#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h6h s THR 2 N 0.00 -0.16 -0.05 4.28 -1.32 -1.25 -4.60 115.64 112.54 3h6h s THR 2 Ca 0.00 0.08 0.03 0.00 -1.21 0.00 0.00 61.69 60.60 3h6h s THR 2 Cb 0.00 -0.44 0.00 0.00 -1.51 0.00 0.00 72.50 70.56 3h6h s THR 2 CO 0.00 -0.08 -0.15 -2.28 -2.21 0.00 0.00 174.62 169.90 3h6h s HIS 3 N 2.20 1.56 -0.26 9.09 5.65 -1.09 -5.02 115.29 127.41 3h6h s HIS 3 Ca 0.04 -0.48 -0.15 0.00 0.25 0.00 0.00 55.06 54.72 3h6h s HIS 3 Cb -0.14 -1.08 -0.04 0.00 -1.18 0.00 0.00 32.58 30.14 3h6h s HIS 3 CO -0.07 -0.19 0.36 0.08 -0.65 0.00 0.00 174.74 174.26 3h6h s VAL 4 N 0.23 5.19 -0.12 0.89 1.01 -1.26 -1.08 120.40 125.25 3h6h s VAL 4 Ca -0.07 0.55 0.01 0.00 0.00 0.00 0.00 61.98 62.47 3h6h s VAL 4 Cb -0.12 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.59 3h6h s VAL 4 CO 0.03 0.17 -0.14 -0.22 0.00 0.00 0.00 175.10 174.94 3h6h s LEU 5 N 1.97 1.67 -0.19 3.92 2.96 -0.91 -4.81 118.68 123.28 3h6h s LEU 5 Ca 0.15 -0.43 -0.02 0.00 -0.22 0.00 0.00 54.13 53.60 3h6h s LEU 5 Cb -0.16 -1.09 -0.01 0.00 0.50 0.00 0.00 46.19 45.44 3h6h s LEU 5 CO 0.10 -0.02 -0.09 -0.60 -1.32 0.00 0.00 176.35 174.42 3h6h s ARG 6 N 1.18 3.32 0.16 1.98 3.52 -1.26 -1.53 118.95 126.32 3h6h s ARG 6 Ca -0.03 -0.67 -0.10 0.00 -0.13 0.00 0.00 55.73 54.80 3h6h s ARG 6 Cb -0.14 -2.85 -0.07 0.00 -1.56 0.00 0.00 34.95 30.33 3h6h s ARG 6 CO -0.05 -0.10 0.49 -0.06 -0.81 0.00 0.00 175.30 174.78 3h6h s PHE 7 N 1.18 3.51 0.08 5.12 0.08 -0.77 -1.66 117.98 125.52 3h6h s PHE 7 Ca 0.02 0.86 0.03 0.00 0.12 0.00 0.00 56.93 57.96 3h6h s PHE 7 Cb -0.14 -2.23 -0.04 0.00 -0.57 0.00 0.00 43.02 40.03 3h6h s PHE 7 CO -0.03 0.39 0.06 0.20 -0.10 0.00 0.00 175.22 175.74 3h6h s GLY 8 N -2.07 2.00 -0.00 4.36 0.00 -0.34 -1.68 107.32 109.59 3h6h s GLY 8 Ca 0.41 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 44.10 3h6h s GLY 8 CO 0.20 -1.00 0.00 -0.32 0.00 0.00 0.00 173.10 171.98 3h6h s GLY 9 N -2.34 0.01 -0.18 0.20 0.00 -0.77 -0.54 107.32 103.70 3h6h s GLY 9 Ca 0.28 0.01 0.00 0.00 0.00 0.00 0.00 44.72 45.02 3h6h s GLY 9 CO 0.21 0.03 -0.17 -0.42 0.00 0.00 0.00 173.10 172.75 3h6h s ILE 10 N 0.05 2.37 0.36 0.90 1.01 -1.16 -1.78 121.20 122.95 3h6h s ILE 10 Ca -0.00 -0.85 0.03 0.00 0.00 0.00 0.00 60.65 59.83 3h6h s ILE 10 Cb -0.01 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 3h6h s ILE 10 CO -0.00 0.52 0.10 -0.36 0.00 0.00 0.00 174.94 175.19 3h6h s PHE 11 N 1.20 1.82 0.29 3.97 0.08 -0.70 -3.74 117.98 120.90 3h6h s PHE 11 Ca 0.02 -1.14 -0.29 0.00 0.12 0.00 0.00 56.93 55.64 3h6h s PHE 11 Cb -0.14 -1.18 -0.09 0.00 -0.57 0.00 0.00 43.02 41.04 3h6h s PHE 11 CO -0.08 -0.18 1.10 -2.00 -0.10 0.00 0.00 175.22 173.95 3h6h s GLU 12 N -3.82 4.60 -0.19 0.44 2.12 -1.26 -1.44 118.70 119.15 3h6h s GLU 12 Ca 0.30 1.78 -0.20 0.00 0.36 0.00 0.00 54.97 57.22 3h6h s GLU 12 Cb 0.06 -3.14 -0.03 0.00 0.26 0.00 0.00 34.13 31.28 3h6h s GLU 12 CO 0.15 0.18 0.58 -0.47 -0.54 0.00 0.00 175.26 175.16 3h6h s TYR 13 N -1.20 3.39 -0.46 5.30 5.04 -0.95 -4.63 117.35 123.84 3h6h s TYR 13 Ca 0.45 0.87 0.03 0.00 -2.44 0.00 0.00 57.07 55.98 3h6h s TYR 13 Cb -0.31 -2.73 0.13 0.00 0.35 0.00 0.00 41.96 39.39 3h6h s TYR 13 CO 0.40 -0.12 0.22 0.54 -1.34 0.00 0.00 175.55 175.25 3h6h s VAL 14 N 1.71 1.96 -1.17 3.14 0.11 -1.26 -4.94 120.40 119.93 3h6h s VAL 14 Ca 0.27 -2.80 0.01 0.00 -2.93 0.00 0.00 61.98 56.52 3h6h s VAL 14 Cb -0.16 -2.38 0.03 0.00 -1.53 0.00 0.00 36.38 32.35 3h6h s VAL 14 CO 0.10 -0.82 0.64 -1.84 -3.33 0.00 0.00 175.10 169.85 3h6h n GLU 15 N 3.49 1.12 0.00 1.54 0.28 -1.26 -3.46 120.64 122.35 3h6h n GLU 15 Ca 0.06 -0.11 0.00 0.00 -0.16 0.00 0.00 57.16 56.95 3h6h n GLU 15 Cb 0.34 -1.43 0.00 0.00 1.43 0.00 0.00 31.44 31.79 3h6h n GLU 15 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 3h6h n SER 16 N -0.07 0.49 0.00 -1.84 3.41 -1.26 -5.12 113.62 109.24 3h6h n SER 16 Ca 0.01 -1.23 0.00 0.00 -0.26 0.00 0.00 58.87 57.39 3h6h n SER 16 Cb 0.23 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.18 3h6h n SER 16 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h6h n GLY 17 N -0.11 -0.96 3.85 5.00 0.00 -1.23 -5.16 105.19 106.58 3h6h n GLY 17 Ca 0.00 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.68 3h6h n GLY 17 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h6h s PRO 18 N -0.44 3.68 0.52 1.61 0.05 -1.26 -4.96 135.00 134.20 3h6h s PRO 18 Ca 0.00 0.86 -0.22 0.00 0.05 0.00 0.00 61.00 61.69 3h6h s PRO 18 Cb 0.00 -2.09 -0.05 0.00 0.05 0.00 0.00 34.50 32.40 3h6h s PRO 18 CO 0.00 -0.50 1.26 0.00 0.05 0.00 0.00 177.00 177.81 3h6h s MET 19 N -4.72 3.33 1.17 4.56 0.23 -1.26 -4.82 119.30 117.79 3h6h s MET 19 Ca 0.57 2.00 -0.15 0.00 -1.03 0.00 0.00 55.69 57.08 3h6h s MET 19 Cb -0.11 -2.25 0.23 0.00 -1.53 0.00 0.00 34.83 31.17 3h6h s MET 19 CO 0.45 -0.96 0.64 0.41 -2.03 0.00 0.00 175.02 173.52 3h6h n GLY 20 N 0.59 -2.26 0.13 3.16 0.00 -1.26 -4.83 105.19 100.71 3h6h n GLY 20 Ca 0.10 -1.05 -0.06 0.00 0.00 0.00 0.00 46.02 45.01 3h6h n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h6h h ALA 21 N -2.50 0.68 0.18 4.61 0.00 -1.98 -2.95 119.26 117.30 3h6h h ALA 21 Ca -0.60 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 53.63 3h6h h ALA 21 Cb 1.35 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3h6h h ALA 21 CO 0.45 0.89 -0.09 0.93 0.00 0.00 0.00 179.25 181.44 3h6h h GLU 22 N 0.07 -0.24 -0.58 0.00 5.08 -1.91 -2.47 114.58 114.54 3h6h h GLU 22 Ca -0.02 0.02 0.13 0.00 -1.00 0.00 0.00 59.36 58.48 3h6h h GLU 22 Cb 1.36 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.63 3h6h h GLU 22 CO 0.11 0.14 0.40 1.49 -1.00 0.00 0.00 179.01 180.14 3h6h h GLU 23 N -0.68 0.23 -0.25 2.33 4.81 -1.93 -0.77 114.58 118.31 3h6h h GLU 23 Ca -0.03 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.01 3h6h h GLU 23 Cb 0.49 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.81 3h6h h GLU 23 CO 0.04 0.15 -0.55 1.25 -0.73 0.00 0.00 179.01 179.17 3h6h h LEU 24 N 0.24 0.85 -0.79 1.64 6.46 -1.48 -2.49 115.31 119.73 3h6h h LEU 24 Ca 0.27 -0.46 -0.12 0.00 -0.12 0.00 0.00 57.88 57.45 3h6h h LEU 24 Cb 0.76 -0.25 -0.01 0.00 -0.73 0.00 0.00 40.66 40.43 3h6h h LEU 24 CO -0.05 1.23 -0.46 0.00 -0.62 0.00 0.00 178.44 178.54 3h6h h ALA 25 N 0.79 0.97 0.37 1.25 0.00 -0.70 -0.61 119.26 121.32 3h6h h ALA 25 Ca 0.01 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.45 3h6h h ALA 25 Cb 1.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3h6h h ALA 25 CO 0.12 0.64 -0.18 0.35 0.00 0.00 0.00 179.25 180.17 3h6h h PHE 26 N 0.27 -0.47 0.00 0.00 3.57 -1.19 -1.59 116.94 117.53 3h6h h PHE 26 Ca 0.02 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.41 3h6h h PHE 26 Cb 0.91 0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.80 3h6h h PHE 26 CO 0.02 -0.29 -0.49 0.00 -2.23 0.00 0.00 178.31 175.32 3h6h h ARG 27 N -0.50 0.00 -0.26 1.11 3.08 -1.34 -2.49 114.38 113.98 3h6h h ARG 27 Ca -0.05 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.82 3h6h h ARG 27 Cb 0.39 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 3h6h h ARG 27 CO 0.08 0.49 -0.56 0.35 -1.07 0.00 0.00 179.97 179.26 3h6h h PHE 28 N 0.00 0.99 0.58 3.04 -0.00 -1.01 -2.63 116.94 117.90 3h6h h PHE 28 Ca -0.00 -0.36 -0.03 0.00 -0.00 0.00 0.00 57.97 57.58 3h6h h PHE 28 Cb 0.87 -0.18 0.01 0.00 -0.00 0.00 0.00 35.95 36.64 3h6h h PHE 28 CO 0.00 1.16 -0.28 0.00 -0.00 0.00 0.00 178.31 179.19 3h6h h ALA 29 N 0.76 -0.77 -0.90 2.41 0.00 -1.10 -1.68 119.26 117.98 3h6h h ALA 29 Ca 0.01 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 54.88 3h6h h ALA 29 Cb 1.15 0.30 -0.16 0.00 0.00 0.00 0.00 17.79 19.08 3h6h h ALA 29 CO 0.12 -0.81 -0.31 0.28 0.00 0.00 0.00 179.25 178.53 3h6h h VAL 30 N -1.03 0.06 -0.71 0.00 2.07 -1.48 0.37 116.25 115.53 3h6h h VAL 30 Ca -0.08 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 3h6h h VAL 30 Cb 0.65 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.45 3h6h h VAL 30 CO 0.13 0.00 0.24 0.78 0.02 0.00 0.00 177.57 178.74 3h6h h ASN 31 N -0.03 1.02 -0.37 0.57 4.21 -1.43 -2.18 115.58 117.37 3h6h h ASN 31 Ca 0.37 -0.20 -0.03 0.00 1.21 0.00 0.00 56.30 57.65 3h6h h ASN 31 Cb 0.62 -0.27 -0.02 0.00 -1.12 0.00 0.00 38.32 37.53 3h6h h ASN 31 CO -0.92 0.94 0.15 0.74 -1.29 0.00 0.00 177.43 177.05 3h6h h THR 32 N 1.03 1.17 0.04 2.81 2.02 0.00 -2.01 112.91 117.97 3h6h h THR 32 Ca 0.23 -0.55 -0.24 0.00 0.77 0.00 0.00 66.41 66.63 3h6h h THR 32 Cb 0.28 0.68 0.02 0.00 -1.74 0.00 0.00 68.15 67.39 3h6h h THR 32 CO -0.01 0.21 -0.96 0.40 0.37 0.00 0.00 175.52 175.53 3h6h h ILE 33 N 0.60 1.33 -0.46 3.11 2.04 -0.88 -2.06 117.51 121.19 3h6h h ILE 33 Ca 0.15 -2.26 0.05 0.00 1.00 0.00 0.00 64.86 63.80 3h6h h ILE 33 Cb 0.15 2.56 -0.05 0.00 -0.74 0.00 0.00 36.82 38.74 3h6h h ILE 33 CO -0.01 0.68 0.18 0.78 0.00 0.00 0.00 178.15 179.78 3h6h h ASN 34 N 0.19 0.21 0.52 1.72 2.35 -1.24 0.26 115.58 119.59 3h6h h ASN 34 Ca -0.13 0.05 -0.01 0.00 -0.55 0.00 0.00 56.30 55.66 3h6h h ASN 34 Cb 1.64 0.02 -0.00 0.00 0.05 0.00 0.00 38.32 40.03 3h6h h ASN 34 CO 0.19 0.16 -0.05 0.03 -1.65 0.00 0.00 177.43 176.10 3h6h h ARG 35 N 0.37 0.00 -5.99 0.81 3.08 -1.34 -3.41 114.38 107.90 3h6h h ARG 35 Ca 0.21 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.69 3h6h h ARG 35 Cb 0.19 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 3h6h h ARG 35 CO -0.20 0.05 0.43 1.21 -1.07 0.00 0.00 179.97 180.39 3h6h s ASN 36 N -5.70 7.00 0.12 7.04 3.84 0.08 -4.94 114.94 122.37 3h6h s ASN 36 Ca -0.02 1.22 -0.04 0.00 0.21 0.00 0.00 52.86 54.23 3h6h s ASN 36 Cb 0.11 -2.47 -0.13 0.00 -0.55 0.00 0.00 41.25 38.22 3h6h s ASN 36 CO 0.52 -0.42 1.27 0.03 -2.79 0.00 0.00 177.10 175.71 3h6h h ARG 37 N 7.31 0.38 0.00 0.43 3.08 -1.81 -3.32 114.38 120.46 3h6h h ARG 37 Ca -0.29 -0.45 -0.11 0.00 0.07 0.00 0.00 59.98 59.21 3h6h h ARG 37 Cb 1.13 0.14 -0.02 0.00 0.08 0.00 0.00 29.97 31.30 3h6h h ARG 37 CO 0.85 1.13 -0.51 1.15 -1.07 0.00 0.00 179.97 181.51 3h6h h THR 38 N 0.20 1.07 -3.49 2.04 2.02 -1.92 -3.25 112.91 109.59 3h6h h THR 38 Ca -0.09 -1.96 -0.64 0.00 0.77 0.00 0.00 66.41 64.49 3h6h h THR 38 Cb 1.65 2.16 -0.21 0.00 -1.74 0.00 0.00 68.15 70.01 3h6h h THR 38 CO 0.17 0.50 -0.62 -0.22 0.37 0.00 0.00 175.52 175.72 3h6h s LEU 39 N -7.02 3.47 -1.16 2.58 2.96 -1.25 -4.60 118.68 113.66 3h6h s LEU 39 Ca 0.01 -0.13 -0.11 0.00 -0.22 0.00 0.00 54.13 53.67 3h6h s LEU 39 Cb 0.11 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.87 3h6h s LEU 39 CO 0.73 0.05 0.81 0.18 -1.32 0.00 0.00 176.35 176.80 3h6h n LEU 40 N 4.32 -3.72 0.01 -0.68 4.77 -1.26 -4.77 117.00 115.66 3h6h n LEU 40 Ca -0.17 -0.88 -0.12 0.00 -0.03 0.00 0.00 56.01 54.82 3h6h n LEU 40 Cb 0.52 -2.70 -0.06 0.00 -2.33 0.00 0.00 43.42 38.84 3h6h n LEU 40 CO 0.32 0.35 0.85 -0.65 -1.33 0.00 0.00 177.39 176.93 3h6h h PRO 41 N -1.65 0.08 0.00 3.23 0.11 -1.81 -2.76 132.00 129.20 3h6h h PRO 41 Ca -0.64 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.47 3h6h h PRO 41 Cb 1.35 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3h6h h PRO 41 CO 0.49 0.13 -0.47 -0.91 -0.21 0.00 0.00 178.00 177.04 3h6h h ASN 42 N 0.00 0.00 -2.88 -2.05 2.35 -1.88 -3.47 115.58 107.66 3h6h h ASN 42 Ca 0.02 -0.12 -0.63 0.00 -0.55 0.00 0.00 56.30 55.02 3h6h h ASN 42 Cb 0.08 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.40 3h6h h ASN 42 CO -0.00 0.06 -0.43 -0.89 -1.65 0.00 0.00 177.43 174.51 3h6h s THR 43 N -3.18 5.36 -0.14 2.81 2.01 -1.04 -2.69 115.64 118.77 3h6h s THR 43 Ca 0.07 -0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.07 3h6h s THR 43 Cb 0.12 -3.56 0.01 0.00 0.01 0.00 0.00 72.50 69.08 3h6h s THR 43 CO 0.70 0.31 -0.20 -0.89 -0.69 0.00 0.00 174.62 173.85 3h6h s THR 44 N -1.35 1.90 -0.08 -0.82 2.01 -0.24 -4.83 115.64 112.23 3h6h s THR 44 Ca 0.29 -0.87 -0.23 0.00 0.31 0.00 0.00 61.69 61.18 3h6h s THR 44 Cb -0.13 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.65 3h6h s THR 44 CO 0.18 0.52 0.70 -0.76 -0.69 0.00 0.00 174.62 174.58 3h6h s LEU 45 N 0.97 4.30 0.42 4.42 1.43 -1.26 -2.15 118.68 126.82 3h6h s LEU 45 Ca -0.04 1.17 0.03 0.00 -1.03 0.00 0.00 54.13 54.27 3h6h s LEU 45 Cb -0.15 -3.08 -0.04 0.00 0.03 0.00 0.00 46.19 42.95 3h6h s LEU 45 CO -0.04 -0.14 0.06 0.28 0.23 0.00 0.00 176.35 176.74 3h6h s THR 46 N 0.92 1.10 0.28 5.49 -1.32 -0.58 -4.95 115.64 116.59 3h6h s THR 46 Ca 0.37 -2.00 -0.20 0.00 -1.21 0.00 0.00 61.69 58.65 3h6h s THR 46 Cb -0.18 -2.50 0.02 0.00 -1.51 0.00 0.00 72.50 68.34 3h6h s THR 46 CO 0.17 0.00 0.70 -0.72 -2.21 0.00 0.00 174.62 172.57 3h6h s TYR 47 N -3.06 -0.15 -0.08 9.09 -0.85 -1.26 -1.85 117.35 119.19 3h6h s TYR 47 Ca 0.23 -0.30 -0.01 0.00 -0.52 0.00 0.00 57.07 56.47 3h6h s TYR 47 Cb 0.05 0.67 0.03 0.00 0.38 0.00 0.00 41.96 43.09 3h6h s TYR 47 CO 0.12 -1.22 0.00 0.34 -1.52 0.00 0.00 175.55 173.27 3h6h s ASP 48 N -2.93 1.63 -0.26 -0.18 2.15 -0.68 -4.94 116.67 111.46 3h6h s ASP 48 Ca 0.12 -0.11 -0.07 0.00 0.43 0.00 0.00 52.55 52.92 3h6h s ASP 48 Cb -0.06 -0.44 -0.01 0.00 -0.30 0.00 0.00 42.92 42.11 3h6h s ASP 48 CO 0.07 -0.20 0.06 0.42 -0.17 0.00 0.00 175.17 175.35 3h6h s THR 49 N 1.97 4.10 -0.03 1.71 -4.23 -1.26 -1.84 115.64 116.07 3h6h s THR 49 Ca 0.05 -0.39 -0.04 0.00 -1.18 0.00 0.00 61.69 60.13 3h6h s THR 49 Cb -0.12 -2.98 -0.04 0.00 1.34 0.00 0.00 72.50 70.69 3h6h s THR 49 CO -0.05 0.25 0.19 -1.10 -0.54 0.00 0.00 174.62 173.37 3h6h s GLN 50 N 1.56 3.46 -0.09 3.99 -1.52 -0.73 -5.00 119.66 121.33 3h6h s GLN 50 Ca 0.05 -0.24 0.02 0.00 -1.95 0.00 0.00 55.36 53.24 3h6h s GLN 50 Cb -0.16 -3.11 -0.02 0.00 -0.22 0.00 0.00 33.01 29.50 3h6h s GLN 50 CO 0.02 0.69 -0.14 0.15 -0.25 0.00 0.00 175.29 175.76 3h6h s LYS 51 N -1.73 2.96 0.05 2.91 1.02 -1.26 -1.73 119.74 121.96 3h6h s LYS 51 Ca 0.25 -0.70 -0.01 0.00 0.02 0.00 0.00 55.97 55.52 3h6h s LYS 51 Cb -0.13 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.65 3h6h s LYS 51 CO 0.15 0.40 -0.03 0.96 -0.92 0.00 0.00 175.35 175.92 3h6h s ILE 52 N -0.14 0.21 -0.10 2.17 -5.25 -0.52 -4.88 121.20 112.69 3h6h s ILE 52 Ca -0.01 -1.73 -0.30 0.00 -0.99 0.00 0.00 60.65 57.62 3h6h s ILE 52 Cb -0.14 -1.42 -0.04 0.00 2.95 0.00 0.00 42.46 43.81 3h6h s ILE 52 CO 0.03 -0.96 1.47 0.21 -1.79 0.00 0.00 174.94 173.91 3h6h s ASN 53 N -2.81 6.80 0.34 4.36 2.47 -1.26 -2.23 114.94 122.61 3h6h s ASN 53 Ca 0.05 2.00 0.26 0.00 0.42 0.00 0.00 52.86 55.59 3h6h s ASN 53 Cb 0.07 -2.54 1.19 0.00 -1.45 0.00 0.00 41.25 38.52 3h6h s ASN 53 CO -0.09 -0.84 1.77 -0.07 -3.72 0.00 0.00 177.10 174.15 3h6h h LEU 54 N 9.88 0.00 -1.73 3.21 -0.00 -1.96 -2.47 115.31 122.24 3h6h h LEU 54 Ca -0.34 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.54 3h6h h LEU 54 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.81 3h6h h LEU 54 CO 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 179.40 3h6h n TYR 55 N -2.40 0.04 -2.79 1.13 4.11 -1.26 -4.44 117.16 111.54 3h6h n TYR 55 Ca 0.00 -0.03 -0.43 0.00 -0.00 0.00 0.00 57.90 57.45 3h6h n TYR 55 Cb 0.16 -0.00 -0.03 0.00 -0.00 0.00 0.00 39.34 39.47 3h6h n TYR 55 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 3h6h s ASP 56 N -1.40 6.52 0.43 9.48 -1.08 -0.93 -4.84 116.67 124.84 3h6h s ASP 56 Ca 0.21 -1.69 0.13 0.00 -0.52 0.00 0.00 52.55 50.68 3h6h s ASP 56 Cb 0.15 -2.46 0.93 0.00 -1.46 0.00 0.00 42.92 40.07 3h6h s ASP 56 CO 0.22 -1.27 1.96 0.77 0.52 0.00 0.00 175.17 177.37 3h6h h SER 57 N 9.25 0.07 -0.46 -0.34 4.64 -1.86 -2.13 113.55 122.72 3h6h h SER 57 Ca 0.11 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.42 3h6h h SER 57 Cb 1.03 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 63.07 3h6h h SER 57 CO 1.22 0.25 0.30 0.15 -0.87 0.00 0.00 176.83 177.87 3h6h h PHE 58 N 0.07 0.56 -0.45 4.77 3.57 -1.95 -0.99 116.94 122.52 3h6h h PHE 58 Ca 0.01 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.44 3h6h h PHE 58 Cb 0.35 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3h6h h PHE 58 CO 0.00 0.34 -0.07 1.49 -2.23 0.00 0.00 178.31 177.84 3h6h h GLU 59 N 0.60 0.84 0.00 1.11 4.81 -1.80 -1.77 114.58 118.37 3h6h h GLU 59 Ca 0.17 -0.30 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 3h6h h GLU 59 Cb -0.05 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 3h6h h GLU 59 CO -0.05 0.93 -0.06 0.00 -0.73 0.00 0.00 179.01 179.10 3h6h h ALA 60 N 0.88 1.40 0.03 2.92 0.00 -1.12 -2.14 119.26 121.24 3h6h h ALA 60 Ca 0.12 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 3h6h h ALA 60 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3h6h h ALA 60 CO 0.04 0.07 -0.02 0.77 0.00 0.00 0.00 179.25 180.11 3h6h h SER 61 N 0.00 -0.04 -0.89 0.00 0.02 -0.66 -2.62 113.55 109.36 3h6h h SER 61 Ca -0.00 -0.66 0.12 0.00 -0.84 0.00 0.00 61.79 60.41 3h6h h SER 61 Cb 0.16 0.01 -0.08 0.00 0.14 0.00 0.00 62.40 62.63 3h6h h SER 61 CO 0.01 0.73 0.51 0.11 -1.14 0.00 0.00 176.83 177.05 3h6h h LYS 62 N -0.90 0.76 0.00 3.45 1.57 -1.00 -1.36 116.57 119.09 3h6h h LYS 62 Ca -0.00 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 3h6h h LYS 62 Cb 0.70 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.82 3h6h h LYS 62 CO 0.01 0.50 -0.53 0.87 -0.57 0.00 0.00 179.45 179.73 3h6h h LYS 63 N 0.78 0.00 -0.13 3.15 1.79 -1.50 -2.30 116.57 118.36 3h6h h LYS 63 Ca 0.45 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.77 3h6h h LYS 63 Cb 0.52 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 3h6h h LYS 63 CO -0.30 0.53 -0.59 0.00 -1.08 0.00 0.00 179.45 178.02 3h6h h ALA 64 N 1.47 0.75 -0.13 3.86 0.00 -0.89 -2.93 119.26 121.37 3h6h h ALA 64 Ca -0.01 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.35 3h6h h ALA 64 Cb 1.19 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 3h6h h ALA 64 CO 0.07 0.71 -0.02 0.00 0.00 0.00 0.00 179.25 180.01 3h6h h ASP 66 N -0.05 0.47 0.63 0.00 3.32 -1.40 0.15 116.42 119.54 3h6h h ASP 66 Ca 0.03 0.12 -0.20 0.00 0.02 0.00 0.00 57.03 57.01 3h6h h ASP 66 Cb 0.41 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 3h6h h ASP 66 CO 0.01 0.12 -0.90 1.56 -1.72 0.00 0.00 179.24 178.31 3h6h h GLN 67 N 0.53 0.17 0.00 3.56 4.20 -1.45 -0.43 115.11 121.69 3h6h h GLN 67 Ca 0.53 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 59.00 3h6h h GLN 67 Cb 0.89 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 3h6h h GLN 67 CO -0.44 0.95 -0.20 -0.07 -0.67 0.00 0.00 178.83 178.40 3h6h h LEU 68 N 0.09 0.00 0.13 1.46 3.38 -0.78 -0.33 115.31 119.27 3h6h h LEU 68 Ca -0.04 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.61 3h6h h LEU 68 Cb 1.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.28 3h6h h LEU 68 CO 0.13 0.20 -1.58 -1.28 0.09 0.00 0.00 178.44 176.01 3h6h h SER 69 N 0.00 0.44 -0.27 -0.43 0.87 -0.52 0.16 113.55 113.81 3h6h h SER 69 Ca -0.00 -0.62 -0.05 0.00 -1.23 0.00 0.00 61.79 59.89 3h6h h SER 69 Cb 0.57 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 3h6h h SER 69 CO 0.03 1.52 0.03 -0.07 -0.53 0.00 0.00 176.83 177.80 3h6h h LEU 70 N 0.08 0.52 0.00 2.23 3.38 -0.96 -3.41 115.31 117.15 3h6h h LEU 70 Ca -0.26 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3h6h h LEU 70 Cb 2.04 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 42.65 3h6h h LEU 70 CO 0.17 0.57 0.00 0.61 0.09 0.00 0.00 178.44 179.88 3h6h n GLY 71 N -0.90 1.28 2.94 0.83 0.00 -0.14 -4.73 105.19 104.46 3h6h n GLY 71 Ca 0.02 -1.02 -0.12 0.00 0.00 0.00 0.00 46.02 44.89 3h6h n GLY 71 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h6h s VAL 72 N 0.00 0.17 -0.73 1.61 -7.23 -1.16 -4.75 120.40 108.31 3h6h s VAL 72 Ca 0.00 -0.40 0.25 0.00 -1.81 0.00 0.00 61.98 60.02 3h6h s VAL 72 Cb 0.00 -0.21 0.11 0.00 0.56 0.00 0.00 36.38 36.84 3h6h s VAL 72 CO 0.00 -0.15 1.47 0.00 -0.31 0.00 0.00 175.10 176.11 3h6h n ALA 73 N 2.49 2.83 -3.61 1.32 0.00 -0.66 -4.76 120.51 118.12 3h6h n ALA 73 Ca -0.16 -0.20 -0.11 0.00 0.00 0.00 0.00 53.44 52.96 3h6h n ALA 73 Cb 0.58 -1.25 -0.06 0.00 0.00 0.00 0.00 19.45 18.71 3h6h n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6h s ALA 74 N -3.12 -1.93 -0.36 0.00 0.00 -1.26 -4.19 121.76 110.91 3h6h s ALA 74 Ca 0.08 1.76 -0.09 0.00 0.00 0.00 0.00 51.96 53.71 3h6h s ALA 74 Cb 0.14 -1.08 0.03 0.00 0.00 0.00 0.00 23.12 22.22 3h6h s ALA 74 CO 0.68 -0.28 0.16 0.42 0.00 0.00 0.00 175.76 176.74 3h6h s ILE 75 N -0.28 4.21 -1.16 0.00 1.01 -0.93 -1.20 121.20 122.85 3h6h s ILE 75 Ca 0.00 -0.99 -0.20 0.00 0.00 0.00 0.00 60.65 59.46 3h6h s ILE 75 Cb -0.03 -3.37 -0.04 0.00 0.01 0.00 0.00 42.46 39.03 3h6h s ILE 75 CO -0.02 -0.21 1.93 0.49 0.00 0.00 0.00 174.94 177.12 3h6h n PHE 76 N 4.91 3.18 -0.25 3.97 3.72 0.30 -1.76 117.46 131.53 3h6h n PHE 76 Ca -0.12 -2.15 -0.24 0.00 -0.05 0.00 0.00 57.45 54.89 3h6h n PHE 76 Cb 0.45 -2.41 0.23 0.00 -0.94 0.00 0.00 39.48 36.82 3h6h n PHE 76 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3h6h n GLY 77 N 5.13 -3.50 3.58 1.37 0.00 -1.14 -2.99 105.19 107.65 3h6h n GLY 77 Ca 0.48 -1.13 -0.28 0.00 0.00 0.00 0.00 46.02 45.08 3h6h n GLY 77 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3h6h s PRO 78 N -4.49 -0.24 -0.16 1.61 0.02 -1.24 -4.57 135.00 125.94 3h6h s PRO 78 Ca 0.53 0.69 -0.12 0.00 0.02 0.00 0.00 61.00 62.12 3h6h s PRO 78 Cb -0.09 -1.64 -0.07 0.00 0.02 0.00 0.00 34.50 32.71 3h6h s PRO 78 CO 0.44 -3.23 -0.07 0.43 -0.33 0.00 0.00 177.00 174.24 3h6h n SER 79 N -4.55 1.82 -4.41 2.53 7.64 -1.26 -4.62 113.62 110.78 3h6h n SER 79 Ca 0.04 0.58 -0.42 0.00 1.01 0.00 0.00 58.87 60.09 3h6h n SER 79 Cb 0.56 -0.90 0.01 0.00 -1.01 0.00 0.00 64.21 62.86 3h6h n SER 79 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 3h6h n HIS 80 N -4.57 -1.01 0.05 1.43 -0.00 -1.26 -4.77 115.22 105.09 3h6h n HIS 80 Ca -0.14 0.60 -0.12 0.00 -0.00 0.00 0.00 57.72 58.06 3h6h n HIS 80 Cb 0.38 -1.92 -0.09 0.00 -0.00 0.00 0.00 29.99 28.36 3h6h n HIS 80 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 3h6h h SER 81 N 0.62 -0.14 0.60 0.26 4.64 -1.89 -1.86 113.55 115.79 3h6h h SER 81 Ca -0.39 -0.38 -0.02 0.00 -0.47 0.00 0.00 61.79 60.54 3h6h h SER 81 Cb 1.41 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 63.54 3h6h h SER 81 CO 0.50 0.34 -0.07 0.77 -0.87 0.00 0.00 176.83 177.49 3h6h h SER 82 N -0.66 0.00 0.49 4.97 4.64 -1.90 0.31 113.55 121.40 3h6h h SER 82 Ca -0.02 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.01 3h6h h SER 82 Cb 0.50 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.58 3h6h h SER 82 CO 0.03 0.07 -1.51 0.28 -0.87 0.00 0.00 176.83 174.83 3h6h h SER 83 N 0.00 0.32 0.72 4.97 0.02 -1.77 -3.26 113.55 114.55 3h6h h SER 83 Ca -0.00 -0.45 -0.04 0.00 -0.84 0.00 0.00 61.79 60.46 3h6h h SER 83 Cb 0.40 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 3h6h h SER 83 CO 0.01 1.38 -0.19 0.00 -1.14 0.00 0.00 176.83 176.88 3h6h h ALA 84 N 0.57 1.10 -0.16 3.77 0.00 -0.52 -2.71 119.26 121.31 3h6h h ALA 84 Ca -0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3h6h h ALA 84 Cb 1.99 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.75 3h6h h ALA 84 CO 0.15 0.24 0.03 -0.91 0.00 0.00 0.00 179.25 178.76 3h6h h ASN 85 N 0.00 0.25 -0.31 0.00 2.35 -1.03 -2.39 115.58 114.46 3h6h h ASN 85 Ca -0.00 -0.26 -0.13 0.00 -0.55 0.00 0.00 56.30 55.36 3h6h h ASN 85 Cb 0.61 -0.07 -0.00 0.00 0.05 0.00 0.00 38.32 38.91 3h6h h ASN 85 CO 0.03 0.45 -0.32 0.00 -1.65 0.00 0.00 177.43 175.93 3h6h h ALA 86 N 0.81 0.45 0.00 -0.83 0.00 -1.56 -2.60 119.26 115.53 3h6h h ALA 86 Ca 0.05 -0.42 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 3h6h h ALA 86 Cb 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3h6h h ALA 86 CO 0.00 0.50 -0.08 0.28 0.00 0.00 0.00 179.25 179.95 3h6h h VAL 87 N 0.52 0.25 -0.01 0.00 2.07 -1.55 -2.31 116.25 115.22 3h6h h VAL 87 Ca 0.05 -0.59 -0.23 0.00 0.82 0.00 0.00 66.70 66.75 3h6h h VAL 87 Cb 0.90 1.46 0.01 0.00 -1.52 0.00 0.00 31.29 32.14 3h6h h VAL 87 CO 0.08 0.08 -0.94 -0.61 0.02 0.00 0.00 177.57 176.20 3h6h h GLN 88 N 0.00 0.47 -0.19 1.57 4.15 -1.06 -1.70 115.11 118.34 3h6h h GLN 88 Ca -0.00 -0.49 -0.15 0.00 0.77 0.00 0.00 58.65 58.78 3h6h h GLN 88 Cb 0.46 0.14 0.00 0.00 0.21 0.00 0.00 27.48 28.28 3h6h h GLN 88 CO 0.01 1.14 -0.46 1.03 -1.93 0.00 0.00 178.83 178.62 3h6h h SER 89 N 0.27 0.74 0.61 -0.69 0.87 -1.16 -2.44 113.55 111.76 3h6h h SER 89 Ca -0.08 -0.57 -0.03 0.00 -1.23 0.00 0.00 61.79 59.88 3h6h h SER 89 Cb 1.57 -0.21 0.01 0.00 -0.44 0.00 0.00 62.40 63.33 3h6h h SER 89 CO 0.17 1.17 -0.30 0.40 -0.53 0.00 0.00 176.83 177.74 3h6h h ILE 90 N 0.34 0.35 -1.01 2.23 2.04 -1.47 -1.65 117.51 118.34 3h6h h ILE 90 Ca -0.00 -0.15 0.25 0.00 1.00 0.00 0.00 64.86 65.96 3h6h h ILE 90 Cb 1.07 0.41 -0.09 0.00 -0.74 0.00 0.00 36.82 37.47 3h6h h ILE 90 CO 0.10 0.02 0.66 0.00 0.00 0.00 0.00 178.15 178.93 3h6h h ASN 92 N 0.39 0.09 -0.34 0.00 -1.24 -1.10 0.44 115.58 113.82 3h6h h ASN 92 Ca 0.56 -0.39 0.03 0.00 0.71 0.00 0.00 56.30 57.21 3h6h h ASN 92 Cb 1.44 -0.02 -0.02 0.00 0.73 0.00 0.00 38.32 40.45 3h6h h ASN 92 CO -0.25 0.46 0.23 0.00 -1.29 0.00 0.00 177.43 176.57 3h6h h ALA 93 N 0.63 1.90 -0.37 1.57 0.00 -0.32 -2.21 119.26 120.45 3h6h h ALA 93 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3h6h h ALA 93 Cb 0.43 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3h6h h ALA 93 CO 0.01 0.06 0.00 1.28 0.00 0.00 0.00 179.25 180.59 3h6h n LEU 94 N -4.49 3.02 -3.83 0.00 4.32 -0.87 -4.36 117.00 110.80 3h6h n LEU 94 Ca 0.03 -1.81 -0.27 0.00 -0.02 0.00 0.00 56.01 53.94 3h6h n LEU 94 Cb 0.16 -0.24 0.03 0.00 -1.62 0.00 0.00 43.42 41.75 3h6h n LEU 94 CO 0.35 0.73 0.08 0.61 -1.22 0.00 0.00 177.39 177.94 3h6h n GLY 95 N 0.83 -0.45 3.40 -0.72 0.00 -0.01 -1.25 105.19 106.99 3h6h n GLY 95 Ca 0.14 0.18 -0.34 0.00 0.00 0.00 0.00 46.02 46.00 3h6h n GLY 95 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h6h s VAL 96 N -3.39 3.61 0.22 1.61 1.01 -0.31 -3.94 120.40 119.22 3h6h s VAL 96 Ca 0.50 -0.44 -0.32 0.00 0.00 0.00 0.00 61.98 61.73 3h6h s VAL 96 Cb -0.25 -2.61 -0.14 0.00 0.00 0.00 0.00 36.38 33.38 3h6h s VAL 96 CO 0.81 0.46 1.33 -2.65 0.00 0.00 0.00 175.10 175.05 3h6h n PRO 97 N 4.14 1.76 -3.88 2.72 -0.02 -1.26 -4.51 135.00 133.95 3h6h n PRO 97 Ca -0.18 0.63 -0.36 0.00 -2.02 0.00 0.00 63.50 61.57 3h6h n PRO 97 Cb 0.52 -2.23 -0.13 0.00 -0.02 0.00 0.00 33.50 31.64 3h6h n PRO 97 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3h6h s HIS 98 N -0.10 3.06 -0.34 6.00 2.46 -1.19 -2.19 115.29 122.99 3h6h s HIS 98 Ca 0.70 -0.50 -0.09 0.00 0.47 0.00 0.00 55.06 55.63 3h6h s HIS 98 Cb -0.71 -2.17 0.01 0.00 -0.13 0.00 0.00 32.58 29.58 3h6h s HIS 98 CO 0.50 -0.34 0.16 0.42 -2.47 0.00 0.00 174.74 173.01 3h6h s ILE 99 N 1.38 4.42 -0.07 0.89 -1.09 -0.72 -2.21 121.20 123.80 3h6h s ILE 99 Ca 0.05 -0.70 -0.04 0.00 -2.23 0.00 0.00 60.65 57.74 3h6h s ILE 99 Cb -0.15 -3.36 -0.04 0.00 -1.58 0.00 0.00 42.46 37.33 3h6h s ILE 99 CO 0.02 -0.07 0.10 -1.10 -1.23 0.00 0.00 174.94 172.66 3h6h s GLN 100 N 1.55 3.24 0.00 2.79 -0.21 -0.44 -2.86 119.66 123.73 3h6h s GLN 100 Ca 0.03 -0.31 0.00 0.00 0.02 0.00 0.00 55.36 55.10 3h6h s GLN 100 Cb -0.18 -3.00 0.00 0.00 1.00 0.00 0.00 33.01 30.83 3h6h s GLN 100 CO 0.06 0.72 0.36 0.25 -2.12 0.00 0.00 175.29 174.55 3h6h n THR 101 N 1.69 0.00 -4.46 -0.19 -2.24 -1.26 -1.09 114.28 106.73 3h6h n THR 101 Ca -0.17 -0.43 -0.23 0.00 -2.27 0.00 0.00 64.05 60.95 3h6h n THR 101 Cb 0.54 1.12 -0.13 0.00 -2.10 0.00 0.00 70.33 69.75 3h6h n THR 101 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 3h6h s ARG 102 N -0.14 1.18 0.38 -0.78 6.06 -1.26 -4.11 118.95 120.28 3h6h s ARG 102 Ca 0.00 -0.95 -0.26 0.00 -2.50 0.00 0.00 55.73 52.02 3h6h s ARG 102 Cb 0.00 -1.30 -0.09 0.00 0.06 0.00 0.00 34.95 33.62 3h6h s ARG 102 CO 0.00 0.32 1.18 -0.46 -2.50 0.00 0.00 175.30 173.84 3h6h s TRP 103 N -0.92 3.12 0.11 5.12 -0.00 -1.26 -4.85 118.94 120.27 3h6h s TRP 103 Ca 0.05 1.55 -0.11 0.00 -0.00 0.00 0.00 56.10 57.59 3h6h s TRP 103 Cb -0.09 -3.41 0.01 0.00 -0.00 0.00 0.00 33.47 29.98 3h6h s TRP 103 CO 0.02 -1.29 0.27 -1.59 -0.00 0.00 0.00 176.95 174.37 3h6h s LYS 104 N -2.15 0.95 -0.16 5.86 -2.85 -1.26 -4.83 119.74 115.30 3h6h s LYS 104 Ca 0.55 -0.89 -0.29 0.00 -1.00 0.00 0.00 55.97 54.34 3h6h s LYS 104 Cb -0.32 0.39 -0.01 0.00 -2.06 0.00 0.00 37.83 35.83 3h6h s LYS 104 CO 0.40 -0.33 1.23 -1.58 0.10 0.00 0.00 175.35 175.17 3h6h s HIS 105 N -3.85 2.92 -0.70 1.78 5.65 -1.26 -4.97 115.29 114.86 3h6h s HIS 105 Ca 0.05 1.07 -0.23 0.00 0.25 0.00 0.00 55.06 56.21 3h6h s HIS 105 Cb 0.04 -3.47 0.07 0.00 -1.18 0.00 0.00 32.58 28.03 3h6h s HIS 105 CO -0.10 -1.54 1.03 -0.65 -0.65 0.00 0.00 174.74 172.82 3h6h s GLN 106 N 3.37 3.17 0.46 2.88 1.11 -1.26 -5.02 119.66 124.36 3h6h s GLN 106 Ca 0.54 -0.84 -0.23 0.00 0.01 0.00 0.00 55.36 54.84 3h6h s GLN 106 Cb -0.21 -4.31 -0.10 0.00 -1.01 0.00 0.00 33.01 27.39 3h6h s GLN 106 CO 0.14 -1.87 0.95 0.28 0.01 0.00 0.00 175.29 174.80 3h6h n VAL 107 N 5.97 2.58 -0.05 1.09 0.31 -1.26 -4.90 118.33 122.08 3h6h n VAL 107 Ca 0.00 -0.50 -0.12 0.00 -0.01 0.00 0.00 64.34 63.71 3h6h n VAL 107 Cb 0.46 -1.09 -0.07 0.00 -0.91 0.00 0.00 33.84 32.23 3h6h n VAL 107 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 3h6h h SER 108 N 1.26 0.28 0.27 4.52 4.64 -2.06 -2.99 113.55 119.47 3h6h h SER 108 Ca -0.45 -0.41 -0.00 0.00 -0.47 0.00 0.00 61.79 60.45 3h6h h SER 108 Cb 1.35 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3h6h h SER 108 CO 0.55 0.64 -0.02 -2.24 -0.87 0.00 0.00 176.83 174.88 3h6h h ASP 109 N -0.07 0.00 -2.89 4.97 -0.00 -2.05 -3.44 116.42 112.95 3h6h h ASP 109 Ca 0.03 0.00 -0.53 0.00 -0.00 0.00 0.00 57.03 56.53 3h6h h ASP 109 Cb 0.53 0.00 0.03 0.00 -0.00 0.00 0.00 39.33 39.89 3h6h h ASP 109 CO 0.02 0.02 0.83 0.21 -0.00 0.00 0.00 179.24 180.32 3h6h s ASN 110 N -5.55 6.72 0.00 4.15 3.84 -1.13 -4.93 114.94 118.04 3h6h s ASN 110 Ca -0.03 2.42 0.09 0.00 0.21 0.00 0.00 52.86 55.55 3h6h s ASN 110 Cb 0.12 -2.58 0.09 0.00 -0.55 0.00 0.00 41.25 38.33 3h6h s ASN 110 CO 0.48 -0.75 0.84 0.29 -2.79 0.00 0.00 177.10 175.17 3h6h n LYS 111 N 4.33 0.55 -1.51 0.43 4.76 -1.26 -4.98 118.16 120.49 3h6h n LYS 111 Ca 0.13 -1.15 -0.49 0.00 -2.87 0.00 0.00 58.31 53.93 3h6h n LYS 111 Cb 0.41 -1.19 -0.04 0.00 -1.84 0.00 0.00 35.03 32.38 3h6h n LYS 111 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 3h6h n ASP 112 N 0.52 0.27 0.00 4.39 8.00 -1.26 -4.88 116.55 123.59 3h6h n ASP 112 Ca 0.06 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.71 3h6h n ASP 112 Cb 0.25 -1.10 0.00 0.00 -0.02 0.00 0.00 41.12 40.25 3h6h n ASP 112 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3h6h n SER 113 N 1.77 0.14 -4.27 -2.24 3.41 -1.26 -4.89 113.62 106.28 3h6h n SER 113 Ca 0.16 -0.49 -0.44 0.00 -0.26 0.00 0.00 58.87 57.83 3h6h n SER 113 Cb 0.24 0.61 0.00 0.00 -0.26 0.00 0.00 64.21 64.80 3h6h n SER 113 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3h6h n PHE 114 N -0.61 4.41 -3.62 7.33 3.01 -1.26 -4.93 117.46 121.79 3h6h n PHE 114 Ca 0.00 -3.37 -0.03 0.00 1.01 0.00 0.00 57.45 55.06 3h6h n PHE 114 Cb 0.01 -1.84 -0.01 0.00 -0.01 0.00 0.00 39.48 37.63 3h6h n PHE 114 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 3h6h s TYR 115 N -0.33 -0.13 0.02 1.38 -0.85 -1.26 -3.14 117.35 113.04 3h6h s TYR 115 Ca 0.36 0.00 -0.13 0.00 -0.52 0.00 0.00 57.07 56.78 3h6h s TYR 115 Cb -0.03 0.55 0.02 0.00 0.38 0.00 0.00 41.96 42.88 3h6h s TYR 115 CO -0.01 -0.40 0.28 0.14 -1.52 0.00 0.00 175.55 174.04 3h6h s VAL 116 N -2.69 0.08 -0.07 -3.49 -7.23 -0.94 -4.76 120.40 101.31 3h6h s VAL 116 Ca 0.11 -0.63 0.03 0.00 -1.81 0.00 0.00 61.98 59.68 3h6h s VAL 116 Cb 0.01 -0.78 0.01 0.00 0.56 0.00 0.00 36.38 36.17 3h6h s VAL 116 CO -0.04 -0.35 -0.17 -0.55 -0.31 0.00 0.00 175.10 173.69 3h6h s SER 117 N -1.74 2.27 0.04 4.85 0.15 -0.79 -1.32 113.70 117.15 3h6h s SER 117 Ca -0.09 -0.39 0.23 0.00 0.70 0.00 0.00 55.95 56.40 3h6h s SER 117 Cb -0.03 -0.95 0.16 0.00 -1.71 0.00 0.00 66.02 63.50 3h6h s SER 117 CO -0.00 0.10 1.14 0.18 1.20 0.00 0.00 173.24 175.86 3h6h n LEU 118 N 3.56 0.64 -4.72 3.45 4.32 -0.25 -3.12 117.00 120.88 3h6h n LEU 118 Ca -0.21 -0.06 -0.42 0.00 -0.02 0.00 0.00 56.01 55.31 3h6h n LEU 118 Cb 0.52 -0.13 -0.03 0.00 -1.62 0.00 0.00 43.42 42.16 3h6h n LEU 118 CO 0.26 0.08 1.13 -0.47 -1.22 0.00 0.00 177.39 177.17 3h6h s TYR 119 N -3.11 3.13 -0.16 -1.77 6.04 -1.26 -4.89 117.35 115.33 3h6h s TYR 119 Ca 0.06 0.86 -0.35 0.00 0.04 0.00 0.00 57.07 57.69 3h6h s TYR 119 Cb 0.15 -3.80 -0.12 0.00 -1.04 0.00 0.00 41.96 37.16 3h6h s TYR 119 CO 0.78 -2.81 1.93 -2.30 -1.54 0.00 0.00 175.55 171.60 3h6h n PRO 120 N 3.53 1.89 -2.29 4.97 -0.02 -1.26 -4.31 135.00 137.51 3h6h n PRO 120 Ca 0.11 0.67 -0.41 0.00 -2.02 0.00 0.00 63.50 61.85 3h6h n PRO 120 Cb 0.40 -2.59 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 3h6h n PRO 120 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3h6h s ASP 121 N 4.70 7.01 -0.35 2.55 2.15 -0.89 -4.86 116.67 126.98 3h6h s ASP 121 Ca 0.96 2.46 0.05 0.00 0.43 0.00 0.00 52.55 56.45 3h6h s ASP 121 Cb -0.74 -2.63 0.59 0.00 -0.30 0.00 0.00 42.92 39.83 3h6h s ASP 121 CO 0.52 -0.36 1.74 2.22 -0.17 0.00 0.00 175.17 179.13 3h6h n PHE 122 N 1.26 2.47 0.16 -5.34 1.16 -1.26 -1.91 117.46 114.00 3h6h n PHE 122 Ca 0.00 -1.47 0.02 0.00 -1.87 0.00 0.00 57.45 54.13 3h6h n PHE 122 Cb 0.43 -0.78 0.26 0.00 -1.61 0.00 0.00 39.48 37.79 3h6h n PHE 122 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 3h6h h SER 123 N 1.29 0.00 0.01 5.98 4.64 -1.92 -2.68 113.55 120.86 3h6h h SER 123 Ca 0.45 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 61.40 3h6h h SER 123 Cb 2.45 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.49 3h6h h SER 123 CO 0.85 0.50 -2.04 -1.20 -0.87 0.00 0.00 176.83 174.06 3h6h n SER 124 N -3.74 1.93 -0.05 4.97 7.64 -0.93 -4.04 113.62 119.41 3h6h n SER 124 Ca -0.01 0.33 0.03 0.00 1.01 0.00 0.00 58.87 60.24 3h6h n SER 124 Cb 0.55 -0.85 0.38 0.00 -1.01 0.00 0.00 64.21 63.28 3h6h n SER 124 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 3h6h h LEU 125 N -0.89 0.56 -1.30 -3.43 3.38 -1.54 0.24 115.31 112.33 3h6h h LEU 125 Ca -0.55 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.34 3h6h h LEU 125 Cb 1.54 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 3h6h h LEU 125 CO -0.30 0.41 -0.17 0.28 0.09 0.00 0.00 178.44 178.75 3h6h h SER 126 N 0.66 0.26 1.11 -0.43 0.02 -1.69 -0.21 113.55 113.27 3h6h h SER 126 Ca 0.18 -0.06 -0.18 0.00 -0.84 0.00 0.00 61.79 60.89 3h6h h SER 126 Cb -0.07 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 3h6h h SER 126 CO -0.04 0.45 -0.84 -0.09 -1.14 0.00 0.00 176.83 175.17 3h6h h ARG 127 N 0.25 0.00 -0.19 3.45 1.12 -1.35 -2.00 114.38 115.66 3h6h h ARG 127 Ca 0.05 0.00 -0.19 0.00 -1.11 0.00 0.00 59.98 58.73 3h6h h ARG 127 Cb 0.45 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.41 3h6h h ARG 127 CO 0.03 0.84 -0.64 0.00 -3.11 0.00 0.00 179.97 177.09 3h6h h ALA 128 N 1.16 0.51 -0.76 2.80 0.00 -0.65 0.45 119.26 122.75 3h6h h ALA 128 Ca -0.01 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.30 3h6h h ALA 128 Cb 1.62 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 3h6h h ALA 128 CO 0.11 0.70 0.30 0.82 0.00 0.00 0.00 179.25 181.17 3h6h h ILE 129 N 0.51 1.26 -0.02 0.00 1.08 -1.01 -2.37 117.51 116.96 3h6h h ILE 129 Ca -0.01 -0.81 -0.01 0.00 -0.39 0.00 0.00 64.86 63.64 3h6h h ILE 129 Cb 1.23 0.35 -0.00 0.00 -3.07 0.00 0.00 36.82 35.33 3h6h h ILE 129 CO 0.13 0.33 -0.01 0.25 -0.69 0.00 0.00 178.15 178.16 3h6h h LEU 130 N 1.11 0.04 -1.66 1.44 5.85 -1.17 -2.05 115.31 118.88 3h6h h LEU 130 Ca 0.25 -0.44 0.17 0.00 0.84 0.00 0.00 57.88 58.71 3h6h h LEU 130 Cb 0.22 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.19 3h6h h LEU 130 CO -0.02 0.47 0.53 0.44 -0.34 0.00 0.00 178.44 179.52 3h6h h ASP 131 N -0.40 0.31 -0.08 1.25 5.19 -0.81 -0.93 116.42 120.95 3h6h h ASP 131 Ca 0.00 0.02 -0.14 0.00 -0.62 0.00 0.00 57.03 56.29 3h6h h ASP 131 Cb 0.46 -0.04 0.01 0.00 0.18 0.00 0.00 39.33 39.94 3h6h h ASP 131 CO 0.00 0.15 -0.50 0.25 -3.12 0.00 0.00 179.24 176.01 3h6h h LEU 132 N 0.32 0.59 -1.66 1.55 5.85 -1.27 -2.72 115.31 117.96 3h6h h LEU 132 Ca 0.39 -0.66 -0.01 0.00 0.84 0.00 0.00 57.88 58.44 3h6h h LEU 132 Cb 1.04 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 3h6h h LEU 132 CO -0.11 1.16 0.15 0.58 -0.34 0.00 0.00 178.44 179.87 3h6h h VAL 133 N 0.06 1.09 0.00 1.05 2.07 -0.46 -2.46 116.25 117.60 3h6h h VAL 133 Ca -0.04 -0.24 -0.21 0.00 0.82 0.00 0.00 66.70 67.03 3h6h h VAL 133 Cb 1.16 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 3h6h h VAL 133 CO 0.10 0.10 -1.00 1.56 0.02 0.00 0.00 177.57 178.35 3h6h h GLN 134 N 0.38 0.00 -0.42 1.57 4.20 -1.35 -2.37 115.11 117.12 3h6h h GLN 134 Ca 0.10 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.72 3h6h h GLN 134 Cb 0.02 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.78 3h6h h GLN 134 CO -0.02 0.94 -0.11 0.35 -0.67 0.00 0.00 178.83 179.32 3h6h h PHE 135 N 0.00 0.84 -0.00 2.96 3.57 -1.14 -1.73 116.94 121.43 3h6h h PHE 135 Ca -0.02 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.32 3h6h h PHE 135 Cb 1.76 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 40.28 3h6h h PHE 135 CO 0.00 0.84 -0.03 1.19 -2.23 0.00 0.00 178.31 178.07 3h6h n PHE 136 N -4.16 0.00 -3.72 0.41 3.72 -0.96 -4.92 117.46 107.82 3h6h n PHE 136 Ca 0.01 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.15 3h6h n PHE 136 Cb 0.37 -0.16 0.06 0.00 -0.94 0.00 0.00 39.48 38.80 3h6h n PHE 136 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 3h6h n LYS 137 N -1.03 -6.79 -2.34 -1.08 5.02 -0.65 -4.95 118.16 106.32 3h6h n LYS 137 Ca 0.17 0.73 -0.38 0.00 -2.02 0.00 0.00 58.31 56.82 3h6h n LYS 137 Cb 0.22 -5.69 -0.02 0.00 -0.02 0.00 0.00 35.03 29.51 3h6h n LYS 137 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3h6h s TRP 138 N -3.33 3.07 0.00 2.13 0.52 -0.92 -4.95 118.94 115.46 3h6h s TRP 138 Ca 0.56 1.57 0.00 0.00 0.02 0.00 0.00 56.10 58.25 3h6h s TRP 138 Cb -0.26 -3.33 0.00 0.00 -1.15 0.00 0.00 33.47 28.73 3h6h s TRP 138 CO 0.77 -1.20 0.00 1.63 0.02 0.00 0.00 176.95 178.18 3h6h n LYS 139 N -0.10 1.67 -5.04 4.98 4.01 -1.26 -4.87 118.16 117.55 3h6h n LYS 139 Ca 0.05 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.56 3h6h n LYS 139 Cb 0.48 -0.97 -0.15 0.00 -0.51 0.00 0.00 35.03 33.87 3h6h n LYS 139 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 3h6h s THR 140 N -1.92 1.96 0.06 -0.18 2.01 -1.26 -1.58 115.64 114.73 3h6h s THR 140 Ca 0.00 -1.18 -0.10 0.00 0.31 0.00 0.00 61.69 60.72 3h6h s THR 140 Cb 0.00 -1.65 0.01 0.00 0.01 0.00 0.00 72.50 70.86 3h6h s THR 140 CO 0.00 0.44 0.22 0.54 -0.69 0.00 0.00 174.62 175.14 3h6h s VAL 141 N -0.68 0.11 -0.17 3.82 0.11 -1.03 -4.70 120.40 117.87 3h6h s VAL 141 Ca 0.10 -0.94 -0.00 0.00 -2.93 0.00 0.00 61.98 58.21 3h6h s VAL 141 Cb -0.09 -1.08 0.04 0.00 -1.53 0.00 0.00 36.38 33.71 3h6h s VAL 141 CO 0.00 -0.52 -0.07 -0.89 -3.33 0.00 0.00 175.10 170.29 3h6h s THR 142 N -3.09 1.27 -0.22 5.04 2.01 -0.73 -1.93 115.64 117.99 3h6h s THR 142 Ca -0.01 -0.71 -0.20 0.00 0.31 0.00 0.00 61.69 61.08 3h6h s THR 142 Cb 0.01 -1.39 -0.02 0.00 0.01 0.00 0.00 72.50 71.10 3h6h s THR 142 CO -0.07 0.17 0.62 -0.69 -0.69 0.00 0.00 174.62 173.97 3h6h s VAL 143 N 1.57 5.01 -0.26 3.82 1.01 -0.44 -1.15 120.40 129.96 3h6h s VAL 143 Ca 0.01 1.15 -0.02 0.00 0.00 0.00 0.00 61.98 63.12 3h6h s VAL 143 Cb -0.15 -3.93 0.03 0.00 0.00 0.00 0.00 36.38 32.32 3h6h s VAL 143 CO -0.08 0.08 -0.04 -0.69 0.00 0.00 0.00 175.10 174.37 3h6h s VAL 144 N 2.16 2.98 0.25 2.92 1.01 -0.27 -1.22 120.40 128.23 3h6h s VAL 144 Ca 0.27 -1.07 0.08 0.00 0.00 0.00 0.00 61.98 61.27 3h6h s VAL 144 Cb -0.16 -2.55 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3h6h s VAL 144 CO 0.09 0.13 0.09 -0.72 0.00 0.00 0.00 175.10 174.69 3h6h s TYR 145 N 1.32 2.90 0.00 5.22 -0.85 -0.90 -0.62 117.35 124.42 3h6h s TYR 145 Ca -0.01 -0.16 0.00 0.00 -0.52 0.00 0.00 57.07 56.38 3h6h s TYR 145 Cb -0.17 -1.30 0.00 0.00 0.38 0.00 0.00 41.96 40.86 3h6h s TYR 145 CO -0.03 0.57 0.00 -3.47 -1.52 0.00 0.00 175.55 171.10 3h6h n ASP 146 N -0.97 0.00 -4.56 -0.18 -0.08 -0.84 -1.87 116.55 108.05 3h6h n ASP 146 Ca -0.07 0.25 -0.32 0.00 -1.51 0.00 0.00 54.79 53.14 3h6h n ASP 146 Cb 0.58 -0.45 -0.11 0.00 2.34 0.00 0.00 41.12 43.48 3h6h n ASP 146 CO 0.00 0.00 0.00 1.51 0.12 0.00 0.00 177.20 178.83 3h6h s ASP 147 N -3.20 4.41 0.28 1.67 -4.77 -1.26 -4.53 116.67 109.27 3h6h s ASP 147 Ca 0.00 -0.23 0.22 0.00 -3.30 0.00 0.00 52.55 49.24 3h6h s ASP 147 Cb 0.00 -0.95 0.93 0.00 -1.09 0.00 0.00 42.92 41.81 3h6h s ASP 147 CO 0.00 0.27 0.94 -1.54 0.70 0.00 0.00 175.17 175.54 3h6h n SER 148 N 1.51 0.10 0.07 2.11 3.41 -1.26 -0.71 113.62 118.86 3h6h n SER 148 Ca -0.15 0.79 0.07 0.00 -0.26 0.00 0.00 58.87 59.32 3h6h n SER 148 Cb 0.52 -0.39 0.34 0.00 -0.26 0.00 0.00 64.21 64.42 3h6h n SER 148 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 3h6h n THR 149 N -3.75 1.27 0.24 6.66 5.66 -1.26 -2.04 114.28 121.06 3h6h n THR 149 Ca 0.25 0.46 0.13 0.00 -3.05 0.00 0.00 64.05 61.84 3h6h n THR 149 Cb 1.00 -1.39 0.44 0.00 -1.55 0.00 0.00 70.33 68.82 3h6h n THR 149 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 3h6h h GLY 150 N 0.99 0.00 1.08 1.09 0.00 -1.32 -2.84 103.07 102.07 3h6h h GLY 150 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 3h6h h GLY 150 CO 0.00 0.00 -0.17 1.41 0.00 0.00 0.00 176.54 177.78 3h6h h LEU 151 N 0.00 0.99 -1.50 3.11 3.38 -1.65 -0.26 115.31 119.38 3h6h h LEU 151 Ca -0.00 -0.38 -0.04 0.00 0.09 0.00 0.00 57.88 57.55 3h6h h LEU 151 Cb 0.77 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3h6h h LEU 151 CO 0.01 1.15 -0.20 0.40 0.09 0.00 0.00 178.44 179.89 3h6h h ILE 152 N 0.83 0.63 0.17 1.22 2.04 -1.69 -2.26 117.51 118.46 3h6h h ILE 152 Ca 0.12 -0.88 -0.29 0.00 1.00 0.00 0.00 64.86 64.81 3h6h h ILE 152 Cb 0.74 1.57 0.02 0.00 -0.74 0.00 0.00 36.82 38.40 3h6h h ILE 152 CO 0.06 0.19 -1.36 -0.09 0.00 0.00 0.00 178.15 176.95 3h6h h ARG 153 N 0.00 0.37 -0.86 2.37 2.43 -1.28 -3.31 114.38 114.09 3h6h h ARG 153 Ca -0.00 -0.63 -0.45 0.00 -0.81 0.00 0.00 59.98 58.09 3h6h h ARG 153 Cb 0.55 0.23 -0.27 0.00 -0.42 0.00 0.00 29.97 30.07 3h6h h ARG 153 CO 0.03 1.30 0.50 1.28 -1.51 0.00 0.00 179.97 181.56 3h6h n LEU 154 N -3.85 6.19 0.10 3.80 4.77 -0.14 -4.67 117.00 123.20 3h6h n LEU 154 Ca -0.20 -3.66 0.02 0.00 -0.03 0.00 0.00 56.01 52.13 3h6h n LEU 154 Cb 0.97 -0.80 0.37 0.00 -2.33 0.00 0.00 43.42 41.63 3h6h n LEU 154 CO 0.50 1.11 0.89 0.06 -1.33 0.00 0.00 177.39 178.62 3h6h h GLN 155 N 1.01 0.29 0.00 3.23 3.07 -1.50 -0.58 115.11 120.63 3h6h h GLN 155 Ca 0.55 -0.07 0.00 0.00 0.09 0.00 0.00 58.65 59.22 3h6h h GLN 155 Cb 2.59 -0.04 0.00 0.00 0.08 0.00 0.00 27.48 30.11 3h6h h GLN 155 CO 0.96 0.41 0.00 0.93 0.09 0.00 0.00 178.83 181.22 3h6h h GLU 156 N 0.28 0.00 0.14 0.06 4.39 -1.88 -2.46 114.58 115.10 3h6h h GLU 156 Ca 0.06 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 59.45 3h6h h GLU 156 Cb 0.38 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.02 3h6h h GLU 156 CO 0.02 0.00 -1.59 1.25 -1.16 0.00 0.00 179.01 177.53 3h6h h LEU 157 N 0.00 0.46 -1.86 1.33 6.46 -1.40 -3.33 115.31 116.97 3h6h h LEU 157 Ca 0.00 -0.89 -0.01 0.00 -0.12 0.00 0.00 57.88 56.86 3h6h h LEU 157 Cb 0.34 -0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.12 3h6h h LEU 157 CO 0.00 1.70 -0.05 0.40 -0.62 0.00 0.00 178.44 179.88 3h6h h ILE 158 N -0.13 0.16 0.00 4.05 2.04 -1.01 -2.95 117.51 119.66 3h6h h ILE 158 Ca -0.33 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.07 3h6h h ILE 158 Cb 1.90 1.39 0.00 0.00 -0.74 0.00 0.00 36.82 39.37 3h6h h ILE 158 CO 0.10 0.04 -1.26 0.29 0.00 0.00 0.00 178.15 177.33 3h6h n LYS 159 N -3.22 0.57 -0.03 2.37 5.02 -0.96 -4.37 118.16 117.53 3h6h n LYS 159 Ca -0.01 0.02 0.21 0.00 -2.02 0.00 0.00 58.31 56.51 3h6h n LYS 159 Cb 0.25 -1.71 0.69 0.00 -0.02 0.00 0.00 35.03 34.24 3h6h n LYS 159 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3h6h h ALA 160 N 2.09 2.54 0.00 7.82 0.00 -1.62 -1.81 119.26 128.28 3h6h h ALA 160 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3h6h h ALA 160 Cb 0.95 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3h6h h ALA 160 CO 0.00 -0.70 0.00 -2.30 0.00 0.00 0.00 179.25 176.25 3h6h n PRO 161 N -4.37 0.09 -0.02 0.00 -0.02 -1.26 -1.42 135.00 128.00 3h6h n PRO 161 Ca 0.11 0.00 0.03 0.00 -2.02 0.00 0.00 63.50 61.62 3h6h n PRO 161 Cb 0.65 -1.23 -0.08 0.00 -0.02 0.00 0.00 33.50 32.82 3h6h n PRO 161 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3h6h n SER 162 N -0.73 2.59 -0.01 2.55 7.64 -0.68 -4.75 113.62 120.22 3h6h n SER 162 Ca 0.01 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.88 3h6h n SER 162 Cb 0.00 1.29 -0.00 0.00 -1.01 0.00 0.00 64.21 64.49 3h6h n SER 162 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3h6h n ARG 163 N -2.00 0.07 -2.05 1.43 1.74 -0.51 -5.03 116.66 110.31 3h6h n ARG 163 Ca -0.06 0.11 -0.28 0.00 -0.77 0.00 0.00 57.85 56.85 3h6h n ARG 163 Cb 0.42 -0.70 0.12 0.00 -1.02 0.00 0.00 32.46 31.28 3h6h n ARG 163 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3h6h s TYR 164 N -1.23 2.30 -1.06 -1.55 5.04 -0.57 -5.00 117.35 115.27 3h6h s TYR 164 Ca -0.03 0.41 -0.16 0.00 -2.44 0.00 0.00 57.07 54.85 3h6h s TYR 164 Cb 0.00 -3.61 0.16 0.00 0.35 0.00 0.00 41.96 38.87 3h6h s TYR 164 CO 0.05 -2.01 1.26 1.21 -1.34 0.00 0.00 175.55 174.71 3h6h s ASN 165 N -4.70 6.88 -0.02 4.32 2.47 -1.26 -4.56 114.94 118.06 3h6h s ASN 165 Ca 0.66 -2.59 -0.06 0.00 0.42 0.00 0.00 52.86 51.29 3h6h s ASN 165 Cb -0.08 -2.38 0.00 0.00 -1.45 0.00 0.00 41.25 37.34 3h6h s ASN 165 CO 0.49 -0.86 0.13 -0.22 -3.72 0.00 0.00 177.10 172.92 3h6h s LEU 166 N 1.88 1.57 -0.25 3.21 2.96 -1.26 -4.78 118.68 122.00 3h6h s LEU 166 Ca 0.37 -0.04 -0.02 0.00 -0.22 0.00 0.00 54.13 54.21 3h6h s LEU 166 Cb -0.04 0.56 0.08 0.00 0.50 0.00 0.00 46.19 47.29 3h6h s LEU 166 CO -0.05 -0.24 0.07 -0.13 -1.32 0.00 0.00 176.35 174.68 3h6h s ARG 167 N -0.83 0.59 0.02 1.98 0.52 -0.62 -4.48 118.95 116.14 3h6h s ARG 167 Ca -0.09 -0.66 0.05 0.00 -0.52 0.00 0.00 55.73 54.51 3h6h s ARG 167 Cb -0.05 -1.92 -0.03 0.00 0.52 0.00 0.00 34.95 33.47 3h6h s ARG 167 CO 0.01 -0.82 -0.10 -0.48 0.02 0.00 0.00 175.30 173.93 3h6h s LEU 168 N 1.82 2.99 0.00 2.53 0.05 -1.26 -2.48 118.68 122.34 3h6h s LEU 168 Ca 0.04 -0.25 -0.01 0.00 0.05 0.00 0.00 54.13 53.96 3h6h s LEU 168 Cb -0.17 -1.74 -0.04 0.00 -2.05 0.00 0.00 46.19 42.20 3h6h s LEU 168 CO -0.18 0.26 0.12 -0.54 -0.55 0.00 0.00 176.35 175.46 3h6h s LYS 169 N -1.50 3.20 -0.24 1.48 1.02 -0.81 -4.99 119.74 117.90 3h6h s LYS 169 Ca 0.17 -0.44 -0.03 0.00 0.02 0.00 0.00 55.97 55.68 3h6h s LYS 169 Cb -0.11 -2.94 0.01 0.00 -0.52 0.00 0.00 37.83 34.27 3h6h s LYS 169 CO 0.07 0.65 -0.03 0.42 -0.92 0.00 0.00 175.35 175.54 3h6h s ILE 170 N -1.27 3.27 0.21 2.17 -1.09 -1.26 -1.32 121.20 121.91 3h6h s ILE 170 Ca 0.25 -0.71 0.11 0.00 -2.23 0.00 0.00 60.65 58.07 3h6h s ILE 170 Cb -0.12 -2.58 -0.05 0.00 -1.58 0.00 0.00 42.46 38.14 3h6h s ILE 170 CO 0.17 0.29 -0.22 -0.13 -1.23 0.00 0.00 174.94 173.83 3h6h s ARG 171 N 1.43 1.50 0.04 2.79 0.52 -0.36 -5.01 118.95 119.86 3h6h s ARG 171 Ca 0.03 -1.57 0.08 0.00 -0.52 0.00 0.00 55.73 53.76 3h6h s ARG 171 Cb -0.15 -1.70 -0.03 0.00 0.52 0.00 0.00 34.95 33.59 3h6h s ARG 171 CO -0.03 0.35 -0.24 -1.14 0.02 0.00 0.00 175.30 174.26 3h6h s GLN 172 N -2.94 1.67 0.54 3.54 0.74 -1.26 -2.13 119.66 119.81 3h6h s GLN 172 Ca 0.22 -1.02 -0.19 0.00 0.05 0.00 0.00 55.36 54.42 3h6h s GLN 172 Cb -0.06 -1.80 -0.06 0.00 1.10 0.00 0.00 33.01 32.18 3h6h s GLN 172 CO 0.10 0.47 1.07 -0.51 -0.55 0.00 0.00 175.29 175.87 3h6h s LEU 173 N -1.15 3.72 0.73 3.68 1.43 -0.78 -4.94 118.68 121.37 3h6h s LEU 173 Ca 0.10 1.98 -0.12 0.00 -1.03 0.00 0.00 54.13 55.07 3h6h s LEU 173 Cb -0.09 -4.56 0.03 0.00 0.03 0.00 0.00 46.19 41.59 3h6h s LEU 173 CO 0.02 -1.04 1.11 -2.84 0.23 0.00 0.00 176.35 173.82 3h6h s PRO 174 N -3.47 2.66 0.23 1.29 0.02 -1.26 -4.90 135.00 129.56 3h6h s PRO 174 Ca 0.68 0.44 -0.13 0.00 0.02 0.00 0.00 61.00 62.01 3h6h s PRO 174 Cb -0.19 -2.00 0.30 0.00 0.02 0.00 0.00 34.50 32.63 3h6h s PRO 174 CO 0.27 -1.17 1.45 0.00 -0.33 0.00 0.00 177.00 177.22 3h6h n ALA 175 N -3.10 0.01 -2.92 -1.55 0.00 -1.26 -4.44 120.51 107.26 3h6h n ALA 175 Ca 0.07 0.97 -0.34 0.00 0.00 0.00 0.00 53.44 54.14 3h6h n ALA 175 Cb 0.57 -0.49 -0.12 0.00 0.00 0.00 0.00 19.45 19.41 3h6h n ALA 175 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 3h6h s ASP 176 N -5.30 4.62 0.56 0.00 3.84 -1.26 -4.99 116.67 114.13 3h6h s ASP 176 Ca -0.13 -0.15 0.32 0.00 -0.00 0.00 0.00 52.55 52.59 3h6h s ASP 176 Cb 0.21 -1.65 1.62 0.00 -1.38 0.00 0.00 42.92 41.73 3h6h s ASP 176 CO 0.69 0.20 2.11 0.74 -0.00 0.00 0.00 175.17 178.91 3h6h h THR 177 N 5.05 0.35 0.00 2.11 2.02 -1.97 -3.08 112.91 117.39 3h6h h THR 177 Ca -0.33 -0.43 0.00 0.00 0.77 0.00 0.00 66.41 66.42 3h6h h THR 177 Cb 1.19 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 68.91 3h6h h THR 177 CO 0.60 0.07 0.00 0.50 0.37 0.00 0.00 175.52 177.06 3h6h h LYS 178 N 0.00 0.00 -2.11 6.66 1.63 -1.94 0.81 116.57 121.62 3h6h h LYS 178 Ca -0.00 0.00 -0.56 0.00 -0.85 0.00 0.00 60.65 59.24 3h6h h LYS 178 Cb 0.31 0.00 -0.41 0.00 -0.60 0.00 0.00 32.23 31.53 3h6h h LYS 178 CO 0.01 0.00 -0.89 -0.25 -3.45 0.00 0.00 179.45 174.87 3h6h n ASP 179 N -2.72 2.19 -1.20 4.20 10.43 -1.16 -4.75 116.55 123.53 3h6h n ASP 179 Ca -0.02 -3.17 0.08 0.00 2.57 0.00 0.00 54.79 54.24 3h6h n ASP 179 Cb 0.06 -0.63 0.26 0.00 1.84 0.00 0.00 41.12 42.65 3h6h n ASP 179 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3h6h n ALA 180 N 0.66 2.78 0.03 2.24 0.00 0.28 -4.46 120.51 122.03 3h6h n ALA 180 Ca 0.26 -1.12 -0.19 0.00 0.00 0.00 0.00 53.44 52.39 3h6h n ALA 180 Cb 0.50 -1.00 -0.14 0.00 0.00 0.00 0.00 19.45 18.80 3h6h n ALA 180 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h6h h LYS 181 N 3.16 0.24 -0.63 0.00 1.57 -1.85 -1.48 116.57 117.57 3h6h h LYS 181 Ca 0.00 -0.41 0.14 0.00 -1.87 0.00 0.00 60.65 58.50 3h6h h LYS 181 Cb 1.03 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.46 3h6h h LYS 181 CO 0.12 1.20 0.43 -1.35 -0.57 0.00 0.00 179.45 179.28 3h6h h PRO 182 N -0.50 0.26 0.01 3.15 0.11 -1.98 0.13 132.00 133.19 3h6h h PRO 182 Ca -0.12 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.98 3h6h h PRO 182 Cb 1.52 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.57 3h6h h PRO 182 CO 0.12 0.17 -0.01 1.25 -0.21 0.00 0.00 178.00 179.32 3h6h h LEU 183 N 0.26 -0.02 -2.17 2.35 5.85 -1.85 -3.07 115.31 116.68 3h6h h LEU 183 Ca 0.30 -0.77 0.06 0.00 0.84 0.00 0.00 57.88 58.32 3h6h h LEU 183 Cb 0.82 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.85 3h6h h LEU 183 CO -0.07 0.80 0.21 -0.07 -0.34 0.00 0.00 178.44 178.97 3h6h h LEU 184 N -0.86 0.00 -0.24 2.25 3.38 -0.72 -0.44 115.31 118.68 3h6h h LEU 184 Ca -0.00 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.78 3h6h h LEU 184 Cb 0.78 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 3h6h h LEU 184 CO 0.00 0.00 -0.89 0.50 0.09 0.00 0.00 178.44 178.14 3h6h h LYS 185 N 0.00 0.03 -0.18 1.13 3.64 -0.78 -1.12 116.57 119.29 3h6h h LYS 185 Ca 0.10 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.25 3h6h h LYS 185 Cb 0.53 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.37 3h6h h LYS 185 CO -0.00 0.90 -0.64 0.93 -2.27 0.00 0.00 179.45 178.37 3h6h h GLU 186 N 0.02 0.75 -0.73 1.90 5.08 -1.00 -1.39 114.58 119.20 3h6h h GLU 186 Ca -0.02 -0.57 -0.06 0.00 -1.00 0.00 0.00 59.36 57.72 3h6h h GLU 186 Cb 1.56 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.88 3h6h h GLU 186 CO 0.12 1.18 0.23 0.52 -1.00 0.00 0.00 179.01 180.06 3h6h h MET 187 N 0.47 1.14 0.15 2.33 2.86 -1.32 -0.44 114.93 120.12 3h6h h MET 187 Ca -0.03 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.36 3h6h h MET 187 Cb 1.26 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.76 3h6h h MET 187 CO 0.13 0.97 -0.07 -0.22 1.06 0.00 0.00 176.91 178.79 3h6h h LYS 188 N 1.09 -0.19 -0.18 1.72 3.64 -1.21 0.18 116.57 121.62 3h6h h LYS 188 Ca 0.24 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.68 3h6h h LYS 188 Cb 0.31 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 3h6h h LYS 188 CO -0.01 0.03 0.14 -0.09 -2.27 0.00 0.00 179.45 177.25 3h6h h ARG 189 N -0.40 0.00 -0.59 1.90 2.43 -1.12 -0.48 114.38 116.11 3h6h h ARG 189 Ca -0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3h6h h ARG 189 Cb 0.31 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 3h6h h ARG 189 CO 0.03 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.90 3h6h n GLY 190 N -1.53 1.84 3.86 2.80 0.00 -0.19 -4.94 105.19 107.04 3h6h n GLY 190 Ca 0.01 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 3h6h n GLY 190 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h6h n LYS 191 N 1.30 -5.05 -2.75 1.61 5.02 -0.19 -4.87 118.16 113.24 3h6h n LYS 191 Ca 0.21 0.58 -0.43 0.00 -2.02 0.00 0.00 58.31 56.64 3h6h n LYS 191 Cb 0.52 -5.29 0.00 0.00 -0.02 0.00 0.00 35.03 30.24 3h6h n LYS 191 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3h6h n GLU 192 N -4.52 3.39 0.20 1.97 1.02 -0.06 -4.79 120.64 117.86 3h6h n GLU 192 Ca -0.10 -3.69 0.12 0.00 -0.02 0.00 0.00 57.16 53.48 3h6h n GLU 192 Cb 0.59 -3.07 0.17 0.00 -0.02 0.00 0.00 31.44 29.10 3h6h n GLU 192 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 3h6h h PHE 193 N 6.84 0.00 -3.59 -0.32 0.04 -1.87 -3.43 116.94 114.62 3h6h h PHE 193 Ca 0.36 0.00 -0.65 0.00 2.80 0.00 0.00 57.97 60.47 3h6h h PHE 193 Cb 0.81 0.00 -0.24 0.00 2.20 0.00 0.00 35.95 38.72 3h6h h PHE 193 CO 1.18 0.00 -0.65 -1.01 -0.60 0.00 0.00 178.31 177.23 3h6h s HIS 194 N -3.22 3.06 0.01 -0.55 3.76 -1.26 -1.40 115.29 115.69 3h6h s HIS 194 Ca 0.07 -0.56 0.01 0.00 -0.15 0.00 0.00 55.06 54.42 3h6h s HIS 194 Cb 0.06 -2.21 -0.01 0.00 1.11 0.00 0.00 32.58 31.53 3h6h s HIS 194 CO 0.68 -0.41 -0.05 0.08 -0.85 0.00 0.00 174.74 174.19 3h6h s VAL 195 N 1.58 0.32 -0.22 -0.90 1.01 -0.91 -1.78 120.40 119.50 3h6h s VAL 195 Ca 0.06 -0.52 -0.00 0.00 0.00 0.00 0.00 61.98 61.52 3h6h s VAL 195 Cb -0.15 -0.34 0.02 0.00 0.00 0.00 0.00 36.38 35.91 3h6h s VAL 195 CO 0.02 -0.14 -0.12 -0.63 0.00 0.00 0.00 175.10 174.23 3h6h s ILE 196 N -0.65 2.56 -0.36 2.22 1.01 -0.30 -0.32 121.20 125.36 3h6h s ILE 196 Ca -0.04 -0.97 -0.17 0.00 0.00 0.00 0.00 60.65 59.47 3h6h s ILE 196 Cb -0.05 -2.22 -0.00 0.00 0.01 0.00 0.00 42.46 40.20 3h6h s ILE 196 CO -0.00 0.34 0.44 -0.36 0.00 0.00 0.00 174.94 175.36 3h6h s PHE 197 N 1.31 3.19 -0.80 3.97 0.08 0.34 -1.11 117.98 124.96 3h6h s PHE 197 Ca 0.02 0.02 -0.14 0.00 0.12 0.00 0.00 56.93 56.95 3h6h s PHE 197 Cb -0.15 -2.81 0.21 0.00 -0.57 0.00 0.00 43.02 39.70 3h6h s PHE 197 CO -0.08 -0.51 0.74 0.34 -0.10 0.00 0.00 175.22 175.61 3h6h s ASP 198 N 1.76 6.69 0.20 1.36 -1.08 0.21 -2.44 116.67 123.36 3h6h s ASP 198 Ca 0.15 -2.62 -0.23 0.00 -0.52 0.00 0.00 52.55 49.32 3h6h s ASP 198 Cb -0.16 -2.20 0.05 0.00 -1.46 0.00 0.00 42.92 39.14 3h6h s ASP 198 CO 0.13 -0.59 0.82 0.00 0.52 0.00 0.00 175.17 176.05 3h6h s SER 200 N -2.89 4.20 0.46 0.00 1.04 -1.26 -4.19 113.70 111.06 3h6h s SER 200 Ca 0.10 2.44 0.16 0.00 0.48 0.00 0.00 55.95 59.13 3h6h s SER 200 Cb -0.03 -2.60 1.13 0.00 0.10 0.00 0.00 66.02 64.62 3h6h s SER 200 CO 0.03 -2.26 2.01 1.12 0.98 0.00 0.00 173.24 175.11 3h6h h HIS 201 N -0.16 0.29 -0.49 5.02 2.07 -1.97 0.02 115.15 119.93 3h6h h HIS 201 Ca -0.48 0.01 -0.06 0.00 -2.85 0.00 0.00 60.37 56.98 3h6h h HIS 201 Cb 1.31 -0.10 -0.02 0.00 2.57 0.00 0.00 27.41 31.17 3h6h h HIS 201 CO 0.45 0.14 0.05 0.93 -3.07 0.00 0.00 177.93 176.44 3h6h h GLU 202 N 0.28 0.78 -0.00 5.12 5.08 -1.94 0.67 114.58 124.57 3h6h h GLU 202 Ca 0.23 -0.19 -0.17 0.00 -1.00 0.00 0.00 59.36 58.23 3h6h h GLU 202 Cb 0.55 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 3h6h h GLU 202 CO -0.05 0.76 -0.80 0.52 -1.00 0.00 0.00 179.01 178.44 3h6h h MET 203 N 0.74 0.09 -0.32 2.33 2.86 -1.53 -3.07 114.93 116.03 3h6h h MET 203 Ca 0.15 -0.10 -0.15 0.00 -2.06 0.00 0.00 59.70 57.55 3h6h h MET 203 Cb 0.38 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.06 3h6h h MET 203 CO 0.01 0.84 -0.41 0.00 1.06 0.00 0.00 176.91 178.41 3h6h h ALA 204 N 1.13 0.67 -0.50 6.32 0.00 -0.51 -1.37 119.26 125.00 3h6h h ALA 204 Ca -0.02 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 3h6h h ALA 204 Cb 1.40 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 3h6h h ALA 204 CO 0.11 0.67 0.11 0.00 0.00 0.00 0.00 179.25 180.14 3h6h h ALA 205 N 0.89 1.25 0.00 0.00 0.00 -0.87 -2.25 119.26 118.28 3h6h h ALA 205 Ca 0.05 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 3h6h h ALA 205 Cb 0.98 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3h6h h ALA 205 CO 0.09 0.52 -0.70 0.78 0.00 0.00 0.00 179.25 179.94 3h6h h GLY 206 N 0.94 0.00 1.14 0.00 0.00 -1.41 -3.22 103.07 100.51 3h6h h GLY 206 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.19 3h6h h GLY 206 CO -0.00 0.00 -1.31 1.19 0.00 0.00 0.00 176.54 176.42 3h6h h ILE 207 N 0.00 1.33 -0.23 2.60 6.09 -1.05 -3.16 117.51 123.09 3h6h h ILE 207 Ca -0.03 -2.62 0.07 0.00 -1.37 0.00 0.00 64.86 60.91 3h6h h ILE 207 Cb 1.45 3.02 -0.01 0.00 0.47 0.00 0.00 36.82 41.75 3h6h h ILE 207 CO 0.07 0.78 0.18 -0.07 -3.07 0.00 0.00 178.15 176.04 3h6h h LEU 208 N 0.07 0.00 -0.16 2.19 3.38 -1.50 0.25 115.31 119.54 3h6h h LEU 208 Ca -0.22 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 3h6h h LEU 208 Cb 2.02 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.77 3h6h h LEU 208 CO 0.25 0.00 -0.02 0.11 0.09 0.00 0.00 178.44 178.87 3h6h h LYS 209 N 0.00 0.29 -0.17 1.13 1.57 -1.56 -1.87 116.57 115.96 3h6h h LYS 209 Ca 0.11 -0.10 -0.07 0.00 -1.87 0.00 0.00 60.65 58.72 3h6h h LYS 209 Cb 0.47 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3h6h h LYS 209 CO -0.00 0.54 -0.22 1.96 -0.57 0.00 0.00 179.45 181.16 3h6h h GLN 210 N 0.01 0.30 -0.21 3.15 1.08 -1.28 -2.11 115.11 116.04 3h6h h GLN 210 Ca 0.04 -0.09 -0.07 0.00 -1.45 0.00 0.00 58.65 57.08 3h6h h GLN 210 Cb 0.42 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.82 3h6h h GLN 210 CO 0.01 0.51 -0.12 0.00 -0.95 0.00 0.00 178.83 178.27 3h6h h ALA 211 N 1.51 0.30 -0.29 3.87 0.00 -0.90 -2.12 119.26 121.63 3h6h h ALA 211 Ca 0.05 -0.31 0.04 0.00 0.00 0.00 0.00 54.91 54.69 3h6h h ALA 211 Cb 0.54 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3h6h h ALA 211 CO 0.04 0.16 0.04 1.25 0.00 0.00 0.00 179.25 180.74 3h6h h LEU 212 N 0.16 -0.02 -2.21 0.00 5.85 -1.19 -0.86 115.31 117.04 3h6h h LEU 212 Ca 0.04 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.87 3h6h h LEU 212 Cb 0.63 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3h6h h LEU 212 CO 0.04 0.03 0.19 0.00 -0.34 0.00 0.00 178.44 178.35 3h6h h ALA 213 N 1.22 1.85 -0.01 1.25 0.00 -1.24 -1.33 119.26 120.99 3h6h h ALA 213 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3h6h h ALA 213 Cb 0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3h6h h ALA 213 CO -0.19 -0.28 -0.48 -1.33 0.00 0.00 0.00 179.25 176.98 3h6h n MET 214 N -3.90 1.05 -2.23 0.00 2.81 -0.64 -4.95 117.12 109.26 3h6h n MET 214 Ca 0.02 -0.84 0.00 0.00 -1.81 0.00 0.00 57.70 55.07 3h6h n MET 214 Cb 0.31 -1.48 0.00 0.00 -0.71 0.00 0.00 33.22 31.34 3h6h n MET 214 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3h6h n GLY 215 N 1.41 0.75 0.18 3.03 0.00 -0.50 -4.95 105.19 105.12 3h6h n GLY 215 Ca 0.09 -0.74 0.05 0.00 0.00 0.00 0.00 46.02 45.43 3h6h n GLY 215 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3h6h n MET 216 N -0.68 2.39 -3.53 1.61 2.81 -0.42 -4.76 117.12 114.54 3h6h n MET 216 Ca 0.00 -2.06 -0.40 0.00 -1.81 0.00 0.00 57.70 53.43 3h6h n MET 216 Cb 0.48 -1.28 -0.05 0.00 -0.71 0.00 0.00 33.22 31.66 3h6h n MET 216 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 3h6h s MET 217 N -1.81 3.48 0.18 0.03 1.00 -1.25 -4.70 119.30 116.22 3h6h s MET 217 Ca 0.18 -3.08 -0.00 0.00 0.00 0.00 0.00 55.69 52.79 3h6h s MET 217 Cb 0.14 -4.15 0.00 0.00 0.00 0.00 0.00 34.83 30.83 3h6h s MET 217 CO 0.04 -1.25 0.24 0.25 0.00 0.00 0.00 175.02 174.29 3h6h n THR 218 N 2.77 0.00 1.30 2.05 -2.24 -1.26 -4.67 114.28 112.23 3h6h n THR 218 Ca 0.19 -1.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.11 3h6h n THR 218 Cb 0.39 0.59 0.68 0.00 -2.10 0.00 0.00 70.33 69.88 3h6h n THR 218 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 3h6h n GLU 219 N -0.31 0.45 0.04 -0.78 0.00 -1.18 -2.90 120.64 115.96 3h6h n GLU 219 Ca 0.01 0.04 -0.09 0.00 0.00 0.00 0.00 57.16 57.12 3h6h n GLU 219 Cb 0.31 -1.50 -0.13 0.00 0.00 0.00 0.00 31.44 30.12 3h6h n GLU 219 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.13 179.01 3h6h h TYR 220 N 0.00 0.08 -2.75 -1.84 0.05 -1.95 -3.47 116.97 107.09 3h6h h TYR 220 Ca 0.00 -0.06 -0.55 0.00 0.05 0.00 0.00 58.73 58.17 3h6h h TYR 220 Cb 0.20 -0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.91 3h6h h TYR 220 CO 0.00 1.06 -0.39 0.71 -1.05 0.00 0.00 178.16 178.49 3h6h s TYR 221 N -2.67 3.49 -0.03 4.88 2.02 -1.14 -4.81 117.35 119.08 3h6h s TYR 221 Ca -0.02 0.26 -0.01 0.00 -0.37 0.00 0.00 57.07 56.93 3h6h s TYR 221 Cb 0.09 -1.78 0.03 0.00 -0.40 0.00 0.00 41.96 39.90 3h6h s TYR 221 CO 0.83 0.45 0.03 -1.58 -1.57 0.00 0.00 175.55 173.71 3h6h s HIS 222 N -1.79 0.15 -0.12 2.71 5.65 -0.49 -2.55 115.29 118.84 3h6h s HIS 222 Ca 0.37 0.13 0.00 0.00 0.25 0.00 0.00 55.06 55.81 3h6h s HIS 222 Cb -0.11 -0.41 -0.02 0.00 -1.18 0.00 0.00 32.58 30.87 3h6h s HIS 222 CO 0.29 -0.15 -0.13 0.71 -0.65 0.00 0.00 174.74 174.80 3h6h s TYR 223 N 1.54 2.80 -0.07 3.88 2.02 -0.44 -2.15 117.35 124.94 3h6h s TYR 223 Ca -0.03 -0.60 -0.01 0.00 -0.37 0.00 0.00 57.07 56.06 3h6h s TYR 223 Cb -0.13 -1.82 -0.03 0.00 -0.40 0.00 0.00 41.96 39.58 3h6h s TYR 223 CO -0.03 -0.17 0.00 0.42 -1.57 0.00 0.00 175.55 174.20 3h6h s ILE 224 N 0.25 4.30 -0.12 2.71 1.01 0.56 -1.20 121.20 128.71 3h6h s ILE 224 Ca -0.09 -0.31 0.02 0.00 0.00 0.00 0.00 60.65 60.27 3h6h s ILE 224 Cb -0.15 -2.83 0.01 0.00 0.01 0.00 0.00 42.46 39.49 3h6h s ILE 224 CO 0.05 0.56 -0.20 -0.36 0.00 0.00 0.00 174.94 174.99 3h6h s PHE 225 N -0.93 2.39 0.31 3.97 0.08 -0.18 -0.51 117.98 123.11 3h6h s PHE 225 Ca 0.15 -1.17 0.04 0.00 0.12 0.00 0.00 56.93 56.07 3h6h s PHE 225 Cb -0.11 -1.66 0.50 0.00 -0.57 0.00 0.00 43.02 41.18 3h6h s PHE 225 CO 0.04 -0.55 1.77 1.79 -0.10 0.00 0.00 175.22 178.18 3h6h h THR 226 N 5.87 1.25 -3.18 0.64 1.35 -1.80 -3.37 112.91 113.66 3h6h h THR 226 Ca -0.31 -1.15 -0.58 0.00 -0.55 0.00 0.00 66.41 63.83 3h6h h THR 226 Cb 1.19 1.29 0.12 0.00 -1.73 0.00 0.00 68.15 69.02 3h6h h THR 226 CO 0.52 0.36 0.33 1.07 -0.25 0.00 0.00 175.52 177.56 3h6h n THR 227 N -4.16 2.34 1.06 6.82 5.66 -1.26 -4.79 114.28 119.95 3h6h n THR 227 Ca -0.00 -0.50 0.11 0.00 -3.05 0.00 0.00 64.05 60.61 3h6h n THR 227 Cb 0.37 -1.34 0.09 0.00 -1.55 0.00 0.00 70.33 67.89 3h6h n THR 227 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 3h6h n LEU 228 N 0.55 1.34 -2.96 1.09 4.77 -1.26 -4.30 117.00 116.23 3h6h n LEU 228 Ca 0.08 -0.48 -0.40 0.00 -0.03 0.00 0.00 56.01 55.18 3h6h n LEU 228 Cb 0.38 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.44 3h6h n LEU 228 CO 0.59 0.27 1.52 0.47 -1.33 0.00 0.00 177.39 178.91 3h6h n ASP 229 N -0.73 7.48 0.04 -1.43 8.00 -1.26 -4.57 116.55 124.09 3h6h n ASP 229 Ca 0.08 -3.83 -0.09 0.00 0.71 0.00 0.00 54.79 51.67 3h6h n ASP 229 Cb 0.39 -1.07 0.06 0.00 -0.02 0.00 0.00 41.12 40.48 3h6h n ASP 229 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3h6h h LEU 230 N 3.07 0.48 0.00 0.64 5.85 -1.82 -2.75 115.31 120.78 3h6h h LEU 230 Ca 0.56 -0.29 0.00 0.00 0.84 0.00 0.00 57.88 59.00 3h6h h LEU 230 Cb 0.05 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3h6h h LEU 230 CO 1.41 1.00 0.00 0.49 -0.34 0.00 0.00 178.44 181.00 3h6h n PHE 231 N -3.88 0.00 0.37 1.25 3.01 -1.26 -1.99 117.46 114.95 3h6h n PHE 231 Ca -0.04 0.00 0.14 0.00 1.01 0.00 0.00 57.45 58.56 3h6h n PHE 231 Cb 0.66 -0.39 0.42 0.00 -0.01 0.00 0.00 39.48 40.15 3h6h n PHE 231 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3h6h h ALA 232 N 2.59 1.00 -2.71 4.37 0.00 -1.85 -3.46 119.26 119.19 3h6h h ALA 232 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.35 3h6h h ALA 232 Cb 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 3h6h h ALA 232 CO 0.00 0.00 0.05 -0.51 0.00 0.00 0.00 179.25 178.79 3h6h s LEU 233 N -5.44 4.55 0.01 0.00 1.02 -0.84 -1.37 118.68 116.62 3h6h s LEU 233 Ca 0.06 1.41 -0.30 0.00 0.02 0.00 0.00 54.13 55.31 3h6h s LEU 233 Cb 0.09 -3.05 -0.06 0.00 0.02 0.00 0.00 46.19 43.19 3h6h s LEU 233 CO 0.57 0.24 1.42 -0.62 0.02 0.00 0.00 176.35 177.98 3h6h s ASP 234 N -1.09 6.83 0.00 2.29 2.15 -0.46 -4.77 116.67 121.62 3h6h s ASP 234 Ca 0.32 2.16 0.01 0.00 0.43 0.00 0.00 52.55 55.46 3h6h s ASP 234 Cb -0.21 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 39.86 3h6h s ASP 234 CO 0.22 -0.73 0.75 0.52 -0.17 0.00 0.00 175.17 175.76 3h6h n VAL 235 N 4.61 0.46 -0.34 1.11 0.31 -1.26 -4.71 118.33 118.52 3h6h n VAL 235 Ca 0.13 -0.73 -0.01 0.00 -0.01 0.00 0.00 64.34 63.72 3h6h n VAL 235 Cb 0.43 0.78 0.12 0.00 -0.91 0.00 0.00 33.84 34.26 3h6h n VAL 235 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3h6h h GLU 236 N 0.11 1.12 0.00 5.55 4.57 -2.00 -2.55 114.58 121.38 3h6h h GLU 236 Ca 0.00 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3h6h h GLU 236 Cb 0.25 -0.25 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 3h6h h GLU 236 CO 0.00 0.74 0.00 -2.30 -1.18 0.00 0.00 179.01 176.27 3h6h n PRO 237 N -4.50 0.13 0.00 0.92 -0.02 -1.26 -3.89 135.00 126.37 3h6h n PRO 237 Ca 0.12 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 3h6h n PRO 237 Cb 0.09 -1.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 3h6h n PRO 237 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3h6h n TYR 238 N -2.01 0.00 0.49 6.00 4.01 -1.01 -4.77 117.16 119.88 3h6h n TYR 238 Ca 0.02 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.86 3h6h n TYR 238 Cb 0.18 0.00 0.42 0.00 -0.31 0.00 0.00 39.34 39.63 3h6h n TYR 238 CO 0.00 0.00 0.00 2.89 -0.46 0.00 0.00 176.86 179.29 3h6h n ARG 239 N -0.77 0.11 0.01 -0.72 1.85 -0.99 -2.37 116.66 113.77 3h6h n ARG 239 Ca 0.00 0.32 0.11 0.00 -1.00 0.00 0.00 57.85 57.27 3h6h n ARG 239 Cb 0.00 -1.70 -0.12 0.00 -1.05 0.00 0.00 32.46 29.59 3h6h n ARG 239 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3h6h n TYR 240 N -1.90 0.12 0.26 2.89 4.01 -1.26 -4.21 117.16 117.06 3h6h n TYR 240 Ca 0.03 0.03 0.15 0.00 -0.16 0.00 0.00 57.90 57.96 3h6h n TYR 240 Cb 0.23 -0.43 0.58 0.00 -0.31 0.00 0.00 39.34 39.41 3h6h n TYR 240 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3h6h h SER 241 N 0.00 0.00 -3.04 7.72 4.64 -1.78 -3.47 113.55 117.63 3h6h h SER 241 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 3h6h h SER 241 Cb 0.86 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.99 3h6h h SER 241 CO 0.00 0.04 -0.38 0.61 -0.87 0.00 0.00 176.83 176.23 3h6h n GLY 242 N 0.19 -0.07 3.73 -0.77 0.00 -1.25 -4.00 105.19 103.02 3h6h n GLY 242 Ca 0.01 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 3h6h n GLY 242 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3h6h s VAL 243 N -2.95 2.79 -0.13 1.61 -7.23 -1.19 -3.12 120.40 110.19 3h6h s VAL 243 Ca 0.20 0.26 -0.06 0.00 -1.81 0.00 0.00 61.98 60.57 3h6h s VAL 243 Cb -0.09 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.09 3h6h s VAL 243 CO 0.25 -0.34 0.07 0.20 -0.31 0.00 0.00 175.10 174.97 3h6h s ASN 244 N -3.39 5.81 -0.04 4.85 0.02 -1.06 -4.93 114.94 116.21 3h6h s ASN 244 Ca 0.63 0.25 -0.01 0.00 -1.02 0.00 0.00 52.86 52.71 3h6h s ASN 244 Cb -0.18 -1.85 0.03 0.00 0.02 0.00 0.00 41.25 39.27 3h6h s ASN 244 CO 0.57 0.33 0.06 -0.04 0.02 0.00 0.00 177.10 178.04 3h6h s MET 245 N -0.56 -0.04 0.01 -0.60 -1.94 -1.26 -1.32 119.30 113.58 3h6h s MET 245 Ca 0.11 0.30 0.01 0.00 -1.71 0.00 0.00 55.69 54.41 3h6h s MET 245 Cb -0.12 -0.36 -0.01 0.00 2.01 0.00 0.00 34.83 36.35 3h6h s MET 245 CO 0.02 -0.25 -0.04 0.99 -0.01 0.00 0.00 175.02 175.74 3h6h s THR 246 N 1.63 0.27 0.06 2.05 2.01 -0.34 -0.42 115.64 120.90 3h6h s THR 246 Ca -0.02 -0.45 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 3h6h s THR 246 Cb -0.12 -0.29 0.01 0.00 0.01 0.00 0.00 72.50 72.11 3h6h s THR 246 CO -0.03 -0.12 0.14 0.61 -0.69 0.00 0.00 174.62 174.52 3h6h n GLY 247 N 2.46 1.72 3.81 4.40 0.00 -0.69 -1.02 105.19 115.88 3h6h n GLY 247 Ca -0.16 -1.04 -0.22 0.00 0.00 0.00 0.00 46.02 44.59 3h6h n GLY 247 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3h6h s PHE 248 N -7.46 2.68 -0.17 1.61 0.08 -1.26 -1.58 117.98 111.88 3h6h s PHE 248 Ca 0.03 -0.51 -0.04 0.00 0.12 0.00 0.00 56.93 56.52 3h6h s PHE 248 Cb -0.01 -2.04 0.08 0.00 -0.57 0.00 0.00 43.02 40.48 3h6h s PHE 248 CO 0.02 0.04 0.28 0.50 -0.10 0.00 0.00 175.22 175.96 3h6h s ARG 249 N -4.02 0.20 0.04 0.44 3.52 0.07 -4.45 118.95 114.74 3h6h s ARG 249 Ca 0.44 0.60 0.04 0.00 -0.13 0.00 0.00 55.73 56.68 3h6h s ARG 249 Cb -0.01 -0.38 -0.24 0.00 -1.56 0.00 0.00 34.95 32.77 3h6h s ARG 249 CO 0.25 -0.43 0.99 0.97 -0.81 0.00 0.00 175.30 176.27 3h6h h ILE 250 N 6.27 1.31 -2.18 4.11 6.09 -1.84 -1.93 117.51 129.34 3h6h h ILE 250 Ca -0.16 -3.02 -0.52 0.00 -1.37 0.00 0.00 64.86 59.79 3h6h h ILE 250 Cb 1.13 2.73 -0.03 0.00 0.47 0.00 0.00 36.82 41.12 3h6h h ILE 250 CO 0.19 0.81 1.36 -0.22 -3.07 0.00 0.00 178.15 177.22 3h6h s LEU 251 N -6.69 3.38 -1.19 2.19 2.96 -1.26 -4.36 118.68 113.70 3h6h s LEU 251 Ca -0.04 0.79 -0.22 0.00 -0.22 0.00 0.00 54.13 54.43 3h6h s LEU 251 Cb 0.08 -2.88 -0.08 0.00 0.50 0.00 0.00 46.19 43.81 3h6h s LEU 251 CO 0.84 -2.20 1.92 0.21 -1.32 0.00 0.00 176.35 175.80 3h6h s ASN 252 N 7.89 5.16 0.30 3.68 3.84 -0.42 -4.71 114.94 130.68 3h6h s ASN 252 Ca 0.76 -1.73 0.16 0.00 0.21 0.00 0.00 52.86 52.26 3h6h s ASN 252 Cb -0.17 -2.59 0.20 0.00 -0.55 0.00 0.00 41.25 38.14 3h6h s ASN 252 CO 0.26 -2.94 1.51 0.71 -2.79 0.00 0.00 177.10 173.84 3h6h h THR 253 N 6.13 0.85 -0.39 -5.21 1.35 -1.90 -3.27 112.91 110.47 3h6h h THR 253 Ca 0.23 -2.07 0.11 0.00 -0.55 0.00 0.00 66.41 64.14 3h6h h THR 253 Cb 0.93 2.32 -0.02 0.00 -1.73 0.00 0.00 68.15 69.66 3h6h h THR 253 CO 1.24 0.46 0.36 -0.33 -0.25 0.00 0.00 175.52 177.00 3h6h h GLU 254 N 0.00 0.00 -6.30 4.72 4.39 -1.99 -3.40 114.58 112.00 3h6h h GLU 254 Ca -0.00 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.15 3h6h h GLU 254 Cb 1.28 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.90 3h6h h GLU 254 CO 0.06 0.00 0.26 1.21 -1.16 0.00 0.00 179.01 179.38 3h6h s ASN 255 N -5.72 7.25 0.33 1.42 2.47 -1.23 -4.96 114.94 114.49 3h6h s ASN 255 Ca -0.05 1.51 0.04 0.00 0.42 0.00 0.00 52.86 54.79 3h6h s ASN 255 Cb 0.17 -2.51 0.57 0.00 -1.45 0.00 0.00 41.25 38.02 3h6h s ASN 255 CO 0.61 -0.17 1.84 0.74 -3.72 0.00 0.00 177.10 176.40 3h6h h THR 256 N 4.64 1.21 -0.57 -5.21 2.02 -1.91 -2.04 112.91 111.04 3h6h h THR 256 Ca -0.42 -0.88 -0.06 0.00 0.77 0.00 0.00 66.41 65.83 3h6h h THR 256 Cb 1.21 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 68.63 3h6h h THR 256 CO 0.74 0.29 0.13 1.56 0.37 0.00 0.00 175.52 178.61 3h6h h GLN 257 N 0.48 0.90 -0.21 6.66 4.20 -1.93 -1.68 115.11 123.53 3h6h h GLN 257 Ca 0.10 -0.20 -0.16 0.00 0.06 0.00 0.00 58.65 58.45 3h6h h GLN 257 Cb 0.40 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 3h6h h GLN 257 CO 0.02 0.81 -0.54 0.28 -0.67 0.00 0.00 178.83 178.73 3h6h h VAL 258 N 0.86 1.31 -0.54 -0.54 2.07 -1.72 -2.93 116.25 114.76 3h6h h VAL 258 Ca 0.18 -1.78 -0.08 0.00 0.82 0.00 0.00 66.70 65.85 3h6h h VAL 258 Cb 0.33 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.81 3h6h h VAL 258 CO 0.00 0.56 0.02 0.28 0.02 0.00 0.00 177.57 178.45 3h6h h SER 259 N 0.48 0.86 0.15 0.57 0.02 -0.91 -1.03 113.55 113.68 3h6h h SER 259 Ca 0.01 -0.21 -0.16 0.00 -0.84 0.00 0.00 61.79 60.59 3h6h h SER 259 Cb 1.10 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 3h6h h SER 259 CO 0.11 0.91 -0.58 0.77 -1.14 0.00 0.00 176.83 176.89 3h6h h SER 260 N 0.83 0.50 0.88 3.07 4.64 -1.32 -1.56 113.55 120.58 3h6h h SER 260 Ca 0.16 -0.28 -0.11 0.00 -0.47 0.00 0.00 61.79 61.09 3h6h h SER 260 Cb 0.46 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.39 3h6h h SER 260 CO 0.02 0.97 -0.54 0.40 -0.87 0.00 0.00 176.83 176.81 3h6h h ILE 261 N 0.33 1.15 0.00 0.95 2.04 -1.32 -2.19 117.51 118.47 3h6h h ILE 261 Ca -0.00 -2.01 -0.09 0.00 1.00 0.00 0.00 64.86 63.76 3h6h h ILE 261 Cb 1.11 2.16 -0.01 0.00 -0.74 0.00 0.00 36.82 39.34 3h6h h ILE 261 CO 0.10 0.53 -0.42 0.40 0.00 0.00 0.00 178.15 178.76 3h6h h ILE 262 N 0.00 0.90 0.14 -0.67 2.04 -0.88 -2.94 117.51 116.09 3h6h h ILE 262 Ca -0.01 -1.73 -0.28 0.00 1.00 0.00 0.00 64.86 63.84 3h6h h ILE 262 Cb 1.12 2.06 0.01 0.00 -0.74 0.00 0.00 36.82 39.28 3h6h h ILE 262 CO 0.07 0.41 -1.25 -0.08 0.00 0.00 0.00 178.15 177.30 3h6h h GLU 263 N 0.00 0.37 0.00 2.37 4.81 -0.92 -1.53 114.58 119.68 3h6h h GLU 263 Ca -0.00 -0.58 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 3h6h h GLU 263 Cb 1.03 0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.62 3h6h h GLU 263 CO 0.05 1.26 0.00 1.63 -0.73 0.00 0.00 179.01 181.22 3h6h n LYS 264 N -3.61 0.17 -0.03 1.92 5.02 -0.86 -1.52 118.16 119.24 3h6h n LYS 264 Ca -0.10 0.42 -0.22 0.00 -2.02 0.00 0.00 58.31 56.40 3h6h n LYS 264 Cb 1.01 -1.84 -0.13 0.00 -0.02 0.00 0.00 35.03 34.05 3h6h n LYS 264 CO 0.00 0.00 0.00 2.35 -0.52 0.00 0.00 177.40 179.23 3h6h h TRP 265 N 0.00 0.33 -0.07 2.13 2.91 -1.32 -3.32 115.95 116.60 3h6h h TRP 265 Ca 0.00 -0.24 0.01 0.00 1.13 0.00 0.00 58.89 59.79 3h6h h TRP 265 Cb 0.32 -0.01 -0.00 0.00 -0.51 0.00 0.00 29.16 28.95 3h6h h TRP 265 CO 0.00 1.67 0.05 0.77 -1.03 0.00 0.00 178.44 179.90 3h6h h SER 266 N -0.32 0.05 -4.34 2.65 0.02 -1.12 -3.32 113.55 107.17 3h6h h SER 266 Ca -0.39 -0.00 -0.49 0.00 -0.84 0.00 0.00 61.79 60.07 3h6h h SER 266 Cb 1.77 -0.01 0.07 0.00 0.14 0.00 0.00 62.40 64.37 3h6h h SER 266 CO -0.01 0.04 0.38 -0.32 -1.14 0.00 0.00 176.83 175.77 3h6h s MET 267 N -5.11 2.87 -0.07 3.45 -2.45 -0.58 -3.56 119.30 113.86 3h6h s MET 267 Ca -0.05 0.38 0.00 0.00 -1.25 0.00 0.00 55.69 54.77 3h6h s MET 267 Cb 0.17 -2.06 0.00 0.00 1.25 0.00 0.00 34.83 34.19 3h6h s MET 267 CO 0.68 -0.98 0.00 0.39 1.05 0.00 0.00 175.02 176.16 3h6h n GLU 268 N -2.94 -1.98 0.00 4.11 1.02 -1.26 -4.84 120.64 114.76 3h6h n GLU 268 Ca 0.06 0.52 0.00 0.00 -0.02 0.00 0.00 57.16 57.73 3h6h n GLU 268 Cb 0.57 -5.02 0.00 0.00 -0.02 0.00 0.00 31.44 26.98 3h6h n GLU 268 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3h6h n ARG 269 N 0.89 3.60 0.00 3.49 5.12 -1.23 -5.08 116.66 123.45 3h6h n ARG 269 Ca -0.01 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.91 3h6h n ARG 269 Cb 0.51 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.81 3h6h n ARG 269 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 3h6h n LEU 270 N 0.00 0.00 0.00 0.55 -0.00 -1.26 -5.08 117.00 111.21 3h6h n LEU 270 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 3h6h n LEU 270 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 3h6h n LEU 270 CO 0.00 0.00 0.00 -2.65 -0.00 0.00 0.00 177.39 174.74 3h6h n PRO 276 N 0.00 0.00 0.00 1.47 -0.02 -1.26 -4.29 135.00 130.90 3h6h n PRO 276 Ca 0.00 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.50 3h6h n PRO 276 Cb 0.00 0.00 0.10 0.00 -0.02 0.00 0.00 33.50 33.58 3h6h n PRO 276 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3h6h n ASP 277 N 0.00 0.00 -0.26 2.55 2.03 -1.26 -3.17 116.55 116.44 3h6h n ASP 277 Ca 0.00 -0.61 -0.07 0.00 0.52 0.00 0.00 54.79 54.63 3h6h n ASP 277 Cb 0.00 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.45 3h6h n ASP 277 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3h6h h SER 278 N 0.00 1.04 0.00 1.67 4.64 -2.01 -3.47 113.55 115.42 3h6h h SER 278 Ca 0.00 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 61.12 3h6h h SER 278 Cb 0.00 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.82 3h6h h SER 278 CO 0.00 0.97 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 3h6h n GLY 279 N -0.77 0.71 3.84 -0.77 0.00 -1.19 -4.52 105.19 102.49 3h6h n GLY 279 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 3h6h n GLY 279 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h6h s LEU 280 N 0.00 3.95 -0.02 0.99 2.01 -1.26 -1.36 118.68 122.99 3h6h s LEU 280 Ca 0.00 -0.05 -0.27 0.00 0.01 0.00 0.00 54.13 53.82 3h6h s LEU 280 Cb 0.00 -2.55 -0.04 0.00 0.01 0.00 0.00 46.19 43.61 3h6h s LEU 280 CO 0.00 0.06 0.84 -0.76 1.01 0.00 0.00 176.35 177.50 3h6h s LEU 281 N -3.18 4.36 0.62 1.79 1.43 -0.47 -4.69 118.68 118.55 3h6h s LEU 281 Ca 0.32 1.46 -0.18 0.00 -1.03 0.00 0.00 54.13 54.70 3h6h s LEU 281 Cb -0.10 -3.34 -0.02 0.00 0.03 0.00 0.00 46.19 42.76 3h6h s LEU 281 CO 0.25 -0.16 1.20 -0.62 0.23 0.00 0.00 176.35 177.25 3h6h s ASP 282 N 0.75 5.02 -0.96 2.29 2.15 -1.26 -4.13 116.67 120.53 3h6h s ASP 282 Ca 0.44 2.37 -0.05 0.00 0.43 0.00 0.00 52.55 55.74 3h6h s ASP 282 Cb -0.20 -2.59 -0.04 0.00 -0.30 0.00 0.00 42.92 39.79 3h6h s ASP 282 CO 0.24 -1.70 0.83 0.61 -0.17 0.00 0.00 175.17 174.98 3h6h n GLY 283 N 0.43 -1.18 2.84 2.66 0.00 -1.26 -5.03 105.19 103.65 3h6h n GLY 283 Ca 0.13 0.54 -0.17 0.00 0.00 0.00 0.00 46.02 46.53 3h6h n GLY 283 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3h6h s PHE 284 N -3.27 0.31 -0.48 1.61 5.36 -1.26 -4.79 117.98 115.46 3h6h s PHE 284 Ca 0.31 -0.01 -0.26 0.00 -0.96 0.00 0.00 56.93 56.01 3h6h s PHE 284 Cb -0.05 -0.37 0.03 0.00 -0.34 0.00 0.00 43.02 42.29 3h6h s PHE 284 CO 0.76 -0.11 0.99 1.41 -1.46 0.00 0.00 175.22 176.81 3h6h s MET 285 N 0.83 3.55 0.86 10.12 -2.45 -1.26 -5.03 119.30 125.92 3h6h s MET 285 Ca -0.08 0.21 -0.11 0.00 -1.25 0.00 0.00 55.69 54.45 3h6h s MET 285 Cb -0.12 -3.94 0.11 0.00 1.25 0.00 0.00 34.83 32.13 3h6h s MET 285 CO -0.01 -1.32 1.09 0.95 1.05 0.00 0.00 175.02 176.78 3h6h s THR 286 N 4.02 2.84 0.23 10.11 -4.23 -1.26 -4.87 115.64 122.48 3h6h s THR 286 Ca 0.39 0.27 -0.03 0.00 -1.18 0.00 0.00 61.69 61.14 3h6h s THR 286 Cb -0.09 -2.69 0.06 0.00 1.34 0.00 0.00 72.50 71.12 3h6h s THR 286 CO 0.27 -0.36 1.68 0.74 -0.54 0.00 0.00 174.62 176.41 3h6h h THR 287 N -1.46 1.26 -0.05 3.99 2.02 -1.95 -2.37 112.91 114.34 3h6h h THR 287 Ca -0.47 -1.21 0.02 0.00 0.77 0.00 0.00 66.41 65.52 3h6h h THR 287 Cb 1.26 1.09 -0.00 0.00 -1.74 0.00 0.00 68.15 68.76 3h6h h THR 287 CO 0.52 0.41 0.10 -2.24 0.37 0.00 0.00 175.52 174.67 3h6h h ASP 288 N 0.70 0.00 0.19 4.18 3.04 -1.92 -1.52 116.42 121.09 3h6h h ASP 288 Ca 0.11 0.00 -0.35 0.00 -3.24 0.00 0.00 57.03 53.55 3h6h h ASP 288 Cb 0.63 0.00 -0.04 0.00 -1.04 0.00 0.00 39.33 38.88 3h6h h ASP 288 CO 0.04 0.00 -2.05 0.00 -2.04 0.00 0.00 179.24 175.20 3h6h n ALA 289 N -2.20 1.21 0.26 4.15 0.00 -0.92 -3.52 120.51 119.49 3h6h n ALA 289 Ca -0.02 -0.81 0.14 0.00 0.00 0.00 0.00 53.44 52.76 3h6h n ALA 289 Cb 0.18 -0.57 0.59 0.00 0.00 0.00 0.00 19.45 19.65 3h6h n ALA 289 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h6h h ALA 290 N 0.42 1.01 0.09 0.00 0.00 -1.09 -2.49 119.26 117.20 3h6h h ALA 290 Ca -0.43 -0.07 -0.27 0.00 0.00 0.00 0.00 54.91 54.13 3h6h h ALA 290 Cb 2.03 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 19.83 3h6h h ALA 290 CO 0.05 0.10 -1.12 -0.07 0.00 0.00 0.00 179.25 178.21 3h6h h LEU 291 N 0.00 0.83 -0.73 0.00 3.38 -1.42 -2.40 115.31 114.98 3h6h h LEU 291 Ca -0.00 -0.81 -0.05 0.00 0.09 0.00 0.00 57.88 57.11 3h6h h LEU 291 Cb 0.61 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 3h6h h LEU 291 CO 0.01 1.55 0.26 -0.03 0.09 0.00 0.00 178.44 180.32 3h6h h MET 292 N 0.22 1.12 -0.27 1.13 4.05 -1.56 0.27 114.93 119.89 3h6h h MET 292 Ca -0.16 -0.23 -0.03 0.00 -0.28 0.00 0.00 59.70 58.99 3h6h h MET 292 Cb 1.80 -0.17 -0.02 0.00 -0.80 0.00 0.00 31.60 32.42 3h6h h MET 292 CO 0.22 0.94 0.02 -0.92 0.23 0.00 0.00 176.91 177.39 3h6h h TYR 293 N 1.07 0.41 0.00 1.39 3.20 -1.50 -2.42 116.97 119.12 3h6h h TYR 293 Ca 0.24 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 3h6h h TYR 293 Cb 0.27 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.41 3h6h h TYR 293 CO 0.02 0.40 -0.40 -0.44 -1.64 0.00 0.00 178.16 176.10 3h6h h ASP 294 N 0.40 0.00 0.37 -2.11 3.32 -0.83 -3.16 116.42 114.40 3h6h h ASP 294 Ca 0.09 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.88 3h6h h ASP 294 Cb 0.24 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.80 3h6h h ASP 294 CO 0.00 0.04 -1.13 0.00 -1.72 0.00 0.00 179.24 176.44 3h6h h ALA 295 N 1.96 0.17 -0.51 3.45 0.00 -0.07 -1.82 119.26 122.44 3h6h h ALA 295 Ca -0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 54.91 54.04 3h6h h ALA 295 Cb 1.04 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 3h6h h ALA 295 CO 0.00 0.83 -0.03 0.28 0.00 0.00 0.00 179.25 180.33 3h6h h VAL 296 N 0.19 1.25 -0.15 0.00 2.07 -1.53 -2.34 116.25 115.75 3h6h h VAL 296 Ca -0.13 -1.09 -0.19 0.00 0.82 0.00 0.00 66.70 66.11 3h6h h VAL 296 Cb 1.80 0.89 -0.00 0.00 -1.52 0.00 0.00 31.29 32.47 3h6h h VAL 296 CO 0.20 0.39 -0.68 0.45 0.02 0.00 0.00 177.57 177.95 3h6h h HIS 297 N 0.80 0.77 -0.08 1.57 -0.00 -1.54 -2.49 115.15 114.18 3h6h h HIS 297 Ca 0.15 -0.32 -0.05 0.00 -0.00 0.00 0.00 60.37 60.15 3h6h h HIS 297 Cb 0.52 -0.13 0.00 0.00 -0.00 0.00 0.00 27.41 27.80 3h6h h HIS 297 CO 0.03 1.09 -0.16 0.28 -0.00 0.00 0.00 177.93 179.17 3h6h h VAL 298 N 0.42 1.40 -0.89 2.45 2.07 -1.27 -2.04 116.25 118.39 3h6h h VAL 298 Ca -0.02 -1.44 0.07 0.00 0.82 0.00 0.00 66.70 66.13 3h6h h VAL 298 Cb 1.26 2.14 -0.06 0.00 -1.52 0.00 0.00 31.29 33.10 3h6h h VAL 298 CO 0.13 0.41 0.55 0.58 0.02 0.00 0.00 177.57 179.26 3h6h h VAL 299 N -0.20 1.04 0.00 2.57 2.07 -1.52 -2.06 116.25 118.15 3h6h h VAL 299 Ca 0.00 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.14 3h6h h VAL 299 Cb 0.73 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 3h6h h VAL 299 CO 0.04 0.18 -0.22 0.28 0.02 0.00 0.00 177.57 177.87 3h6h h SER 300 N 1.00 0.00 0.65 0.57 0.02 -1.32 -1.06 113.55 113.41 3h6h h SER 300 Ca 0.39 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.26 3h6h h SER 300 Cb 0.19 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 3h6h h SER 300 CO -0.18 0.22 -0.40 0.58 -1.14 0.00 0.00 176.83 175.91 3h6h h VAL 301 N 0.00 1.05 0.00 2.27 2.07 -0.64 -2.01 116.25 118.99 3h6h h VAL 301 Ca -0.00 -1.48 -0.16 0.00 0.82 0.00 0.00 66.70 65.87 3h6h h VAL 301 Cb 0.41 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 3h6h h VAL 301 CO 0.03 0.39 -0.87 0.00 0.02 0.00 0.00 177.57 177.14 3h6h h ALA 302 N 1.60 0.56 -0.07 1.67 0.00 -1.05 -3.30 119.26 118.68 3h6h h ALA 302 Ca -0.00 -0.73 -0.18 0.00 0.00 0.00 0.00 54.91 54.00 3h6h h ALA 302 Cb 0.83 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 3h6h h ALA 302 CO 0.05 0.95 -0.72 0.28 0.00 0.00 0.00 179.25 179.81 3h6h h VAL 303 N 0.00 1.39 0.00 0.00 2.07 -0.89 -2.98 116.25 115.85 3h6h h VAL 303 Ca -0.04 -2.17 0.00 0.00 0.82 0.00 0.00 66.70 65.31 3h6h h VAL 303 Cb 1.59 2.13 0.00 0.00 -1.52 0.00 0.00 31.29 33.49 3h6h h VAL 303 CO 0.09 0.65 0.00 -0.61 0.02 0.00 0.00 177.57 177.71 3h6h h GLN 304 N 0.24 0.00 -0.03 1.57 4.15 -1.45 -1.99 115.11 117.60 3h6h h GLN 304 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.39 3h6h h GLN 304 Cb 1.29 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.98 3h6h h GLN 304 CO 0.12 0.00 -0.02 1.04 -1.93 0.00 0.00 178.83 178.04 3h6h n GLN 305 N -2.65 2.15 -3.19 1.69 6.02 -1.13 -4.60 117.38 115.68 3h6h n GLN 305 Ca -0.00 -1.70 -0.21 0.00 -0.01 0.00 0.00 57.00 55.08 3h6h n GLN 305 Cb 0.18 -1.46 -0.05 0.00 1.02 0.00 0.00 30.24 29.93 3h6h n GLN 305 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3h6h n PHE 306 N 1.05 0.33 -0.11 1.08 7.35 -0.75 -4.95 117.46 121.47 3h6h n PHE 306 Ca 0.15 -3.74 -0.03 0.00 -0.76 0.00 0.00 57.45 53.06 3h6h n PHE 306 Cb 0.55 -0.40 0.19 0.00 0.35 0.00 0.00 39.48 40.16 3h6h n PHE 306 CO 0.00 0.00 0.00 -1.35 -0.76 0.00 0.00 176.76 174.65 3h6h h PRO 307 N 3.43 0.78 -1.13 -7.13 0.11 -1.81 -2.07 132.00 124.18 3h6h h PRO 307 Ca 0.09 -0.18 0.32 0.00 0.11 0.00 0.00 66.00 66.34 3h6h h PRO 307 Cb 0.90 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 31.85 3h6h h PRO 307 CO 0.52 0.75 0.80 1.96 -0.21 0.00 0.00 178.00 181.82 3h6h h GLN 308 N 0.75 0.07 -6.95 1.05 7.50 -1.93 -3.42 115.11 112.17 3h6h h GLN 308 Ca 0.16 -0.00 -0.52 0.00 0.50 0.00 0.00 58.65 58.78 3h6h h GLN 308 Cb 0.37 -0.02 0.07 0.00 0.05 0.00 0.00 27.48 27.95 3h6h h GLN 308 CO 0.01 0.05 0.56 1.41 -1.50 0.00 0.00 178.83 179.36 3h6h s MET 309 N -5.05 3.99 0.11 1.46 1.75 -0.78 -5.04 119.30 115.73 3h6h s MET 309 Ca -0.06 2.01 -0.06 0.00 -1.25 0.00 0.00 55.69 56.33 3h6h s MET 309 Cb 0.23 -2.71 -0.02 0.00 2.84 0.00 0.00 34.83 35.18 3h6h s MET 309 CO 0.80 -0.43 0.16 0.95 -0.65 0.00 0.00 175.02 175.85 3h6h s THR 310 N -1.33 0.13 0.87 10.11 -4.23 -1.26 -5.10 115.64 114.83 3h6h s THR 310 Ca 0.57 -1.45 -0.12 0.00 -1.18 0.00 0.00 61.69 59.52 3h6h s THR 310 Cb -0.35 -1.61 0.12 0.00 1.34 0.00 0.00 72.50 72.00 3h6h s THR 310 CO 0.44 -0.58 1.11 -0.69 -0.54 0.00 0.00 174.62 174.36 3h6h s VAL 311 N -3.93 2.48 -0.17 2.29 1.01 -1.26 -4.94 120.40 115.89 3h6h s VAL 311 Ca 0.11 0.16 -0.14 0.00 0.00 0.00 0.00 61.98 62.11 3h6h s VAL 311 Cb 0.05 -2.86 0.05 0.00 0.00 0.00 0.00 36.38 33.63 3h6h s VAL 311 CO -0.06 -0.20 0.44 -0.44 0.00 0.00 0.00 175.10 174.84 3h6h s SER 312 N -3.87 -0.49 -0.81 3.32 0.01 -1.26 -5.03 113.70 105.57 3h6h s SER 312 Ca 0.63 0.91 -0.26 0.00 1.31 0.00 0.00 55.95 58.54 3h6h s SER 312 Cb -0.15 0.88 0.04 0.00 0.21 0.00 0.00 66.02 66.99 3h6h s SER 312 CO 0.54 -0.17 1.31 -0.55 0.41 0.00 0.00 173.24 174.79 3h6h s SER 313 N 0.60 6.25 0.01 2.44 0.15 -1.26 -4.37 113.70 117.51 3h6h s SER 313 Ca -0.03 -0.72 -0.01 0.00 0.70 0.00 0.00 55.95 55.89 3h6h s SER 313 Cb -0.05 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 3h6h s SER 313 CO -0.04 -1.74 0.14 -0.76 1.20 0.00 0.00 173.24 172.04 3h6h s LEU 314 N 5.49 4.17 0.04 3.45 1.43 0.57 -4.91 118.68 128.92 3h6h s LEU 314 Ca 0.37 0.25 0.05 0.00 -1.03 0.00 0.00 54.13 53.77 3h6h s LEU 314 Cb -0.06 -2.52 -0.03 0.00 0.03 0.00 0.00 46.19 43.60 3h6h s LEU 314 CO 0.09 0.25 -0.11 -1.10 0.23 0.00 0.00 176.35 175.71 3h6h s GLN 315 N -1.95 2.31 0.40 1.70 -1.52 -1.26 -2.80 119.66 116.53 3h6h s GLN 315 Ca 0.27 -0.87 0.27 0.00 -1.95 0.00 0.00 55.36 53.07 3h6h s GLN 315 Cb -0.12 -2.36 0.80 0.00 -0.22 0.00 0.00 33.01 31.10 3h6h s GLN 315 CO 0.18 0.56 1.76 0.00 -0.25 0.00 0.00 175.29 177.54 3h6h h ASN 317 N 0.00 0.00 -4.13 0.00 2.35 -2.02 -3.45 115.58 108.33 3h6h h ASN 317 Ca 0.00 -0.27 -0.54 0.00 -0.55 0.00 0.00 56.30 54.94 3h6h h ASN 317 Cb 0.73 0.00 0.18 0.00 0.05 0.00 0.00 38.32 39.28 3h6h h ASN 317 CO 0.00 0.98 0.35 0.54 -1.65 0.00 0.00 177.43 177.65 3h6h n ARG 318 N -4.58 0.42 -3.28 0.81 1.74 -1.25 -4.98 116.66 105.54 3h6h n ARG 318 Ca -0.14 0.21 -0.25 0.00 -0.77 0.00 0.00 57.85 56.90 3h6h n ARG 318 Cb 0.38 -2.44 -0.07 0.00 -1.02 0.00 0.00 32.46 29.31 3h6h n ARG 318 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 3h6h n HIS 319 N -2.92 1.23 -3.94 -1.55 -0.00 -1.26 -4.54 115.22 102.24 3h6h n HIS 319 Ca 0.14 -3.80 -0.30 0.00 0.46 0.00 0.00 57.72 54.22 3h6h n HIS 319 Cb 0.50 -0.43 -0.14 0.00 -0.12 0.00 0.00 29.99 29.80 3h6h n HIS 319 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 3h6h s LYS 320 N -1.72 2.05 0.30 1.57 1.02 -1.26 -5.09 119.74 116.61 3h6h s LYS 320 Ca 0.37 -2.70 -0.25 0.00 0.02 0.00 0.00 55.97 53.41 3h6h s LYS 320 Cb 0.17 -3.34 -0.16 0.00 -0.52 0.00 0.00 37.83 33.97 3h6h s LYS 320 CO -0.07 -1.13 0.34 -2.30 -0.92 0.00 0.00 175.35 171.27 3h6h n PRO 321 N 3.00 0.05 -1.60 -1.68 -0.02 -1.26 -4.87 135.00 128.61 3h6h n PRO 321 Ca 0.07 0.02 -0.36 0.00 -2.02 0.00 0.00 63.50 61.20 3h6h n PRO 321 Cb 0.32 -1.03 0.08 0.00 -0.02 0.00 0.00 33.50 32.85 3h6h n PRO 321 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 3h6h n TRP 322 N -0.48 1.81 0.04 6.00 -0.00 -0.38 -4.93 117.44 119.51 3h6h n TRP 322 Ca 0.15 0.42 -0.07 0.00 -0.00 0.00 0.00 57.50 57.99 3h6h n TRP 322 Cb 0.32 -2.24 -0.12 0.00 -0.00 0.00 0.00 31.31 29.27 3h6h n TRP 322 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 3h6h h ARG 323 N 0.24 0.00 -0.40 5.87 3.08 -1.90 -3.22 114.38 118.06 3h6h h ARG 323 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 3h6h h ARG 323 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.38 3h6h h ARG 323 CO 0.52 0.89 0.00 1.19 -1.07 0.00 0.00 179.97 181.49 3h6h n PHE 324 N -3.28 0.61 0.22 3.04 3.72 -1.26 -4.75 117.46 115.75 3h6h n PHE 324 Ca -0.03 -0.54 -0.10 0.00 -0.05 0.00 0.00 57.45 56.73 3h6h n PHE 324 Cb 0.96 -0.06 -0.05 0.00 -0.94 0.00 0.00 39.48 39.39 3h6h n PHE 324 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3h6h h GLY 325 N 2.34 -0.78 0.77 1.37 0.00 -1.68 -1.58 103.07 103.52 3h6h h GLY 325 Ca 0.00 0.31 0.16 0.00 0.00 0.00 0.00 47.33 47.80 3h6h h GLY 325 CO 0.03 -0.27 0.46 -0.84 0.00 0.00 0.00 176.54 175.92 3h6h h THR 326 N -0.61 0.51 0.04 4.70 2.02 -1.82 -0.99 112.91 116.76 3h6h h THR 326 Ca -0.06 0.00 -0.30 0.00 0.77 0.00 0.00 66.41 66.82 3h6h h THR 326 Cb 0.48 0.65 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 3h6h h THR 326 CO 0.07 0.00 -1.71 -0.09 0.37 0.00 0.00 175.52 174.15 3h6h h ARG 327 N 0.00 0.07 0.06 6.66 2.43 -1.87 -3.22 114.38 118.51 3h6h h ARG 327 Ca 0.26 -0.13 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3h6h h ARG 327 Cb 1.18 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 3h6h h ARG 327 CO -0.00 0.72 -0.03 0.35 -1.51 0.00 0.00 179.97 179.50 3h6h h PHE 328 N 0.02 -0.07 -0.83 2.20 3.57 -0.38 -2.63 116.94 118.82 3h6h h PHE 328 Ca -0.30 -0.00 0.24 0.00 3.53 0.00 0.00 57.97 61.44 3h6h h PHE 328 Cb 2.01 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 40.73 3h6h h PHE 328 CO 0.02 0.53 0.60 1.98 -2.23 0.00 0.00 178.31 179.21 3h6h h MET 329 N -0.80 0.02 0.16 1.11 4.05 -1.37 0.58 114.93 118.69 3h6h h MET 329 Ca -0.01 -0.00 -0.29 0.00 -0.28 0.00 0.00 59.70 59.12 3h6h h MET 329 Cb 0.64 -0.00 0.03 0.00 -0.80 0.00 0.00 31.60 31.46 3h6h h MET 329 CO 0.01 0.01 -1.23 1.03 0.23 0.00 0.00 176.91 176.97 3h6h h SER 330 N 0.02 0.80 -0.19 1.39 0.87 -1.56 -2.89 113.55 111.98 3h6h h SER 330 Ca 0.40 -0.87 0.02 0.00 -1.23 0.00 0.00 61.79 60.11 3h6h h SER 330 Cb 1.57 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 63.26 3h6h h SER 330 CO -0.01 1.60 0.13 -0.07 -0.53 0.00 0.00 176.83 177.94 3h6h h LEU 331 N 0.12 0.15 0.03 2.23 3.38 -0.54 -2.70 115.31 117.98 3h6h h LEU 331 Ca -0.20 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 3h6h h LEU 331 Cb 1.93 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.65 3h6h h LEU 331 CO 0.23 0.10 -0.01 0.40 0.09 0.00 0.00 178.44 179.25 3h6h h ILE 332 N 0.17 1.35 0.00 1.22 2.04 -1.28 -3.18 117.51 117.84 3h6h h ILE 332 Ca 0.08 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.68 3h6h h ILE 332 Cb 0.11 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.37 3h6h h ILE 332 CO -0.01 0.32 0.00 0.11 0.00 0.00 0.00 178.15 178.56 3h6h h LYS 333 N -0.60 0.00 -0.64 2.37 1.57 -1.26 0.25 116.57 118.26 3h6h h LYS 333 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h6h h LYS 333 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 3h6h h LYS 333 CO 0.01 0.00 0.00 0.39 -0.57 0.00 0.00 179.45 179.28 3h6h n GLU 334 N -3.08 2.67 -2.00 3.15 -0.58 -1.12 -4.11 120.64 115.57 3h6h n GLU 334 Ca -0.03 -2.57 -0.33 0.00 -0.42 0.00 0.00 57.16 53.81 3h6h n GLU 334 Cb 0.09 -1.56 0.02 0.00 -0.57 0.00 0.00 31.44 29.42 3h6h n GLU 334 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h6h s ALA 335 N -1.14 2.62 -0.04 0.62 0.00 0.07 -5.02 121.76 118.88 3h6h s ALA 335 Ca 0.46 0.58 0.01 0.00 0.00 0.00 0.00 51.96 53.01 3h6h s ALA 335 Cb 0.25 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 20.08 3h6h s ALA 335 CO 0.33 -0.98 -0.05 -1.01 0.00 0.00 0.00 175.76 174.05 3h6h s HIS 336 N -2.21 0.75 -0.11 0.00 3.76 -1.26 -4.47 115.29 111.75 3h6h s HIS 336 Ca 0.67 -0.20 -0.13 0.00 -0.15 0.00 0.00 55.06 55.25 3h6h s HIS 336 Cb -0.20 -0.63 0.03 0.00 1.11 0.00 0.00 32.58 32.89 3h6h s HIS 336 CO 0.36 -0.16 0.35 -0.46 -0.85 0.00 0.00 174.74 173.97 3h6h s TRP 337 N 0.69 -0.34 -0.75 1.40 -0.00 -1.20 -5.02 118.94 113.72 3h6h s TRP 337 Ca -0.09 0.80 -0.11 0.00 -0.00 0.00 0.00 56.10 56.69 3h6h s TRP 337 Cb -0.13 0.13 0.20 0.00 -0.00 0.00 0.00 33.47 33.67 3h6h s TRP 337 CO 0.00 -0.23 0.66 -1.21 -0.00 0.00 0.00 176.95 176.17 3h6h s GLU 338 N -0.16 3.28 0.00 5.86 0.41 -1.26 -1.64 118.70 125.19 3h6h s GLU 338 Ca -0.03 -2.41 0.00 0.00 -0.41 0.00 0.00 54.97 52.12 3h6h s GLU 338 Cb -0.03 -4.24 0.00 0.00 -1.78 0.00 0.00 34.13 28.08 3h6h s GLU 338 CO 0.01 -1.26 0.00 0.41 -0.49 0.00 0.00 175.26 173.93 3h6h n GLY 339 N 3.97 1.54 0.23 -1.39 0.00 -1.12 -4.93 105.19 103.48 3h6h n GLY 339 Ca 0.10 -2.03 0.07 0.00 0.00 0.00 0.00 46.02 44.16 3h6h n GLY 339 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3h6h h LEU 340 N 0.00 0.00 -3.57 0.99 3.38 -1.95 -2.96 115.31 111.20 3h6h h LEU 340 Ca 0.00 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 3h6h h LEU 340 Cb 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.70 3h6h h LEU 340 CO 0.00 0.19 0.09 0.35 0.09 0.00 0.00 178.44 179.16 3h6h n THR 341 N -4.10 2.74 -2.13 0.22 -2.24 -1.26 -1.30 114.28 106.20 3h6h n THR 341 Ca -0.02 -1.63 0.00 0.00 -2.27 0.00 0.00 64.05 60.13 3h6h n THR 341 Cb 0.26 -0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 3h6h n THR 341 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3h6h n GLY 342 N 0.09 -0.81 3.66 3.38 0.00 -1.12 -4.74 105.19 105.64 3h6h n GLY 342 Ca 0.31 -1.52 -0.42 0.00 0.00 0.00 0.00 46.02 44.39 3h6h n GLY 342 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3h6h s ARG 343 N 0.00 4.07 -0.19 1.61 0.52 -1.26 -2.80 118.95 120.90 3h6h s ARG 343 Ca 0.00 2.56 -0.07 0.00 -0.52 0.00 0.00 55.73 57.70 3h6h s ARG 343 Cb 0.00 -4.17 -0.04 0.00 0.52 0.00 0.00 34.95 31.26 3h6h s ARG 343 CO 0.00 -1.03 0.05 0.42 0.02 0.00 0.00 175.30 174.76 3h6h s ILE 344 N 4.71 4.57 -0.26 1.52 1.01 -0.65 -4.70 121.20 127.39 3h6h s ILE 344 Ca 0.89 -0.11 -0.19 0.00 0.00 0.00 0.00 60.65 61.24 3h6h s ILE 344 Cb -0.42 -3.07 0.07 0.00 0.01 0.00 0.00 42.46 39.06 3h6h s ILE 344 CO 0.41 0.44 0.66 0.28 0.00 0.00 0.00 174.94 176.72 3h6h s THR 345 N 0.62 -0.00 0.34 2.92 -1.32 -1.26 -3.24 115.64 113.70 3h6h s THR 345 Ca 0.02 0.01 0.02 0.00 -1.21 0.00 0.00 61.69 60.53 3h6h s THR 345 Cb -0.13 -0.94 -0.03 0.00 -1.51 0.00 0.00 72.50 69.89 3h6h s THR 345 CO 0.02 0.00 0.52 -0.36 -2.21 0.00 0.00 174.62 172.59 3h6h s PHE 346 N 1.07 3.42 -0.49 9.09 0.40 -1.26 -4.55 117.98 125.66 3h6h s PHE 346 Ca -0.06 0.21 -0.24 0.00 -0.60 0.00 0.00 56.93 56.24 3h6h s PHE 346 Cb -0.05 -1.90 0.03 0.00 0.51 0.00 0.00 43.02 41.61 3h6h s PHE 346 CO -0.10 0.11 0.86 1.21 0.70 0.00 0.00 175.22 177.99 3h6h s ASN 347 N -4.06 6.40 0.42 1.36 3.84 0.01 -4.92 114.94 117.98 3h6h s ASN 347 Ca 0.40 -0.18 0.21 0.00 0.21 0.00 0.00 52.86 53.51 3h6h s ASN 347 Cb -0.10 -2.41 1.18 0.00 -0.55 0.00 0.00 41.25 39.38 3h6h s ASN 347 CO 0.34 -1.04 1.76 0.50 -2.79 0.00 0.00 177.10 175.87 3h6h h LYS 348 N 9.11 0.31 -0.00 0.43 3.64 -1.89 0.15 116.57 128.32 3h6h h LYS 348 Ca -0.25 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.11 3h6h h LYS 348 Cb 1.08 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.83 3h6h h LYS 348 CO 1.02 0.21 -0.00 1.15 -2.27 0.00 0.00 179.45 179.55 3h6h h THR 349 N 0.32 1.31 0.00 1.00 2.02 -1.97 -3.38 112.91 112.21 3h6h h THR 349 Ca 0.61 -0.91 -0.11 0.00 0.77 0.00 0.00 66.41 66.78 3h6h h THR 349 Cb 1.69 1.92 -0.02 0.00 -1.74 0.00 0.00 68.15 70.00 3h6h h THR 349 CO -0.28 0.24 -2.10 0.59 0.37 0.00 0.00 175.52 174.33 3h6h n ASN 350 N -4.90 0.07 0.00 4.18 3.02 -0.35 -4.96 115.26 112.32 3h6h n ASN 350 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.47 3h6h n ASN 350 Cb 0.20 1.69 0.00 0.00 -0.61 0.00 0.00 39.78 41.06 3h6h n ASN 350 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3h6h n GLY 351 N 1.42 0.81 3.97 7.41 0.00 0.38 -4.98 105.19 114.21 3h6h n GLY 351 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 3h6h n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h6h s LEU 352 N 0.00 3.63 -0.74 0.99 1.43 -1.26 -1.89 118.68 120.83 3h6h s LEU 352 Ca 0.00 0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 52.96 3h6h s LEU 352 Cb 0.00 -2.93 0.19 0.00 0.03 0.00 0.00 46.19 43.48 3h6h s LEU 352 CO 0.00 -0.76 0.71 -0.60 0.23 0.00 0.00 176.35 175.93 3h6h s ARG 353 N -4.49 3.41 -0.01 1.70 3.52 -1.18 -0.81 118.95 121.08 3h6h s ARG 353 Ca 0.51 -2.18 0.18 0.00 -0.13 0.00 0.00 55.73 54.11 3h6h s ARG 353 Cb -0.10 -4.41 -0.24 0.00 -1.56 0.00 0.00 34.95 28.64 3h6h s ARG 353 CO 0.36 -1.33 0.57 0.25 -0.81 0.00 0.00 175.30 174.34 3h6h n THR 354 N 4.45 0.00 -4.05 4.11 -2.24 -1.26 -2.10 114.28 113.19 3h6h n THR 354 Ca 0.06 -0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.24 3h6h n THR 354 Cb 0.45 0.51 -0.15 0.00 -2.10 0.00 0.00 70.33 69.04 3h6h n THR 354 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h6h s ASP 355 N -3.45 3.54 0.38 3.42 2.15 -1.26 -4.82 116.67 116.63 3h6h s ASP 355 Ca -0.00 -0.56 -0.08 0.00 0.43 0.00 0.00 52.55 52.34 3h6h s ASP 355 Cb 0.13 -1.57 0.03 0.00 -0.30 0.00 0.00 42.92 41.21 3h6h s ASP 355 CO 0.75 -0.01 0.64 0.72 -0.17 0.00 0.00 175.17 177.11 3h6h s PHE 356 N 1.35 0.65 0.03 -5.34 -0.12 -1.26 -4.55 117.98 108.75 3h6h s PHE 356 Ca 0.05 -1.11 0.06 0.00 -0.05 0.00 0.00 56.93 55.89 3h6h s PHE 356 Cb -0.13 0.37 -0.03 0.00 -0.63 0.00 0.00 43.02 42.60 3h6h s PHE 356 CO -0.10 -1.39 -0.16 -0.51 -0.05 0.00 0.00 175.22 173.02 3h6h s ASP 357 N -3.18 3.95 0.03 1.98 1.01 -1.26 -4.30 116.67 114.90 3h6h s ASP 357 Ca 0.24 -0.37 0.05 0.00 0.71 0.00 0.00 52.55 53.17 3h6h s ASP 357 Cb -0.03 -0.70 -0.02 0.00 1.01 0.00 0.00 42.92 43.18 3h6h s ASP 357 CO 0.17 0.26 -0.15 -0.76 0.21 0.00 0.00 175.17 174.90 3h6h s LEU 358 N -1.44 2.14 -0.16 1.23 1.43 -0.09 -4.72 118.68 117.07 3h6h s LEU 358 Ca 0.15 -0.43 -0.14 0.00 -1.03 0.00 0.00 54.13 52.68 3h6h s LEU 358 Cb -0.11 -0.68 -0.05 0.00 0.03 0.00 0.00 46.19 45.39 3h6h s LEU 358 CO 0.06 0.08 0.30 -1.81 0.23 0.00 0.00 176.35 175.21 3h6h s ASP 359 N -0.99 6.45 -0.25 2.29 1.01 -0.73 -1.31 116.67 123.15 3h6h s ASP 359 Ca 0.03 0.52 -0.15 0.00 0.71 0.00 0.00 52.55 53.67 3h6h s ASP 359 Cb -0.08 -2.19 -0.04 0.00 1.01 0.00 0.00 42.92 41.63 3h6h s ASP 359 CO 0.01 0.10 0.36 0.54 0.21 0.00 0.00 175.17 176.38 3h6h s VAL 360 N 0.47 5.20 -0.03 -1.27 0.11 -0.57 -0.75 120.40 123.56 3h6h s VAL 360 Ca 0.17 0.57 0.07 0.00 -2.93 0.00 0.00 61.98 59.86 3h6h s VAL 360 Cb -0.13 -3.69 -0.02 0.00 -1.53 0.00 0.00 36.38 31.01 3h6h s VAL 360 CO 0.04 0.20 -0.23 0.27 -3.33 0.00 0.00 175.10 172.05 3h6h s ILE 361 N 1.76 2.29 0.08 7.04 -4.36 -0.61 -1.08 121.20 126.32 3h6h s ILE 361 Ca 0.15 -1.02 0.02 0.00 -0.26 0.00 0.00 60.65 59.55 3h6h s ILE 361 Cb -0.15 -1.82 -0.04 0.00 1.25 0.00 0.00 42.46 41.70 3h6h s ILE 361 CO 0.09 0.58 -0.07 -0.55 0.24 0.00 0.00 174.94 175.23 3h6h s SER 362 N -0.63 1.05 -0.78 4.36 0.15 0.02 -1.70 113.70 116.16 3h6h s SER 362 Ca 0.10 -0.84 -0.24 0.00 0.70 0.00 0.00 55.95 55.67 3h6h s SER 362 Cb -0.10 0.07 0.05 0.00 -1.71 0.00 0.00 66.02 64.33 3h6h s SER 362 CO -0.01 -0.37 1.20 -0.22 1.20 0.00 0.00 173.24 175.05 3h6h s LEU 363 N -2.51 3.76 0.90 3.45 2.96 0.44 -1.37 118.68 126.32 3h6h s LEU 363 Ca 0.04 -0.94 -0.12 0.00 -0.22 0.00 0.00 54.13 52.89 3h6h s LEU 363 Cb -0.00 -2.51 0.19 0.00 0.50 0.00 0.00 46.19 44.37 3h6h s LEU 363 CO -0.03 -1.59 1.24 -0.54 -1.32 0.00 0.00 176.35 174.11 3h6h s LYS 364 N 4.83 0.84 0.47 1.98 -0.14 -0.96 -4.58 119.74 122.18 3h6h s LYS 364 Ca 0.33 -0.66 0.27 0.00 -1.36 0.00 0.00 55.97 54.54 3h6h s LYS 364 Cb -0.09 -1.98 1.02 0.00 -1.68 0.00 0.00 37.83 35.10 3h6h s LYS 364 CO 0.07 -2.20 1.86 1.49 -0.76 0.00 0.00 175.35 175.81 3h6h h GLU 365 N -1.36 0.00 -1.02 1.68 4.81 -1.96 -2.78 114.58 113.95 3h6h h GLU 365 Ca -0.42 0.00 -0.44 0.00 -0.13 0.00 0.00 59.36 58.37 3h6h h GLU 365 Cb 1.24 0.00 -0.25 0.00 0.63 0.00 0.00 28.75 30.36 3h6h h GLU 365 CO 0.37 0.15 0.56 0.39 -0.73 0.00 0.00 179.01 179.75 3h6h n GLU 366 N -3.30 2.06 0.00 1.92 4.71 -1.26 -4.71 120.64 120.07 3h6h n GLU 366 Ca 0.00 -2.49 0.00 0.00 -0.01 0.00 0.00 57.16 54.66 3h6h n GLU 366 Cb 0.40 -1.98 0.00 0.00 -1.01 0.00 0.00 31.44 28.85 3h6h n GLU 366 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3h6h n GLY 367 N -0.81 -3.11 3.77 0.62 0.00 -1.05 -4.96 105.19 99.64 3h6h n GLY 367 Ca 0.49 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 3h6h n GLY 367 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h6h s LEU 368 N 0.00 4.09 -0.03 0.99 1.43 -1.26 -2.27 118.68 121.63 3h6h s LEU 368 Ca 0.00 2.53 -0.13 0.00 -1.03 0.00 0.00 54.13 55.50 3h6h s LEU 368 Cb 0.00 -4.08 0.02 0.00 0.03 0.00 0.00 46.19 42.16 3h6h s LEU 368 CO 0.00 -0.97 0.28 -0.70 0.23 0.00 0.00 176.35 175.19 3h6h s GLU 369 N -2.50 0.59 -0.07 1.70 2.12 -0.47 -4.91 118.70 115.16 3h6h s GLU 369 Ca 0.61 -0.14 -0.30 0.00 0.36 0.00 0.00 54.97 55.51 3h6h s GLU 369 Cb -0.35 0.26 -0.02 0.00 0.26 0.00 0.00 34.13 34.28 3h6h s GLU 369 CO 0.43 -0.15 1.04 0.21 -0.54 0.00 0.00 175.26 176.25 3h6h s LYS 370 N -1.11 4.44 -0.04 4.30 2.20 -1.26 -0.80 119.74 127.47 3h6h s LYS 370 Ca -0.12 1.45 0.06 0.00 -0.36 0.00 0.00 55.97 57.00 3h6h s LYS 370 Cb -0.05 -3.52 0.09 0.00 -1.51 0.00 0.00 37.83 32.84 3h6h s LYS 370 CO 0.03 -0.27 0.97 0.44 -0.36 0.00 0.00 175.35 176.16 3h6h n ILE 371 N 4.40 1.03 -3.88 5.43 -5.35 -0.24 -4.95 119.36 115.79 3h6h n ILE 371 Ca 0.08 -1.15 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 3h6h n ILE 371 Cb 0.49 0.34 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 3h6h n ILE 371 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3h6h n GLY 372 N -0.67 -1.30 3.32 3.28 0.00 -1.18 -3.11 105.19 105.53 3h6h n GLY 372 Ca 0.05 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.64 3h6h n GLY 372 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3h6h s THR 373 N -2.97 0.29 -0.29 2.61 -4.23 -0.85 -1.51 115.64 108.68 3h6h s THR 373 Ca 0.00 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 3h6h s THR 373 Cb 0.00 -2.52 0.12 0.00 1.34 0.00 0.00 72.50 71.44 3h6h s THR 373 CO 0.00 0.00 0.72 0.86 -0.54 0.00 0.00 174.62 175.66 3h6h s TRP 374 N -3.65 -1.14 0.03 3.99 -0.00 -0.42 -1.60 118.94 116.14 3h6h s TRP 374 Ca 0.36 2.07 0.03 0.00 -0.00 0.00 0.00 56.10 58.56 3h6h s TRP 374 Cb 0.05 0.68 -0.02 0.00 -0.00 0.00 0.00 33.47 34.19 3h6h s TRP 374 CO 0.17 -0.57 -0.08 0.16 -0.00 0.00 0.00 176.95 176.64 3h6h s ASP 375 N 2.36 0.96 0.58 5.86 1.47 -1.18 -0.91 116.67 125.81 3h6h s ASP 375 Ca -0.07 -0.41 0.29 0.00 1.18 0.00 0.00 52.55 53.55 3h6h s ASP 375 Cb -0.09 -0.02 1.45 0.00 -0.34 0.00 0.00 42.92 43.92 3h6h s ASP 375 CO -0.19 -0.08 1.86 -0.65 0.68 0.00 0.00 175.17 176.79 3h6h h PRO 376 N 5.00 0.00 0.34 2.11 0.11 -1.89 0.19 132.00 137.86 3h6h h PRO 376 Ca -0.34 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.75 3h6h h PRO 376 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3h6h h PRO 376 CO 0.44 0.00 -0.16 0.00 -0.21 0.00 0.00 178.00 178.07 3h6h h ALA 377 N 1.41 -0.58 -0.66 -0.75 0.00 -1.96 -3.36 119.26 113.37 3h6h h ALA 377 Ca 0.27 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3h6h h ALA 377 Cb 1.39 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.35 3h6h h ALA 377 CO -0.00 -0.54 0.00 -1.13 0.00 0.00 0.00 179.25 177.57 3h6h n SER 378 N -4.35 3.99 0.00 0.00 3.41 -1.02 -5.06 113.62 110.59 3h6h n SER 378 Ca -0.06 -2.16 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 3h6h n SER 378 Cb 0.18 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 3h6h n SER 378 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3h6h n GLY 379 N 1.41 1.15 3.77 5.00 0.00 0.63 -4.64 105.19 112.50 3h6h n GLY 379 Ca 0.23 -0.55 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 3h6h n GLY 379 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h6h s LEU 380 N 0.00 4.37 -0.37 0.99 1.43 -1.26 -3.09 118.68 120.75 3h6h s LEU 380 Ca 0.00 2.66 0.02 0.00 -1.03 0.00 0.00 54.13 55.78 3h6h s LEU 380 Cb 0.00 -3.72 0.15 0.00 0.03 0.00 0.00 46.19 42.65 3h6h s LEU 380 CO 0.00 -0.60 0.29 0.21 0.23 0.00 0.00 176.35 176.47 3h6h s ASN 381 N -0.57 2.16 0.39 2.29 2.47 -0.63 -4.99 114.94 116.06 3h6h s ASN 381 Ca 0.51 -2.08 -0.17 0.00 0.42 0.00 0.00 52.86 51.53 3h6h s ASN 381 Cb -0.39 -0.06 -0.09 0.00 -1.45 0.00 0.00 41.25 39.26 3h6h s ASN 381 CO 0.51 -0.27 0.85 -0.04 -3.72 0.00 0.00 177.10 174.43 3h6h s MET 382 N 1.07 4.07 -0.18 0.43 -1.94 -1.26 -2.02 119.30 119.47 3h6h s MET 382 Ca 0.19 0.86 -0.04 0.00 -1.71 0.00 0.00 55.69 54.99 3h6h s MET 382 Cb -0.17 -2.30 -0.03 0.00 2.01 0.00 0.00 34.83 34.34 3h6h s MET 382 CO -0.02 0.02 -0.02 0.95 -0.01 0.00 0.00 175.02 175.94 3h6h s THR 383 N -2.16 3.91 0.00 2.05 -4.23 -1.18 -4.98 115.64 109.05 3h6h s THR 383 Ca 0.57 -0.34 0.00 0.00 -1.18 0.00 0.00 61.69 60.74 3h6h s THR 383 Cb -0.10 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 71.01 3h6h s THR 383 CO 0.18 0.46 0.00 -0.62 -0.54 0.00 0.00 174.62 174.11