 118.97 3h1j h GLN 218 Ca -0.03 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.41 3h1j h GLN 218 Cb 0.48 0.01 -0.03 0.00 0.21 0.00 0.00 27.48 28.15 3h1j h GLN 218 CO 0.05 -0.03 -0.20 0.28 -1.93 0.00 0.00 178.83 177.01 3h1j h VAL 219 N -0.04 0.55 -0.75 2.39 2.07 -1.48 0.11 116.25 119.09 3h1j h VAL 219 Ca 0.26 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.93 3h1j h VAL 219 Cb 0.53 0.55 -0.14 0.00 -1.52 0.00 0.00 31.29 30.71 3h1j h VAL 219 CO -0.92 0.00 -0.22 0.00 0.02 0.00 0.00 177.57 176.46 3h1j h ALA 220 N 0.51 0.42 0.04 1.67 0.00 -0.86 0.23 119.26 121.27 3h1j h ALA 220 Ca 0.04 0.28 -0.25 0.00 0.00 0.00 0.00 54.91 54.98 3h1j h ALA 220 Cb 0.39 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 3h1j h ALA 220 CO -0.15 -0.45 -1.22 1.05 0.00 0.00 0.00 179.25 178.48 3h1j h GLU 221 N -0.02 0.08 -0.00 0.00 4.11 -1.18 -2.37 114.58 115.20 3h1j h GLU 221 Ca 0.35 -0.14 0.00 0.00 0.07 0.00 0.00 59.36 59.64 3h1j h GLU 221 Cb 0.56 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.86 3h1j h GLU 221 CO -0.78 0.98 -0.19 1.04 0.07 0.00 0.00 179.01 180.13 3h1j n GLN 222 N -3.35 0.21 0.00 1.06 6.02 0.35 -4.38 117.38 117.29 3h1j n GLN 222 Ca -0.06 -0.07 0.00 0.00 -0.01 0.00 0.00 57.00 56.86 3h1j n GLN 222 Cb 0.99 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.75 3h1j n GLN 222 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3h1j n PHE 223 N -1.34 0.00 -2.97 1.08 3.01 0.76 -5.02 117.46 112.98 3h1j n PHE 223 Ca 0.09 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.18 3h1j n PHE 223 Cb 0.32 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.73 3h1j n PHE 223 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3h1j s LEU 224 N -1.78 4.39 0.00 4.37 1.43 -0.89 -4.98 118.68 121.23 3h1j s LEU 224 Ca 0.00 1.60 0.00 0.00 -1.03 0.00 0.00 54.13 54.70 3h1j s LEU 224 Cb 0.00 -3.66 0.00 0.00 0.03 0.00 0.00 46.19 42.56 3h1j s LEU 224 CO 0.00 0.04 0.00 0.59 0.23 0.00 0.00 176.35 177.21 3h1j n ASN 225 N 0.85 1.52 -2.64 2.29 4.13 -1.26 -4.88 115.26 115.26 3h1j n ASN 225 Ca -0.02 0.00 -0.26 0.00 1.68 0.00 0.00 54.58 55.98 3h1j n ASN 225 Cb 0.50 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.74 3h1j n ASN 225 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3h1j n ILE 226 N -2.08 0.45 -1.25 2.41 0.13 -1.26 -4.93 119.36 112.82 3h1j n ILE 226 Ca 0.00 -0.31 -0.30 0.00 -1.10 0.00 0.00 62.75 61.04 3h1j n ILE 226 Cb 0.23 0.00 0.23 0.00 -0.84 0.00 0.00 39.64 39.26 3h1j n ILE 226 CO 0.00 0.00 0.00 -0.60 2.80 0.00 0.00 176.55 178.75 3h1j s ARG 227 N -0.61 -0.91 0.00 9.51 3.00 -1.26 -4.24 118.95 124.44 3h1j s ARG 227 Ca 0.37 -0.16 0.00 0.00 -1.00 0.00 0.00 55.73 54.93 3h1j s ARG 227 Cb -0.40 -1.64 0.00 0.00 0.00 0.00 0.00 34.95 32.90 3h1j s ARG 227 CO 0.38 -3.48 0.00 -1.13 0.00 0.00 0.00 175.30 171.07 3h1j n SER 228 N -4.58 1.12 -0.05 -2.12 3.41 -1.26 0.54 113.62 110.68 3h1j n SER 228 Ca 0.14 -0.52 0.00 0.00 -0.26 0.00 0.00 58.87 58.23 3h1j n SER 228 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 3h1j n SER 228 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h1j n GLY 229 N 5.00 -2.96 0.20 5.00 0.00 -1.26 -4.50 105.19 106.67 3h1j n GLY 229 Ca 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 46.02 45.04 3h1j n GLY 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1j n ALA 230 N -0.16 0.54 0.00 4.61 0.00 -1.26 -4.76 120.51 119.47 3h1j n ALA 230 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3h1j n ALA 230 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.03 3h1j n ALA 230 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1j n GLY 231 N -0.04 1.77 3.73 0.00 0.00 -1.26 -3.60 105.19 105.79 3h1j n GLY 231 Ca 0.00 0.44 -0.39 0.00 0.00 0.00 0.00 46.02 46.07 3h1j n GLY 231 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3h1j s THR 232 N 0.00 5.07 0.36 2.61 2.01 -0.71 -5.05 115.64 119.93 3h1j s THR 232 Ca 0.00 1.18 0.02 0.00 0.31 0.00 0.00 61.69 63.20 3h1j s THR 232 Cb 0.00 -3.92 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 3h1j s THR 232 CO 0.00 0.33 0.55 -0.44 -0.69 0.00 0.00 174.62 174.37 3h1j s SER 233 N 0.47 6.12 -0.01 3.53 0.01 -1.24 -4.87 113.70 117.70 3h1j s SER 233 Ca 0.31 0.27 -0.18 0.00 1.31 0.00 0.00 55.95 57.66 3h1j s SER 233 Cb -0.17 -1.76 -0.05 0.00 0.21 0.00 0.00 66.02 64.25 3h1j s SER 233 CO 0.15 -0.41 0.50 -0.55 0.41 0.00 0.00 173.24 173.34 3h1j s SER 234 N -4.10 6.87 -0.90 2.44 0.15 -1.26 -4.99 113.70 111.90 3h1j s SER 234 Ca 0.42 1.03 -0.25 0.00 0.70 0.00 0.00 55.95 57.86 3h1j s SER 234 Cb -0.10 -2.31 -0.05 0.00 -1.71 0.00 0.00 66.02 61.86 3h1j s SER 234 CO 0.35 0.19 1.95 0.00 1.20 0.00 0.00 173.24 176.93 3h1j s ALA 235 N -0.47 1.65 0.00 5.45 0.00 -1.26 -4.86 121.76 122.26 3h1j s ALA 235 Ca 0.27 -1.50 0.00 0.00 0.00 0.00 0.00 51.96 50.73 3h1j s ALA 235 Cb -0.17 -4.56 0.00 0.00 0.00 0.00 0.00 23.12 18.39 3h1j s ALA 235 CO 0.15 -4.84 0.00 1.63 0.00 0.00 0.00 175.76 172.70 3h1j n LYS 236 N 8.85 0.00 -1.85 0.00 5.02 -1.26 -4.52 118.16 124.40 3h1j n LYS 236 Ca 0.40 0.00 -0.42 0.00 -2.02 0.00 0.00 58.31 56.27 3h1j n LYS 236 Cb 0.47 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.45 3h1j n LYS 236 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h1j s ALA 237 N 0.00 3.44 0.08 7.82 0.00 -1.26 -4.87 121.76 126.97 3h1j s ALA 237 Ca 0.00 0.99 -0.17 0.00 0.00 0.00 0.00 51.96 52.78 3h1j s ALA 237 Cb 0.00 -3.84 -0.07 0.00 0.00 0.00 0.00 23.12 19.21 3h1j s ALA 237 CO 0.00 -1.72 0.53 0.99 0.00 0.00 0.00 175.76 175.56 3h1j s THR 238 N 4.91 4.82 0.07 0.00 2.01 -1.26 -4.99 115.64 121.19 3h1j s THR 238 Ca 0.82 1.05 -0.20 0.00 0.31 0.00 0.00 61.69 63.67 3h1j s THR 238 Cb -0.35 -3.82 -0.07 0.00 0.01 0.00 0.00 72.50 68.27 3h1j s THR 238 CO 0.35 0.48 0.59 -0.47 -0.69 0.00 0.00 174.62 174.87 3h1j s TYR 239 N -1.19 3.79 -0.05 4.92 5.04 -1.26 -1.37 117.35 127.23 3h1j s TYR 239 Ca 0.30 1.28 -0.09 0.00 -2.44 0.00 0.00 57.07 56.13 3h1j s TYR 239 Cb -0.18 -2.53 -0.03 0.00 0.35 0.00 0.00 41.96 39.57 3h1j s TYR 239 CO 0.18 0.55 -0.17 1.87 -1.34 0.00 0.00 175.55 176.63 3h1j n TRP 240 N 1.87 0.00 -1.19 4.97 -0.00 -0.67 -4.78 117.44 117.65 3h1j n TRP 240 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.40 3h1j n TRP 240 Cb 0.51 -0.28 0.00 0.00 -0.00 0.00 0.00 31.31 31.54 3h1j n TRP 240 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3h1j n GLY 241 N 2.44 0.64 2.01 5.87 0.00 -0.74 -5.01 105.19 110.41 3h1j n GLY 241 Ca -0.10 -0.30 -0.16 0.00 0.00 0.00 0.00 46.02 45.46 3h1j n GLY 241 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h1j n GLY 242 N -0.46 -1.93 2.96 -0.02 0.00 0.33 -4.63 105.19 101.44 3h1j n GLY 242 Ca 0.00 -1.59 -0.07 0.00 0.00 0.00 0.00 46.02 44.36 3h1j n GLY 242 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3h1j s GLU 243 N -4.48 0.51 -0.21 1.61 2.12 -1.26 -1.98 118.70 115.01 3h1j s GLU 243 Ca 0.40 0.02 -0.07 0.00 0.36 0.00 0.00 54.97 55.68 3h1j s GLU 243 Cb -0.02 -0.24 -0.03 0.00 0.26 0.00 0.00 34.13 34.10 3h1j s GLU 243 CO 0.29 -1.08 0.05 0.42 -0.54 0.00 0.00 175.26 174.41 3h1j s ILE 244 N 2.37 4.37 -0.14 -3.70 1.01 -0.39 -4.98 121.20 119.73 3h1j s ILE 244 Ca 0.11 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.62 3h1j s ILE 244 Cb -0.12 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.36 3h1j s ILE 244 CO -0.24 0.40 -0.20 -0.13 0.00 0.00 0.00 174.94 174.78 3h1j s ARG 245 N 1.06 3.11 -0.47 2.79 0.52 -1.26 -2.08 118.95 122.62 3h1j s ARG 245 Ca 0.04 -0.81 0.01 0.00 -0.52 0.00 0.00 55.73 54.44 3h1j s ARG 245 Cb -0.14 -2.49 0.13 0.00 0.52 0.00 0.00 34.95 32.96 3h1j s ARG 245 CO 0.03 0.04 0.24 -2.00 0.02 0.00 0.00 175.30 173.62 3h1j s GLU 246 N 0.71 2.00 -0.02 3.54 2.12 -0.77 -5.00 118.70 121.29 3h1j s GLU 246 Ca -0.09 -2.21 -0.30 0.00 0.36 0.00 0.00 54.97 52.73 3h1j s GLU 246 Cb -0.16 -3.46 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 3h1j s GLU 246 CO 0.01 -1.07 1.26 -1.14 -0.54 0.00 0.00 175.26 173.77 3h1j s GLN 247 N 0.42 4.34 0.00 4.30 2.00 -1.26 -1.50 119.66 127.96 3h1j s GLN 247 Ca 0.13 1.77 0.00 0.00 -2.00 0.00 0.00 55.36 55.26 3h1j s GLN 247 Cb -0.22 -3.53 0.00 0.00 0.80 0.00 0.00 33.01 30.06 3h1j s GLN 247 CO -0.04 -0.46 0.20 0.27 -0.50 0.00 0.00 175.29 174.76 3h1j n ASN 248 N 5.08 0.00 0.00 6.67 2.04 -0.84 -4.86 115.26 123.35 3h1j n ASN 248 Ca 0.11 -1.00 0.00 0.00 -0.44 0.00 0.00 54.58 53.25 3h1j n ASN 248 Cb 0.45 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.70 3h1j n ASN 248 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3h1j n GLY 249 N 0.00 1.81 1.82 4.83 0.00 -1.25 -4.86 105.19 107.54 3h1j n GLY 249 Ca 0.00 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.48 3h1j n GLY 249 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3h1j n HIS 250 N 0.00 0.74 -0.31 1.61 -0.00 -1.26 -3.88 115.22 112.12 3h1j n HIS 250 Ca 0.00 0.48 0.06 0.00 -0.00 0.00 0.00 57.72 58.27 3h1j n HIS 250 Cb 0.00 -1.20 0.16 0.00 -0.00 0.00 0.00 29.99 28.95 3h1j n HIS 250 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 3h1j h SER 251 N 3.96 -0.64 -3.36 0.26 4.64 -1.96 -2.87 113.55 113.57 3h1j h SER 251 Ca -0.12 0.25 -0.53 0.00 -0.47 0.00 0.00 61.79 60.92 3h1j h SER 251 Cb 0.74 0.49 -0.01 0.00 -0.31 0.00 0.00 62.40 63.31 3h1j h SER 251 CO 0.55 -0.28 0.45 -0.76 -0.87 0.00 0.00 176.83 175.93 3h1j s LEU 252 N -11.03 4.39 -0.35 5.97 1.43 -1.26 -2.45 118.68 115.39 3h1j s LEU 252 Ca -0.14 1.84 -0.14 0.00 -1.03 0.00 0.00 54.13 54.66 3h1j s LEU 252 Cb 0.25 -3.58 -0.01 0.00 0.03 0.00 0.00 46.19 42.88 3h1j s LEU 252 CO 0.77 -0.32 0.32 -0.69 0.23 0.00 0.00 176.35 176.66 3h1j s VAL 253 N 0.83 5.21 -0.06 -1.59 1.01 -0.13 -4.55 120.40 121.11 3h1j s VAL 253 Ca 0.54 -0.07 -0.13 0.00 0.00 0.00 0.00 61.98 62.31 3h1j s VAL 253 Cb -0.25 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.28 3h1j s VAL 253 CO 0.29 -0.08 0.33 -1.00 0.00 0.00 0.00 175.10 174.63 3h1j s HIS 254 N 1.92 3.64 0.00 5.22 3.76 -0.82 -2.57 115.29 126.44 3h1j s HIS 254 Ca 0.10 0.81 -0.08 0.00 -0.15 0.00 0.00 55.06 55.73 3h1j s HIS 254 Cb -0.17 -2.23 0.00 0.00 1.11 0.00 0.00 32.58 31.30 3h1j s HIS 254 CO 0.11 0.57 0.16 0.00 -0.85 0.00 0.00 174.74 174.74 3h1j s ALA 255 N -0.71 -0.38 -0.17 -1.40 0.00 -0.16 -1.71 121.76 117.23 3h1j s ALA 255 Ca 0.20 -0.09 -0.05 0.00 0.00 0.00 0.00 51.96 52.03 3h1j s ALA 255 Cb -0.15 0.11 0.08 0.00 0.00 0.00 0.00 23.12 23.17 3h1j s ALA 255 CO 0.09 -0.22 0.32 0.00 0.00 0.00 0.00 175.76 175.96 3h1j s ALA 256 N -1.41 -0.79 -0.16 0.00 0.00 -0.32 -0.13 121.76 118.95 3h1j s ALA 256 Ca -0.15 1.07 -0.02 0.00 0.00 0.00 0.00 51.96 52.87 3h1j s ALA 256 Cb -0.07 -1.21 -0.01 0.00 0.00 0.00 0.00 23.12 21.82 3h1j s ALA 256 CO 0.02 -0.79 -0.09 0.08 0.00 0.00 0.00 175.76 174.98 3h1j s VAL 257 N 2.49 3.24 0.28 0.00 1.01 -0.26 -1.95 120.40 125.21 3h1j s VAL 257 Ca 0.02 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.46 3h1j s VAL 257 Cb -0.13 -2.40 -0.03 0.00 0.00 0.00 0.00 36.38 33.82 3h1j s VAL 257 CO -0.11 0.49 0.24 0.68 0.00 0.00 0.00 175.10 176.40 3h1j s VAL 258 N 0.67 0.00 0.17 2.92 -7.23 -0.77 -1.05 120.40 115.11 3h1j s VAL 258 Ca -0.05 -1.97 -0.03 0.00 -1.81 0.00 0.00 61.98 58.12 3h1j s VAL 258 Cb -0.15 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.26 3h1j s VAL 258 CO 0.02 0.00 0.16 -0.89 -0.31 0.00 0.00 175.10 174.08 3h1j s THR 259 N -3.71 0.05 0.49 5.32 2.01 0.54 -0.90 115.64 119.44 3h1j s THR 259 Ca 0.39 -1.81 -0.24 0.00 0.31 0.00 0.00 61.69 60.35 3h1j s THR 259 Cb 0.04 -2.18 -0.07 0.00 0.01 0.00 0.00 72.50 70.30 3h1j s THR 259 CO 0.21 -0.23 1.37 -0.70 -0.69 0.00 0.00 174.62 174.57 3h1j s GLU 260 N -4.07 3.49 0.00 4.92 2.12 -1.26 -1.28 118.70 122.62 3h1j s GLU 260 Ca 0.28 2.26 0.00 0.00 0.36 0.00 0.00 54.97 57.87 3h1j s GLU 260 Cb 0.06 -2.48 0.00 0.00 0.26 0.00 0.00 34.13 31.97 3h1j s GLU 260 CO 0.06 -0.92 0.00 0.41 -0.54 0.00 0.00 175.26 174.27 3h1j n GLY 261 N 0.64 2.08 3.45 -1.50 0.00 0.19 -4.64 105.19 105.41 3h1j n GLY 261 Ca 0.07 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3h1j n GLY 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1j s ALA 262 N -2.07 2.58 1.01 4.61 0.00 -1.26 -4.48 121.76 122.15 3h1j s ALA 262 Ca 0.00 -1.15 -0.11 0.00 0.00 0.00 0.00 51.96 50.70 3h1j s ALA 262 Cb 0.00 -0.77 0.15 0.00 0.00 0.00 0.00 23.12 22.51 3h1j s ALA 262 CO 0.00 0.57 0.90 0.00 0.00 0.00 0.00 175.76 177.22 3h1j n ALA 263 N 1.76 -1.09 -1.26 0.00 0.00 -1.26 -4.05 120.51 114.61 3h1j n ALA 263 Ca -0.16 -1.17 -0.32 0.00 0.00 0.00 0.00 53.44 51.78 3h1j n ALA 263 Cb 0.52 -0.06 0.09 0.00 0.00 0.00 0.00 19.45 20.00 3h1j n ALA 263 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3h1j s VAL 264 N -2.95 2.95 0.00 0.00 1.01 -0.85 -3.68 120.40 116.89 3h1j s VAL 264 Ca 0.51 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.86 3h1j s VAL 264 Cb -0.01 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.56 3h1j s VAL 264 CO 0.36 -0.34 0.00 0.61 0.00 0.00 0.00 175.10 175.72 3h1j n GLY 265 N -0.54 0.76 0.65 4.51 0.00 -1.26 -4.90 105.19 104.41 3h1j n GLY 265 Ca 0.11 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 3h1j n GLY 265 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3h1j n SER 266 N 1.95 0.17 0.04 1.61 2.88 -1.24 -4.78 113.62 114.25 3h1j n SER 266 Ca 0.00 0.21 0.01 0.00 -1.33 0.00 0.00 58.87 57.75 3h1j n SER 266 Cb 0.00 -0.16 0.33 0.00 -0.75 0.00 0.00 64.21 63.63 3h1j n SER 266 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h1j h ALA 267 N 0.80 1.42 -0.80 -1.46 0.00 -1.91 -1.35 119.26 115.96 3h1j h ALA 267 Ca -0.08 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.85 3h1j h ALA 267 Cb 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 3h1j h ALA 267 CO 0.16 0.41 0.57 1.49 0.00 0.00 0.00 179.25 181.87 3h1j h GLU 268 N 0.41 0.11 -0.58 0.00 4.81 -1.95 0.27 114.58 117.66 3h1j h GLU 268 Ca 0.09 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 3h1j h GLU 268 Cb 0.34 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 3h1j h GLU 268 CO 0.01 0.07 0.26 0.00 -0.73 0.00 0.00 179.01 178.63 3h1j h ALA 269 N 1.61 1.36 0.00 2.92 0.00 -1.52 -1.98 119.26 121.66 3h1j h ALA 269 Ca 0.39 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3h1j h ALA 269 Cb 1.38 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 3h1j h ALA 269 CO -0.05 0.49 -0.04 -0.91 0.00 0.00 0.00 179.25 178.74 3h1j h ASN 270 N 0.82 0.00 0.27 0.00 2.35 -0.55 -1.96 115.58 116.51 3h1j h ASN 270 Ca 0.20 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.94 3h1j h ASN 270 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 3h1j h ASN 270 CO -0.02 0.04 -0.13 0.00 -1.65 0.00 0.00 177.43 175.67 3h1j h ALA 271 N 1.96 -0.36 -0.92 -0.83 0.00 -1.37 -2.64 119.26 115.10 3h1j h ALA 271 Ca -0.00 -0.17 0.11 0.00 0.00 0.00 0.00 54.91 54.85 3h1j h ALA 271 Cb 0.08 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 3h1j h ALA 271 CO 0.01 -0.55 0.56 0.74 0.00 0.00 0.00 179.25 180.00 3h1j h PHE 272 N -0.66 1.01 -0.75 0.00 -1.00 -1.40 0.47 116.94 114.62 3h1j h PHE 272 Ca -0.04 0.03 0.05 0.00 2.81 0.00 0.00 57.97 60.82 3h1j h PHE 272 Cb 0.46 -0.31 -0.05 0.00 3.61 0.00 0.00 35.95 39.66 3h1j h PHE 272 CO 0.02 0.40 0.45 0.77 -1.61 0.00 0.00 178.31 178.34 3h1j h SER 273 N 0.89 0.71 -0.07 2.17 0.02 -1.32 1.05 113.55 117.00 3h1j h SER 273 Ca 0.45 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 61.39 3h1j h SER 273 Cb 0.44 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 3h1j h SER 273 CO -0.26 0.47 -0.08 0.58 -1.14 0.00 0.00 176.83 176.40 3h1j h VAL 274 N 0.85 1.38 -0.66 2.27 2.07 -0.72 -2.42 116.25 119.02 3h1j h VAL 274 Ca 0.32 -1.25 0.06 0.00 0.82 0.00 0.00 66.70 66.64 3h1j h VAL 274 Cb 0.12 2.05 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 3h1j h VAL 274 CO -0.15 0.35 0.43 0.25 0.02 0.00 0.00 177.57 178.47 3h1j h LEU 275 N -0.26 0.59 0.00 2.57 5.85 0.44 0.19 115.31 124.70 3h1j h LEU 275 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3h1j h LEU 275 Cb 0.60 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.50 3h1j h LEU 275 CO 0.02 0.39 0.00 1.67 -0.34 0.00 0.00 178.44 180.18 3h1j n GLN 276 N -4.48 0.00 0.33 1.25 7.27 0.36 -0.96 117.38 121.15 3h1j n GLN 276 Ca 0.09 0.63 0.18 0.00 0.07 0.00 0.00 57.00 57.97 3h1j n GLN 276 Cb 0.22 -1.49 0.96 0.00 2.41 0.00 0.00 30.24 32.34 3h1j n GLN 276 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 3h1j h HIS 277 N 0.00 0.00 -0.03 3.69 3.86 -1.05 0.22 115.15 121.85 3h1j h HIS 277 Ca 0.00 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.16 3h1j h HIS 277 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3h1j h HIS 277 CO -0.09 0.00 -0.19 0.28 0.86 0.00 0.00 177.93 178.79 3h1j h VAL 278 N 0.00 1.50 0.00 2.45 2.07 -0.34 -3.21 116.25 118.73 3h1j h VAL 278 Ca 0.01 -1.74 -0.08 0.00 0.82 0.00 0.00 66.70 65.71 3h1j h VAL 278 Cb 0.44 2.56 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 3h1j h VAL 278 CO -0.00 0.48 -0.36 -0.07 0.02 0.00 0.00 177.57 177.63 3h1j h LEU 279 N -0.44 0.00 0.00 2.57 3.38 0.47 -3.11 115.31 118.18 3h1j h LEU 279 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3h1j h LEU 279 Cb 0.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.62 3h1j h LEU 279 CO 0.04 0.36 0.00 0.61 0.09 0.00 0.00 178.44 179.54 3h1j n GLY 280 N 0.03 2.61 2.75 0.83 0.00 -0.09 0.10 105.19 111.42 3h1j n GLY 280 Ca -0.01 -1.13 -0.28 0.00 0.00 0.00 0.00 46.02 44.60 3h1j n GLY 280 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1j n ALA 281 N 1.17 4.59 -1.00 4.61 0.00 -1.26 -1.91 120.51 126.71 3h1j n ALA 281 Ca 0.00 -4.73 0.00 0.00 0.00 0.00 0.00 53.44 48.71 3h1j n ALA 281 Cb 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3h1j n ALA 281 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1j n GLY 282 N 0.18 -3.62 0.68 0.00 0.00 -1.26 -4.96 105.19 96.22 3h1j n GLY 282 Ca 0.31 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.68 3h1j n GLY 282 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h1j n PRO 283 N 0.31 0.00 0.00 1.61 -0.04 -1.26 -4.96 135.00 130.66 3h1j n PRO 283 Ca 0.00 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.47 3h1j n PRO 283 Cb 0.00 -0.21 -0.01 0.00 -0.04 0.00 0.00 33.50 33.24 3h1j n PRO 283 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3h1j n LEU 284 N 0.53 0.26 -4.18 1.53 4.77 -1.26 -4.98 117.00 113.67 3h1j n LEU 284 Ca 0.02 -0.55 -0.32 0.00 -0.03 0.00 0.00 56.01 55.13 3h1j n LEU 284 Cb 0.10 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.02 3h1j n LEU 284 CO 0.11 0.06 -0.55 0.27 -1.33 0.00 0.00 177.39 175.96 3h1j s ILE 285 N -1.20 2.02 -0.37 -0.08 -4.36 -1.26 -5.05 121.20 110.90 3h1j s ILE 285 Ca 0.01 -0.97 -0.42 0.00 -0.26 0.00 0.00 60.65 59.02 3h1j s ILE 285 Cb 0.02 -1.78 -0.17 0.00 1.25 0.00 0.00 42.46 41.79 3h1j s ILE 285 CO 0.12 0.54 1.83 1.17 0.24 0.00 0.00 174.94 178.84 3h1j n LYS 286 N 3.93 0.71 -2.34 0.37 4.81 -1.26 0.22 118.16 124.61 3h1j n LYS 286 Ca -0.20 0.25 -0.21 0.00 -0.87 0.00 0.00 58.31 57.28 3h1j n LYS 286 Cb 0.52 -1.93 -0.02 0.00 0.02 0.00 0.00 35.03 33.62 3h1j n LYS 286 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 3h1j n ARG 287 N 5.75 -1.67 0.00 1.64 1.74 -1.26 -4.96 116.66 117.89 3h1j n ARG 287 Ca 0.34 1.03 0.00 0.00 -0.77 0.00 0.00 57.85 58.44 3h1j n ARG 287 Cb 0.07 -5.67 0.00 0.00 -1.02 0.00 0.00 32.46 25.84 3h1j n ARG 287 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3h1j n GLY 288 N -0.97 -3.31 0.00 -0.13 0.00 0.59 -5.02 105.19 96.35 3h1j n GLY 288 Ca -0.24 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.56 3h1j n GLY 288 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3h1j n SER 289 N -0.34 2.97 -3.11 1.61 2.88 -1.26 -5.05 113.62 111.32 3h1j n SER 289 Ca 0.00 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.48 3h1j n SER 289 Cb 0.00 0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 3h1j n SER 289 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3h1j n SER 290 N -1.01 -7.43 0.12 -3.46 7.64 -1.26 -4.74 113.62 103.48 3h1j n SER 290 Ca 0.00 -0.02 -0.20 0.00 1.01 0.00 0.00 58.87 59.66 3h1j n SER 290 Cb 0.07 -4.79 -0.14 0.00 -1.01 0.00 0.00 64.21 58.34 3h1j n SER 290 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 3h1j h VAL 291 N 0.84 1.38 0.00 0.44 2.07 -2.01 -3.07 116.25 115.89 3h1j h VAL 291 Ca -0.09 -2.79 0.00 0.00 0.82 0.00 0.00 66.70 64.63 3h1j h VAL 291 Cb 1.06 2.91 0.00 0.00 -1.52 0.00 0.00 31.29 33.74 3h1j h VAL 291 CO 0.28 0.83 0.00 0.41 0.02 0.00 0.00 177.57 179.11 3h1j n THR 292 N -3.66 0.00 -3.72 2.57 -1.04 -1.26 -4.37 114.28 102.80 3h1j n THR 292 Ca -0.12 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.51 3h1j n THR 292 Cb 1.04 -0.56 -0.11 0.00 -1.82 0.00 0.00 70.33 68.87 3h1j n THR 292 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3h1j s SER 293 N -1.81 5.37 0.11 8.00 0.15 -1.16 -4.61 113.70 119.75 3h1j s SER 293 Ca 0.10 -1.70 -0.28 0.00 0.70 0.00 0.00 55.95 54.78 3h1j s SER 293 Cb 0.05 -1.88 -0.08 0.00 -1.71 0.00 0.00 66.02 62.39 3h1j s SER 293 CO 0.08 -0.50 1.62 0.11 1.20 0.00 0.00 173.24 175.74 3h1j h LYS 294 N 8.20 -0.50 0.29 5.44 1.79 -1.29 -1.73 116.57 128.77 3h1j h LYS 294 Ca -0.19 0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.31 3h1j h LYS 294 Cb 1.07 0.11 -0.02 0.00 -1.58 0.00 0.00 32.23 31.81 3h1j h LYS 294 CO 0.70 -0.33 -0.33 1.25 -1.08 0.00 0.00 179.45 179.66 3h1j h LEU 295 N -0.52 -0.91 -0.13 2.94 5.85 0.39 0.12 115.31 123.05 3h1j h LEU 295 Ca 0.03 0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.84 3h1j h LEU 295 Cb 0.56 0.30 -0.02 0.00 0.37 0.00 0.00 40.66 41.87 3h1j h LEU 295 CO -0.19 -0.42 -0.12 0.22 -0.34 0.00 0.00 178.44 177.59 3h1j h TYR 296 N -0.62 -0.38 -0.95 1.25 5.03 -1.67 0.68 116.97 120.30 3h1j h TYR 296 Ca -0.04 0.02 0.30 0.00 2.58 0.00 0.00 58.73 61.60 3h1j h TYR 296 Cb 0.55 0.18 -0.16 0.00 1.55 0.00 0.00 36.73 38.85 3h1j h TYR 296 CO -0.21 -0.10 0.30 1.96 -1.32 0.00 0.00 178.16 178.79 3h1j h GLN 297 N -0.05 0.12 -0.25 1.82 1.08 -1.27 0.84 115.11 117.39 3h1j h GLN 297 Ca 0.02 -0.01 -0.01 0.00 -1.45 0.00 0.00 58.65 57.20 3h1j h GLN 297 Cb 0.11 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 3h1j h GLN 297 CO -0.16 0.08 0.12 0.78 -0.95 0.00 0.00 178.83 178.70 3h1j h GLY 298 N 0.13 0.39 1.58 3.46 0.00 0.15 -2.82 103.07 105.96 3h1j h GLY 298 Ca 0.66 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.73 3h1j h GLY 298 CO -0.75 0.19 -0.04 -2.08 0.00 0.00 0.00 176.54 173.86 3h1j h VAL 299 N 0.28 1.21 0.18 4.60 2.07 0.57 -2.92 116.25 122.23 3h1j h VAL 299 Ca 0.09 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 3h1j h VAL 299 Cb 0.13 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3h1j h VAL 299 CO -0.01 0.29 -0.09 0.00 0.02 0.00 0.00 177.57 177.78 3h1j h ALA 300 N 1.47 -0.24 0.00 1.67 0.00 -1.23 0.36 119.26 121.30 3h1j h ALA 300 Ca 0.10 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3h1j h ALA 300 Cb 0.38 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3h1j h ALA 300 CO 0.02 -0.63 0.00 1.63 0.00 0.00 0.00 179.25 180.27 3h1j n LYS 301 N -5.19 0.10 -0.02 0.00 5.02 -1.08 -2.32 118.16 114.68 3h1j n LYS 301 Ca -0.09 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.18 3h1j n LYS 301 Cb 0.12 -1.28 -0.02 0.00 -0.02 0.00 0.00 35.03 33.83 3h1j n LYS 301 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h1j n ALA 302 N -0.78 1.91 -2.35 7.82 0.00 -0.02 -5.08 120.51 122.01 3h1j n ALA 302 Ca 0.01 -0.19 -0.24 0.00 0.00 0.00 0.00 53.44 53.03 3h1j n ALA 302 Cb 0.01 0.34 -0.04 0.00 0.00 0.00 0.00 19.45 19.75 3h1j n ALA 302 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3h1j s THR 303 N -2.08 2.21 -0.16 0.00 -1.32 -0.39 -4.93 115.64 108.98 3h1j s THR 303 Ca -0.04 -1.52 -0.02 0.00 -1.21 0.00 0.00 61.69 58.89 3h1j s THR 303 Cb 0.01 -2.73 -0.09 0.00 -1.51 0.00 0.00 72.50 68.18 3h1j s THR 303 CO 0.11 0.00 -0.17 0.35 -2.21 0.00 0.00 174.62 172.70 3h1j n THR 304 N -1.50 0.90 -2.02 5.08 -2.24 -1.26 -4.84 114.28 108.39 3h1j n THR 304 Ca 0.00 -0.30 -0.28 0.00 -2.27 0.00 0.00 64.05 61.20 3h1j n THR 304 Cb 0.64 -1.31 0.10 0.00 -2.10 0.00 0.00 70.33 67.66 3h1j n THR 304 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3h1j s GLN 305 N -2.31 1.80 0.68 -0.78 -1.52 -1.26 -5.04 119.66 111.23 3h1j s GLN 305 Ca -0.22 -0.13 -0.17 0.00 -1.95 0.00 0.00 55.36 52.89 3h1j s GLN 305 Cb 0.07 -2.01 0.01 0.00 -0.22 0.00 0.00 33.01 30.85 3h1j s GLN 305 CO 0.33 -1.62 1.24 -2.30 -0.25 0.00 0.00 175.29 172.69 3h1j n PRO 306 N -3.26 0.89 -3.76 2.91 -0.02 -1.26 -4.99 135.00 125.52 3h1j n PRO 306 Ca 0.09 0.36 -0.01 0.00 -2.02 0.00 0.00 63.50 61.93 3h1j n PRO 306 Cb 0.61 -2.48 0.02 0.00 -0.02 0.00 0.00 33.50 31.62 3h1j n PRO 306 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 3h1j n PHE 307 N -2.21 -1.03 -3.65 6.00 1.16 -1.26 -4.14 117.46 112.32 3h1j n PHE 307 Ca 0.15 -1.04 -0.10 0.00 -1.87 0.00 0.00 57.45 54.59 3h1j n PHE 307 Cb 0.49 0.50 -0.08 0.00 -1.61 0.00 0.00 39.48 38.78 3h1j n PHE 307 CO 0.00 0.00 0.00 0.34 -1.87 0.00 0.00 176.76 175.23 3h1j s ASP 308 N -3.40 -0.79 -0.09 5.98 2.15 0.23 -5.00 116.67 115.76 3h1j s ASP 308 Ca 0.23 1.36 -0.05 0.00 0.43 0.00 0.00 52.55 54.52 3h1j s ASP 308 Cb -0.02 1.29 0.04 0.00 -0.30 0.00 0.00 42.92 43.93 3h1j s ASP 308 CO 0.03 -0.23 0.22 0.00 -0.17 0.00 0.00 175.17 175.02 3h1j s ALA 309 N 1.09 -0.49 0.27 3.66 0.00 -1.26 0.58 121.76 125.60 3h1j s ALA 309 Ca -0.06 0.84 0.03 0.00 0.00 0.00 0.00 51.96 52.76 3h1j s ALA 309 Cb -0.05 -0.53 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 3h1j s ALA 309 CO -0.11 -0.17 0.18 -1.12 0.00 0.00 0.00 175.76 174.54 3h1j s SER 310 N 0.95 1.05 -0.34 0.00 0.01 -0.05 -4.39 113.70 110.93 3h1j s SER 310 Ca -0.07 -1.54 -0.18 0.00 1.31 0.00 0.00 55.95 55.47 3h1j s SER 310 Cb -0.08 0.42 -0.01 0.00 0.21 0.00 0.00 66.02 66.56 3h1j s SER 310 CO -0.06 -0.91 0.53 0.00 0.41 0.00 0.00 173.24 173.21 3h1j s ALA 311 N -3.78 3.48 0.03 1.44 0.00 -0.80 -1.72 121.76 120.42 3h1j s ALA 311 Ca 0.38 -0.96 -0.21 0.00 0.00 0.00 0.00 51.96 51.18 3h1j s ALA 311 Cb 0.05 -3.02 -0.06 0.00 0.00 0.00 0.00 23.12 20.09 3h1j s ALA 311 CO 0.18 -1.19 0.61 0.12 0.00 0.00 0.00 175.76 175.49 3h1j s PHE 312 N 2.42 3.74 -0.30 0.00 5.36 0.45 -4.84 117.98 124.81 3h1j s PHE 312 Ca 0.19 1.27 -0.07 0.00 -0.96 0.00 0.00 56.93 57.37 3h1j s PHE 312 Cb -0.15 -2.60 0.15 0.00 -0.34 0.00 0.00 43.02 40.08 3h1j s PHE 312 CO 0.13 0.43 0.65 1.21 -1.46 0.00 0.00 175.22 176.18 3h1j s ASN 313 N -0.53 -1.20 0.04 6.13 2.47 -1.26 -1.43 114.94 119.15 3h1j s ASN 313 Ca 0.31 1.26 0.07 0.00 0.42 0.00 0.00 52.86 54.92 3h1j s ASN 313 Cb -0.19 2.21 -0.02 0.00 -1.45 0.00 0.00 41.25 41.80 3h1j s ASN 313 CO 0.19 -0.23 -0.20 -0.69 -3.72 0.00 0.00 177.10 172.45 3h1j s VAL 314 N 2.87 1.59 -0.24 -5.21 1.01 -0.48 -5.03 120.40 114.91 3h1j s VAL 314 Ca 0.04 -1.15 0.00 0.00 0.00 0.00 0.00 61.98 60.88 3h1j s VAL 314 Cb -0.13 -1.38 0.07 0.00 0.00 0.00 0.00 36.38 34.93 3h1j s VAL 314 CO -0.20 0.20 -0.02 0.20 0.00 0.00 0.00 175.10 175.29 3h1j s ASN 315 N -1.12 3.75 0.37 3.32 0.01 -1.26 -2.10 114.94 117.91 3h1j s ASN 315 Ca 0.07 -1.21 0.07 0.00 -0.71 0.00 0.00 52.86 51.08 3h1j s ASN 315 Cb -0.09 -1.07 -0.01 0.00 0.41 0.00 0.00 41.25 40.50 3h1j s ASN 315 CO 0.02 -0.27 0.44 -0.31 -1.51 0.00 0.00 177.10 175.46 3h1j s TYR 316 N 1.47 2.90 0.04 2.20 4.12 0.13 -4.63 117.35 123.60 3h1j s TYR 316 Ca -0.02 -0.34 -0.11 0.00 0.02 0.00 0.00 57.07 56.61 3h1j s TYR 316 Cb -0.18 -2.09 -0.04 0.00 -1.52 0.00 0.00 41.96 38.13 3h1j s TYR 316 CO -0.09 -0.10 1.18 0.66 0.02 0.00 0.00 175.55 177.23 3h1j h SER 317 N 0.93 -0.63 -0.77 2.29 4.64 -1.94 -2.22 113.55 115.85 3h1j h SER 317 Ca -0.43 0.08 -0.38 0.00 -0.47 0.00 0.00 61.79 60.60 3h1j h SER 317 Cb 1.26 0.26 -0.22 0.00 -0.31 0.00 0.00 62.40 63.39 3h1j h SER 317 CO 0.53 -0.14 0.38 -0.90 -0.87 0.00 0.00 176.83 175.83 3h1j n ASP 318 N -3.61 3.50 0.00 4.97 5.68 -1.26 -3.73 116.55 122.10 3h1j n ASP 318 Ca -0.01 -3.61 0.00 0.00 -0.50 0.00 0.00 54.79 50.67 3h1j n ASP 318 Cb 0.12 -0.76 0.00 0.00 -1.14 0.00 0.00 41.12 39.33 3h1j n ASP 318 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 3h1j n SER 319 N -1.02 0.00 -3.65 -1.12 2.88 -1.17 -4.77 113.62 104.77 3h1j n SER 319 Ca 0.49 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.99 3h1j n SER 319 Cb 1.44 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.90 3h1j n SER 319 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3h1j s GLY 320 N 0.00 -0.10 0.02 0.46 0.00 -1.26 -0.69 107.32 105.75 3h1j s GLY 320 Ca 0.00 -0.11 0.03 0.00 0.00 0.00 0.00 44.72 44.63 3h1j s GLY 320 CO 0.00 0.27 -0.09 1.08 0.00 0.00 0.00 173.10 174.35 3h1j s LEU 321 N -3.01 2.11 -0.17 0.66 1.43 -0.89 0.54 118.68 119.35 3h1j s LEU 321 Ca 0.14 -0.31 -0.15 0.00 -1.03 0.00 0.00 54.13 52.77 3h1j s LEU 321 Cb -0.03 -0.39 0.04 0.00 0.03 0.00 0.00 46.19 45.85 3h1j s LEU 321 CO 0.05 0.01 0.44 0.12 0.23 0.00 0.00 176.35 177.19 3h1j s PHE 322 N -0.63 -0.49 -2.08 0.29 5.36 -0.40 -1.39 117.98 118.64 3h1j s PHE 322 Ca -0.01 1.18 0.00 0.00 -0.96 0.00 0.00 56.93 57.15 3h1j s PHE 322 Cb -0.06 0.17 0.00 0.00 -0.34 0.00 0.00 43.02 42.79 3h1j s PHE 322 CO 0.00 -0.23 0.00 0.41 -1.46 0.00 0.00 175.22 173.94 3h1j n GLY 323 N 2.87 -0.67 3.10 13.12 0.00 -0.52 -0.34 105.19 122.74 3h1j n GLY 323 Ca -0.13 -0.46 -0.17 0.00 0.00 0.00 0.00 46.02 45.26 3h1j n GLY 323 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h1j s PHE 324 N -4.00 0.93 -0.12 1.61 -0.12 -0.21 0.17 117.98 116.24 3h1j s PHE 324 Ca 0.00 -0.39 0.02 0.00 -0.05 0.00 0.00 56.93 56.51 3h1j s PHE 324 Cb 0.00 -0.55 -0.00 0.00 -0.63 0.00 0.00 43.02 41.84 3h1j s PHE 324 CO 0.00 -0.01 -0.19 -0.47 -0.05 0.00 0.00 175.22 174.50 3h1j s TYR 325 N -1.01 2.67 0.17 3.49 6.04 -0.70 -1.11 117.35 126.91 3h1j s TYR 325 Ca -0.03 -0.93 0.09 0.00 0.04 0.00 0.00 57.07 56.24 3h1j s TYR 325 Cb -0.08 -1.78 -0.04 0.00 -1.04 0.00 0.00 41.96 39.02 3h1j s TYR 325 CO 0.01 -0.36 -0.19 0.95 -1.54 0.00 0.00 175.55 174.42 3h1j s THR 326 N 0.42 1.88 -0.04 4.34 -4.23 0.81 -0.87 115.64 117.94 3h1j s THR 326 Ca -0.14 -1.95 -0.00 0.00 -1.18 0.00 0.00 61.69 58.42 3h1j s THR 326 Cb -0.17 -1.88 0.03 0.00 1.34 0.00 0.00 72.50 71.81 3h1j s THR 326 CO 0.06 -0.31 0.01 -0.63 -0.54 0.00 0.00 174.62 173.21 3h1j s ILE 327 N -2.06 0.21 0.36 2.99 1.01 0.20 -0.98 121.20 122.93 3h1j s ILE 327 Ca 0.17 0.13 -0.16 0.00 0.00 0.00 0.00 60.65 60.78 3h1j s ILE 327 Cb -0.06 -0.34 0.05 0.00 0.01 0.00 0.00 42.46 42.12 3h1j s ILE 327 CO 0.07 0.18 0.76 -0.94 0.00 0.00 0.00 174.94 175.01 3h1j s SER 328 N 1.40 -0.00 0.62 3.58 1.04 -1.06 -0.60 113.70 118.68 3h1j s SER 328 Ca -0.04 -1.07 -0.17 0.00 0.48 0.00 0.00 55.95 55.15 3h1j s SER 328 Cb -0.13 0.82 -0.02 0.00 0.10 0.00 0.00 66.02 66.79 3h1j s SER 328 CO -0.03 -1.61 1.14 -1.10 0.98 0.00 0.00 173.24 172.63 3h1j s GLN 329 N -2.65 2.91 0.15 4.02 -0.21 -1.26 -0.95 119.66 121.67 3h1j s GLN 329 Ca 0.15 1.55 -0.19 0.00 0.02 0.00 0.00 55.36 56.90 3h1j s GLN 329 Cb -0.05 -1.95 0.04 0.00 1.00 0.00 0.00 33.01 32.05 3h1j s GLN 329 CO 0.11 -1.19 1.68 0.00 -2.12 0.00 0.00 175.29 173.76 3h1j h ALA 330 N 0.44 0.15 -0.86 6.09 0.00 -1.80 -2.65 119.26 120.63 3h1j h ALA 330 Ca -0.48 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 3h1j h ALA 330 Cb 1.26 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 19.28 3h1j h ALA 330 CO 0.54 -0.49 0.51 0.00 0.00 0.00 0.00 179.25 179.81 3h1j h ALA 331 N 1.23 1.10 -0.23 0.00 0.00 -1.89 -2.28 119.26 117.18 3h1j h ALA 331 Ca 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3h1j h ALA 331 Cb 0.26 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3h1j h ALA 331 CO -0.33 0.57 0.00 0.72 0.00 0.00 0.00 179.25 180.21 3h1j n HIS 332 N -4.41 0.80 -0.12 0.00 8.25 -1.06 -4.14 115.22 114.54 3h1j n HIS 332 Ca 0.09 -0.28 -0.10 0.00 -0.26 0.00 0.00 57.72 57.17 3h1j n HIS 332 Cb 0.06 -0.24 -0.02 0.00 1.12 0.00 0.00 29.99 30.91 3h1j n HIS 332 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h1j h ALA 333 N 2.86 0.47 0.31 -1.41 0.00 -1.06 -1.57 119.26 118.86 3h1j h ALA 333 Ca 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 54.91 54.69 3h1j h ALA 333 Cb 1.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3h1j h ALA 333 CO 0.18 0.19 -0.28 0.78 0.00 0.00 0.00 179.25 180.12 3h1j h GLY 334 N 0.42 -0.65 0.87 0.00 0.00 -1.44 -1.21 103.07 101.06 3h1j h GLY 334 Ca 0.10 0.32 -0.01 0.00 0.00 0.00 0.00 47.33 47.74 3h1j h GLY 334 CO 0.01 -0.25 -0.09 1.05 0.00 0.00 0.00 176.54 177.26 3h1j h GLU 335 N -0.61 -0.25 -0.63 4.80 4.11 -1.84 -1.62 114.58 118.54 3h1j h GLU 335 Ca -0.02 0.02 0.11 0.00 0.07 0.00 0.00 59.36 59.53 3h1j h GLU 335 Cb 0.55 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.77 3h1j h GLU 335 CO -0.04 -0.06 0.22 0.28 0.07 0.00 0.00 179.01 179.48 3h1j h VAL 336 N -0.39 0.72 0.08 -1.06 2.07 -1.28 0.22 116.25 116.62 3h1j h VAL 336 Ca -0.03 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 3h1j h VAL 336 Cb 0.30 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 3h1j h VAL 336 CO 0.04 0.07 -0.04 0.40 0.02 0.00 0.00 177.57 178.06 3h1j h ILE 337 N 0.38 1.09 -0.36 4.57 2.04 -1.14 -2.63 117.51 121.45 3h1j h ILE 337 Ca 0.33 -0.61 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 3h1j h ILE 337 Cb 0.44 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 3h1j h ILE 337 CO -0.34 0.15 0.11 0.03 0.00 0.00 0.00 178.15 178.10 3h1j h ARG 338 N -0.39 0.56 -0.14 2.37 3.08 -1.06 -1.87 114.38 116.92 3h1j h ARG 338 Ca -0.01 -0.12 0.04 0.00 0.07 0.00 0.00 59.98 59.96 3h1j h ARG 338 Cb 0.33 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3h1j h ARG 338 CO 0.02 0.58 0.21 0.00 -1.07 0.00 0.00 179.97 179.71 3h1j h ALA 339 N 0.96 1.63 0.00 0.04 0.00 -0.60 0.47 119.26 121.76 3h1j h ALA 339 Ca 0.12 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3h1j h ALA 339 Cb 0.25 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3h1j h ALA 339 CO -0.00 -0.29 -0.53 0.00 0.00 0.00 0.00 179.25 178.43 3h1j h ALA 340 N 1.71 0.74 0.14 0.00 0.00 -0.96 -2.67 119.26 118.22 3h1j h ALA 340 Ca 0.07 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 3h1j h ALA 340 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.28 3h1j h ALA 340 CO -0.00 0.43 -0.07 0.52 0.00 0.00 0.00 179.25 180.14 3h1j h MET 341 N 0.00 -0.18 -0.83 0.00 2.07 0.30 -2.97 114.93 113.32 3h1j h MET 341 Ca -0.02 0.01 0.11 0.00 -2.07 0.00 0.00 59.70 57.73 3h1j h MET 341 Cb 1.27 0.04 -0.06 0.00 -1.87 0.00 0.00 31.60 30.98 3h1j h MET 341 CO 0.04 0.18 0.54 -0.91 1.07 0.00 0.00 176.91 177.83 3h1j h ASN 342 N -0.97 0.67 0.33 1.22 2.35 -1.47 0.69 115.58 118.40 3h1j h ASN 342 Ca -0.02 0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 3h1j h ASN 342 Cb 0.44 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.69 3h1j h ASN 342 CO 0.03 0.38 -0.10 -0.61 -1.65 0.00 0.00 177.43 175.48 3h1j h GLN 343 N 0.73 0.00 0.00 0.81 5.75 -1.53 0.74 115.11 121.60 3h1j h GLN 343 Ca 0.39 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.72 3h1j h GLN 343 Cb 0.51 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.03 3h1j h GLN 343 CO -0.16 0.10 -1.44 -0.11 -2.65 0.00 0.00 178.83 174.58 3h1j n LEU 344 N -3.66 0.85 0.03 -2.39 7.94 0.22 -3.78 117.00 116.22 3h1j n LEU 344 Ca -0.02 0.38 -0.19 0.00 -1.11 0.00 0.00 56.01 55.07 3h1j n LEU 344 Cb 0.22 0.08 -0.13 0.00 0.53 0.00 0.00 43.42 44.12 3h1j n LEU 344 CO 0.30 0.16 0.16 0.11 -1.11 0.00 0.00 177.39 177.00 3h1j h LYS 345 N 0.00 0.36 -0.47 1.96 1.57 -0.42 -2.85 116.57 116.72 3h1j h LYS 345 Ca -0.17 -0.48 0.14 0.00 -1.87 0.00 0.00 60.65 58.27 3h1j h LYS 345 Cb 1.60 0.16 -0.02 0.00 0.08 0.00 0.00 32.23 34.05 3h1j h LYS 345 CO 0.05 1.17 0.40 0.00 -0.57 0.00 0.00 179.45 180.50 3h1j h ALA 346 N 0.22 2.30 0.00 3.86 0.00 -1.02 0.83 119.26 125.44 3h1j h ALA 346 Ca -0.11 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.61 3h1j h ALA 346 Cb 1.46 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.26 3h1j h ALA 346 CO 0.14 -0.65 -0.99 0.00 0.00 0.00 0.00 179.25 177.75 3h1j h ALA 347 N 1.64 0.57 0.00 0.00 0.00 -1.64 0.13 119.26 119.95 3h1j h ALA 347 Ca 0.23 -0.82 0.00 0.00 0.00 0.00 0.00 54.91 54.32 3h1j h ALA 347 Cb 1.03 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3h1j h ALA 347 CO -0.00 1.03 0.00 0.00 0.00 0.00 0.00 179.25 180.27 3h1j h ALA 348 N 1.24 1.00 -1.82 0.00 0.00 0.75 -3.27 119.26 117.16 3h1j h ALA 348 Ca -0.07 0.00 -0.70 0.00 0.00 0.00 0.00 54.91 54.14 3h1j h ALA 348 Cb 1.64 0.00 -0.34 0.00 0.00 0.00 0.00 17.79 19.09 3h1j h ALA 348 CO 0.09 0.00 0.20 1.04 0.00 0.00 0.00 179.25 180.58 3h1j n GLN 349 N -2.85 4.19 -1.05 0.00 6.02 0.59 -4.67 117.38 119.61 3h1j n GLN 349 Ca 0.03 -4.73 -0.04 0.00 -0.01 0.00 0.00 57.00 52.25 3h1j n GLN 349 Cb 0.43 -2.37 -0.02 0.00 1.02 0.00 0.00 30.24 29.30 3h1j n GLN 349 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h1j n GLY 350 N 0.14 0.37 1.14 1.08 0.00 -1.24 -4.84 105.19 101.84 3h1j n GLY 350 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.39 3h1j n GLY 350 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h1j n GLY 351 N 0.67 1.58 3.10 -0.02 0.00 0.45 -4.72 105.19 106.25 3h1j n GLY 351 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 3h1j n GLY 351 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h1j s VAL 352 N 0.32 1.64 0.28 1.61 1.01 -1.26 -4.63 120.40 119.37 3h1j s VAL 352 Ca 0.00 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 3h1j s VAL 352 Cb 0.00 -1.48 -0.06 0.00 0.00 0.00 0.00 36.38 34.84 3h1j s VAL 352 CO 0.00 0.47 0.58 -0.89 0.00 0.00 0.00 175.10 175.26 3h1j s THR 353 N 0.83 4.95 0.32 3.92 2.01 -1.26 -4.95 115.64 121.45 3h1j s THR 353 Ca -0.09 0.32 0.35 0.00 0.31 0.00 0.00 61.69 62.57 3h1j s THR 353 Cb -0.16 -3.68 0.38 0.00 0.01 0.00 0.00 72.50 69.05 3h1j s THR 353 CO 0.00 -0.24 2.10 -0.08 -0.69 0.00 0.00 174.62 175.71 3h1j h GLU 354 N 1.99 0.00 0.05 4.92 4.57 -1.99 -0.81 114.58 123.32 3h1j h GLU 354 Ca -0.47 0.00 -0.25 0.00 -1.18 0.00 0.00 59.36 57.46 3h1j h GLU 354 Cb 1.18 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 3h1j h GLU 354 CO 0.67 0.04 -1.18 1.49 -1.18 0.00 0.00 179.01 178.85 3h1j h GLU 355 N 0.00 0.11 -0.04 1.92 4.81 -1.99 -2.55 114.58 116.85 3h1j h GLU 355 Ca -0.00 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 59.03 3h1j h GLU 355 Cb 0.36 0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 3h1j h GLU 355 CO 0.01 1.05 0.01 -0.44 -0.73 0.00 0.00 179.01 178.90 3h1j h ASP 356 N 0.03 0.06 -0.11 1.04 3.32 -1.57 -1.86 116.42 117.33 3h1j h ASP 356 Ca -0.09 -0.26 0.03 0.00 0.02 0.00 0.00 57.03 56.72 3h1j h ASP 356 Cb 1.88 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 41.41 3h1j h ASP 356 CO 0.15 0.31 0.08 0.58 -1.72 0.00 0.00 179.24 178.64 3h1j h VAL 357 N -0.19 0.93 0.15 -1.35 2.07 -1.31 -1.65 116.25 114.90 3h1j h VAL 357 Ca 0.01 0.00 -0.30 0.00 0.82 0.00 0.00 66.70 67.23 3h1j h VAL 357 Cb 0.27 0.95 0.03 0.00 -1.52 0.00 0.00 31.29 31.02 3h1j h VAL 357 CO 0.00 0.00 -1.29 0.71 0.02 0.00 0.00 177.57 177.01 3h1j h THR 358 N 0.00 1.30 0.33 2.57 1.35 -1.16 -2.90 112.91 114.40 3h1j h THR 358 Ca 0.05 -2.56 -0.02 0.00 -0.55 0.00 0.00 66.41 63.34 3h1j h THR 358 Cb 0.21 2.77 0.00 0.00 -1.73 0.00 0.00 68.15 69.40 3h1j h THR 358 CO -0.00 0.77 -0.16 0.11 -0.25 0.00 0.00 175.52 175.99 3h1j h LYS 359 N 0.23 -0.43 -1.00 4.72 1.57 -0.79 -2.57 116.57 118.30 3h1j h LYS 359 Ca -0.20 0.03 0.20 0.00 -1.87 0.00 0.00 60.65 58.82 3h1j h LYS 359 Cb 1.96 0.10 -0.11 0.00 0.08 0.00 0.00 32.23 34.26 3h1j h LYS 359 CO 0.24 -0.22 0.61 0.00 -0.57 0.00 0.00 179.45 179.52 3h1j h ALA 360 N 0.07 1.73 0.00 3.86 0.00 -1.44 0.67 119.26 124.14 3h1j h ALA 360 Ca -0.05 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3h1j h ALA 360 Cb 0.42 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 3h1j h ALA 360 CO 0.08 -0.12 -0.04 0.87 0.00 0.00 0.00 179.25 180.04 3h1j h LYS 361 N 0.71 0.00 0.00 0.00 1.57 -1.25 0.18 116.57 117.79 3h1j h LYS 361 Ca 0.59 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.32 3h1j h LYS 361 Cb 0.99 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 3h1j h LYS 361 CO -0.39 0.04 -0.43 -0.91 -0.57 0.00 0.00 179.45 177.19 3h1j h ASN 362 N 0.00 0.00 -0.80 0.86 2.35 0.52 -2.48 115.58 116.02 3h1j h ASN 362 Ca -0.00 -0.36 0.19 0.00 -0.55 0.00 0.00 56.30 55.58 3h1j h ASN 362 Cb 0.15 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.39 3h1j h ASN 362 CO 0.01 0.92 0.07 1.56 -1.65 0.00 0.00 177.43 178.34 3h1j h GLN 363 N -1.00 0.13 0.12 0.81 4.20 -0.92 1.32 115.11 119.76 3h1j h GLN 363 Ca -0.08 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 3h1j h GLN 363 Cb 0.68 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 3h1j h GLN 363 CO -0.05 0.09 -0.08 1.25 -0.67 0.00 0.00 178.83 179.37 3h1j h LEU 364 N 0.13 -0.20 -1.21 1.46 5.85 -0.76 0.43 115.31 121.02 3h1j h LEU 364 Ca 0.46 0.01 0.01 0.00 0.84 0.00 0.00 57.88 59.20 3h1j h LEU 364 Cb 0.85 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 3h1j h LEU 364 CO -0.67 -0.13 0.53 0.11 -0.34 0.00 0.00 178.44 177.95 3h1j h LYS 365 N -0.20 1.06 0.21 1.25 1.57 -0.01 -1.70 116.57 118.74 3h1j h LYS 365 Ca -0.01 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3h1j h LYS 365 Cb 0.17 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.24 3h1j h LYS 365 CO 0.00 0.70 -0.10 0.00 -0.57 0.00 0.00 179.45 179.49 3h1j h ALA 366 N 1.50 -0.80 -0.38 3.86 0.00 0.21 -1.97 119.26 121.68 3h1j h ALA 366 Ca 0.30 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.18 3h1j h ALA 366 Cb -0.12 0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 3h1j h ALA 366 CO -0.06 -0.78 -0.22 2.41 0.00 0.00 0.00 179.25 180.59 3h1j n THR 367 N -2.95 -0.26 -0.16 0.00 -1.04 0.14 -0.40 114.28 109.61 3h1j n THR 367 Ca -0.03 1.66 -0.10 0.00 -2.04 0.00 0.00 64.05 63.54 3h1j n THR 367 Cb 0.11 -2.12 -0.07 0.00 -1.82 0.00 0.00 70.33 66.43 3h1j n THR 367 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 3h1j h TYR 368 N 0.00 -1.30 -0.97 -1.42 3.20 -1.40 0.94 116.97 116.02 3h1j h TYR 368 Ca 0.06 0.07 0.22 0.00 3.14 0.00 0.00 58.73 62.22 3h1j h TYR 368 Cb 0.16 0.62 -0.12 0.00 1.54 0.00 0.00 36.73 38.93 3h1j h TYR 368 CO -0.85 -0.34 0.54 -0.07 -1.64 0.00 0.00 178.16 175.80 3h1j h LEU 369 N -0.21 0.62 0.07 2.82 3.38 -0.30 -1.97 115.31 119.71 3h1j h LEU 369 Ca 0.07 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 3h1j h LEU 369 Cb 0.40 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.18 3h1j h LEU 369 CO -0.51 0.13 -0.03 0.24 0.09 0.00 0.00 178.44 178.36 3h1j h MET 370 N 0.59 -0.09 0.00 1.13 2.86 0.39 -3.24 114.93 116.57 3h1j h MET 370 Ca 0.59 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 58.24 3h1j h MET 370 Cb 1.06 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.74 3h1j h MET 370 CO -0.45 0.38 0.66 0.66 1.06 0.00 0.00 176.91 179.21 3h1j h SER 371 N -0.61 0.00 -0.44 1.22 4.64 -0.05 0.41 113.55 118.72 3h1j h SER 371 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3h1j h SER 371 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3h1j h SER 371 CO 0.02 0.00 0.00 1.33 -0.87 0.00 0.00 176.83 177.31 3h1j n VAL 372 N -2.01 1.93 0.09 0.95 0.24 -1.21 -4.20 118.33 114.12 3h1j n VAL 372 Ca -0.00 -1.43 -0.22 0.00 -2.04 0.00 0.00 64.34 60.65 3h1j n VAL 372 Cb 0.67 0.02 -0.13 0.00 -1.47 0.00 0.00 33.84 32.93 3h1j n VAL 372 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 3h1j h GLU 373 N 2.82 0.60 -6.78 7.34 5.08 -0.37 -3.34 114.58 119.94 3h1j h GLU 373 Ca 0.00 -0.82 -0.50 0.00 -1.00 0.00 0.00 59.36 57.04 3h1j h GLU 373 Cb 1.36 0.27 0.01 0.00 0.50 0.00 0.00 28.75 30.89 3h1j h GLU 373 CO 0.21 1.37 0.46 0.95 -1.00 0.00 0.00 179.01 181.00 3h1j s THR 374 N -2.94 3.62 0.33 1.13 -4.23 -1.26 -4.88 115.64 107.40 3h1j s THR 374 Ca -0.10 1.61 0.11 0.00 -1.18 0.00 0.00 61.69 62.13 3h1j s THR 374 Cb 0.05 -4.02 0.34 0.00 1.34 0.00 0.00 72.50 70.21 3h1j s THR 374 CO 0.93 0.37 1.63 0.00 -0.54 0.00 0.00 174.62 177.01 3h1j h ALA 375 N 4.03 1.73 -0.16 3.99 0.00 -1.95 0.13 119.26 127.02 3h1j h ALA 375 Ca -0.46 0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 3h1j h ALA 375 Cb 1.21 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3h1j h ALA 375 CO 0.68 -0.63 -0.38 0.37 0.00 0.00 0.00 179.25 179.28 3h1j h GLN 376 N 0.18 0.55 -0.42 0.00 4.15 -1.95 -2.22 115.11 115.40 3h1j h GLN 376 Ca 0.70 -0.37 0.07 0.00 0.77 0.00 0.00 58.65 59.81 3h1j h GLN 376 Cb 1.60 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 29.29 3h1j h GLN 376 CO -0.69 0.99 0.09 0.78 -1.93 0.00 0.00 178.83 178.06 3h1j h GLY 377 N 0.19 0.51 0.78 2.39 0.00 -0.96 0.15 103.07 106.13 3h1j h GLY 377 Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.29 3h1j h GLY 377 CO 0.08 -0.04 -0.04 -2.00 0.00 0.00 0.00 176.54 174.55 3h1j h LEU 378 N 0.23 -0.09 -2.31 3.11 5.85 -1.36 -0.79 115.31 119.94 3h1j h LEU 378 Ca 0.20 -0.19 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3h1j h LEU 378 Cb 0.25 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3h1j h LEU 378 CO -0.26 0.14 -0.00 0.25 -0.34 0.00 0.00 178.44 178.23 3h1j h LEU 379 N -0.33 0.00 0.22 2.25 5.85 -1.03 0.16 115.31 122.42 3h1j h LEU 379 Ca -0.01 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.39 3h1j h LEU 379 Cb 0.28 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.34 3h1j h LEU 379 CO 0.02 0.00 -1.45 -1.13 -0.34 0.00 0.00 178.44 175.54 3h1j h ASN 380 N 0.00 0.72 -0.20 1.25 -1.24 -0.56 -2.81 115.58 112.75 3h1j h ASN 380 Ca -0.00 -0.93 0.03 0.00 0.71 0.00 0.00 56.30 56.11 3h1j h ASN 380 Cb 0.01 -0.24 -0.03 0.00 0.73 0.00 0.00 38.32 38.79 3h1j h ASN 380 CO 0.00 1.69 0.03 -0.08 -1.29 0.00 0.00 177.43 177.78 3h1j h GLU 381 N 0.04 0.11 0.00 6.67 4.57 -0.10 -0.65 114.58 125.22 3h1j h GLU 381 Ca -0.27 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.91 3h1j h GLU 381 Cb 2.06 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 30.63 3h1j h GLU 381 CO 0.23 0.07 0.00 -0.89 -1.18 0.00 0.00 179.01 177.24 3h1j n ILE 382 N -5.09 0.00 -0.04 2.32 5.41 -0.06 -3.47 119.36 118.43 3h1j n ILE 382 Ca -0.03 1.24 0.24 0.00 1.00 0.00 0.00 62.75 65.21 3h1j n ILE 382 Cb 0.09 -2.20 0.72 0.00 -0.71 0.00 0.00 39.64 37.54 3h1j n ILE 382 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 3h1j h GLY 383 N 0.00 0.00 0.98 7.39 0.00 -1.56 -0.96 103.07 108.92 3h1j h GLY 383 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h1j h GLY 383 CO 0.00 0.00 0.22 1.76 0.00 0.00 0.00 176.54 178.52 3h1j h SER 384 N 0.00 0.44 0.12 0.19 0.02 -1.14 -1.10 113.55 112.08 3h1j h SER 384 Ca 0.31 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 3h1j h SER 384 Cb 1.47 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.90 3h1j h SER 384 CO -0.00 0.37 -0.06 -0.08 -1.14 0.00 0.00 176.83 175.92 3h1j h GLU 385 N 0.48 -0.16 0.00 3.45 4.81 -1.36 -2.33 114.58 119.48 3h1j h GLU 385 Ca 0.13 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 3h1j h GLU 385 Cb 0.01 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.43 3h1j h GLU 385 CO -0.02 0.32 0.30 0.00 -0.73 0.00 0.00 179.01 178.88 3h1j n ALA 386 N -2.57 0.50 -0.10 2.92 0.00 -0.45 -0.04 120.51 120.76 3h1j n ALA 386 Ca -0.07 0.04 -0.14 0.00 0.00 0.00 0.00 53.44 53.26 3h1j n ALA 386 Cb 0.27 -0.55 -0.10 0.00 0.00 0.00 0.00 19.45 19.07 3h1j n ALA 386 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3h1j n LEU 387 N -1.52 2.58 0.07 0.00 7.94 -0.42 -3.28 117.00 122.37 3h1j n LEU 387 Ca -0.00 -0.10 -0.11 0.00 -1.11 0.00 0.00 56.01 54.69 3h1j n LEU 387 Cb 0.31 -0.60 -0.01 0.00 0.53 0.00 0.00 43.42 43.65 3h1j n LEU 387 CO 0.02 0.81 0.26 -0.07 -1.11 0.00 0.00 177.39 177.29 3h1j h LEU 388 N 0.00 0.41 -3.25 -1.96 3.38 0.12 -3.40 115.31 110.62 3h1j h LEU 388 Ca -0.48 -0.32 -0.17 0.00 0.09 0.00 0.00 57.88 57.00 3h1j h LEU 388 Cb 1.79 -0.13 -0.30 0.00 0.09 0.00 0.00 40.66 42.12 3h1j h LEU 388 CO -0.06 1.10 -0.77 -1.54 0.09 0.00 0.00 178.44 177.26 3h1j n SER 389 N -3.74 0.29 -1.45 -0.43 3.41 0.05 -5.02 113.62 106.73 3h1j n SER 389 Ca -0.05 -2.02 0.00 0.00 -0.26 0.00 0.00 58.87 56.54 3h1j n SER 389 Cb 0.79 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.67 3h1j n SER 389 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h1j n GLY 390 N 0.01 -0.24 0.00 5.00 0.00 -1.20 -4.79 105.19 103.97 3h1j n GLY 390 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3h1j n GLY 390 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h1j n THR 391 N -1.23 0.00 -3.01 2.61 -2.24 -1.26 -4.92 114.28 104.22 3h1j n THR 391 Ca 0.00 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.80 3h1j n THR 391 Cb 0.24 -0.06 -0.00 0.00 -2.10 0.00 0.00 70.33 68.41 3h1j n THR 391 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3h1j s HIS 392 N 0.86 -1.09 0.49 4.78 2.46 -1.26 -3.78 115.29 117.74 3h1j s HIS 392 Ca 0.00 0.21 -0.24 0.00 0.47 0.00 0.00 55.06 55.51 3h1j s HIS 392 Cb 0.00 0.20 -0.07 0.00 -0.13 0.00 0.00 32.58 32.58 3h1j s HIS 392 CO 0.00 -0.73 1.40 0.99 -2.47 0.00 0.00 174.74 173.93 3h1j s THR 393 N 2.00 2.06 0.12 0.89 2.01 -1.26 -4.97 115.64 116.49 3h1j s THR 393 Ca 0.16 0.05 -0.15 0.00 0.31 0.00 0.00 61.69 62.05 3h1j s THR 393 Cb -0.01 -3.03 -0.07 0.00 0.01 0.00 0.00 72.50 69.40 3h1j s THR 393 CO -0.12 0.00 0.54 0.00 -0.69 0.00 0.00 174.62 174.35 3h1j s ALA 394 N -1.24 3.59 -0.21 7.40 0.00 -1.26 -4.90 121.76 125.13 3h1j s ALA 394 Ca 0.66 -0.10 0.03 0.00 0.00 0.00 0.00 51.96 52.54 3h1j s ALA 394 Cb -0.42 -2.54 0.16 0.00 0.00 0.00 0.00 23.12 20.32 3h1j s ALA 394 CO 0.53 0.44 0.84 -0.35 0.00 0.00 0.00 175.76 177.22 3h1j n PRO 395 N 1.10 0.02 -0.01 0.00 -0.04 -1.26 0.01 135.00 134.82 3h1j n PRO 395 Ca -0.07 0.31 -0.11 0.00 -0.04 0.00 0.00 63.50 63.59 3h1j n PRO 395 Cb 0.52 -1.93 -0.09 0.00 -0.04 0.00 0.00 33.50 31.96 3h1j n PRO 395 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3h1j h SER 396 N 0.00 -0.07 -0.18 3.54 0.87 -2.00 -3.03 113.55 112.68 3h1j h SER 396 Ca 0.00 -0.55 -0.00 0.00 -1.23 0.00 0.00 61.79 60.00 3h1j h SER 396 Cb 0.71 0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 3h1j h SER 396 CO 0.00 0.62 0.10 0.58 -0.53 0.00 0.00 176.83 177.60 3h1j h VAL 397 N -0.88 1.11 -0.89 2.23 2.07 -0.79 -2.62 116.25 116.48 3h1j h VAL 397 Ca -0.01 -0.31 0.14 0.00 0.82 0.00 0.00 66.70 67.34 3h1j h VAL 397 Cb 0.62 0.99 -0.09 0.00 -1.52 0.00 0.00 31.29 31.29 3h1j h VAL 397 CO 0.01 0.11 0.50 1.62 0.02 0.00 0.00 177.57 179.83 3h1j h VAL 398 N 0.18 0.79 -0.63 2.57 3.04 -1.61 0.21 116.25 120.80 3h1j h VAL 398 Ca 0.06 -0.25 0.04 0.00 -1.01 0.00 0.00 66.70 65.54 3h1j h VAL 398 Cb 0.09 -0.01 -0.04 0.00 -2.01 0.00 0.00 31.29 29.32 3h1j h VAL 398 CO -0.01 0.13 0.41 0.00 -1.01 0.00 0.00 177.57 177.10 3h1j h ALA 399 N 1.55 1.71 0.50 3.17 0.00 -1.34 -2.66 119.26 122.19 3h1j h ALA 399 Ca 0.48 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.33 3h1j h ALA 399 Cb 0.61 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3h1j h ALA 399 CO -0.33 0.21 -0.24 1.96 0.00 0.00 0.00 179.25 180.86 3h1j h GLN 400 N 0.70 -0.64 -0.80 0.00 4.20 -0.40 -2.94 115.11 115.24 3h1j h GLN 400 Ca 0.26 0.04 0.23 0.00 0.06 0.00 0.00 58.65 59.24 3h1j h GLN 400 Cb 0.15 0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.04 3h1j h GLN 400 CO -0.07 -0.34 0.83 0.87 -0.67 0.00 0.00 178.83 179.45 3h1j h LYS 401 N -0.98 0.00 0.03 1.46 1.79 -1.07 -1.49 116.57 116.31 3h1j h LYS 401 Ca -0.07 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 3h1j h LYS 401 Cb 0.60 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 3h1j h LYS 401 CO 0.11 0.00 -0.01 0.82 -1.08 0.00 0.00 179.45 179.29 3h1j h ILE 402 N 0.00 0.00 0.00 1.86 2.04 -1.31 -3.32 117.51 116.78 3h1j h ILE 402 Ca 0.38 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 66.17 3h1j h ILE 402 Cb 2.03 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 3h1j h ILE 402 CO -0.00 0.00 0.00 -0.90 0.00 0.00 0.00 178.15 177.25 3h1j n ASP 403 N -2.28 0.00 0.00 1.72 5.68 -0.81 -0.59 116.55 120.26 3h1j n ASP 403 Ca -0.00 0.20 0.14 0.00 -0.50 0.00 0.00 54.79 54.63 3h1j n ASP 403 Cb 0.01 -0.23 0.69 0.00 -1.14 0.00 0.00 41.12 40.45 3h1j n ASP 403 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3h1j n SER 404 N -1.23 0.00 -4.71 -1.12 3.41 -0.63 -4.73 113.62 104.61 3h1j n SER 404 Ca 0.01 0.10 -0.42 0.00 -0.26 0.00 0.00 58.87 58.30 3h1j n SER 404 Cb 0.01 -0.37 -0.03 0.00 -0.26 0.00 0.00 64.21 63.57 3h1j n SER 404 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3h1j s VAL 405 N -2.73 4.00 0.34 -3.33 1.01 0.24 -5.02 120.40 114.90 3h1j s VAL 405 Ca 0.22 1.44 0.07 0.00 0.00 0.00 0.00 61.98 63.71 3h1j s VAL 405 Cb 0.19 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.64 3h1j s VAL 405 CO 0.47 0.11 0.47 0.42 0.00 0.00 0.00 175.10 176.58 3h1j s THR 406 N 1.05 4.06 0.29 3.92 -4.23 -1.26 -4.99 115.64 114.48 3h1j s THR 406 Ca 0.59 -0.99 0.02 0.00 -1.18 0.00 0.00 61.69 60.13 3h1j s THR 406 Cb -0.30 -3.40 0.29 0.00 1.34 0.00 0.00 72.50 70.43 3h1j s THR 406 CO 0.29 -0.16 1.83 -1.28 -0.54 0.00 0.00 174.62 174.76 3h1j h SER 407 N 0.88 0.90 0.63 3.99 0.87 -1.95 -2.73 113.55 116.13 3h1j h SER 407 Ca -0.46 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.13 3h1j h SER 407 Cb 1.26 -0.12 0.01 0.00 -0.44 0.00 0.00 62.40 63.10 3h1j h SER 407 CO 0.53 0.45 -0.30 0.00 -0.53 0.00 0.00 176.83 176.97 3h1j h ALA 408 N 1.56 -1.11 -0.63 6.23 0.00 -1.98 -2.92 119.26 120.41 3h1j h ALA 408 Ca 0.51 -0.19 0.13 0.00 0.00 0.00 0.00 54.91 55.37 3h1j h ALA 408 Cb 0.57 0.33 -0.12 0.00 0.00 0.00 0.00 17.79 18.57 3h1j h ALA 408 CO -0.29 -1.05 -0.13 -0.25 0.00 0.00 0.00 179.25 177.54 3h1j n ASP 409 N -4.50 -0.20 0.46 0.00 8.00 -1.05 -0.09 116.55 119.18 3h1j n ASP 409 Ca -0.10 1.08 -0.20 0.00 0.71 0.00 0.00 54.79 56.28 3h1j n ASP 409 Cb 0.33 -0.34 -0.10 0.00 -0.02 0.00 0.00 41.12 40.99 3h1j n ASP 409 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3h1j h VAL 410 N 0.00 0.00 -0.00 2.53 2.07 -1.46 -0.15 116.25 119.23 3h1j h VAL 410 Ca 0.32 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.84 3h1j h VAL 410 Cb 0.52 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 30.29 3h1j h VAL 410 CO -0.64 0.00 0.01 0.58 0.02 0.00 0.00 177.57 177.54 3h1j h VAL 411 N -1.26 0.30 0.66 2.57 2.07 -0.41 0.19 116.25 120.37 3h1j h VAL 411 Ca -0.12 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 3h1j h VAL 411 Cb 0.99 0.99 0.01 0.00 -1.52 0.00 0.00 31.29 31.76 3h1j h VAL 411 CO 0.14 0.00 -0.32 0.78 0.02 0.00 0.00 177.57 178.20 3h1j h ASN 412 N 0.00 -0.75 -0.66 0.57 2.35 0.23 -1.05 115.58 116.27 3h1j h ASN 412 Ca 0.00 0.01 0.14 0.00 -0.55 0.00 0.00 56.30 55.90 3h1j h ASN 412 Cb 0.02 0.19 -0.11 0.00 0.05 0.00 0.00 38.32 38.47 3h1j h ASN 412 CO -0.00 -0.37 0.01 0.00 -1.65 0.00 0.00 177.43 175.42 3h1j h ALA 413 N -1.13 0.66 -0.95 -0.83 0.00 -0.16 0.49 119.26 117.35 3h1j h ALA 413 Ca -0.09 0.20 0.22 0.00 0.00 0.00 0.00 54.91 55.24 3h1j h ALA 413 Cb 0.70 0.35 -0.12 0.00 0.00 0.00 0.00 17.79 18.72 3h1j h ALA 413 CO 0.15 -0.40 0.51 0.00 0.00 0.00 0.00 179.25 179.51 3h1j h ALA 414 N 1.60 1.59 -0.02 0.00 0.00 -0.82 -1.12 119.26 120.49 3h1j h ALA 414 Ca 0.35 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.34 3h1j h ALA 414 Cb 0.58 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.41 3h1j h ALA 414 CO -0.56 -0.23 -0.14 0.87 0.00 0.00 0.00 179.25 179.19 3h1j h LYS 415 N 0.56 0.12 -0.25 0.00 1.57 0.12 -3.00 116.57 115.69 3h1j h LYS 415 Ca 0.58 -0.11 0.07 0.00 -1.87 0.00 0.00 60.65 59.32 3h1j h LYS 415 Cb 1.04 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.37 3h1j h LYS 415 CO -0.46 0.80 0.67 -0.22 -0.57 0.00 0.00 179.45 179.67 3h1j h LYS 416 N -0.52 0.00 0.00 3.15 3.64 0.43 0.25 116.57 123.52 3h1j h LYS 416 Ca -0.01 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3h1j h LYS 416 Cb 0.84 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.65 3h1j h LYS 416 CO 0.03 0.00 -0.19 0.35 -2.27 0.00 0.00 179.45 177.37 3h1j h PHE 417 N 0.00 0.00 -0.04 1.91 3.57 -1.32 -2.34 116.94 118.72 3h1j h PHE 417 Ca 0.12 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.63 3h1j h PHE 417 Cb 1.46 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.20 3h1j h PHE 417 CO 0.00 0.47 0.06 0.28 -2.23 0.00 0.00 178.31 176.89 3h1j h VAL 418 N -1.00 0.42 0.00 1.41 2.07 -0.46 -3.17 116.25 115.52 3h1j h VAL 418 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3h1j h VAL 418 Cb 0.52 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 3h1j h VAL 418 CO -0.02 0.00 -0.43 0.77 0.02 0.00 0.00 177.57 177.91 3h1j h SER 419 N 0.00 0.00 -2.71 0.57 4.64 -1.19 -3.49 113.55 111.37 3h1j h SER 419 Ca 0.02 0.00 -0.55 0.00 -0.47 0.00 0.00 61.79 60.79 3h1j h SER 419 Cb 0.13 0.00 0.22 0.00 -0.31 0.00 0.00 62.40 62.44 3h1j h SER 419 CO -0.00 0.70 -1.15 0.61 -0.87 0.00 0.00 176.83 176.12 3h1j n GLY 420 N 1.64 -3.20 3.74 -0.77 0.00 -0.88 -4.91 105.19 100.82 3h1j n GLY 420 Ca -0.06 -0.71 -0.41 0.00 0.00 0.00 0.00 46.02 44.84 3h1j n GLY 420 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3h1j s LYS 421 N -2.71 4.59 0.35 1.61 2.20 -1.26 -4.94 119.74 119.56 3h1j s LYS 421 Ca 0.50 1.76 0.07 0.00 -0.36 0.00 0.00 55.97 57.95 3h1j s LYS 421 Cb -0.22 -3.25 -0.02 0.00 -1.51 0.00 0.00 37.83 32.82 3h1j s LYS 421 CO 0.73 0.07 0.37 0.15 -0.36 0.00 0.00 175.35 176.31 3h1j s LYS 422 N -0.57 2.83 0.15 4.03 1.02 -1.26 -4.28 119.74 121.66 3h1j s LYS 422 Ca 0.49 -1.23 0.07 0.00 0.02 0.00 0.00 55.97 55.32 3h1j s LYS 422 Cb -0.30 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.38 3h1j s LYS 422 CO 0.36 0.04 -0.16 -1.12 -0.92 0.00 0.00 175.35 173.55 3h1j s SER 423 N -4.08 2.35 -0.14 2.83 0.01 -0.08 -4.30 113.70 110.29 3h1j s SER 423 Ca 0.43 -0.85 -0.13 0.00 1.31 0.00 0.00 55.95 56.71 3h1j s SER 423 Cb -0.07 -0.11 0.04 0.00 0.21 0.00 0.00 66.02 66.09 3h1j s SER 423 CO 0.28 -0.10 0.38 -0.32 0.41 0.00 0.00 173.24 173.89 3h1j s MET 424 N -2.82 0.44 -0.02 12.44 1.75 -0.84 -1.85 119.30 128.40 3h1j s MET 424 Ca 0.13 0.55 0.03 0.00 -1.25 0.00 0.00 55.69 55.14 3h1j s MET 424 Cb -0.05 0.19 0.00 0.00 2.84 0.00 0.00 34.83 37.82 3h1j s MET 424 CO 0.05 -0.06 -0.09 0.00 -0.65 0.00 0.00 175.02 174.26 3h1j s ALA 425 N 0.30 0.84 0.19 4.11 0.00 -0.82 -1.27 121.76 125.11 3h1j s ALA 425 Ca -0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 51.96 51.52 3h1j s ALA 425 Cb -0.03 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 3h1j s ALA 425 CO -0.01 0.15 0.29 0.00 0.00 0.00 0.00 175.76 176.20 3h1j s ALA 426 N 0.08 0.21 -0.24 0.00 0.00 -0.88 -1.17 121.76 119.75 3h1j s ALA 426 Ca -0.01 -1.07 -0.27 0.00 0.00 0.00 0.00 51.96 50.61 3h1j s ALA 426 Cb -0.07 1.01 0.12 0.00 0.00 0.00 0.00 23.12 24.18 3h1j s ALA 426 CO 0.00 -0.68 0.98 -1.54 0.00 0.00 0.00 175.76 174.53 3h1j s SER 427 N -3.02 -0.46 0.00 0.00 1.04 -0.70 -1.84 113.70 108.72 3h1j s SER 427 Ca 0.23 0.79 0.00 0.00 0.48 0.00 0.00 55.95 57.45 3h1j s SER 427 Cb 0.03 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.92 3h1j s SER 427 CO 0.05 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.65 3h1j n GLY 428 N 1.83 0.68 3.57 7.32 0.00 -0.56 -1.94 105.19 116.09 3h1j n GLY 428 Ca -0.12 -2.11 -0.38 0.00 0.00 0.00 0.00 46.02 43.41 3h1j n GLY 428 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3h1j s ASP 429 N -4.00 6.25 0.00 1.61 -1.08 -1.09 -1.98 116.67 116.38 3h1j s ASP 429 Ca 0.00 -1.72 0.00 0.00 -0.52 0.00 0.00 52.55 50.31 3h1j s ASP 429 Cb 0.00 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.89 3h1j s ASP 429 CO 0.00 -1.76 0.28 0.18 0.52 0.00 0.00 175.17 174.40 3h1j n LEU 430 N 10.11 0.13 -0.33 -1.34 4.77 -1.26 -4.32 117.00 124.76 3h1j n LEU 430 Ca 0.41 -0.06 0.05 0.00 -0.03 0.00 0.00 56.01 56.38 3h1j n LEU 430 Cb 0.48 -0.06 0.14 0.00 -2.33 0.00 0.00 43.42 41.64 3h1j n LEU 430 CO 0.69 0.03 0.69 1.23 -1.33 0.00 0.00 177.39 178.70 3h1j h GLY 431 N 2.20 0.71 -2.74 -0.72 0.00 -1.89 0.23 103.07 100.87 3h1j h GLY 431 Ca 0.00 0.29 -0.18 0.00 0.00 0.00 0.00 47.33 47.44 3h1j h GLY 431 CO 0.00 -0.36 0.15 1.44 0.00 0.00 0.00 176.54 177.77 3h1j n SER 432 N -5.58 3.86 -4.75 0.19 7.64 -1.26 -4.97 113.62 108.75 3h1j n SER 432 Ca 0.15 -3.36 -0.37 0.00 1.01 0.00 0.00 58.87 56.30 3h1j n SER 432 Cb 0.49 -0.68 -0.07 0.00 -1.01 0.00 0.00 64.21 62.94 3h1j n SER 432 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3h1j s THR 433 N -3.05 5.25 0.47 0.44 2.01 0.07 -1.55 115.64 119.27 3h1j s THR 433 Ca 0.49 0.65 -0.16 0.00 0.31 0.00 0.00 61.69 62.99 3h1j s THR 433 Cb 0.41 -3.67 -0.08 0.00 0.01 0.00 0.00 72.50 69.17 3h1j s THR 433 CO 0.08 0.42 0.92 -2.16 -0.69 0.00 0.00 174.62 173.20 3h1j s PRO 434 N 0.14 3.96 0.39 4.92 0.04 -1.26 -5.00 135.00 138.18 3h1j s PRO 434 Ca 0.19 0.87 -0.11 0.00 0.04 0.00 0.00 61.00 62.00 3h1j s PRO 434 Cb -0.14 -2.21 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 3h1j s PRO 434 CO 0.07 -0.17 0.75 -0.06 0.04 0.00 0.00 177.00 177.63 3h1j s PHE 435 N -2.48 3.46 0.30 0.56 0.40 -1.26 -4.97 117.98 113.99 3h1j s PHE 435 Ca 0.58 1.03 0.03 0.00 -0.60 0.00 0.00 56.93 57.97 3h1j s PHE 435 Cb -0.10 -2.43 0.76 0.00 0.51 0.00 0.00 43.02 41.77 3h1j s PHE 435 CO 0.28 -0.06 1.63 1.25 0.70 0.00 0.00 175.22 179.02 3h1j h LEU 436 N 1.41 -0.02 -4.13 -0.37 5.85 -1.97 -0.91 115.31 115.17 3h1j h LEU 436 Ca -0.47 0.21 -0.25 0.00 0.84 0.00 0.00 57.88 58.21 3h1j h LEU 436 Cb 1.19 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 42.45 3h1j h LEU 436 CO 0.64 -0.19 0.12 -0.90 -0.34 0.00 0.00 178.44 177.77 3h1j n ASP 437 N -5.25 5.67 0.00 1.25 5.75 -1.26 -2.44 116.55 120.27 3h1j n ASP 437 Ca 0.23 -2.50 0.00 0.00 -0.01 0.00 0.00 54.79 52.51 3h1j n ASP 437 Cb 0.73 -1.43 0.00 0.00 -1.03 0.00 0.00 41.12 39.39 3h1j n ASP 437 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3h1j n GLU 438 N 2.61 0.00 0.00 0.11 1.02 -0.34 -5.21 120.64 118.82 3h1j n GLU 438 Ca 0.47 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.73 3h1j n GLU 438 Cb 0.83 -0.11 0.10 0.00 -0.02 0.00 0.00 31.44 32.24 3h1j n GLU 438 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59