#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3eat s HIS 0 N 0.00 -0.44 0.32 1.61 -3.43 -1.26 -5.12 115.29 106.97 3eat s HIS 0 Ca 0.00 0.31 -0.04 0.00 -0.80 0.00 0.00 55.06 54.53 3eat s HIS 0 Cb 0.00 0.54 -0.05 0.00 -1.43 0.00 0.00 32.58 31.64 3eat s HIS 0 CO 0.00 -0.66 0.58 -1.64 -2.00 0.00 0.00 174.74 171.02 3eat s MET 1 N -3.23 3.61 -0.33 -0.38 -1.94 -1.26 -5.09 119.30 110.67 3eat s MET 1 Ca 0.03 -0.02 0.04 0.00 -1.71 0.00 0.00 55.69 54.03 3eat s MET 1 Cb -0.01 -2.62 0.10 0.00 2.01 0.00 0.00 34.83 34.31 3eat s MET 1 CO -0.10 0.16 0.04 1.21 -0.01 0.00 0.00 175.02 176.32 3eat s ASN 2 N -3.39 4.72 0.00 3.03 3.84 -1.26 -4.80 114.94 117.07 3eat s ASN 2 Ca 0.44 -2.08 0.21 0.00 0.21 0.00 0.00 52.86 51.64 3eat s ASN 2 Cb -0.10 -1.60 0.54 0.00 -0.55 0.00 0.00 41.25 39.54 3eat s ASN 2 CO 0.32 -0.36 1.45 0.00 -2.79 0.00 0.00 177.10 175.72 3eat n ALA 3 N 4.28 2.46 -2.75 1.71 0.00 -1.26 -4.94 120.51 120.01 3eat n ALA 3 Ca 0.02 -0.81 -0.33 0.00 0.00 0.00 0.00 53.44 52.32 3eat n ALA 3 Cb 0.42 -0.96 -0.13 0.00 0.00 0.00 0.00 19.45 18.78 3eat n ALA 3 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3eat s TYR 4 N -1.58 2.82 -0.07 0.00 2.02 -1.26 -5.08 117.35 114.20 3eat s TYR 4 Ca 0.36 -0.30 -0.00 0.00 -0.37 0.00 0.00 57.07 56.76 3eat s TYR 4 Cb 0.20 -1.75 0.02 0.00 -0.40 0.00 0.00 41.96 40.04 3eat s TYR 4 CO 0.29 0.06 -0.03 -0.51 -1.57 0.00 0.00 175.55 173.78 3eat s LEU 5 N -0.27 1.02 0.29 -1.29 1.43 -1.26 -4.67 118.68 113.92 3eat s LEU 5 Ca 0.02 -0.15 -0.01 0.00 -1.03 0.00 0.00 54.13 52.97 3eat s LEU 5 Cb -0.13 -0.53 -0.04 0.00 0.03 0.00 0.00 46.19 45.53 3eat s LEU 5 CO 0.03 -0.12 0.50 -0.55 0.23 0.00 0.00 176.35 176.44 3eat s SER 6 N 1.47 6.36 0.00 2.29 0.15 -1.26 -4.97 113.70 117.74 3eat s SER 6 Ca -0.02 0.51 0.27 0.00 0.70 0.00 0.00 55.95 57.41 3eat s SER 6 Cb -0.13 -2.05 0.90 0.00 -1.71 0.00 0.00 66.02 63.02 3eat s SER 6 CO -0.03 -0.19 1.66 -0.90 1.20 0.00 0.00 173.24 174.98 3eat n ASP 7 N -1.22 0.61 -4.87 5.45 5.68 -1.26 -4.89 116.55 116.04 3eat n ASP 7 Ca -0.04 -0.48 -0.31 0.00 -0.50 0.00 0.00 54.79 53.46 3eat n ASP 7 Cb 0.55 0.03 -0.02 0.00 -1.14 0.00 0.00 41.12 40.54 3eat n ASP 7 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 3eat s GLN 8 N -2.67 3.77 -1.45 0.11 -1.52 -1.26 -4.98 119.66 111.67 3eat s GLN 8 Ca 0.21 0.64 -0.12 0.00 -1.95 0.00 0.00 55.36 54.14 3eat s GLN 8 Cb 0.19 -2.26 -0.04 0.00 -0.22 0.00 0.00 33.01 30.69 3eat s GLN 8 CO 0.55 -0.22 2.53 -0.35 -0.25 0.00 0.00 175.29 177.55 3eat n PRO 9 N -1.75 3.09 -3.99 2.91 -0.04 -1.26 -4.84 135.00 129.11 3eat n PRO 9 Ca 0.04 -2.27 -0.08 0.00 -0.04 0.00 0.00 63.50 61.15 3eat n PRO 9 Cb 0.54 -2.97 -0.09 0.00 -0.04 0.00 0.00 33.50 30.94 3eat n PRO 9 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3eat s VAL 10 N 2.87 0.18 -0.26 0.52 -7.23 -1.26 -1.80 120.40 113.43 3eat s VAL 10 Ca 0.57 -1.51 -0.08 0.00 -1.81 0.00 0.00 61.98 59.15 3eat s VAL 10 Cb 0.16 -1.41 -0.04 0.00 0.56 0.00 0.00 36.38 35.65 3eat s VAL 10 CO -0.06 -0.84 0.11 -0.13 -0.31 0.00 0.00 175.10 173.87 3eat s ARG 11 N -3.83 3.76 0.03 4.82 0.52 0.55 -4.67 118.95 120.14 3eat s ARG 11 Ca 0.06 -0.42 0.00 0.00 -0.52 0.00 0.00 55.73 54.85 3eat s ARG 11 Cb 0.06 -3.43 -0.04 0.00 0.52 0.00 0.00 34.95 32.07 3eat s ARG 11 CO -0.10 -0.17 0.13 -0.51 0.02 0.00 0.00 175.30 174.67 3eat s LEU 12 N 1.62 4.07 0.16 2.53 1.43 -1.26 -0.81 118.68 126.42 3eat s LEU 12 Ca 0.06 0.17 -0.23 0.00 -1.03 0.00 0.00 54.13 53.10 3eat s LEU 12 Cb -0.15 -2.56 0.07 0.00 0.03 0.00 0.00 46.19 43.58 3eat s LEU 12 CO 0.06 0.22 0.65 -0.94 0.23 0.00 0.00 176.35 176.57 3eat s SER 13 N -2.14 -0.50 0.41 2.29 1.04 -0.54 -4.67 113.70 109.60 3eat s SER 13 Ca 0.28 -0.10 -0.27 0.00 0.48 0.00 0.00 55.95 56.34 3eat s SER 13 Cb -0.12 0.60 -0.10 0.00 0.10 0.00 0.00 66.02 66.49 3eat s SER 13 CO 0.20 -0.99 1.45 -2.65 0.98 0.00 0.00 173.24 172.23 3eat n PRO 14 N -0.38 2.47 -1.96 4.02 -0.02 -1.26 -0.20 135.00 137.66 3eat n PRO 14 Ca -0.14 0.87 -0.42 0.00 -2.02 0.00 0.00 63.50 61.79 3eat n PRO 14 Cb 0.64 -2.64 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 3eat n PRO 14 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3eat s LEU 15 N -2.26 4.37 -0.01 2.45 2.96 -1.23 -4.48 118.68 120.47 3eat s LEU 15 Ca 0.57 2.60 0.02 0.00 -0.22 0.00 0.00 54.13 57.09 3eat s LEU 15 Cb -0.47 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.63 3eat s LEU 15 CO 0.61 -0.80 -0.06 -0.13 -1.32 0.00 0.00 176.35 174.65 3eat s ARG 16 N 1.03 0.57 1.02 1.98 0.52 -1.26 -4.17 118.95 118.63 3eat s ARG 16 Ca 0.69 -0.20 -0.16 0.00 -0.52 0.00 0.00 55.73 55.53 3eat s ARG 16 Cb -0.43 -0.56 0.21 0.00 0.52 0.00 0.00 34.95 34.69 3eat s ARG 16 CO 0.32 0.10 1.23 0.16 0.02 0.00 0.00 175.30 177.12 3eat s ASP 17 N 0.04 2.60 0.13 0.23 3.84 0.13 -4.90 116.67 118.75 3eat s ASP 17 Ca -0.00 0.50 0.18 0.00 -0.00 0.00 0.00 52.55 53.23 3eat s ASP 17 Cb -0.05 -0.71 0.77 0.00 -1.38 0.00 0.00 42.92 41.56 3eat s ASP 17 CO -0.00 -3.07 1.55 -1.84 -0.00 0.00 0.00 175.17 171.80 3eat n GLU 18 N -4.04 0.09 -0.81 2.11 0.28 -1.26 -1.20 120.64 115.82 3eat n GLU 18 Ca 0.13 0.37 0.08 0.00 -0.16 0.00 0.00 57.16 57.58 3eat n GLU 18 Cb 0.59 -1.69 0.39 0.00 1.43 0.00 0.00 31.44 32.16 3eat n GLU 18 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 3eat n GLN 19 N -1.87 4.52 -0.94 3.44 3.00 -1.26 -4.95 117.38 119.31 3eat n GLN 19 Ca 0.02 -3.08 0.00 0.00 -0.01 0.00 0.00 57.00 53.93 3eat n GLN 19 Cb 0.17 -2.15 0.00 0.00 0.00 0.00 0.00 30.24 28.27 3eat n GLN 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3eat n GLY 20 N 0.78 0.82 3.77 1.08 0.00 -0.34 -5.02 105.19 106.27 3eat n GLY 20 Ca 0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.89 3eat n GLY 20 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3eat s ASN 21 N -2.77 6.85 -0.34 1.61 2.47 -1.26 -4.77 114.94 116.73 3eat s ASN 21 Ca 0.00 2.62 0.02 0.00 0.42 0.00 0.00 52.86 55.92 3eat s ASN 21 Cb 0.00 -2.64 0.10 0.00 -1.45 0.00 0.00 41.25 37.26 3eat s ASN 21 CO 0.00 -0.48 0.09 -1.58 -3.72 0.00 0.00 177.10 171.42 3eat s GLN 22 N -1.66 1.18 1.01 0.43 0.74 -1.26 -0.70 119.66 119.40 3eat s GLN 22 Ca 0.49 -1.61 -0.12 0.00 0.05 0.00 0.00 55.36 54.17 3eat s GLN 22 Cb -0.39 -2.66 0.20 0.00 1.10 0.00 0.00 33.01 31.26 3eat s GLN 22 CO 0.51 -0.98 1.09 -1.25 -0.55 0.00 0.00 175.29 174.10 3eat s PRO 23 N 1.08 0.33 -0.21 1.67 0.04 -1.26 -4.86 135.00 131.80 3eat s PRO 23 Ca 0.11 0.48 -0.04 0.00 0.04 0.00 0.00 61.00 61.60 3eat s PRO 23 Cb -0.19 -1.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.59 3eat s PRO 23 CO -0.14 -2.79 2.83 0.54 0.04 0.00 0.00 177.00 177.49 3eat n ARG 24 N -4.21 1.97 -3.79 4.56 1.74 0.94 -4.82 116.66 113.06 3eat n ARG 24 Ca 0.05 -1.44 0.02 0.00 -0.77 0.00 0.00 57.85 55.71 3eat n ARG 24 Cb 0.57 -1.85 0.00 0.00 -1.02 0.00 0.00 32.46 30.17 3eat n ARG 24 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 3eat s PHE 25 N -0.57 -0.01 0.00 -1.55 -0.71 -1.26 -4.87 117.98 109.00 3eat s PHE 25 Ca 0.49 -0.12 0.00 0.00 -1.04 0.00 0.00 56.93 56.26 3eat s PHE 25 Cb 0.29 0.56 0.00 0.00 -1.21 0.00 0.00 43.02 42.66 3eat s PHE 25 CO -0.08 -0.32 0.00 0.41 -1.34 0.00 0.00 175.22 173.89 3eat n GLY 26 N -0.67 -0.61 3.48 1.99 0.00 0.18 -4.58 105.19 104.98 3eat n GLY 26 Ca -0.03 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.25 3eat n GLY 26 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3eat s LEU 27 N -2.26 -0.34 -0.19 0.99 2.96 -0.39 -3.56 118.68 115.88 3eat s LEU 27 Ca 0.00 1.19 -0.09 0.00 -0.22 0.00 0.00 54.13 55.02 3eat s LEU 27 Cb 0.00 1.97 -0.04 0.00 0.50 0.00 0.00 46.19 48.61 3eat s LEU 27 CO 0.00 -0.21 0.09 -0.22 -1.32 0.00 0.00 176.35 174.70 3eat s LEU 28 N 0.75 4.00 -0.08 -0.68 2.96 0.72 -1.16 118.68 125.20 3eat s LEU 28 Ca -0.04 0.16 0.04 0.00 -0.22 0.00 0.00 54.13 54.07 3eat s LEU 28 Cb -0.05 -2.02 -0.01 0.00 0.50 0.00 0.00 46.19 44.61 3eat s LEU 28 CO -0.06 0.18 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.19 3eat s LEU 29 N 0.33 2.30 0.05 -0.68 1.02 0.79 -1.47 118.68 121.02 3eat s LEU 29 Ca 0.05 -0.43 0.03 0.00 0.02 0.00 0.00 54.13 53.80 3eat s LEU 29 Cb -0.12 -1.45 -0.03 0.00 0.02 0.00 0.00 46.19 44.62 3eat s LEU 29 CO -0.01 0.23 -0.09 -1.61 0.02 0.00 0.00 176.35 174.89 3eat s GLU 30 N -0.09 0.62 0.34 1.70 2.02 0.01 -1.17 118.70 122.13 3eat s GLU 30 Ca -0.05 -0.84 -0.28 0.00 0.02 0.00 0.00 54.97 53.83 3eat s GLU 30 Cb -0.14 -0.43 -0.12 0.00 0.10 0.00 0.00 34.13 33.54 3eat s GLU 30 CO 0.04 0.08 1.31 -0.35 0.02 0.00 0.00 175.26 176.36 3eat n PRO 31 N 1.34 2.17 0.00 0.39 -0.04 -1.26 -0.33 135.00 137.27 3eat n PRO 31 Ca -0.22 0.76 0.12 0.00 -0.04 0.00 0.00 63.50 64.12 3eat n PRO 31 Cb 0.55 -2.36 0.09 0.00 -0.04 0.00 0.00 33.50 31.74 3eat n PRO 31 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3eat n GLY 32 N 0.76 0.61 2.94 0.55 0.00 -0.75 -4.43 105.19 104.88 3eat n GLY 32 Ca 0.04 -0.66 -0.11 0.00 0.00 0.00 0.00 46.02 45.29 3eat n GLY 32 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3eat s ARG 33 N -2.17 0.16 0.18 1.61 0.52 -1.26 -4.89 118.95 113.10 3eat s ARG 33 Ca 0.25 -0.21 -0.33 0.00 -0.52 0.00 0.00 55.73 54.92 3eat s ARG 33 Cb 0.19 0.06 -0.15 0.00 0.52 0.00 0.00 34.95 35.58 3eat s ARG 33 CO 0.40 -0.03 1.37 -2.30 0.02 0.00 0.00 175.30 174.76 3eat n PRO 34 N 2.46 1.71 -0.97 3.54 -0.02 -1.26 -2.20 135.00 138.25 3eat n PRO 34 Ca -0.17 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 3eat n PRO 34 Cb 0.58 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 3eat n PRO 34 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3eat n GLY 35 N 2.42 0.42 3.72 -1.23 0.00 -1.26 -4.98 105.19 104.27 3eat n GLY 35 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 3eat n GLY 35 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 3eat n MET 36 N -1.87 2.29 -4.00 1.61 0.00 -0.93 -4.59 117.12 109.63 3eat n MET 36 Ca 0.00 0.81 -0.28 0.00 0.00 0.00 0.00 57.70 58.23 3eat n MET 36 Cb 0.12 -2.45 -0.05 0.00 0.00 0.00 0.00 33.22 30.85 3eat n MET 36 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 175.97 174.39 3eat s HIS 37 N -0.92 3.33 0.50 1.12 2.46 -1.26 -0.75 115.29 119.77 3eat s HIS 37 Ca 0.57 0.09 0.22 0.00 0.47 0.00 0.00 55.06 56.41 3eat s HIS 37 Cb -0.55 -1.63 1.41 0.00 -0.13 0.00 0.00 32.58 31.69 3eat s HIS 37 CO 0.60 0.53 2.12 -0.39 -2.47 0.00 0.00 174.74 175.14 3eat h VAL 38 N 2.03 0.79 0.00 0.89 -1.51 -1.91 -2.43 116.25 114.11 3eat h VAL 38 Ca -0.47 -0.29 -0.00 0.00 -1.23 0.00 0.00 66.70 64.71 3eat h VAL 38 Cb 1.18 1.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.51 3eat h VAL 38 CO 0.68 0.07 -0.01 1.23 -1.23 0.00 0.00 177.57 178.31 3eat h GLY 39 N 0.34 0.00 2.00 5.19 0.00 -1.95 -2.57 103.07 106.09 3eat h GLY 39 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3eat h GLY 39 CO 0.01 0.00 0.00 0.83 0.00 0.00 0.00 176.54 177.38 3eat h GLU 40 N 0.00 0.00 -6.17 4.80 5.08 -1.85 -3.43 114.58 113.01 3eat h GLU 40 Ca -0.00 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.78 3eat h GLU 40 Cb 0.38 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 3eat h GLU 40 CO 0.00 0.00 -0.20 -0.51 -1.00 0.00 0.00 179.01 177.30 3eat s LEU 41 N -4.88 4.34 -0.16 1.33 1.43 -0.97 -5.02 118.68 114.75 3eat s LEU 41 Ca 0.03 0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 53.69 3eat s LEU 41 Cb 0.09 -3.07 -0.01 0.00 0.03 0.00 0.00 46.19 43.22 3eat s LEU 41 CO 0.40 0.15 1.22 -2.16 0.23 0.00 0.00 176.35 176.19 3eat s PRO 42 N -1.95 4.26 0.29 1.29 0.05 -1.26 -4.92 135.00 132.75 3eat s PRO 42 Ca 0.35 1.62 0.03 0.00 0.05 0.00 0.00 61.00 63.04 3eat s PRO 42 Cb -0.14 -3.71 0.71 0.00 0.05 0.00 0.00 34.50 31.41 3eat s PRO 42 CO 0.18 -0.65 1.70 0.00 0.05 0.00 0.00 177.00 178.29 3eat h ALA 43 N 7.96 1.42 -0.91 8.56 0.00 -1.94 -0.97 119.26 133.39 3eat h ALA 43 Ca -0.27 0.15 0.07 0.00 0.00 0.00 0.00 54.91 54.87 3eat h ALA 43 Cb 1.11 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 3eat h ALA 43 CO 0.96 -0.31 0.57 0.37 0.00 0.00 0.00 179.25 180.83 3eat h GLN 44 N 0.43 0.98 -0.34 0.00 5.75 -1.91 0.39 115.11 120.40 3eat h GLN 44 Ca 0.55 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.94 3eat h GLN 44 Cb 1.02 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 29.33 3eat h GLN 44 CO -0.51 0.65 0.02 2.35 -2.65 0.00 0.00 178.83 178.69 3eat h TRP 45 N 1.01 0.65 -0.95 3.99 7.01 -1.59 -2.48 115.95 123.58 3eat h TRP 45 Ca 0.41 -0.11 0.01 0.00 2.11 0.00 0.00 58.89 61.32 3eat h TRP 45 Cb 0.23 -0.17 -0.05 0.00 -2.10 0.00 0.00 29.16 27.07 3eat h TRP 45 CO -0.02 0.69 0.63 -0.07 -2.79 0.00 0.00 178.44 176.88 3eat h LEU 46 N 0.41 1.09 -0.66 0.65 3.38 -0.85 -1.93 115.31 117.40 3eat h LEU 46 Ca 0.10 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.04 3eat h LEU 46 Cb 0.42 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3eat h LEU 46 CO 0.01 0.78 0.39 0.11 0.09 0.00 0.00 178.44 179.83 3eat h LYS 47 N 1.28 0.90 -0.07 1.13 1.57 -0.76 0.19 116.57 120.80 3eat h LYS 47 Ca 0.36 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3eat h LYS 47 Cb -0.12 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.00 3eat h LYS 47 CO -0.08 0.65 0.03 0.78 -0.57 0.00 0.00 179.45 180.26 3eat h GLY 48 N 0.90 0.09 1.04 3.86 0.00 -0.95 -0.71 103.07 107.29 3eat h GLY 48 Ca 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 3eat h GLY 48 CO -0.04 0.02 0.48 1.41 0.00 0.00 0.00 176.54 178.41 3eat h LEU 49 N 0.08 1.13 -1.35 3.11 3.38 -1.07 -2.47 115.31 118.12 3eat h LEU 49 Ca 0.03 -0.11 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 3eat h LEU 49 Cb 0.00 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 3eat h LEU 49 CO -0.02 0.91 -0.15 0.00 0.09 0.00 0.00 178.44 179.27 3eat h ALA 50 N 1.27 1.46 0.00 1.53 0.00 -0.28 0.21 119.26 123.45 3eat h ALA 50 Ca 0.31 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.89 3eat h ALA 50 Cb 0.05 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3eat h ALA 50 CO -0.05 0.38 -0.52 0.00 0.00 0.00 0.00 179.25 179.06 3eat h ARG 51 N 0.24 0.00 0.00 0.00 3.08 -0.68 0.91 114.38 117.92 3eat h ARG 51 Ca 0.05 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.82 3eat h ARG 51 Cb 0.41 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.41 3eat h ARG 51 CO 0.03 0.52 -2.08 -1.13 -1.07 0.00 0.00 179.97 176.24 3eat n SER 52 N -3.59 1.09 0.01 7.04 3.41 -0.99 -4.42 113.62 116.16 3eat n SER 52 Ca -0.00 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.71 3eat n SER 52 Cb 0.60 0.92 -0.03 0.00 -0.26 0.00 0.00 64.21 65.44 3eat n SER 52 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3eat n HIS 53 N -2.57 0.11 0.00 7.33 8.25 0.70 -4.93 115.22 124.11 3eat n HIS 53 Ca -0.25 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.24 3eat n HIS 53 Cb 1.00 -0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.84 3eat n HIS 53 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3eat n HIS 54 N -1.79 0.00 -3.67 4.41 -0.00 0.31 -0.65 115.22 113.83 3eat n HIS 54 Ca 0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.59 3eat n HIS 54 Cb 0.41 -0.12 -0.15 0.00 -0.00 0.00 0.00 29.99 30.13 3eat n HIS 54 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.34 175.17 3eat s LEU 55 N 0.00 -0.09 -0.10 2.41 2.96 -1.26 -0.10 118.68 122.50 3eat s LEU 55 Ca 0.00 0.44 0.01 0.00 -0.22 0.00 0.00 54.13 54.36 3eat s LEU 55 Cb 0.00 0.46 -0.02 0.00 0.50 0.00 0.00 46.19 47.13 3eat s LEU 55 CO 0.00 -0.23 -0.13 -0.76 -1.32 0.00 0.00 176.35 173.90 3eat s LEU 56 N 2.23 2.73 -0.29 -0.68 1.43 -0.01 -1.27 118.68 122.83 3eat s LEU 56 Ca 0.01 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.85 3eat s LEU 56 Cb -0.12 -1.59 0.07 0.00 0.03 0.00 0.00 46.19 44.57 3eat s LEU 56 CO -0.07 0.23 -0.04 -0.22 0.23 0.00 0.00 176.35 176.48 3eat s LEU 57 N -0.03 3.84 -0.40 1.79 2.96 -0.31 -1.58 118.68 124.95 3eat s LEU 57 Ca -0.03 -1.51 -0.18 0.00 -0.22 0.00 0.00 54.13 52.19 3eat s LEU 57 Cb -0.14 -1.62 0.01 0.00 0.50 0.00 0.00 46.19 44.95 3eat s LEU 57 CO 0.04 -0.25 0.50 -0.76 -1.32 0.00 0.00 176.35 174.56 3eat s LEU 58 N 1.11 4.61 -0.08 -0.68 1.02 0.91 -0.15 118.68 125.43 3eat s LEU 58 Ca -0.04 -0.40 0.03 0.00 0.02 0.00 0.00 54.13 53.74 3eat s LEU 58 Cb -0.20 -2.52 0.01 0.00 0.02 0.00 0.00 46.19 43.50 3eat s LEU 58 CO -0.04 -0.59 -0.17 -0.60 0.02 0.00 0.00 176.35 174.97 3eat s ARG 59 N 2.36 2.17 0.00 1.70 3.52 -0.32 -1.21 118.95 127.17 3eat s ARG 59 Ca 0.16 -0.58 0.00 0.00 -0.13 0.00 0.00 55.73 55.18 3eat s ARG 59 Cb -0.16 -1.72 0.00 0.00 -1.56 0.00 0.00 34.95 31.51 3eat s ARG 59 CO 0.15 0.09 0.00 0.41 -0.81 0.00 0.00 175.30 175.14 3eat n GLY 60 N 3.68 0.82 3.86 8.12 0.00 -1.26 -4.32 105.19 116.09 3eat n GLY 60 Ca -0.21 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 3eat n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3eat s PHE 61 N -2.00 3.44 0.62 1.61 0.08 -1.26 -4.73 117.98 115.74 3eat s PHE 61 Ca 0.00 1.14 -0.19 0.00 0.12 0.00 0.00 56.93 58.01 3eat s PHE 61 Cb 0.00 -2.51 -0.02 0.00 -0.57 0.00 0.00 43.02 39.92 3eat s PHE 61 CO 0.00 -0.08 1.29 0.00 -0.10 0.00 0.00 175.22 176.32 3eat s ALA 62 N -2.29 2.47 0.51 5.36 0.00 0.07 -4.90 121.76 122.98 3eat s ALA 62 Ca 0.53 1.19 -0.21 0.00 0.00 0.00 0.00 51.96 53.47 3eat s ALA 62 Cb -0.10 -3.54 -0.07 0.00 0.00 0.00 0.00 23.12 19.41 3eat s ALA 62 CO 0.27 -1.48 1.12 0.00 0.00 0.00 0.00 175.76 175.67 3eat s ALA 63 N -1.42 2.81 0.09 0.00 0.00 -1.26 -3.91 121.76 118.08 3eat s ALA 63 Ca 0.80 0.82 -0.31 0.00 0.00 0.00 0.00 51.96 53.27 3eat s ALA 63 Cb -0.37 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.34 3eat s ALA 63 CO 0.39 -0.64 1.27 -0.06 0.00 0.00 0.00 175.76 176.72 3eat s PHE 64 N -1.74 3.37 0.38 0.00 0.08 -1.26 -4.96 117.98 113.86 3eat s PHE 64 Ca 0.69 1.19 0.09 0.00 0.12 0.00 0.00 56.93 59.02 3eat s PHE 64 Cb -0.24 -3.51 0.77 0.00 -0.57 0.00 0.00 43.02 39.46 3eat s PHE 64 CO 0.28 -1.66 1.90 0.00 -0.10 0.00 0.00 175.22 175.64 3eat h ALA 65 N 6.64 1.49 -2.60 5.36 0.00 -1.96 -3.47 119.26 124.71 3eat h ALA 65 Ca -0.42 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 3eat h ALA 65 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3eat h ALA 65 CO 0.82 0.36 0.13 -0.40 0.00 0.00 0.00 179.25 180.16 3eat n ASP 66 N -4.26 -1.19 -0.08 0.00 5.68 -1.26 -5.04 116.55 110.40 3eat n ASP 66 Ca -0.01 -1.86 -0.07 0.00 -0.50 0.00 0.00 54.79 52.35 3eat n ASP 66 Cb 0.28 1.99 0.10 0.00 -1.14 0.00 0.00 41.12 42.35 3eat n ASP 66 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3eat h ALA 67 N 1.98 0.91 -0.67 2.12 0.00 -1.99 -2.36 119.26 119.25 3eat h ALA 67 Ca -0.18 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.37 3eat h ALA 67 Cb 0.66 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3eat h ALA 67 CO 0.22 0.62 0.39 0.93 0.00 0.00 0.00 179.25 181.41 3eat h GLU 68 N 0.66 0.91 -0.31 0.00 3.07 -1.98 0.83 114.58 117.75 3eat h GLU 68 Ca 0.09 -0.09 -0.02 0.00 -0.50 0.00 0.00 59.36 58.84 3eat h GLU 68 Cb 0.71 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.42 3eat h GLU 68 CO 0.05 0.66 0.11 1.03 -1.40 0.00 0.00 179.01 179.47 3eat h SER 69 N 0.91 0.45 -0.36 1.42 0.87 -1.93 -1.07 113.55 113.84 3eat h SER 69 Ca 0.24 -0.19 0.03 0.00 -1.23 0.00 0.00 61.79 60.64 3eat h SER 69 Cb -0.00 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 3eat h SER 69 CO -0.04 0.51 0.16 0.25 -0.53 0.00 0.00 176.83 177.18 3eat h LEU 70 N 0.35 0.23 -0.46 2.23 5.85 -1.19 -1.83 115.31 120.50 3eat h LEU 70 Ca 0.10 0.02 0.07 0.00 0.84 0.00 0.00 57.88 58.92 3eat h LEU 70 Cb 0.21 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 3eat h LEU 70 CO -0.01 0.17 0.09 0.74 -0.34 0.00 0.00 178.44 179.10 3eat h THR 71 N 0.34 0.75 -0.53 1.05 2.02 -0.52 -0.31 112.91 115.72 3eat h THR 71 Ca 0.15 -0.08 -0.05 0.00 0.77 0.00 0.00 66.41 67.21 3eat h THR 71 Cb 0.08 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 3eat h THR 71 CO -0.12 0.04 0.14 0.03 0.37 0.00 0.00 175.52 175.99 3eat h ARG 72 N 0.23 0.84 -0.26 6.66 3.08 -0.93 -1.31 114.38 122.69 3eat h ARG 72 Ca 0.23 -0.19 0.05 0.00 0.07 0.00 0.00 59.98 60.14 3eat h ARG 72 Cb 0.29 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.17 3eat h ARG 72 CO -0.29 0.79 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.39 3eat h TYR 73 N 0.74 -0.18 -0.27 3.04 3.20 -0.80 -2.25 116.97 120.45 3eat h TYR 73 Ca 0.17 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 3eat h TYR 73 Cb 0.31 0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 3eat h TYR 73 CO 0.02 -0.13 0.02 0.00 -1.64 0.00 0.00 178.16 176.43 3eat h HIS 75 N 0.39 0.57 0.01 0.00 3.86 -0.67 -1.54 115.15 117.77 3eat h HIS 75 Ca 0.09 -0.01 -0.20 0.00 -1.16 0.00 0.00 60.37 59.09 3eat h HIS 75 Cb 0.23 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 3eat h HIS 75 CO 0.01 0.43 -0.89 0.22 0.86 0.00 0.00 177.93 178.56 3eat h ASP 76 N 0.58 0.20 -0.31 2.45 3.58 -0.95 -3.34 116.42 118.64 3eat h ASP 76 Ca 0.15 -0.16 -0.04 0.00 0.42 0.00 0.00 57.03 57.39 3eat h ASP 76 Cb 0.08 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.06 3eat h ASP 76 CO -0.02 0.98 0.03 0.15 -2.88 0.00 0.00 179.24 177.51 3eat h PHE 77 N 0.08 0.55 -0.92 0.28 3.57 -0.30 -3.49 116.94 116.72 3eat h PHE 77 Ca -0.04 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.38 3eat h PHE 77 Cb 1.52 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.11 3eat h PHE 77 CO 0.02 0.62 0.00 0.41 -2.23 0.00 0.00 178.31 177.13 3eat n GLY 78 N -0.43 1.41 3.61 2.40 0.00 -0.72 -4.81 105.19 106.65 3eat n GLY 78 Ca -0.02 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.81 3eat n GLY 78 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3eat s GLU 79 N -0.44 3.94 0.26 1.61 -1.05 -1.26 -4.42 118.70 117.34 3eat s GLU 79 Ca 0.00 0.51 -0.30 0.00 -0.15 0.00 0.00 54.97 55.03 3eat s GLU 79 Cb 0.00 -3.73 -0.10 0.00 -0.44 0.00 0.00 34.13 29.86 3eat s GLU 79 CO 0.00 -0.66 1.48 0.08 0.95 0.00 0.00 175.26 177.12 3eat s VAL 80 N 2.87 2.50 -0.48 1.83 1.01 -1.26 -0.37 120.40 126.50 3eat s VAL 80 Ca 0.31 0.42 -0.24 0.00 0.00 0.00 0.00 61.98 62.46 3eat s VAL 80 Cb -0.14 -3.27 0.03 0.00 0.00 0.00 0.00 36.38 33.00 3eat s VAL 80 CO 0.12 0.07 0.87 -0.32 0.00 0.00 0.00 175.10 175.84 3eat s MET 81 N -0.40 3.42 0.30 2.72 1.75 -0.57 -4.74 119.30 121.76 3eat s MET 81 Ca 0.60 -0.09 -0.27 0.00 -1.25 0.00 0.00 55.69 54.68 3eat s MET 81 Cb -0.43 -3.97 -0.10 0.00 2.84 0.00 0.00 34.83 33.17 3eat s MET 81 CO 0.44 -1.26 0.95 -0.51 -0.65 0.00 0.00 175.02 174.00 3eat s LEU 82 N 3.61 4.45 0.45 4.11 1.43 -1.26 -4.56 118.68 126.89 3eat s LEU 82 Ca 0.32 1.89 0.07 0.00 -1.03 0.00 0.00 54.13 55.38 3eat s LEU 82 Cb -0.12 -3.87 -0.02 0.00 0.03 0.00 0.00 46.19 42.21 3eat s LEU 82 CO 0.23 -0.01 0.32 0.26 0.23 0.00 0.00 176.35 177.38 3eat s TRP 83 N -1.46 2.42 0.48 0.29 0.52 -0.11 -4.96 118.94 116.12 3eat s TRP 83 Ca 0.47 -0.61 0.21 0.00 0.02 0.00 0.00 56.10 56.20 3eat s TRP 83 Cb -0.22 -2.04 1.23 0.00 -1.15 0.00 0.00 33.47 31.30 3eat s TRP 83 CO 0.27 -0.10 1.93 -1.35 0.02 0.00 0.00 176.95 177.73 3eat h PRO 84 N 1.10 0.21 0.00 4.98 0.11 -2.03 0.12 132.00 136.49 3eat h PRO 84 Ca -0.41 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3eat h PRO 84 Cb 1.27 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3eat h PRO 84 CO 0.62 0.14 0.00 1.97 -0.21 0.00 0.00 178.00 180.52 3eat n PHE 85 N -4.42 0.00 0.00 0.65 -1.74 -1.26 -5.03 117.46 105.66 3eat n PHE 85 Ca 0.14 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.03 3eat n PHE 85 Cb 0.63 -0.14 0.00 0.00 1.52 0.00 0.00 39.48 41.49 3eat n PHE 85 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 3eat n GLY 86 N 1.01 0.67 0.13 4.97 0.00 0.41 -4.68 105.19 107.69 3eat n GLY 86 Ca 0.18 -1.73 -0.20 0.00 0.00 0.00 0.00 46.02 44.28 3eat n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eat n ALA 87 N 0.33 0.98 -3.04 4.61 0.00 -1.26 -0.93 120.51 121.20 3eat n ALA 87 Ca 0.00 -0.63 -0.38 0.00 0.00 0.00 0.00 53.44 52.43 3eat n ALA 87 Cb 0.00 -0.68 -0.12 0.00 0.00 0.00 0.00 19.45 18.65 3eat n ALA 87 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3eat s VAL 88 N -2.56 4.27 -0.17 0.00 1.01 -1.26 -4.32 120.40 117.37 3eat s VAL 88 Ca -0.21 -0.52 -0.27 0.00 0.00 0.00 0.00 61.98 60.98 3eat s VAL 88 Cb 0.07 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 33.27 3eat s VAL 88 CO 0.77 0.10 0.93 -0.22 0.00 0.00 0.00 175.10 176.68 3eat s LEU 89 N 1.56 4.17 -0.17 3.92 2.96 -0.28 -4.90 118.68 125.95 3eat s LEU 89 Ca 0.04 1.31 -0.23 0.00 -0.22 0.00 0.00 54.13 55.03 3eat s LEU 89 Cb -0.17 -3.40 -0.02 0.00 0.50 0.00 0.00 46.19 43.10 3eat s LEU 89 CO 0.04 -0.49 0.72 -1.61 -1.32 0.00 0.00 176.35 173.70 3eat s GLU 90 N 2.41 4.28 -0.55 1.98 0.41 -1.26 -1.15 118.70 124.82 3eat s GLU 90 Ca 0.42 0.81 0.04 0.00 -0.41 0.00 0.00 54.97 55.84 3eat s GLU 90 Cb -0.17 -3.56 0.14 0.00 -1.78 0.00 0.00 34.13 28.77 3eat s GLU 90 CO 0.12 -0.23 0.31 -0.51 -0.49 0.00 0.00 175.26 174.46 3eat s LEU 91 N 1.84 4.22 -0.16 1.80 1.43 0.11 -5.01 118.68 122.91 3eat s LEU 91 Ca 0.34 -3.17 -0.04 0.00 -1.03 0.00 0.00 54.13 50.23 3eat s LEU 91 Cb -0.16 -1.56 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 3eat s LEU 91 CO 0.12 -0.20 -0.03 -0.69 0.23 0.00 0.00 176.35 175.78 3eat s VAL 92 N -0.49 3.93 0.04 -1.59 1.01 -1.26 -0.29 120.40 121.76 3eat s VAL 92 Ca 0.19 -0.34 0.08 0.00 0.00 0.00 0.00 61.98 61.90 3eat s VAL 92 Cb -0.21 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.42 3eat s VAL 92 CO -0.04 0.49 -0.21 -1.61 0.00 0.00 0.00 175.10 173.73 3eat s GLU 93 N 0.36 1.43 0.14 2.72 2.02 0.96 -5.00 118.70 121.33 3eat s GLU 93 Ca -0.04 -0.97 0.05 0.00 0.02 0.00 0.00 54.97 54.04 3eat s GLU 93 Cb -0.14 -1.56 -0.04 0.00 0.10 0.00 0.00 34.13 32.49 3eat s GLU 93 CO 0.03 0.40 0.07 -0.65 0.02 0.00 0.00 175.26 175.13 3eat s GLN 94 N -1.20 2.72 -0.06 1.61 -0.21 -1.26 -2.17 119.66 119.09 3eat s GLN 94 Ca 0.08 -0.89 -0.29 0.00 0.02 0.00 0.00 55.36 54.28 3eat s GLN 94 Cb -0.09 -2.58 -0.07 0.00 1.00 0.00 0.00 33.01 31.28 3eat s GLN 94 CO 0.02 0.50 1.95 -2.00 -2.12 0.00 0.00 175.29 173.64 3eat s GLU 95 N -2.81 3.88 -0.13 2.91 2.12 -1.26 -2.65 118.70 120.76 3eat s GLU 95 Ca 0.29 2.33 0.00 0.00 0.36 0.00 0.00 54.97 57.95 3eat s GLU 95 Cb -0.11 -4.17 0.00 0.00 0.26 0.00 0.00 34.13 30.11 3eat s GLU 95 CO 0.21 -1.24 0.00 0.41 -0.54 0.00 0.00 175.26 174.11 3eat n GLY 96 N 4.78 0.46 3.69 -1.50 0.00 0.68 -4.98 105.19 108.32 3eat n GLY 96 Ca 0.22 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 3eat n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3eat s ALA 97 N -1.83 3.66 0.50 4.61 0.00 -1.08 -4.94 121.76 122.68 3eat s ALA 97 Ca 0.00 1.12 -0.21 0.00 0.00 0.00 0.00 51.96 52.87 3eat s ALA 97 Cb 0.00 -3.66 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 3eat s ALA 97 CO 0.00 -1.04 1.11 -1.21 0.00 0.00 0.00 175.76 174.63 3eat s GLU 98 N 2.52 3.59 -1.42 0.00 2.02 -1.26 -4.92 118.70 119.23 3eat s GLU 98 Ca 0.71 1.59 -0.10 0.00 0.02 0.00 0.00 54.97 57.20 3eat s GLU 98 Cb -0.37 -2.15 0.06 0.00 0.10 0.00 0.00 34.13 31.76 3eat s GLU 98 CO 0.31 -0.65 2.37 -0.25 0.02 0.00 0.00 175.26 177.06 3eat n ASP 99 N -0.96 6.50 -0.73 -0.19 10.43 -1.26 -4.75 116.55 125.59 3eat n ASP 99 Ca 0.10 -2.91 0.00 0.00 2.57 0.00 0.00 54.79 54.54 3eat n ASP 99 Cb 0.50 -1.51 0.00 0.00 1.84 0.00 0.00 41.12 41.95 3eat n ASP 99 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3eat n HIS 100 N 3.78 -0.49 0.00 1.24 -0.00 -1.26 -1.77 115.22 116.72 3eat n HIS 100 Ca 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.31 3eat n HIS 100 Cb 0.31 -0.33 0.00 0.00 -0.00 0.00 0.00 29.99 29.97 3eat n HIS 100 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 176.34 176.78 3eat n ILE 101 N -0.57 0.00 -0.11 0.61 -5.35 -1.26 -4.78 119.36 107.90 3eat n ILE 101 Ca 0.00 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.33 3eat n ILE 101 Cb 0.08 0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.87 3eat n ILE 101 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3eat n PHE 102 N -1.70 0.00 -2.11 4.28 3.01 -0.73 -5.00 117.46 115.21 3eat n PHE 102 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.05 3eat n PHE 102 Cb 0.00 -0.89 -0.03 0.00 -0.01 0.00 0.00 39.48 38.55 3eat n PHE 102 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3eat s ALA 103 N -2.46 3.59 0.76 4.37 0.00 -0.83 -5.00 121.76 122.18 3eat s ALA 103 Ca -0.28 1.22 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 3eat s ALA 103 Cb 0.08 -3.52 0.06 0.00 0.00 0.00 0.00 23.12 19.73 3eat s ALA 103 CO 0.57 -0.64 1.16 -0.80 0.00 0.00 0.00 175.76 176.05 3eat s ASN 104 N 0.43 4.15 -0.12 0.00 0.01 -1.26 -4.77 114.94 113.38 3eat s ASN 104 Ca 0.59 2.18 0.17 0.00 -0.71 0.00 0.00 52.86 55.09 3eat s ASN 104 Cb -0.39 -2.57 0.65 0.00 0.41 0.00 0.00 41.25 39.35 3eat s ASN 104 CO 0.40 -2.28 1.56 -0.46 -1.51 0.00 0.00 177.10 174.80 3eat n ASN 105 N -3.07 4.47 -3.77 -1.22 2.04 -1.26 -4.93 115.26 107.52 3eat n ASN 105 Ca 0.12 -2.51 -0.10 0.00 -0.44 0.00 0.00 54.58 51.65 3eat n ASN 105 Cb 0.51 -0.54 -0.06 0.00 -2.53 0.00 0.00 39.78 37.16 3eat n ASN 105 CO 0.00 0.00 0.00 -0.72 -0.44 0.00 0.00 177.26 176.10 3eat s TYR 106 N -1.95 0.00 -0.17 -2.53 -0.85 -1.26 -2.79 117.35 107.81 3eat s TYR 106 Ca 0.47 -0.36 0.01 0.00 -0.52 0.00 0.00 57.07 56.66 3eat s TYR 106 Cb 0.31 0.07 0.02 0.00 0.38 0.00 0.00 41.96 42.74 3eat s TYR 106 CO 0.21 -0.59 -0.16 0.08 -1.52 0.00 0.00 175.55 173.56 3eat s VAL 107 N -3.69 1.79 0.96 -3.49 1.01 -0.87 -4.97 120.40 111.14 3eat s VAL 107 Ca 0.03 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.09 3eat s VAL 107 Cb 0.03 -1.66 0.17 0.00 0.00 0.00 0.00 36.38 34.92 3eat s VAL 107 CO -0.11 0.47 1.10 -2.84 0.00 0.00 0.00 175.10 173.72 3eat s PRO 108 N 1.39 0.71 0.37 2.72 0.02 -1.26 -0.93 135.00 138.02 3eat s PRO 108 Ca 0.04 0.58 -0.27 0.00 0.02 0.00 0.00 61.00 61.37 3eat s PRO 108 Cb -0.13 -1.76 -0.09 0.00 0.02 0.00 0.00 34.50 32.53 3eat s PRO 108 CO -0.11 -2.56 1.27 -0.51 -0.33 0.00 0.00 177.00 174.75 3eat s LEU 109 N -6.36 4.30 0.00 -5.54 1.43 -1.26 -4.45 118.68 106.80 3eat s LEU 109 Ca 0.65 2.58 -0.10 0.00 -1.03 0.00 0.00 54.13 56.22 3eat s LEU 109 Cb -0.18 -3.83 0.04 0.00 0.03 0.00 0.00 46.19 42.25 3eat s LEU 109 CO 0.57 -0.67 0.50 0.00 0.23 0.00 0.00 176.35 176.98 3eat n HIS 110 N 0.39 -1.07 -4.23 0.29 1.44 0.00 -1.07 115.22 110.98 3eat n HIS 110 Ca 0.02 -0.68 -0.19 0.00 -2.01 0.00 0.00 57.72 54.86 3eat n HIS 110 Cb 0.44 0.33 -0.12 0.00 0.12 0.00 0.00 29.99 30.76 3eat n HIS 110 CO 0.00 0.00 0.00 1.67 -2.81 0.00 0.00 176.34 175.20 3eat s TRP 111 N -4.25 1.42 0.38 -1.40 -2.14 -1.26 -0.50 118.94 111.18 3eat s TRP 111 Ca 0.11 -0.50 -0.25 0.00 2.66 0.00 0.00 56.10 58.13 3eat s TRP 111 Cb -0.02 -0.76 -0.09 0.00 -3.10 0.00 0.00 33.47 29.50 3eat s TRP 111 CO 0.03 0.13 1.04 -0.51 -2.66 0.00 0.00 176.95 174.98 3eat s ASP 112 N -2.14 6.89 0.00 -2.66 1.01 -1.26 -3.80 116.67 114.71 3eat s ASP 112 Ca 0.05 2.02 0.00 0.00 0.71 0.00 0.00 52.55 55.33 3eat s ASP 112 Cb -0.07 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.27 3eat s ASP 112 CO 0.03 -0.40 0.00 0.61 0.21 0.00 0.00 175.17 175.62 3eat n GLY 113 N 0.41 0.69 0.29 0.21 0.00 -1.26 -4.58 105.19 100.95 3eat n GLY 113 Ca 0.04 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.08 3eat n GLY 113 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3eat h MET 114 N 2.22 -0.00 -0.64 1.61 2.86 -1.94 -2.18 114.93 116.86 3eat h MET 114 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3eat h MET 114 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3eat h MET 114 CO 0.00 -0.00 0.00 0.66 1.06 0.00 0.00 176.91 178.63 3eat n TYR 115 N -5.51 0.85 -3.17 -0.22 4.01 -1.26 -4.51 117.16 107.36 3eat n TYR 115 Ca 0.11 -0.44 -0.23 0.00 -0.16 0.00 0.00 57.90 57.18 3eat n TYR 115 Cb 0.39 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 3eat n TYR 115 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3eat s LEU 116 N -1.11 3.79 0.19 7.72 1.43 -0.82 -4.97 118.68 124.91 3eat s LEU 116 Ca 0.46 0.25 -0.05 0.00 -1.03 0.00 0.00 54.13 53.76 3eat s LEU 116 Cb 0.24 -3.13 0.11 0.00 0.03 0.00 0.00 46.19 43.44 3eat s LEU 116 CO 0.32 -0.56 1.54 -0.08 0.23 0.00 0.00 176.35 177.80 3eat h GLU 117 N 0.57 0.70 -5.61 1.70 4.57 -1.94 -3.42 114.58 111.14 3eat h GLU 117 Ca -0.47 -0.37 -0.52 0.00 -1.18 0.00 0.00 59.36 56.82 3eat h GLU 117 Cb 1.24 0.01 -0.28 0.00 -0.16 0.00 0.00 28.75 29.57 3eat h GLU 117 CO 0.58 0.98 -0.82 0.95 -1.18 0.00 0.00 179.01 179.52 3eat s THR 118 N -4.26 1.33 -0.22 0.32 -4.23 -1.26 -1.15 115.64 106.17 3eat s THR 118 Ca -0.09 -0.87 -0.09 0.00 -1.18 0.00 0.00 61.69 59.47 3eat s THR 118 Cb 0.12 -1.14 -0.04 0.00 1.34 0.00 0.00 72.50 72.77 3eat s THR 118 CO 0.85 0.26 0.12 -0.69 -0.54 0.00 0.00 174.62 174.62 3eat s VAL 119 N -0.57 5.07 0.41 2.29 1.01 0.04 -4.85 120.40 123.80 3eat s VAL 119 Ca 0.06 0.08 -0.23 0.00 0.00 0.00 0.00 61.98 61.88 3eat s VAL 119 Cb -0.07 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 32.87 3eat s VAL 119 CO 0.00 0.38 1.02 -2.16 0.00 0.00 0.00 175.10 174.34 3eat s PRO 120 N 0.90 4.18 0.04 2.72 0.04 -1.26 -4.23 135.00 137.38 3eat s PRO 120 Ca 0.06 1.41 -0.16 0.00 0.04 0.00 0.00 61.00 62.34 3eat s PRO 120 Cb -0.13 -2.46 -0.25 0.00 0.04 0.00 0.00 34.50 31.69 3eat s PRO 120 CO 0.03 -0.11 1.12 1.49 0.04 0.00 0.00 177.00 179.57 3eat h GLU 121 N 2.37 0.58 -6.15 4.56 4.81 -1.09 -3.42 114.58 116.24 3eat h GLU 121 Ca -0.48 -0.67 -0.61 0.00 -0.13 0.00 0.00 59.36 57.47 3eat h GLU 121 Cb 1.21 0.20 -0.28 0.00 0.63 0.00 0.00 28.75 30.52 3eat h GLU 121 CO 0.62 1.27 -0.85 -0.06 -0.73 0.00 0.00 179.01 179.26 3eat s PHE 122 N -3.14 1.90 -0.17 0.92 0.08 -1.02 -0.22 117.98 116.32 3eat s PHE 122 Ca -0.11 -0.37 -0.08 0.00 0.12 0.00 0.00 56.93 56.49 3eat s PHE 122 Cb 0.05 -1.17 -0.04 0.00 -0.57 0.00 0.00 43.02 41.28 3eat s PHE 122 CO 0.89 0.04 0.09 -0.65 -0.10 0.00 0.00 175.22 175.49 3eat s GLN 123 N -0.88 3.91 -0.26 0.44 -0.21 -0.49 -1.39 119.66 120.78 3eat s GLN 123 Ca 0.08 -0.27 -0.03 0.00 0.02 0.00 0.00 55.36 55.16 3eat s GLN 123 Cb -0.09 -3.26 0.02 0.00 1.00 0.00 0.00 33.01 30.69 3eat s GLN 123 CO 0.01 0.39 -0.02 0.08 -2.12 0.00 0.00 175.29 173.62 3eat s VAL 124 N 0.07 3.17 -0.19 1.09 1.01 0.12 -0.94 120.40 124.72 3eat s VAL 124 Ca 0.07 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 61.06 3eat s VAL 124 Cb -0.12 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 3eat s VAL 124 CO 0.00 0.15 -0.01 -0.36 0.00 0.00 0.00 175.10 174.88 3eat s PHE 125 N 1.37 3.03 -0.24 5.22 0.08 0.56 -0.68 117.98 127.32 3eat s PHE 125 Ca 0.01 -0.45 -0.06 0.00 0.12 0.00 0.00 56.93 56.54 3eat s PHE 125 Cb -0.17 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.20 3eat s PHE 125 CO -0.02 -0.21 0.04 -1.58 -0.10 0.00 0.00 175.22 173.35 3eat s HIS 126 N 0.87 3.06 -0.50 0.36 5.65 0.18 -0.95 115.29 123.96 3eat s HIS 126 Ca 0.00 -0.53 -0.27 0.00 0.25 0.00 0.00 55.06 54.51 3eat s HIS 126 Cb -0.14 -2.20 0.03 0.00 -1.18 0.00 0.00 32.58 29.08 3eat s HIS 126 CO 0.02 -0.39 1.05 0.00 -0.65 0.00 0.00 174.74 174.77 3eat h VAL 128 N 6.15 1.32 -1.97 0.00 2.07 -1.20 0.36 116.25 122.98 3eat h VAL 128 Ca -0.24 -1.66 0.03 0.00 0.82 0.00 0.00 66.70 65.64 3eat h VAL 128 Cb 1.07 1.87 -0.21 0.00 -1.52 0.00 0.00 31.29 32.49 3eat h VAL 128 CO 1.10 0.52 0.05 -0.62 0.02 0.00 0.00 177.57 178.64 3eat s ASP 129 N -6.67 -0.91 -0.40 0.57 2.15 -1.12 -4.38 116.67 105.90 3eat s ASP 129 Ca -0.12 1.47 0.06 0.00 0.43 0.00 0.00 52.55 54.38 3eat s ASP 129 Cb 0.07 1.38 0.20 0.00 -0.30 0.00 0.00 42.92 44.28 3eat s ASP 129 CO 0.84 -0.23 0.42 0.00 -0.17 0.00 0.00 175.17 176.03 3eat n ALA 130 N 4.24 2.64 0.30 3.66 0.00 -1.26 -0.80 120.51 129.29 3eat n ALA 130 Ca -0.20 -3.22 -0.12 0.00 0.00 0.00 0.00 53.44 49.90 3eat n ALA 130 Cb 0.59 -0.78 -0.06 0.00 0.00 0.00 0.00 19.45 19.20 3eat n ALA 130 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3eat h PRO 131 N 4.92 -0.76 -7.55 0.00 0.13 -1.95 -3.41 132.00 123.38 3eat h PRO 131 Ca 0.18 0.05 -0.47 0.00 -0.87 0.00 0.00 66.00 64.89 3eat h PRO 131 Cb 0.90 0.17 0.11 0.00 0.13 0.00 0.00 31.00 32.31 3eat h PRO 131 CO 0.41 -0.51 0.36 0.20 -0.23 0.00 0.00 178.00 178.23 3eat s GLY 132 N -2.24 1.59 -0.24 1.56 0.00 -1.26 -5.04 107.32 101.68 3eat s GLY 132 Ca -0.12 -0.56 -0.14 0.00 0.00 0.00 0.00 44.72 43.91 3eat s GLY 132 CO 0.35 -0.05 0.34 -0.35 0.00 0.00 0.00 173.10 173.38 3eat s ASP 133 N -4.31 6.28 0.84 1.64 2.15 -1.26 -4.95 116.67 117.06 3eat s ASP 133 Ca 0.62 0.32 -0.07 0.00 0.43 0.00 0.00 52.55 53.86 3eat s ASP 133 Cb -0.13 -2.20 0.17 0.00 -0.30 0.00 0.00 42.92 40.47 3eat s ASP 133 CO 0.51 -0.10 1.15 -0.94 -0.17 0.00 0.00 175.17 175.62 3eat s SER 134 N 1.33 3.73 -0.14 -0.34 1.04 -1.26 -5.05 113.70 113.01 3eat s SER 134 Ca 0.15 -0.18 -0.00 0.00 0.48 0.00 0.00 55.95 56.40 3eat s SER 134 Cb -0.15 -0.01 0.03 0.00 0.10 0.00 0.00 66.02 65.99 3eat s SER 134 CO 0.08 -2.30 -0.11 -0.62 0.98 0.00 0.00 173.24 171.28 3eat s ASP 135 N -4.84 2.54 0.75 7.02 2.15 -1.26 -5.05 116.67 117.98 3eat s ASP 135 Ca 0.71 -0.45 0.00 0.00 0.43 0.00 0.00 52.55 53.23 3eat s ASP 135 Cb -0.04 -1.03 0.00 0.00 -0.30 0.00 0.00 42.92 41.55 3eat s ASP 135 CO 0.48 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 176.00 3eat n GLY 136 N 4.84 0.28 2.43 2.66 0.00 -1.26 -4.18 105.19 109.96 3eat n GLY 136 Ca -0.15 -0.96 -0.01 0.00 0.00 0.00 0.00 46.02 44.91 3eat n GLY 136 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3eat n GLY 137 N 0.00 0.39 3.77 -0.02 0.00 -0.98 -4.91 105.19 103.44 3eat n GLY 137 Ca 0.00 -0.08 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 3eat n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3eat s ARG 138 N -1.16 4.16 0.11 1.61 0.52 -1.26 -4.67 118.95 118.27 3eat s ARG 138 Ca 0.00 1.98 -0.31 0.00 -0.52 0.00 0.00 55.73 56.89 3eat s ARG 138 Cb 0.00 -2.83 -0.08 0.00 0.52 0.00 0.00 34.95 32.56 3eat s ARG 138 CO 0.00 -0.27 1.35 0.99 0.02 0.00 0.00 175.30 177.39 3eat s THR 139 N -1.29 3.42 0.06 0.02 2.01 -1.16 -0.93 115.64 117.76 3eat s THR 139 Ca 0.54 1.03 0.06 0.00 0.31 0.00 0.00 61.69 63.62 3eat s THR 139 Cb -0.34 -3.66 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 3eat s THR 139 CO 0.44 0.09 -0.09 0.42 -0.69 0.00 0.00 174.62 174.79 3eat s THR 140 N 1.01 3.44 0.00 -0.82 -4.23 -0.26 -0.11 115.64 114.67 3eat s THR 140 Ca 0.63 -1.06 0.02 0.00 -1.18 0.00 0.00 61.69 60.10 3eat s THR 140 Cb -0.36 -2.55 -0.01 0.00 1.34 0.00 0.00 72.50 70.93 3eat s THR 140 CO 0.31 0.24 -0.07 -0.36 -0.54 0.00 0.00 174.62 174.21 3eat s PHE 141 N -1.11 0.58 -0.03 3.99 0.08 0.10 -1.04 117.98 120.55 3eat s PHE 141 Ca 0.19 -0.17 0.03 0.00 0.12 0.00 0.00 56.93 57.10 3eat s PHE 141 Cb -0.11 -0.36 0.00 0.00 -0.57 0.00 0.00 43.02 41.98 3eat s PHE 141 CO 0.11 -0.02 -0.11 -1.12 -0.10 0.00 0.00 175.22 173.98 3eat s SER 142 N -0.40 1.48 -0.37 1.36 0.01 0.42 -0.61 113.70 115.58 3eat s SER 142 Ca 0.00 -0.23 -0.23 0.00 1.31 0.00 0.00 55.95 56.80 3eat s SER 142 Cb -0.04 -0.42 0.01 0.00 0.21 0.00 0.00 66.02 65.78 3eat s SER 142 CO -0.00 0.08 0.80 -0.55 0.41 0.00 0.00 173.24 173.98 3eat s SER 143 N 0.20 6.54 0.23 2.44 0.15 0.02 -1.36 113.70 121.92 3eat s SER 143 Ca -0.04 0.32 -0.02 0.00 0.70 0.00 0.00 55.95 56.90 3eat s SER 143 Cb -0.10 -2.40 0.23 0.00 -1.71 0.00 0.00 66.02 62.04 3eat s SER 143 CO 0.01 -0.77 1.63 0.71 1.20 0.00 0.00 173.24 176.03 3eat h THR 144 N 5.79 1.28 -0.96 6.45 1.35 -1.86 -2.09 112.91 122.86 3eat h THR 144 Ca -0.25 -1.39 0.04 0.00 -0.55 0.00 0.00 66.41 64.27 3eat h THR 144 Cb 1.09 1.33 -0.06 0.00 -1.73 0.00 0.00 68.15 68.79 3eat h THR 144 CO 0.92 0.45 0.63 -0.65 -0.25 0.00 0.00 175.52 176.63 3eat h PRO 145 N 0.57 1.16 -0.35 4.72 0.11 -1.80 -1.27 132.00 135.14 3eat h PRO 145 Ca 0.07 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 3eat h PRO 145 Cb 0.77 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.60 3eat h PRO 145 CO 0.06 0.77 0.21 0.00 -0.21 0.00 0.00 178.00 178.83 3eat h ALA 146 N 1.45 0.45 -0.95 -0.75 0.00 -1.82 -2.47 119.26 115.16 3eat h ALA 146 Ca 0.39 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.30 3eat h ALA 146 Cb 0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3eat h ALA 146 CO -0.13 -0.05 0.62 0.00 0.00 0.00 0.00 179.25 179.69 3eat h ALA 147 N 1.09 1.43 0.00 0.00 0.00 -1.20 -1.76 119.26 118.83 3eat h ALA 147 Ca 0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3eat h ALA 147 Cb 0.00 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.48 3eat h ALA 147 CO -0.02 0.45 -0.16 -0.07 0.00 0.00 0.00 179.25 179.44 3eat h LEU 148 N 1.14 0.00 -0.07 0.00 3.38 -0.80 -1.66 115.31 117.30 3eat h LEU 148 Ca 0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.37 3eat h LEU 148 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3eat h LEU 148 CO -0.14 0.16 0.00 0.00 0.09 0.00 0.00 178.44 178.55 3eat n GLN 149 N -4.15 0.14 -0.04 1.13 1.13 -0.67 -3.66 117.38 111.25 3eat n GLN 149 Ca -0.02 0.16 -0.09 0.00 -1.94 0.00 0.00 57.00 55.11 3eat n GLN 149 Cb 0.23 -1.68 -0.14 0.00 0.11 0.00 0.00 30.24 28.76 3eat n GLN 149 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3eat n LEU 150 N -1.93 0.65 -4.70 1.08 4.77 -0.64 -4.95 117.00 111.29 3eat n LEU 150 Ca 0.06 0.31 -0.42 0.00 -0.03 0.00 0.00 56.01 55.93 3eat n LEU 150 Cb 0.36 0.25 -0.00 0.00 -2.33 0.00 0.00 43.42 41.69 3eat n LEU 150 CO 0.27 0.41 0.90 0.00 -1.33 0.00 0.00 177.39 177.63 3eat n ALA 151 N -2.60 1.32 -2.38 -1.18 0.00 -1.10 -5.03 120.51 109.55 3eat n ALA 151 Ca -0.21 0.33 -0.23 0.00 0.00 0.00 0.00 53.44 53.34 3eat n ALA 151 Cb 1.07 -2.26 0.15 0.00 0.00 0.00 0.00 19.45 18.41 3eat n ALA 151 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3eat n ASP 152 N 0.60 0.94 -0.22 0.00 3.85 -1.26 -4.84 116.55 115.62 3eat n ASP 152 Ca 0.05 -1.92 0.02 0.00 -0.71 0.00 0.00 54.79 52.23 3eat n ASP 152 Cb 0.37 -0.76 0.14 0.00 -1.35 0.00 0.00 41.12 39.52 3eat n ASP 152 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 3eat h SER 153 N -0.97 0.15 0.25 -1.12 0.02 -1.99 -1.15 113.55 108.74 3eat h SER 153 Ca -0.36 0.10 -0.34 0.00 -0.84 0.00 0.00 61.79 60.35 3eat h SER 153 Cb 1.20 0.11 0.02 0.00 0.14 0.00 0.00 62.40 63.87 3eat h SER 153 CO 0.34 0.07 -1.64 0.77 -1.14 0.00 0.00 176.83 175.23 3eat h SER 154 N 0.36 0.67 -0.55 3.07 4.64 -1.98 -1.88 113.55 117.88 3eat h SER 154 Ca 0.35 -0.88 0.11 0.00 -0.47 0.00 0.00 61.79 60.90 3eat h SER 154 Cb 0.51 -0.22 -0.10 0.00 -0.31 0.00 0.00 62.40 62.28 3eat h SER 154 CO -0.39 1.73 -0.09 -0.33 -0.87 0.00 0.00 176.83 176.88 3eat h GLU 155 N 0.12 0.04 -0.33 4.77 5.08 -1.92 -0.66 114.58 121.66 3eat h GLU 155 Ca -0.30 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.03 3eat h GLU 155 Cb 2.12 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 31.35 3eat h GLU 155 CO 0.21 0.02 0.10 1.25 -1.00 0.00 0.00 179.01 179.59 3eat h LEU 156 N 0.04 0.49 -0.72 1.33 5.85 -1.23 -0.09 115.31 120.99 3eat h LEU 156 Ca 0.27 -0.21 0.09 0.00 0.84 0.00 0.00 57.88 58.87 3eat h LEU 156 Cb 0.42 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 41.25 3eat h LEU 156 CO -0.53 0.58 0.36 -0.08 -0.34 0.00 0.00 178.44 178.42 3eat h GLU 157 N 0.39 0.59 -0.05 1.25 4.22 -1.03 -1.07 114.58 118.87 3eat h GLU 157 Ca 0.11 -0.04 -0.00 0.00 0.08 0.00 0.00 59.36 59.51 3eat h GLU 157 Cb 0.26 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 3eat h GLU 157 CO -0.00 0.39 0.01 1.25 -2.18 0.00 0.00 179.01 178.48 3eat h LEU 158 N 0.61 0.08 -0.90 1.64 5.85 -0.81 -3.09 115.31 118.68 3eat h LEU 158 Ca 0.35 -0.21 0.11 0.00 0.84 0.00 0.00 57.88 58.97 3eat h LEU 158 Cb 0.37 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.30 3eat h LEU 158 CO -0.27 0.27 0.53 -0.50 -0.34 0.00 0.00 178.44 178.13 3eat h TRP 159 N -0.12 0.95 0.00 1.25 4.06 -0.58 -2.68 115.95 118.83 3eat h TRP 159 Ca 0.02 0.03 -0.05 0.00 2.06 0.00 0.00 58.89 60.94 3eat h TRP 159 Cb 0.22 -0.29 -0.01 0.00 -1.00 0.00 0.00 29.16 28.08 3eat h TRP 159 CO -0.00 0.36 -0.26 0.00 -3.56 0.00 0.00 178.44 174.98 3eat h ARG 160 N 0.84 0.00 0.00 0.49 3.08 -1.13 -2.09 114.38 115.56 3eat h ARG 160 Ca 0.45 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.39 3eat h ARG 160 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.50 3eat h ARG 160 CO -0.27 0.26 -0.67 0.00 -1.07 0.00 0.00 179.97 178.22 3eat h ARG 161 N 0.00 0.00 -7.28 0.04 3.08 -1.42 -3.47 114.38 105.33 3eat h ARG 161 Ca -0.00 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.55 3eat h ARG 161 Cb 0.60 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.73 3eat h ARG 161 CO 0.03 0.45 0.38 0.00 -1.07 0.00 0.00 179.97 179.76 3eat s ALA 162 N -2.97 2.78 -0.26 0.04 0.00 -0.79 -4.30 121.76 116.26 3eat s ALA 162 Ca 0.03 0.18 -0.15 0.00 0.00 0.00 0.00 51.96 52.02 3eat s ALA 162 Cb 0.08 -3.18 0.08 0.00 0.00 0.00 0.00 23.12 20.09 3eat s ALA 162 CO 0.76 -0.95 0.64 0.45 0.00 0.00 0.00 175.76 176.66 3eat s SER 163 N -3.43 -0.87 -0.11 0.00 0.15 -1.10 -2.68 113.70 105.67 3eat s SER 163 Ca 0.60 1.41 -0.08 0.00 0.70 0.00 0.00 55.95 58.57 3eat s SER 163 Cb -0.14 1.28 -0.04 0.00 -1.71 0.00 0.00 66.02 65.41 3eat s SER 163 CO 0.47 -0.23 0.17 -0.83 1.20 0.00 0.00 173.24 174.02 3eat s GLY 164 N 1.59 2.19 -0.13 9.45 0.00 0.51 -0.64 107.32 120.29 3eat s GLY 164 Ca -0.10 -0.60 0.02 0.00 0.00 0.00 0.00 44.72 44.04 3eat s GLY 164 CO -0.19 -0.29 -0.18 0.50 0.00 0.00 0.00 173.10 172.94 3eat s ARG 165 N -0.96 2.57 0.04 2.90 0.52 -0.11 -1.91 118.95 122.01 3eat s ARG 165 Ca 0.16 -0.68 0.06 0.00 -0.52 0.00 0.00 55.73 54.75 3eat s ARG 165 Cb -0.12 -2.17 -0.02 0.00 0.52 0.00 0.00 34.95 33.15 3eat s ARG 165 CO 0.05 -0.09 -0.18 0.71 0.02 0.00 0.00 175.30 175.81 3eat s TYR 166 N 1.04 1.61 -0.04 -0.53 2.02 0.51 -1.94 117.35 120.02 3eat s TYR 166 Ca -0.04 -0.37 -0.06 0.00 -0.37 0.00 0.00 57.07 56.24 3eat s TYR 166 Cb -0.15 -0.96 0.01 0.00 -0.40 0.00 0.00 41.96 40.47 3eat s TYR 166 CO -0.04 0.07 0.14 -1.14 -1.57 0.00 0.00 175.55 173.01 3eat s GLN 167 N -1.16 0.27 0.00 -0.62 0.74 -1.09 -1.12 119.66 116.67 3eat s GLN 167 Ca 0.05 0.01 0.00 0.00 0.05 0.00 0.00 55.36 55.48 3eat s GLN 167 Cb -0.08 0.12 0.00 0.00 1.10 0.00 0.00 33.01 34.14 3eat s GLN 167 CO 0.02 -0.05 0.00 2.89 -0.55 0.00 0.00 175.29 177.60 3eat n ARG 168 N 2.52 1.86 0.00 1.67 1.85 -1.26 -4.86 116.66 118.44 3eat n ARG 168 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.69 3eat n ARG 168 Cb 0.58 -0.95 0.00 0.00 -1.05 0.00 0.00 32.46 31.04 3eat n ARG 168 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 3eat n SER 174 N -2.13 0.00 -4.76 2.89 2.88 -1.26 -5.07 113.62 106.17 3eat n SER 174 Ca 0.00 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.14 3eat n SER 174 Cb 0.45 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.86 3eat n SER 174 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3eat s SER 175 N 0.00 7.51 -0.01 -3.46 0.01 -1.26 -5.07 113.70 111.42 3eat s SER 175 Ca 0.00 1.79 0.05 0.00 1.31 0.00 0.00 55.95 59.10 3eat s SER 175 Cb 0.00 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.66 3eat s SER 175 CO 0.00 0.14 -0.17 -0.13 0.41 0.00 0.00 173.24 173.49 3eat s ARG 176 N -0.94 1.36 -0.03 12.44 0.52 -1.26 -4.35 118.95 126.68 3eat s ARG 176 Ca 0.40 -0.62 -0.03 0.00 -0.52 0.00 0.00 55.73 54.96 3eat s ARG 176 Cb -0.24 -1.32 0.01 0.00 0.52 0.00 0.00 34.95 33.92 3eat s ARG 176 CO 0.29 0.36 0.09 0.45 0.02 0.00 0.00 175.30 176.51 3eat s SER 177 N -0.43 -0.09 -0.05 0.23 0.15 -0.28 -1.18 113.70 112.06 3eat s SER 177 Ca 0.06 0.18 0.02 0.00 0.70 0.00 0.00 55.95 56.91 3eat s SER 177 Cb -0.07 0.17 0.02 0.00 -1.71 0.00 0.00 66.02 64.43 3eat s SER 177 CO -0.01 -0.04 -0.07 0.00 1.20 0.00 0.00 173.24 174.32 3eat s ALA 178 N 0.15 0.85 -0.00 5.45 0.00 0.48 -0.36 121.76 128.33 3eat s ALA 178 Ca -0.01 -0.19 -0.01 0.00 0.00 0.00 0.00 51.96 51.75 3eat s ALA 178 Cb -0.02 -0.43 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 3eat s ALA 178 CO -0.00 0.06 0.01 0.00 0.00 0.00 0.00 175.76 175.83 3eat s ALA 179 N 0.70 -0.02 0.58 0.00 0.00 -0.80 -4.53 121.76 117.68 3eat s ALA 179 Ca -0.11 -0.11 -0.20 0.00 0.00 0.00 0.00 51.96 51.54 3eat s ALA 179 Cb -0.14 0.02 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 3eat s ALA 179 CO 0.01 -0.06 1.34 -2.14 0.00 0.00 0.00 175.76 174.91 3eat s PRO 180 N -0.42 2.92 0.13 0.00 0.02 -1.26 -0.36 135.00 136.02 3eat s PRO 180 Ca -0.05 2.17 -0.16 0.00 0.02 0.00 0.00 61.00 62.99 3eat s PRO 180 Cb -0.03 -2.10 -0.01 0.00 0.02 0.00 0.00 34.50 32.37 3eat s PRO 180 CO -0.00 -1.34 1.66 0.82 -0.33 0.00 0.00 177.00 177.80 3eat h ILE 181 N 1.11 1.21 -3.76 2.83 1.08 -1.63 -3.37 117.51 114.98 3eat h ILE 181 Ca -0.51 -0.66 -0.64 0.00 -0.39 0.00 0.00 64.86 62.66 3eat h ILE 181 Cb 1.31 0.92 -0.16 0.00 -3.07 0.00 0.00 36.82 35.82 3eat h ILE 181 CO 0.56 0.23 -0.33 -0.69 -0.69 0.00 0.00 178.15 177.23 3eat s VAL 182 N -5.45 5.21 0.38 1.67 1.01 -1.26 -0.95 120.40 121.00 3eat s VAL 182 Ca -0.13 0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.22 3eat s VAL 182 Cb 0.10 -3.68 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 3eat s VAL 182 CO 0.75 0.13 0.06 -0.70 0.00 0.00 0.00 175.10 175.34 3eat s GLU 183 N 1.96 1.81 0.01 2.72 2.56 -0.13 -4.94 118.70 122.70 3eat s GLU 183 Ca 0.12 -2.05 0.00 0.00 0.00 0.00 0.00 54.97 53.04 3eat s GLU 183 Cb -0.16 -1.00 -0.04 0.00 2.00 0.00 0.00 34.13 34.93 3eat s GLU 183 CO 0.11 -0.25 0.07 -0.98 -0.56 0.00 0.00 175.26 173.65 3eat s ARG 184 N -3.83 3.02 0.19 4.30 1.70 -1.26 -1.18 118.95 121.89 3eat s ARG 184 Ca 0.30 -0.52 -0.33 0.00 -0.47 0.00 0.00 55.73 54.71 3eat s ARG 184 Cb 0.07 -2.83 -0.13 0.00 -0.57 0.00 0.00 34.95 31.49 3eat s ARG 184 CO 0.14 0.63 1.64 1.58 -1.08 0.00 0.00 175.30 178.21 3eat n HIS 185 N 1.10 2.49 0.56 5.89 -0.00 0.11 -4.82 115.22 120.54 3eat n HIS 185 Ca -0.12 0.17 0.06 0.00 -0.00 0.00 0.00 57.72 57.83 3eat n HIS 185 Cb 0.53 -2.60 0.30 0.00 -0.00 0.00 0.00 29.99 28.21 3eat n HIS 185 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 3eat n PRO 186 N 3.59 0.18 0.00 1.57 -0.04 -1.26 -2.15 135.00 136.88 3eat n PRO 186 Ca 0.16 0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 3eat n PRO 186 Cb 0.32 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 3eat n PRO 186 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3eat n ARG 187 N -1.27 1.28 -0.03 0.54 5.12 -1.26 -4.90 116.66 116.14 3eat n ARG 187 Ca 0.06 0.00 0.01 0.00 -1.93 0.00 0.00 57.85 55.99 3eat n ARG 187 Cb 0.09 -0.80 0.03 0.00 -1.16 0.00 0.00 32.46 30.62 3eat n ARG 187 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3eat n ARG 188 N -1.73 1.99 0.00 5.56 1.74 -1.22 -5.02 116.66 117.97 3eat n ARG 188 Ca 0.00 -1.36 0.00 0.00 -0.77 0.00 0.00 57.85 55.72 3eat n ARG 188 Cb 0.30 -1.06 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 3eat n ARG 188 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 3eat n GLU 189 N -0.17 0.00 -1.57 5.56 -0.58 -0.92 -4.90 120.64 118.07 3eat n GLU 189 Ca 0.02 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.41 3eat n GLU 189 Cb 0.23 -0.83 0.08 0.00 -0.57 0.00 0.00 31.44 30.35 3eat n GLU 189 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 3eat s PHE 190 N -0.31 2.07 0.23 -0.32 -0.12 -1.26 -3.88 117.98 114.40 3eat s PHE 190 Ca 0.00 1.56 -0.31 0.00 -0.05 0.00 0.00 56.93 58.13 3eat s PHE 190 Cb 0.00 -3.55 -0.11 0.00 -0.63 0.00 0.00 43.02 38.74 3eat s PHE 190 CO 0.00 -2.69 1.57 -2.14 -0.05 0.00 0.00 175.22 171.91 3eat s PRO 191 N -3.70 4.19 0.27 1.99 0.02 -1.26 0.04 135.00 136.55 3eat s PRO 191 Ca 0.77 2.45 0.02 0.00 0.02 0.00 0.00 61.00 64.26 3eat s PRO 191 Cb -0.32 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.07 3eat s PRO 191 CO 0.43 -0.59 0.14 0.96 -0.33 0.00 0.00 177.00 177.60 3eat s ILE 192 N 0.54 0.34 -0.10 2.83 -4.36 -0.33 -4.44 121.20 115.68 3eat s ILE 192 Ca 0.66 -2.00 -0.02 0.00 -0.26 0.00 0.00 60.65 59.04 3eat s ILE 192 Cb -0.45 -2.55 -0.03 0.00 1.25 0.00 0.00 42.46 40.67 3eat s ILE 192 CO 0.39 0.00 -0.02 -0.76 0.24 0.00 0.00 174.94 174.79 3eat s LEU 193 N -3.32 3.43 -0.21 0.37 1.43 -1.26 -0.95 118.68 118.17 3eat s LEU 193 Ca 0.37 0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.53 3eat s LEU 193 Cb 0.06 -1.79 0.02 0.00 0.03 0.00 0.00 46.19 44.52 3eat s LEU 193 CO 0.16 0.33 -0.14 -0.13 0.23 0.00 0.00 176.35 176.80 3eat s ARG 194 N -0.59 2.91 -0.20 1.70 1.81 -0.13 -4.91 118.95 119.53 3eat s ARG 194 Ca 0.10 -0.91 -0.10 0.00 -1.72 0.00 0.00 55.73 53.10 3eat s ARG 194 Cb -0.12 -2.76 0.07 0.00 -0.45 0.00 0.00 34.95 31.70 3eat s ARG 194 CO 0.02 -0.30 0.47 0.12 -0.68 0.00 0.00 175.30 174.93 3eat s PHE 195 N 1.30 -0.75 -0.32 -0.53 5.36 -1.26 -3.93 117.98 117.83 3eat s PHE 195 Ca 0.02 1.52 -0.10 0.00 -0.96 0.00 0.00 56.93 57.42 3eat s PHE 195 Cb -0.15 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 42.89 3eat s PHE 195 CO -0.09 -0.42 0.16 0.00 -1.46 0.00 0.00 175.22 173.41 3eat s GLU 197 N 1.58 4.62 0.51 0.00 2.12 -0.23 -5.03 118.70 122.28 3eat s GLU 197 Ca 0.04 1.51 -0.18 0.00 0.36 0.00 0.00 54.97 56.69 3eat s GLU 197 Cb -0.18 -3.38 -0.08 0.00 0.26 0.00 0.00 34.13 30.75 3eat s GLU 197 CO 0.06 0.08 1.01 -1.25 -0.54 0.00 0.00 175.26 174.62 3eat s PRO 198 N 0.32 3.80 0.10 4.30 0.04 -1.26 -4.64 135.00 137.67 3eat s PRO 198 Ca 0.50 1.15 -0.15 0.00 0.04 0.00 0.00 61.00 62.53 3eat s PRO 198 Cb -0.24 -2.11 -0.06 0.00 0.04 0.00 0.00 34.50 32.13 3eat s PRO 198 CO 0.30 -0.40 1.49 -1.00 0.04 0.00 0.00 177.00 177.42 3eat h PRO 199 N 1.14 0.66 0.00 0.56 0.13 -2.00 -3.48 132.00 129.00 3eat h PRO 199 Ca -0.48 -0.27 0.00 0.00 -0.87 0.00 0.00 66.00 64.38 3eat h PRO 199 Cb 1.20 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3eat h PRO 199 CO 0.60 0.85 0.00 0.43 -0.23 0.00 0.00 178.00 179.65 3eat n SER 210 N -4.40 0.00 -0.73 1.44 7.64 -1.26 -5.13 113.62 111.19 3eat n SER 210 Ca -0.03 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.94 3eat n SER 210 Cb 0.36 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 63.67 3eat n SER 210 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 3eat n GLU 211 N 0.00 1.65 -3.80 1.43 0.28 -1.26 -4.88 120.64 114.06 3eat n GLU 211 Ca 0.00 -1.68 -0.30 0.00 -0.16 0.00 0.00 57.16 55.02 3eat n GLU 211 Cb 0.00 -1.33 -0.15 0.00 1.43 0.00 0.00 31.44 31.38 3eat n GLU 211 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 3eat s PHE 212 N -1.27 2.00 0.12 -1.84 0.40 -1.26 -2.67 117.98 113.45 3eat s PHE 212 Ca 0.23 -1.78 0.07 0.00 -0.60 0.00 0.00 56.93 54.84 3eat s PHE 212 Cb 0.15 -1.76 -0.04 0.00 0.51 0.00 0.00 43.02 41.88 3eat s PHE 212 CO 0.21 -0.83 -0.04 -1.01 0.70 0.00 0.00 175.22 174.25 3eat s HIS 213 N 1.52 2.84 -0.28 0.36 3.76 -0.82 -4.98 115.29 117.69 3eat s HIS 213 Ca 0.06 -0.12 0.01 0.00 -0.15 0.00 0.00 55.06 54.86 3eat s HIS 213 Cb -0.18 -1.44 0.08 0.00 1.11 0.00 0.00 32.58 32.15 3eat s HIS 213 CO -0.17 0.47 0.01 0.71 -0.85 0.00 0.00 174.74 174.91 3eat s TYR 214 N -1.41 2.52 0.88 1.40 1.51 -1.26 -0.93 117.35 120.06 3eat s TYR 214 Ca 0.25 -2.03 -0.11 0.00 -1.01 0.00 0.00 57.07 54.17 3eat s TYR 214 Cb -0.11 -1.92 0.17 0.00 -0.11 0.00 0.00 41.96 40.00 3eat s TYR 214 CO 0.17 -0.84 1.21 -0.51 -1.11 0.00 0.00 175.55 174.47 3eat s ASP 215 N 1.34 3.56 0.00 2.29 1.01 0.19 -4.43 116.67 120.63 3eat s ASP 215 Ca 0.02 0.09 0.00 0.00 0.71 0.00 0.00 52.55 53.38 3eat s ASP 215 Cb -0.18 -0.26 0.00 0.00 1.01 0.00 0.00 42.92 43.48 3eat s ASP 215 CO -0.11 -2.42 0.00 0.61 0.21 0.00 0.00 175.17 173.45 3eat n GLY 216 N -3.46 1.57 3.28 0.21 0.00 -1.26 -2.69 105.19 102.84 3eat n GLY 216 Ca 0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.01 3eat n GLY 216 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3eat s ILE 217 N -2.70 1.33 0.10 -0.61 -4.36 -1.26 -4.62 121.20 109.08 3eat s ILE 217 Ca 0.00 -2.11 -0.31 0.00 -0.26 0.00 0.00 60.65 57.97 3eat s ILE 217 Cb 0.00 -1.91 -0.07 0.00 1.25 0.00 0.00 42.46 41.73 3eat s ILE 217 CO 0.00 -0.70 1.36 0.00 0.24 0.00 0.00 174.94 175.84 3eat s ALA 218 N -3.23 3.56 -1.13 2.27 0.00 -1.26 -4.90 121.76 117.07 3eat s ALA 218 Ca 0.18 1.07 0.05 0.00 0.00 0.00 0.00 51.96 53.26 3eat s ALA 218 Cb 0.02 -3.53 0.21 0.00 0.00 0.00 0.00 23.12 19.82 3eat s ALA 218 CO 0.02 -0.60 1.10 -0.35 0.00 0.00 0.00 175.76 175.93 3eat n PRO 219 N 4.01 0.02 0.12 0.00 -0.04 -1.26 -0.04 135.00 137.82 3eat n PRO 219 Ca 0.11 0.37 0.01 0.00 -0.04 0.00 0.00 63.50 63.94 3eat n PRO 219 Cb 0.43 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.39 3eat n PRO 219 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3eat h GLU 220 N 0.00 0.00 0.00 0.54 5.08 -2.00 -3.15 114.58 115.05 3eat h GLU 220 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3eat h GLU 220 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3eat h GLU 220 CO 0.00 0.59 0.00 1.04 -1.00 0.00 0.00 179.01 179.64 3eat n GLN 221 N -3.24 0.03 -0.29 2.33 6.02 0.95 -3.93 117.38 119.24 3eat n GLN 221 Ca 0.02 0.10 0.06 0.00 -0.01 0.00 0.00 57.00 57.16 3eat n GLN 221 Cb 0.77 -1.54 0.16 0.00 1.02 0.00 0.00 30.24 30.65 3eat n GLN 221 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 3eat h ARG 222 N 0.00 0.04 -0.66 -1.09 2.43 -1.61 0.17 114.38 113.67 3eat h ARG 222 Ca 0.00 -0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3eat h ARG 222 Cb 0.44 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 3eat h ARG 222 CO 0.00 0.03 0.41 0.78 -1.51 0.00 0.00 179.97 179.67 3eat h GLY 223 N 0.04 0.94 0.68 2.80 0.00 -1.82 -2.31 103.07 103.40 3eat h GLY 223 Ca 0.44 -0.37 -0.08 0.00 0.00 0.00 0.00 47.33 47.31 3eat h GLY 223 CO -0.79 0.36 -0.27 -2.09 0.00 0.00 0.00 176.54 173.76 3eat h GLU 224 N 0.90 0.33 -0.17 4.80 4.22 -1.27 -1.73 114.58 121.66 3eat h GLU 224 Ca 0.24 -0.24 0.05 0.00 0.08 0.00 0.00 59.36 59.48 3eat h GLU 224 Cb -0.05 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.17 3eat h GLU 224 CO -0.05 0.87 -0.43 1.25 -2.18 0.00 0.00 179.01 178.47 3eat h LEU 225 N -0.15 -1.36 -0.83 1.64 5.85 -1.08 -0.33 115.31 119.04 3eat h LEU 225 Ca -0.01 0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3eat h LEU 225 Cb 0.90 0.56 -0.04 0.00 0.37 0.00 0.00 40.66 42.45 3eat h LEU 225 CO 0.06 -0.42 0.40 -0.07 -0.34 0.00 0.00 178.44 178.07 3eat h LEU 226 N -0.47 1.09 -0.49 2.25 3.38 -1.42 -0.43 115.31 119.22 3eat h LEU 226 Ca 0.08 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 3eat h LEU 226 Cb 0.62 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 3eat h LEU 226 CO -0.42 0.92 -0.12 0.00 0.09 0.00 0.00 178.44 178.91 3eat h ALA 227 N 1.21 0.68 -0.12 1.53 0.00 -1.07 -1.72 119.26 119.78 3eat h ALA 227 Ca 0.29 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 3eat h ALA 227 Cb 0.12 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3eat h ALA 227 CO -0.04 0.59 -0.20 0.66 0.00 0.00 0.00 179.25 180.26 3eat h SER 228 N 0.81 0.38 -0.85 0.00 4.64 -0.75 -1.27 113.55 116.52 3eat h SER 228 Ca 0.13 -0.54 0.05 0.00 -0.47 0.00 0.00 61.79 60.96 3eat h SER 228 Cb 0.68 -0.11 -0.06 0.00 -0.31 0.00 0.00 62.40 62.60 3eat h SER 228 CO 0.05 0.85 0.53 -0.07 -0.87 0.00 0.00 176.83 177.32 3eat h LEU 229 N -0.07 0.85 -0.60 5.97 3.38 -1.12 -1.44 115.31 122.27 3eat h LEU 229 Ca 0.01 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.89 3eat h LEU 229 Cb 0.78 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3eat h LEU 229 CO 0.05 0.55 -0.03 0.03 0.09 0.00 0.00 178.44 179.13 3eat h ARG 230 N 0.99 1.07 -0.63 1.13 3.08 -1.28 -0.59 114.38 118.15 3eat h ARG 230 Ca 0.36 -0.36 0.01 0.00 0.07 0.00 0.00 59.98 60.06 3eat h ARG 230 Cb 0.12 -0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.05 3eat h ARG 230 CO -0.16 1.06 0.42 -0.09 -1.07 0.00 0.00 179.97 180.13 3eat h ARG 231 N 0.97 0.83 0.04 0.04 2.43 -0.73 -1.14 114.38 116.82 3eat h ARG 231 Ca 0.17 -0.05 -0.22 0.00 -0.81 0.00 0.00 59.98 59.06 3eat h ARG 231 Cb 0.59 -0.19 0.02 0.00 -0.42 0.00 0.00 29.97 29.98 3eat h ARG 231 CO 0.04 0.55 -0.90 0.00 -1.51 0.00 0.00 179.97 178.15 3eat h LEU 233 N 0.11 0.00 -1.96 0.00 3.38 -1.08 -3.08 115.31 112.67 3eat h LEU 233 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3eat h LEU 233 Cb 1.59 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.34 3eat h LEU 233 CO 0.17 0.69 0.00 -1.22 0.09 0.00 0.00 178.44 178.17 3eat n TYR 234 N -3.63 0.39 -2.18 1.13 4.01 -0.44 -4.17 117.16 112.28 3eat n TYR 234 Ca -0.01 -0.20 -0.40 0.00 -0.16 0.00 0.00 57.90 57.14 3eat n TYR 234 Cb 0.70 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.71 3eat n TYR 234 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3eat s HIS 235 N -1.61 3.06 0.53 -0.72 2.46 -1.07 -4.80 115.29 113.14 3eat s HIS 235 Ca 0.36 1.48 0.30 0.00 0.47 0.00 0.00 55.06 57.68 3eat s HIS 235 Cb 0.21 -3.57 1.45 0.00 -0.13 0.00 0.00 32.58 30.54 3eat s HIS 235 CO 0.30 -1.64 1.89 -1.35 -2.47 0.00 0.00 174.74 171.47 3eat h PRO 236 N 3.12 0.03 0.00 2.88 0.11 -1.90 0.11 132.00 136.35 3eat h PRO 236 Ca -0.49 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 3eat h PRO 236 Cb 1.23 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3eat h PRO 236 CO 0.64 0.02 -0.31 1.96 -0.21 0.00 0.00 178.00 180.10 3eat h GLN 237 N 0.03 0.00 -0.01 1.05 4.20 -1.92 -3.33 115.11 115.14 3eat h GLN 237 Ca 0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.14 3eat h GLN 237 Cb 1.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.44 3eat h GLN 237 CO -0.02 0.31 -0.12 0.00 -0.67 0.00 0.00 178.83 178.34 3eat n ALA 238 N -2.42 2.66 -3.06 3.87 0.00 0.25 -0.04 120.51 121.78 3eat n ALA 238 Ca -0.02 -0.47 -0.21 0.00 0.00 0.00 0.00 53.44 52.74 3eat n ALA 238 Cb 0.38 -0.31 -0.16 0.00 0.00 0.00 0.00 19.45 19.36 3eat n ALA 238 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3eat s HIS 239 N -1.08 1.07 -0.02 0.00 5.04 -0.44 -0.80 115.29 119.06 3eat s HIS 239 Ca 0.09 -0.28 0.01 0.00 -1.54 0.00 0.00 55.06 53.33 3eat s HIS 239 Cb 0.07 -0.76 0.01 0.00 0.04 0.00 0.00 32.58 31.94 3eat s HIS 239 CO 0.18 -0.12 -0.04 -0.47 -2.34 0.00 0.00 174.74 171.95 3eat s TYR 240 N 0.23 0.52 -0.16 3.88 5.04 0.22 -4.74 117.35 122.33 3eat s TYR 240 Ca -0.04 -0.10 -0.00 0.00 -2.44 0.00 0.00 57.07 54.48 3eat s TYR 240 Cb -0.10 -0.44 -0.00 0.00 0.35 0.00 0.00 41.96 41.77 3eat s TYR 240 CO 0.01 -0.09 -0.14 0.00 -1.34 0.00 0.00 175.55 173.99 3eat s ALA 241 N 0.46 2.54 -0.25 3.97 0.00 -1.26 0.01 121.76 127.23 3eat s ALA 241 Ca -0.05 -1.06 -0.10 0.00 0.00 0.00 0.00 51.96 50.75 3eat s ALA 241 Cb -0.09 -1.28 -0.05 0.00 0.00 0.00 0.00 23.12 21.71 3eat s ALA 241 CO -0.00 -0.07 0.15 -1.58 0.00 0.00 0.00 175.76 174.26 3eat s HIS 242 N 0.88 3.25 -0.58 0.00 2.46 0.84 -4.74 115.29 117.40 3eat s HIS 242 Ca -0.04 0.10 -0.22 0.00 0.47 0.00 0.00 55.06 55.37 3eat s HIS 242 Cb -0.15 -2.29 0.06 0.00 -0.13 0.00 0.00 32.58 30.07 3eat s HIS 242 CO -0.01 -0.06 0.85 0.50 -2.47 0.00 0.00 174.74 173.55 3eat s ARG 243 N 1.33 3.18 0.34 2.88 6.06 -1.26 -3.00 118.95 128.47 3eat s ARG 243 Ca 0.07 -0.71 -0.29 0.00 -2.50 0.00 0.00 55.73 52.30 3eat s ARG 243 Cb -0.15 -4.14 -0.12 0.00 0.06 0.00 0.00 34.95 30.60 3eat s ARG 243 CO 0.06 -1.54 1.44 0.91 -2.50 0.00 0.00 175.30 173.67 3eat n TRP 244 N 7.13 2.67 -4.21 5.12 7.02 -1.26 -5.04 117.44 128.87 3eat n TRP 244 Ca -0.03 0.44 -0.19 0.00 -1.02 0.00 0.00 57.50 56.70 3eat n TRP 244 Cb 0.46 -2.50 -0.12 0.00 -2.42 0.00 0.00 31.31 26.73 3eat n TRP 244 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3eat s ARG 245 N -1.58 0.91 0.01 -0.99 0.52 -1.26 -4.87 118.95 111.70 3eat s ARG 245 Ca 0.57 -1.06 -0.35 0.00 -0.52 0.00 0.00 55.73 54.37 3eat s ARG 245 Cb -0.52 -0.92 -0.14 0.00 0.52 0.00 0.00 34.95 33.89 3eat s ARG 245 CO 0.59 0.20 1.66 0.43 0.02 0.00 0.00 175.30 178.19 3eat n SER 246 N 1.04 2.87 0.00 0.23 7.64 -1.26 -1.18 113.62 122.97 3eat n SER 246 Ca -0.19 1.05 0.00 0.00 1.01 0.00 0.00 58.87 60.74 3eat n SER 246 Cb 0.55 -1.33 0.00 0.00 -1.01 0.00 0.00 64.21 62.41 3eat n SER 246 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3eat n ASP 247 N 4.54 -3.08 -4.72 6.43 8.00 0.13 -4.84 116.55 123.00 3eat n ASP 247 Ca 0.20 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.27 3eat n ASP 247 Cb 0.25 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.12 40.55 3eat n ASP 247 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3eat n ASP 248 N -0.10 3.37 -4.26 -2.24 8.00 -0.32 -4.64 116.55 116.36 3eat n ASP 248 Ca 0.00 1.16 -0.34 0.00 0.71 0.00 0.00 54.79 56.32 3eat n ASP 248 Cb 0.05 -1.53 -0.15 0.00 -0.02 0.00 0.00 41.12 39.47 3eat n ASP 248 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3eat s LEU 249 N -0.47 2.60 -0.06 0.64 2.96 -0.35 -1.14 118.68 122.85 3eat s LEU 249 Ca 0.64 -0.47 0.05 0.00 -0.22 0.00 0.00 54.13 54.13 3eat s LEU 249 Cb -0.55 -1.62 -0.01 0.00 0.50 0.00 0.00 46.19 44.50 3eat s LEU 249 CO 0.52 0.03 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.66 3eat s VAL 250 N 1.18 2.32 -0.14 1.68 1.01 -0.12 -0.06 120.40 126.27 3eat s VAL 250 Ca 0.02 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.03 3eat s VAL 250 Cb -0.14 -1.87 0.02 0.00 0.00 0.00 0.00 36.38 34.39 3eat s VAL 250 CO -0.04 0.57 -0.15 -0.63 0.00 0.00 0.00 175.10 174.85 3eat s ILE 251 N -0.19 1.58 -0.04 2.22 1.01 -0.61 -0.32 121.20 124.84 3eat s ILE 251 Ca -0.02 -0.65 0.06 0.00 0.00 0.00 0.00 60.65 60.04 3eat s ILE 251 Cb -0.13 -1.48 -0.02 0.00 0.01 0.00 0.00 42.46 40.84 3eat s ILE 251 CO 0.03 0.46 -0.21 0.00 0.00 0.00 0.00 174.94 175.23 3eat s ALA 252 N 1.38 2.38 -0.99 9.38 0.00 -0.12 -0.83 121.76 132.96 3eat s ALA 252 Ca 0.03 -1.05 -0.20 0.00 0.00 0.00 0.00 51.96 50.74 3eat s ALA 252 Cb -0.13 -0.76 0.10 0.00 0.00 0.00 0.00 23.12 22.33 3eat s ALA 252 CO -0.09 0.52 1.28 0.34 0.00 0.00 0.00 175.76 177.81 3eat s ASP 253 N -0.57 6.62 0.64 0.00 2.15 0.86 -1.40 116.67 124.97 3eat s ASP 253 Ca 0.08 -1.93 0.39 0.00 0.43 0.00 0.00 52.55 51.52 3eat s ASP 253 Cb -0.11 -2.46 2.18 0.00 -0.30 0.00 0.00 42.92 42.23 3eat s ASP 253 CO 0.00 -1.19 2.32 -1.13 -0.17 0.00 0.00 175.17 175.00 3eat h ASN 254 N 8.99 0.00 1.90 -0.34 -1.24 -0.88 -0.48 115.58 123.54 3eat h ASN 254 Ca 0.19 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.20 3eat h ASN 254 Cb 1.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.05 3eat h ASN 254 CO 1.24 0.00 0.00 -0.07 -1.29 0.00 0.00 177.43 177.31 3eat h LEU 255 N 0.00 0.00 0.00 0.34 3.38 -1.80 -3.37 115.31 113.86 3eat h LEU 255 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3eat h LEU 255 Cb 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 3eat h LEU 255 CO 0.00 0.00 -1.37 0.41 0.09 0.00 0.00 178.44 177.57 3eat n THR 256 N -2.98 0.37 -2.66 0.22 -1.04 -0.68 -4.87 114.28 102.63 3eat n THR 256 Ca 0.04 -0.16 -0.26 0.00 -2.04 0.00 0.00 64.05 61.63 3eat n THR 256 Cb 0.51 -0.76 0.02 0.00 -1.82 0.00 0.00 70.33 68.27 3eat n THR 256 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3eat s LEU 257 N -5.15 3.48 0.20 -4.42 1.43 -0.27 -3.12 118.68 110.83 3eat s LEU 257 Ca -0.07 0.64 0.10 0.00 -1.03 0.00 0.00 54.13 53.76 3eat s LEU 257 Cb 0.02 -3.51 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 3eat s LEU 257 CO 0.16 -0.81 -0.12 -0.76 0.23 0.00 0.00 176.35 175.05 3eat s LEU 258 N -4.78 2.85 0.15 1.79 1.43 -0.47 -4.78 118.68 114.87 3eat s LEU 258 Ca 0.50 -0.69 -0.01 0.00 -1.03 0.00 0.00 54.13 52.90 3eat s LEU 258 Cb -0.10 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.57 3eat s LEU 258 CO 0.43 0.09 0.05 -1.38 0.23 0.00 0.00 176.35 175.77 3eat s HIS 259 N -1.85 0.96 0.00 0.29 -3.43 0.34 -0.44 115.29 111.16 3eat s HIS 259 Ca 0.25 -1.21 0.00 0.00 -0.80 0.00 0.00 55.06 53.30 3eat s HIS 259 Cb -0.08 -0.53 0.00 0.00 -1.43 0.00 0.00 32.58 30.54 3eat s HIS 259 CO 0.15 -0.48 0.00 0.41 -2.00 0.00 0.00 174.74 172.82 3eat n GLY 260 N -0.14 1.74 3.34 -1.38 0.00 -0.21 -0.82 105.19 107.72 3eat n GLY 260 Ca -0.05 -0.36 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 3eat n GLY 260 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3eat s ARG 261 N 1.89 0.47 0.42 1.61 3.52 -0.11 -1.11 118.95 125.64 3eat s ARG 261 Ca 0.00 0.83 -0.25 0.00 -0.13 0.00 0.00 55.73 56.17 3eat s ARG 261 Cb 0.00 0.05 -0.08 0.00 -1.56 0.00 0.00 34.95 33.36 3eat s ARG 261 CO 0.00 -0.14 1.25 -2.00 -0.81 0.00 0.00 175.30 173.61 3eat s GLU 262 N 1.22 3.92 0.47 5.12 2.12 -0.10 -2.06 118.70 129.39 3eat s GLU 262 Ca -0.08 2.03 -0.24 0.00 0.36 0.00 0.00 54.97 57.05 3eat s GLU 262 Cb -0.07 -2.67 -0.08 0.00 0.26 0.00 0.00 34.13 31.57 3eat s GLU 262 CO -0.11 -0.49 1.35 0.00 -0.54 0.00 0.00 175.26 175.46 3eat n ALA 263 N -0.02 1.64 -2.59 6.30 0.00 -1.26 -2.88 120.51 121.70 3eat n ALA 263 Ca 0.05 0.21 -0.22 0.00 0.00 0.00 0.00 53.44 53.48 3eat n ALA 263 Cb 0.45 -2.34 -0.14 0.00 0.00 0.00 0.00 19.45 17.42 3eat n ALA 263 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 3eat s PHE 264 N -1.23 1.39 0.00 0.00 -0.71 -1.12 -2.32 117.98 113.98 3eat s PHE 264 Ca 0.64 -0.34 0.00 0.00 -1.04 0.00 0.00 56.93 56.19 3eat s PHE 264 Cb -0.46 -0.83 0.00 0.00 -1.21 0.00 0.00 43.02 40.52 3eat s PHE 264 CO 0.55 0.04 0.00 0.00 -1.34 0.00 0.00 175.22 174.47 3eat n ALA 265 N 1.99 0.00 -2.60 1.99 0.00 -1.26 -4.86 120.51 115.78 3eat n ALA 265 Ca -0.17 -0.12 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 3eat n ALA 265 Cb 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.91 3eat n ALA 265 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 3eat s HIS 266 N -0.84 3.20 0.27 0.00 5.65 -1.26 -5.05 115.29 117.26 3eat s HIS 266 Ca 0.00 -0.61 -0.29 0.00 0.25 0.00 0.00 55.06 54.42 3eat s HIS 266 Cb 0.00 -2.91 -0.09 0.00 -1.18 0.00 0.00 32.58 28.40 3eat s HIS 266 CO 0.00 -0.72 0.99 -0.98 -0.65 0.00 0.00 174.74 173.39 3eat s ARG 267 N 1.89 4.71 0.46 2.88 1.70 -1.26 -4.11 118.95 125.21 3eat s ARG 267 Ca 0.08 1.56 0.07 0.00 -0.47 0.00 0.00 55.73 56.97 3eat s ARG 267 Cb -0.20 -3.13 0.00 0.00 -0.57 0.00 0.00 34.95 31.05 3eat s ARG 267 CO 0.10 0.35 0.42 0.00 -1.08 0.00 0.00 175.30 175.10 3eat s ALA 268 N -1.27 4.21 0.10 7.88 0.00 -1.26 -0.23 121.76 131.18 3eat s ALA 268 Ca 0.44 -1.78 -0.31 0.00 0.00 0.00 0.00 51.96 50.31 3eat s ALA 268 Cb -0.26 -1.00 -0.08 0.00 0.00 0.00 0.00 23.12 21.78 3eat s ALA 268 CO 0.33 -0.33 1.38 -2.14 0.00 0.00 0.00 175.76 175.00 3eat s PRO 269 N -4.21 4.33 -0.04 0.00 0.02 -1.26 -4.34 135.00 129.49 3eat s PRO 269 Ca 0.47 2.04 -0.25 0.00 0.02 0.00 0.00 61.00 63.28 3eat s PRO 269 Cb -0.03 -3.28 0.05 0.00 0.02 0.00 0.00 34.50 31.26 3eat s PRO 269 CO 0.28 -0.43 0.55 -0.98 -0.33 0.00 0.00 177.00 176.08 3eat s ARG 270 N 1.21 0.92 -0.20 5.54 1.70 -0.92 -4.00 118.95 123.19 3eat s ARG 270 Ca 0.64 0.10 -0.00 0.00 -0.47 0.00 0.00 55.73 56.00 3eat s ARG 270 Cb -0.36 0.43 0.05 0.00 -0.57 0.00 0.00 34.95 34.50 3eat s ARG 270 CO 0.30 -0.28 -0.04 -1.58 -1.08 0.00 0.00 175.30 172.63 3eat s HIS 271 N -1.23 1.84 0.19 5.89 5.65 0.02 -0.03 115.29 127.63 3eat s HIS 271 Ca -0.12 -1.30 0.08 0.00 0.25 0.00 0.00 55.06 53.97 3eat s HIS 271 Cb -0.02 -1.36 -0.04 0.00 -1.18 0.00 0.00 32.58 29.98 3eat s HIS 271 CO 0.08 -0.68 -0.03 -0.51 -0.65 0.00 0.00 174.74 172.95 3eat s LEU 272 N 1.58 3.18 -0.05 8.88 1.43 0.60 -0.63 118.68 133.67 3eat s LEU 272 Ca -0.02 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 3eat s LEU 272 Cb -0.17 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.24 3eat s LEU 272 CO -0.07 0.08 -0.13 -0.13 0.23 0.00 0.00 176.35 176.33 3eat s ARG 273 N -3.03 1.60 -0.10 1.70 0.52 -0.21 0.04 118.95 119.47 3eat s ARG 273 Ca 0.27 -0.44 0.03 0.00 -0.52 0.00 0.00 55.73 55.07 3eat s ARG 273 Cb -0.09 -1.36 0.01 0.00 0.52 0.00 0.00 34.95 34.03 3eat s ARG 273 CO 0.18 0.09 -0.21 0.50 0.02 0.00 0.00 175.30 175.88 3eat s ARG 274 N 0.44 2.77 -0.01 3.54 3.52 -0.30 -0.65 118.95 128.26 3eat s ARG 274 Ca -0.10 -0.78 0.06 0.00 -0.13 0.00 0.00 55.73 54.78 3eat s ARG 274 Cb -0.14 -2.16 -0.03 0.00 -1.56 0.00 0.00 34.95 31.07 3eat s ARG 274 CO 0.03 0.10 -0.18 0.08 -0.81 0.00 0.00 175.30 174.51 3eat s VAL 275 N 0.54 2.72 -0.06 7.11 1.01 0.15 -1.13 120.40 130.74 3eat s VAL 275 Ca -0.15 -0.99 -0.04 0.00 0.00 0.00 0.00 61.98 60.79 3eat s VAL 275 Cb -0.17 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3eat s VAL 275 CO 0.05 0.49 0.15 -1.00 0.00 0.00 0.00 175.10 174.79 3eat s HIS 276 N -0.78 3.53 -0.08 5.22 3.76 -1.26 0.13 115.29 125.80 3eat s HIS 276 Ca 0.12 0.41 0.03 0.00 -0.15 0.00 0.00 55.06 55.48 3eat s HIS 276 Cb -0.10 -1.87 0.00 0.00 1.11 0.00 0.00 32.58 31.72 3eat s HIS 276 CO 0.02 0.67 -0.19 0.42 -0.85 0.00 0.00 174.74 174.81 3eat s ILE 277 N -1.16 1.69 0.61 0.60 -1.09 -0.48 -1.52 121.20 119.85 3eat s ILE 277 Ca 0.21 -0.81 -0.18 0.00 -2.23 0.00 0.00 60.65 57.64 3eat s ILE 277 Cb -0.12 -1.48 -0.02 0.00 -1.58 0.00 0.00 42.46 39.26 3eat s ILE 277 CO 0.11 0.48 1.19 -1.00 -1.23 0.00 0.00 174.94 174.49 3eat s HIS 278 N 0.43 2.38 1.16 3.97 3.76 0.51 -0.63 115.29 126.87 3eat s HIS 278 Ca -0.16 1.53 -0.13 0.00 -0.15 0.00 0.00 55.06 56.15 3eat s HIS 278 Cb -0.17 -3.44 0.28 0.00 1.11 0.00 0.00 32.58 30.35 3eat s HIS 278 CO 0.07 -2.19 1.00 0.00 -0.85 0.00 0.00 174.74 172.77 3eat n ALA 279 N -1.79 -2.80 -3.98 -1.40 0.00 -1.26 -4.48 120.51 104.80 3eat n ALA 279 Ca 0.13 -1.14 -0.31 0.00 0.00 0.00 0.00 53.44 52.12 3eat n ALA 279 Cb 0.50 -2.00 -0.14 0.00 0.00 0.00 0.00 19.45 17.80 3eat n ALA 279 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3eat s GLU 280 N -4.39 1.66 0.88 0.00 2.02 -1.26 -1.83 118.70 115.78 3eat s GLU 280 Ca 0.68 -2.07 -0.09 0.00 0.02 0.00 0.00 54.97 53.51 3eat s GLU 280 Cb -0.25 -3.27 0.19 0.00 0.10 0.00 0.00 34.13 30.90 3eat s GLU 280 CO 0.65 -1.00 1.20 -0.35 0.02 0.00 0.00 175.26 175.78 3eat n PRO 281 N 3.98 -0.76 -1.42 0.39 -0.04 -1.26 -5.08 135.00 130.81 3eat n PRO 281 Ca 0.04 -2.41 -0.48 0.00 -0.04 0.00 0.00 63.50 60.61 3eat n PRO 281 Cb 0.39 -1.06 -0.03 0.00 -0.04 0.00 0.00 33.50 32.77 3eat n PRO 281 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3eat n ALA 282 N -3.42 -2.64 -2.57 0.55 0.00 -0.76 -4.91 120.51 106.77 3eat n ALA 282 Ca -0.20 0.43 -0.40 0.00 0.00 0.00 0.00 53.44 53.28 3eat n ALA 282 Cb 0.59 -1.64 -0.10 0.00 0.00 0.00 0.00 19.45 18.30 3eat n ALA 282 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3eat s LEU 283 N 2.79 4.27 0.11 0.00 2.96 -1.26 -4.90 118.68 122.64 3eat s LEU 283 Ca 0.63 -0.11 -0.31 0.00 -0.22 0.00 0.00 54.13 54.12 3eat s LEU 283 Cb -0.90 -2.25 -0.08 0.00 0.50 0.00 0.00 46.19 43.46 3eat s LEU 283 CO 0.56 -0.21 1.38 -0.60 -1.32 0.00 0.00 176.35 176.17 3eat s ARG 284 N 1.89 4.33 -0.28 1.98 3.52 -1.26 -0.78 118.95 128.35 3eat s ARG 284 Ca 0.10 2.06 -0.28 0.00 -0.13 0.00 0.00 55.73 57.47 3eat s ARG 284 Cb -0.16 -3.25 -0.04 0.00 -1.56 0.00 0.00 34.95 29.93 3eat s ARG 284 CO 0.11 -0.43 2.11 1.21 -0.81 0.00 0.00 175.30 177.49 3eat s ASN 285 N 1.10 5.50 0.00 -2.12 3.84 -0.30 -4.80 114.94 118.17 3eat s ASN 285 Ca 0.64 1.63 0.22 0.00 0.21 0.00 0.00 52.86 55.57 3eat s ASN 285 Cb -0.36 -2.51 1.32 0.00 -0.55 0.00 0.00 41.25 39.14 3eat s ASN 285 CO 0.30 -1.96 1.71 -0.81 -2.79 0.00 0.00 177.10 173.55 3eat n PRO 286 N 8.70 0.74 0.00 0.43 -0.04 -1.26 -3.72 135.00 139.85 3eat n PRO 286 Ca 0.28 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.74 3eat n PRO 286 Cb 0.46 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 3eat n PRO 286 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3eat n HIS 287 N -0.97 0.00 -2.19 0.54 8.25 -1.26 -5.01 115.22 114.58 3eat n HIS 287 Ca 0.17 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.21 3eat n HIS 287 Cb 0.08 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.16 3eat n HIS 287 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3eat s LEU 288 N -2.16 4.40 -0.24 2.41 2.96 -1.24 -0.39 118.68 124.42 3eat s LEU 288 Ca 0.00 2.40 -0.29 0.00 -0.22 0.00 0.00 54.13 56.02 3eat s LEU 288 Cb 0.00 -3.60 0.01 0.00 0.50 0.00 0.00 46.19 43.09 3eat s LEU 288 CO 0.00 -0.58 1.10 -1.10 -1.32 0.00 0.00 176.35 174.44 3eat s GLN 289 N 0.26 4.20 -0.00 1.98 -1.52 -0.32 -4.88 119.66 119.38 3eat s GLN 289 Ca 0.59 1.35 0.12 0.00 -1.95 0.00 0.00 55.36 55.47 3eat s GLN 289 Cb -0.37 -3.69 -0.14 0.00 -0.22 0.00 0.00 33.01 28.59 3eat s GLN 289 CO 0.36 -0.72 0.44 0.54 -0.25 0.00 0.00 175.29 175.67 3eat n ARG 290 N 6.52 2.57 0.00 2.91 1.74 -1.26 -4.77 116.66 124.36 3eat n ARG 290 Ca 0.12 -0.02 0.15 0.00 -0.77 0.00 0.00 57.85 57.33 3eat n ARG 290 Cb 0.46 -1.10 0.88 0.00 -1.02 0.00 0.00 32.46 31.68 3eat n ARG 290 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86