#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 8a3h h VAL 5 N 0.00 0.75 -0.18 -3.33 2.07 -1.88 -0.60 116.25 113.08 8a3h h VAL 5 Ca 0.00 -0.44 -0.16 0.00 0.82 0.00 0.00 66.70 66.92 8a3h h VAL 5 Cb 0.00 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 8a3h h VAL 5 CO 0.00 0.09 -0.56 0.58 0.02 0.00 0.00 177.57 177.70 8a3h h VAL 6 N -0.63 1.32 -0.82 2.57 2.07 -1.75 -0.37 116.25 118.65 8a3h h VAL 6 Ca -0.04 -1.81 -0.03 0.00 0.82 0.00 0.00 66.70 65.64 8a3h h VAL 6 Cb 0.45 1.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 8a3h h VAL 6 CO 0.07 0.56 0.41 -0.08 0.02 0.00 0.00 177.57 178.55 8a3h h GLU 7 N 0.42 1.17 0.11 1.57 4.81 -1.81 0.23 114.58 121.08 8a3h h GLU 7 Ca 0.01 -0.16 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 8a3h h GLU 7 Cb 1.11 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 30.27 8a3h h GLU 7 CO 0.11 0.89 -0.05 1.49 -0.73 0.00 0.00 179.01 180.71 8a3h h GLU 8 N 1.15 -0.14 0.00 1.92 4.81 -0.90 -3.36 114.58 118.06 8a3h h GLU 8 Ca 0.28 0.01 -0.24 0.00 -0.13 0.00 0.00 59.36 59.28 8a3h h GLU 8 Cb 0.09 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.47 8a3h h GLU 8 CO -0.04 0.31 -1.35 0.45 -0.73 0.00 0.00 179.01 177.65 8a3h h HIS 9 N -0.68 0.00 0.00 0.92 3.86 -1.09 -3.47 115.15 114.69 8a3h h HIS 9 Ca -0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 8a3h h HIS 9 Cb 0.52 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.99 8a3h h HIS 9 CO 0.09 0.96 0.00 0.41 0.86 0.00 0.00 177.93 180.25 8a3h n GLY 10 N 1.45 2.80 3.65 2.45 0.00 0.80 -1.98 105.19 114.36 8a3h n GLY 10 Ca -0.09 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.18 8a3h n GLY 10 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 8a3h s GLN 11 N 0.00 4.12 0.36 1.61 2.00 -1.26 -4.81 119.66 121.68 8a3h s GLN 11 Ca 0.00 1.92 -0.13 0.00 -2.00 0.00 0.00 55.36 55.15 8a3h s GLN 11 Cb 0.00 -3.93 -0.08 0.00 0.80 0.00 0.00 33.01 29.80 8a3h s GLN 11 CO 0.00 -0.89 0.76 -0.51 -0.50 0.00 0.00 175.29 174.15 8a3h s LEU 12 N 4.10 3.95 0.31 3.68 1.43 -1.26 -2.15 118.68 128.74 8a3h s LEU 12 Ca 0.67 1.24 -0.15 0.00 -1.03 0.00 0.00 54.13 54.87 8a3h s LEU 12 Cb -0.28 -4.08 0.02 0.00 0.03 0.00 0.00 46.19 41.88 8a3h s LEU 12 CO 0.25 -0.30 0.63 -0.94 0.23 0.00 0.00 176.35 176.22 8a3h s SER 13 N -2.65 0.02 -0.18 2.29 1.04 -0.64 -4.64 113.70 108.94 8a3h s SER 13 Ca 0.53 -0.96 -0.06 0.00 0.48 0.00 0.00 55.95 55.94 8a3h s SER 13 Cb -0.10 0.71 -0.03 0.00 0.10 0.00 0.00 66.02 66.69 8a3h s SER 13 CO 0.23 -1.37 0.03 -0.63 0.98 0.00 0.00 173.24 172.48 8a3h s ILE 14 N -3.42 4.43 -0.09 -1.02 -1.09 -1.26 -0.98 121.20 117.77 8a3h s ILE 14 Ca 0.18 -0.16 -0.01 0.00 -2.23 0.00 0.00 60.65 58.44 8a3h s ILE 14 Cb -0.03 -2.99 0.03 0.00 -1.58 0.00 0.00 42.46 37.88 8a3h s ILE 14 CO 0.11 0.45 -0.05 -0.55 -1.23 0.00 0.00 174.94 173.67 8a3h s SER 15 N 0.53 1.86 -1.57 3.58 0.15 -0.36 -4.82 113.70 113.08 8a3h s SER 15 Ca 0.01 -0.21 -0.15 0.00 0.70 0.00 0.00 55.95 56.30 8a3h s SER 15 Cb -0.13 -0.67 0.10 0.00 -1.71 0.00 0.00 66.02 63.61 8a3h s SER 15 CO 0.02 -0.14 0.94 -3.20 1.20 0.00 0.00 173.24 172.06 8a3h n ASN 16 N 4.91 -4.45 0.00 5.45 5.15 -1.26 -1.56 115.26 123.50 8a3h n ASN 16 Ca -0.12 -0.83 0.00 0.00 -0.60 0.00 0.00 54.58 53.03 8a3h n ASN 16 Cb 0.50 -3.65 0.00 0.00 -0.53 0.00 0.00 39.78 36.10 8a3h n ASN 16 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 8a3h n GLY 17 N -1.64 0.61 3.30 8.20 0.00 -1.26 -5.00 105.19 109.41 8a3h n GLY 17 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 8a3h n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 8a3h s GLU 18 N -0.04 1.67 -0.01 1.61 0.41 -0.60 -4.01 118.70 117.72 8a3h s GLU 18 Ca 0.00 -1.02 -0.30 0.00 -0.41 0.00 0.00 54.97 53.24 8a3h s GLU 18 Cb 0.00 -1.80 -0.05 0.00 -1.78 0.00 0.00 34.13 30.51 8a3h s GLU 18 CO 0.00 0.47 1.31 -1.17 -0.49 0.00 0.00 175.26 175.37 8a3h s LEU 19 N -1.15 4.31 0.16 1.80 2.96 -1.26 -1.22 118.68 124.28 8a3h s LEU 19 Ca 0.10 2.00 0.03 0.00 -0.22 0.00 0.00 54.13 56.04 8a3h s LEU 19 Cb -0.09 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.99 8a3h s LEU 19 CO 0.02 -0.65 -0.05 0.68 -1.32 0.00 0.00 176.35 175.03 8a3h s VAL 20 N 2.18 0.97 0.20 1.68 -7.23 -0.15 -2.06 120.40 115.99 8a3h s VAL 20 Ca 0.60 -2.02 -0.01 0.00 -1.81 0.00 0.00 61.98 58.74 8a3h s VAL 20 Cb -0.29 -1.99 0.04 0.00 0.56 0.00 0.00 36.38 34.70 8a3h s VAL 20 CO 0.25 -0.62 0.27 -0.46 -0.31 0.00 0.00 175.10 174.24 8a3h n ASN 21 N -0.23 0.28 0.00 4.85 0.23 0.10 -1.63 115.26 118.87 8a3h n ASN 21 Ca -0.09 -1.26 0.11 0.00 -0.53 0.00 0.00 54.58 52.81 8a3h n ASN 21 Cb 0.62 -0.18 0.53 0.00 -2.08 0.00 0.00 39.78 38.66 8a3h n ASN 21 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 8a3h n GLU 22 N -1.52 0.25 0.00 -3.83 0.28 -0.84 -0.82 120.64 114.15 8a3h n GLU 22 Ca 0.04 0.09 0.12 0.00 -0.16 0.00 0.00 57.16 57.26 8a3h n GLU 22 Cb 0.15 -1.50 0.17 0.00 1.43 0.00 0.00 31.44 31.69 8a3h n GLU 22 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 8a3h n ARG 23 N -1.33 1.99 -0.79 3.44 1.74 -1.26 -4.97 116.66 115.48 8a3h n ARG 23 Ca 0.09 -1.56 0.00 0.00 -0.77 0.00 0.00 57.85 55.61 8a3h n ARG 23 Cb 0.19 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.16 8a3h n ARG 23 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 8a3h n GLY 24 N 1.33 0.60 3.80 -0.13 0.00 -0.00 -5.05 105.19 105.74 8a3h n GLY 24 Ca 0.14 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 8a3h n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 8a3h s GLU 25 N -0.30 4.27 0.39 1.61 2.02 -1.26 -4.76 118.70 120.66 8a3h s GLU 25 Ca 0.00 0.81 -0.27 0.00 0.02 0.00 0.00 54.97 55.53 8a3h s GLU 25 Cb 0.00 -3.25 -0.11 0.00 0.10 0.00 0.00 34.13 30.88 8a3h s GLU 25 CO 0.00 0.62 1.39 1.04 0.02 0.00 0.00 175.26 178.33 8a3h n GLN 26 N 1.74 2.33 -4.21 1.61 6.02 -1.26 -0.72 117.38 122.89 8a3h n GLN 26 Ca -0.09 0.82 -0.16 0.00 -0.01 0.00 0.00 57.00 57.55 8a3h n GLN 26 Cb 0.50 -2.52 -0.13 0.00 1.02 0.00 0.00 30.24 29.11 8a3h n GLN 26 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 8a3h s VAL 27 N -1.14 0.66 -0.15 5.09 0.11 -0.87 -4.81 120.40 119.29 8a3h s VAL 27 Ca 0.56 -0.69 0.01 0.00 -2.93 0.00 0.00 61.98 58.93 8a3h s VAL 27 Cb -0.50 -0.62 0.02 0.00 -1.53 0.00 0.00 36.38 33.75 8a3h s VAL 27 CO 0.61 -0.05 -0.15 -1.58 -3.33 0.00 0.00 175.10 170.61 8a3h s GLN 28 N -0.81 2.39 0.02 1.54 0.74 -1.26 -4.70 119.66 117.58 8a3h s GLN 28 Ca -0.01 -0.60 -0.16 0.00 0.05 0.00 0.00 55.36 54.64 8a3h s GLN 28 Cb -0.06 -2.15 -0.06 0.00 1.10 0.00 0.00 33.01 31.84 8a3h s GLN 28 CO 0.00 -0.22 0.46 -0.51 -0.55 0.00 0.00 175.29 174.48 8a3h s LEU 29 N 1.42 4.49 -0.03 3.68 1.43 -1.26 -4.99 118.68 123.42 8a3h s LEU 29 Ca 0.04 1.06 -0.00 0.00 -1.03 0.00 0.00 54.13 54.20 8a3h s LEU 29 Cb -0.13 -2.69 0.03 0.00 0.03 0.00 0.00 46.19 43.43 8a3h s LEU 29 CO -0.10 0.31 0.04 -0.54 0.23 0.00 0.00 176.35 176.28 8a3h s LYS 30 N -1.09 -0.03 0.00 1.70 1.02 -1.25 -0.75 119.74 119.34 8a3h s LYS 30 Ca 0.25 0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.47 8a3h s LYS 30 Cb -0.18 -0.32 0.00 0.00 -0.52 0.00 0.00 37.83 36.81 8a3h s LYS 30 CO 0.15 -0.20 0.00 0.41 -0.92 0.00 0.00 175.35 174.79 8a3h n GLY 31 N 4.44 2.18 3.55 -3.33 0.00 -0.64 -2.02 105.19 109.37 8a3h n GLY 31 Ca -0.22 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.72 8a3h n GLY 31 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 8a3h s MET 32 N 0.28 2.27 -0.00 1.61 -1.94 -1.21 -1.51 119.30 118.80 8a3h s MET 32 Ca 0.00 -0.91 -0.10 0.00 -1.71 0.00 0.00 55.69 52.98 8a3h s MET 32 Cb 0.00 -2.35 -0.05 0.00 2.01 0.00 0.00 34.83 34.44 8a3h s MET 32 CO 0.00 0.55 0.32 0.45 -0.01 0.00 0.00 175.02 176.33 8a3h s SER 33 N -1.73 6.60 0.97 3.03 0.15 0.16 -0.96 113.70 121.92 8a3h s SER 33 Ca 0.18 0.72 -0.11 0.00 0.70 0.00 0.00 55.95 57.44 8a3h s SER 33 Cb -0.11 -2.15 0.17 0.00 -1.71 0.00 0.00 66.02 62.22 8a3h s SER 33 CO 0.09 0.28 1.10 -0.94 1.20 0.00 0.00 173.24 174.97 8a3h s SER 34 N -1.42 2.63 0.45 5.45 1.04 0.02 -0.73 113.70 121.14 8a3h s SER 34 Ca 0.25 1.83 0.00 0.00 0.48 0.00 0.00 55.95 58.52 8a3h s SER 34 Cb -0.14 -2.41 0.00 0.00 0.10 0.00 0.00 66.02 63.56 8a3h s SER 34 CO 0.14 -3.22 0.00 1.57 0.98 0.00 0.00 173.24 172.70 8a3h n HIS 35 N -4.29 -1.85 -1.84 5.02 -0.00 -1.25 -4.54 115.22 106.46 8a3h n HIS 35 Ca 0.08 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.84 8a3h n HIS 35 Cb 0.53 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.38 8a3h n HIS 35 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 8a3h s GLY 36 N -1.92 1.52 0.56 1.57 0.00 -1.26 -4.40 107.32 103.39 8a3h s GLY 36 Ca 0.00 1.48 0.36 0.00 0.00 0.00 0.00 44.72 46.56 8a3h s GLY 36 CO 0.00 2.70 2.08 1.41 0.00 0.00 0.00 173.10 179.29 8a3h h LEU 37 N 6.49 0.00 -0.07 0.66 3.38 -1.80 -0.80 115.31 123.17 8a3h h LEU 37 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 8a3h h LEU 37 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 8a3h h LEU 37 CO 0.91 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.44 8a3h n GLN 38 N -2.97 0.19 -0.03 1.13 0.00 -1.26 -3.19 117.38 111.24 8a3h n GLN 38 Ca -0.01 0.19 -0.05 0.00 0.00 0.00 0.00 57.00 57.13 8a3h n GLN 38 Cb 0.20 -1.73 -0.03 0.00 0.00 0.00 0.00 30.24 28.68 8a3h n GLN 38 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 8a3h n TRP 39 N -2.06 0.00 -2.34 2.61 8.01 -0.52 -4.85 117.44 118.30 8a3h n TRP 39 Ca 0.05 0.00 -0.06 0.00 -1.31 0.00 0.00 57.50 56.18 8a3h n TRP 39 Cb 0.38 -0.26 0.06 0.00 -2.01 0.00 0.00 31.31 29.48 8a3h n TRP 39 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 8a3h n TYR 40 N -2.80 1.34 0.32 -5.99 4.01 -0.42 -4.84 117.16 108.78 8a3h n TYR 40 Ca -0.12 -1.80 0.15 0.00 -0.16 0.00 0.00 57.90 55.97 8a3h n TYR 40 Cb 0.62 -0.25 0.67 0.00 -0.31 0.00 0.00 39.34 40.07 8a3h n TYR 40 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 8a3h h GLY 41 N 1.97 0.00 2.00 2.72 0.00 -1.71 -2.76 103.07 105.29 8a3h h GLY 41 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 8a3h h GLY 41 CO 0.33 0.00 -0.03 0.06 0.00 0.00 0.00 176.54 176.89 8a3h h GLN 42 N 0.00 0.00 -0.00 4.80 -0.00 -1.89 -1.53 115.11 116.49 8a3h h GLN 42 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 8a3h h GLN 42 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.81 8a3h h GLN 42 CO 0.00 0.03 -0.00 1.19 -0.00 0.00 0.00 178.83 180.05 8a3h n PHE 43 N -3.23 0.00 -3.82 0.06 3.72 -1.04 -4.67 117.46 108.47 8a3h n PHE 43 Ca -0.01 0.00 -0.36 0.00 -0.05 0.00 0.00 57.45 57.03 8a3h n PHE 43 Cb 0.20 -0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.61 8a3h n PHE 43 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 8a3h s VAL 44 N -2.01 3.18 0.13 -4.37 1.01 -0.58 -4.76 120.40 113.00 8a3h s VAL 44 Ca 0.45 -1.86 -0.25 0.00 0.00 0.00 0.00 61.98 60.32 8a3h s VAL 44 Cb 0.22 -3.08 0.07 0.00 0.00 0.00 0.00 36.38 33.58 8a3h s VAL 44 CO 0.36 -0.52 0.81 0.54 0.00 0.00 0.00 175.10 176.30 8a3h s ASN 45 N 1.61 -0.33 0.21 3.32 2.20 -1.26 -4.87 114.94 115.81 8a3h s ASN 45 Ca 0.05 -0.24 -0.10 0.00 -0.94 0.00 0.00 52.86 51.63 8a3h s ASN 45 Cb -0.22 0.53 0.28 0.00 -2.00 0.00 0.00 41.25 39.85 8a3h s ASN 45 CO -0.03 -0.92 1.72 0.22 -2.94 0.00 0.00 177.10 175.14 8a3h h TYR 46 N 2.00 0.25 -0.47 1.54 3.20 -1.95 -1.51 116.97 120.03 8a3h h TYR 46 Ca -0.25 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.59 8a3h h TYR 46 Cb 1.26 -0.02 -0.02 0.00 1.54 0.00 0.00 36.73 39.49 8a3h h TYR 46 CO 0.32 0.00 0.04 0.93 -1.64 0.00 0.00 178.16 177.81 8a3h h GLU 47 N 0.29 0.80 -0.45 1.82 4.39 -1.95 0.11 114.58 119.60 8a3h h GLU 47 Ca 0.31 -0.24 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 8a3h h GLU 47 Cb 0.44 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 8a3h h GLU 47 CO -0.37 0.84 -0.10 0.66 -1.16 0.00 0.00 179.01 178.87 8a3h h SER 48 N 0.66 0.80 -0.25 1.42 4.64 -1.52 -1.26 113.55 118.04 8a3h h SER 48 Ca 0.14 -0.24 -0.11 0.00 -0.47 0.00 0.00 61.79 61.10 8a3h h SER 48 Cb 0.45 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 8a3h h SER 48 CO 0.02 0.93 -0.22 -0.03 -0.87 0.00 0.00 176.83 176.66 8a3h h MET 49 N 0.74 0.72 -0.53 4.77 1.85 -1.11 -0.53 114.93 120.84 8a3h h MET 49 Ca 0.12 -0.29 -0.07 0.00 -0.61 0.00 0.00 59.70 58.86 8a3h h MET 49 Cb 0.60 -0.04 -0.02 0.00 0.43 0.00 0.00 31.60 32.57 8a3h h MET 49 CO 0.04 0.88 0.05 -0.22 -0.40 0.00 0.00 176.91 177.26 8a3h h LYS 50 N 0.63 0.91 -0.48 0.39 3.64 -0.56 0.01 116.57 121.11 8a3h h LYS 50 Ca 0.09 -0.27 -0.02 0.00 -1.27 0.00 0.00 60.65 59.19 8a3h h LYS 50 Cb 0.71 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 8a3h h LYS 50 CO 0.05 0.91 0.23 2.35 -2.27 0.00 0.00 179.45 180.73 8a3h h TRP 51 N 0.79 0.69 -0.69 1.91 2.91 -0.97 0.17 115.95 120.76 8a3h h TRP 51 Ca 0.16 -0.03 0.01 0.00 1.13 0.00 0.00 58.89 60.16 8a3h h TRP 51 Cb 0.46 -0.21 -0.04 0.00 -0.51 0.00 0.00 29.16 28.86 8a3h h TRP 51 CO 0.03 0.55 0.45 -0.07 -1.03 0.00 0.00 178.44 178.37 8a3h h LEU 52 N 0.64 0.77 -0.06 0.65 3.38 -0.90 0.20 115.31 119.98 8a3h h LEU 52 Ca 0.17 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.13 8a3h h LEU 52 Cb 0.11 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 8a3h h LEU 52 CO -0.02 0.55 0.02 -0.09 0.09 0.00 0.00 178.44 178.99 8a3h h ARG 53 N 0.91 0.05 0.20 1.13 2.43 -0.57 -1.15 114.38 117.38 8a3h h ARG 53 Ca 0.26 -0.00 -0.34 0.00 -0.81 0.00 0.00 59.98 59.09 8a3h h ARG 53 Cb -0.07 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 29.48 8a3h h ARG 53 CO -0.07 0.03 -1.63 -0.44 -1.51 0.00 0.00 179.97 176.35 8a3h h ASP 54 N 0.05 0.66 0.15 -3.80 3.32 -0.76 -2.24 116.42 113.80 8a3h h ASP 54 Ca 0.02 -0.87 -0.36 0.00 0.02 0.00 0.00 57.03 55.85 8a3h h ASP 54 Cb 0.01 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.31 8a3h h ASP 54 CO -0.02 1.71 -2.06 -0.67 -1.72 0.00 0.00 179.24 176.48 8a3h n ASP 55 N -3.61 1.84 0.03 6.45 2.03 0.68 -4.41 116.55 119.55 8a3h n ASP 55 Ca -0.21 0.17 0.04 0.00 0.52 0.00 0.00 54.79 55.31 8a3h n ASP 55 Cb 1.08 -0.60 -0.08 0.00 -0.72 0.00 0.00 41.12 40.81 8a3h n ASP 55 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 8a3h n TRP 56 N -3.35 0.78 -0.73 -0.67 7.02 -0.66 -4.92 117.44 114.90 8a3h n TRP 56 Ca -0.32 0.25 0.00 0.00 -1.02 0.00 0.00 57.50 56.41 8a3h n TRP 56 Cb 1.04 -0.97 0.00 0.00 -2.42 0.00 0.00 31.31 28.96 8a3h n TRP 56 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 8a3h n GLY 57 N 1.35 0.55 3.75 6.99 0.00 -0.53 -2.71 105.19 114.59 8a3h n GLY 57 Ca -0.08 -0.80 -0.37 0.00 0.00 0.00 0.00 46.02 44.77 8a3h n GLY 57 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 8a3h s ILE 58 N -2.00 2.33 0.00 -0.61 -4.36 -0.98 -4.93 121.20 110.65 8a3h s ILE 58 Ca 0.00 0.22 0.00 0.00 -0.26 0.00 0.00 60.65 60.61 8a3h s ILE 58 Cb 0.00 -3.10 0.00 0.00 1.25 0.00 0.00 42.46 40.61 8a3h s ILE 58 CO 0.00 -0.03 0.77 -0.46 0.24 0.00 0.00 174.94 175.46 8a3h n ASN 59 N -1.38 1.32 -3.67 4.36 0.23 -0.86 -4.54 115.26 110.72 8a3h n ASN 59 Ca 0.13 -1.59 -0.15 0.00 -0.53 0.00 0.00 54.58 52.44 8a3h n ASN 59 Cb 0.47 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 38.10 8a3h n ASN 59 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 8a3h s VAL 60 N -0.59 0.03 -0.03 3.53 0.11 -1.25 -1.80 120.40 120.41 8a3h s VAL 60 Ca 0.00 -0.22 0.02 0.00 -2.93 0.00 0.00 61.98 58.85 8a3h s VAL 60 Cb 0.00 -0.76 0.01 0.00 -1.53 0.00 0.00 36.38 34.09 8a3h s VAL 60 CO 0.00 -0.12 -0.08 0.12 -3.33 0.00 0.00 175.10 171.69 8a3h s PHE 61 N -0.99 0.85 -0.22 1.54 5.36 -0.65 -3.36 117.98 120.52 8a3h s PHE 61 Ca -0.10 -0.21 -0.06 0.00 -0.96 0.00 0.00 56.93 55.60 8a3h s PHE 61 Cb -0.03 -0.63 -0.02 0.00 -0.34 0.00 0.00 43.02 42.00 8a3h s PHE 61 CO 0.06 -0.10 0.01 0.50 -1.46 0.00 0.00 175.22 174.22 8a3h s ARG 62 N 0.29 3.60 -0.53 10.12 3.52 -0.14 -0.88 118.95 134.93 8a3h s ARG 62 Ca -0.04 -0.52 -0.18 0.00 -0.13 0.00 0.00 55.73 54.86 8a3h s ARG 62 Cb -0.09 -3.14 0.09 0.00 -1.56 0.00 0.00 34.95 30.25 8a3h s ARG 62 CO 0.00 -0.06 0.59 0.00 -0.81 0.00 0.00 175.30 175.02 8a3h s ALA 63 N 1.21 3.46 -0.88 6.12 0.00 -0.19 -0.80 121.76 130.68 8a3h s ALA 63 Ca 0.03 -2.08 -0.19 0.00 0.00 0.00 0.00 51.96 49.73 8a3h s ALA 63 Cb -0.15 -3.34 0.12 0.00 0.00 0.00 0.00 23.12 19.75 8a3h s ALA 63 CO 0.02 -2.07 1.08 0.00 0.00 0.00 0.00 175.76 174.79 8a3h s ALA 64 N 2.32 3.36 -0.88 0.00 0.00 -1.26 -1.81 121.76 123.49 8a3h s ALA 64 Ca 0.10 -2.65 -0.18 0.00 0.00 0.00 0.00 51.96 49.24 8a3h s ALA 64 Cb -0.23 -3.99 0.15 0.00 0.00 0.00 0.00 23.12 19.05 8a3h s ALA 64 CO 0.08 -2.91 1.01 1.41 0.00 0.00 0.00 175.76 175.35 8a3h s MET 65 N 2.78 3.56 0.34 0.00 1.75 -0.49 -2.28 119.30 124.96 8a3h s MET 65 Ca 0.30 -1.89 -0.27 0.00 -1.25 0.00 0.00 55.69 52.58 8a3h s MET 65 Cb -0.07 -4.74 -0.13 0.00 2.84 0.00 0.00 34.83 32.73 8a3h s MET 65 CO -0.06 -1.64 1.00 0.66 -0.65 0.00 0.00 175.02 174.33 8a3h n TYR 66 N 5.92 1.21 -0.09 4.11 4.02 -1.26 -0.94 117.16 130.13 8a3h n TYR 66 Ca 0.19 0.64 -0.19 0.00 -0.01 0.00 0.00 57.90 58.53 8a3h n TYR 66 Cb 0.48 -2.24 -0.12 0.00 -0.02 0.00 0.00 39.34 37.44 8a3h n TYR 66 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 8a3h h THR 67 N 1.83 1.20 -3.41 -0.72 1.35 -1.89 -0.03 112.91 111.25 8a3h h THR 67 Ca -0.42 -2.24 0.00 0.00 -0.55 0.00 0.00 66.41 63.21 8a3h h THR 67 Cb 1.34 2.61 0.00 0.00 -1.73 0.00 0.00 68.15 70.37 8a3h h THR 67 CO 0.59 0.42 0.00 -0.24 -0.25 0.00 0.00 175.52 176.04 8a3h n SER 68 N -4.48 0.04 -3.11 5.36 2.88 -1.26 -1.01 113.62 112.05 8a3h n SER 68 Ca -0.25 -0.41 -0.21 0.00 -1.33 0.00 0.00 58.87 56.67 8a3h n SER 68 Cb 0.62 0.00 0.06 0.00 -0.75 0.00 0.00 64.21 64.14 8a3h n SER 68 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 8a3h n SER 69 N -1.21 -5.94 0.00 -3.46 7.64 -1.26 -1.16 113.62 108.22 8a3h n SER 69 Ca 0.00 -0.40 0.00 0.00 1.01 0.00 0.00 58.87 59.48 8a3h n SER 69 Cb 0.00 -4.65 0.00 0.00 -1.01 0.00 0.00 64.21 58.55 8a3h n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 8a3h n GLY 70 N -1.71 0.66 0.00 0.23 0.00 -1.26 -5.03 105.19 98.08 8a3h n GLY 70 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 8a3h n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 8a3h n GLY 71 N -2.67 1.06 0.33 -0.02 0.00 -0.31 -4.47 105.19 99.11 8a3h n GLY 71 Ca 0.00 -1.54 0.02 0.00 0.00 0.00 0.00 46.02 44.50 8a3h n GLY 71 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 8a3h h TYR 72 N 0.00 1.01 -0.68 1.61 3.20 -0.75 0.65 116.97 122.01 8a3h h TYR 72 Ca 0.00 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 8a3h h TYR 72 Cb 0.00 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 37.92 8a3h h TYR 72 CO 0.00 0.48 0.24 0.82 -1.64 0.00 0.00 178.16 178.07 8a3h h ILE 73 N 0.97 1.25 -0.12 1.81 1.08 -1.34 -2.52 117.51 118.65 8a3h h ILE 73 Ca 0.40 -0.82 -0.21 0.00 -0.39 0.00 0.00 64.86 63.84 8a3h h ILE 73 Cb 0.24 0.50 0.00 0.00 -3.07 0.00 0.00 36.82 34.49 8a3h h ILE 73 CO -0.20 0.32 -0.76 0.44 -0.69 0.00 0.00 178.15 177.26 8a3h h ASP 74 N 0.98 0.73 -1.83 1.72 3.32 -1.50 -3.43 116.42 116.41 8a3h h ASP 74 Ca 0.22 -0.48 -0.24 0.00 0.02 0.00 0.00 57.03 56.55 8a3h h ASP 74 Cb 0.26 -0.22 -0.30 0.00 0.22 0.00 0.00 39.33 39.29 8a3h h ASP 74 CO -0.01 1.25 -0.57 -0.62 -1.72 0.00 0.00 179.24 177.57 8a3h s ASP 75 N -7.05 0.78 0.00 6.45 -1.08 0.14 -5.02 116.67 110.89 8a3h s ASP 75 Ca -0.08 -0.57 0.24 0.00 -0.52 0.00 0.00 52.55 51.62 8a3h s ASP 75 Cb 0.09 0.91 1.33 0.00 -1.46 0.00 0.00 42.92 43.79 8a3h s ASP 75 CO 0.88 -0.36 1.81 -0.81 0.52 0.00 0.00 175.17 177.21 8a3h n PRO 76 N 5.27 0.53 0.30 4.34 -0.04 -0.96 -3.40 135.00 141.04 8a3h n PRO 76 Ca 0.01 0.04 0.19 0.00 -0.04 0.00 0.00 63.50 63.69 8a3h n PRO 76 Cb 0.48 -1.50 1.00 0.00 -0.04 0.00 0.00 33.50 33.44 8a3h n PRO 76 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 8a3h h SER 77 N 0.00 0.00 0.26 3.54 4.64 -1.93 -1.03 113.55 119.02 8a3h h SER 77 Ca 0.00 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.32 8a3h h SER 77 Cb 0.13 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.22 8a3h h SER 77 CO 0.00 0.00 -0.02 1.62 -0.87 0.00 0.00 176.83 177.56 8a3h h VAL 78 N 0.00 0.18 -0.07 0.95 3.04 -1.93 -0.94 116.25 117.48 8a3h h VAL 78 Ca 0.02 -0.20 0.02 0.00 -1.01 0.00 0.00 66.70 65.53 8a3h h VAL 78 Cb 0.21 1.16 -0.00 0.00 -2.01 0.00 0.00 31.29 30.64 8a3h h VAL 78 CO -0.00 0.02 0.07 0.07 -1.01 0.00 0.00 177.57 176.72 8a3h h LYS 79 N 0.00 0.00 0.00 4.17 2.10 -1.49 -1.13 116.57 120.23 8a3h h LYS 79 Ca -0.00 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.57 8a3h h LYS 79 Cb 0.16 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.48 8a3h h LYS 79 CO 0.00 0.00 -0.39 0.93 -2.00 0.00 0.00 179.45 178.00 8a3h h GLU 80 N 0.00 0.00 -0.26 0.07 4.39 -1.38 -1.49 114.58 115.90 8a3h h GLU 80 Ca 0.03 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.58 8a3h h GLU 80 Cb 0.17 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.81 8a3h h GLU 80 CO -0.00 0.39 -0.46 -0.22 -1.16 0.00 0.00 179.01 177.56 8a3h h LYS 81 N 0.00 0.68 -0.35 2.33 1.63 -1.35 -0.86 116.57 118.66 8a3h h LYS 81 Ca -0.00 -0.38 0.03 0.00 -0.85 0.00 0.00 60.65 59.45 8a3h h LYS 81 Cb 0.85 0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 32.47 8a3h h LYS 81 CO 0.05 1.00 0.14 0.28 -3.45 0.00 0.00 179.45 177.47 8a3h h VAL 82 N 0.55 0.93 -0.65 2.00 2.07 -1.16 -1.20 116.25 118.79 8a3h h VAL 82 Ca 0.03 -0.10 0.04 0.00 0.82 0.00 0.00 66.70 67.49 8a3h h VAL 82 Cb 1.01 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 8a3h h VAL 82 CO 0.10 0.05 0.38 0.11 0.02 0.00 0.00 177.57 178.23 8a3h h LYS 83 N 0.30 0.71 -0.59 1.57 1.57 -1.09 -0.16 116.57 118.88 8a3h h LYS 83 Ca 0.15 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.95 8a3h h LYS 83 Cb 0.10 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.20 8a3h h LYS 83 CO -0.14 0.47 0.30 1.49 -0.57 0.00 0.00 179.45 180.99 8a3h h GLU 84 N 0.73 0.54 -0.45 3.15 4.81 -0.79 -0.18 114.58 122.38 8a3h h GLU 84 Ca 0.28 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.43 8a3h h GLU 84 Cb 0.10 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.34 8a3h h GLU 84 CO -0.14 0.35 0.13 0.00 -0.73 0.00 0.00 179.01 178.62 8a3h h ALA 85 N 1.33 0.59 -0.34 2.92 0.00 -0.53 -0.56 119.26 122.68 8a3h h ALA 85 Ca 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 8a3h h ALA 85 Cb 0.21 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 8a3h h ALA 85 CO -0.20 0.26 0.17 0.28 0.00 0.00 0.00 179.25 179.77 8a3h h VAL 86 N 0.60 1.15 -0.69 0.00 2.07 -0.73 -0.89 116.25 117.76 8a3h h VAL 86 Ca 0.14 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.20 8a3h h VAL 86 Cb 0.29 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 8a3h h VAL 86 CO -0.00 0.16 0.22 -0.33 0.02 0.00 0.00 177.57 177.63 8a3h h GLU 87 N 0.42 1.05 -0.58 1.57 5.08 -0.94 -0.46 114.58 120.72 8a3h h GLU 87 Ca 0.12 -0.21 -0.02 0.00 -1.00 0.00 0.00 59.36 58.24 8a3h h GLU 87 Cb 0.09 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 8a3h h GLU 87 CO -0.02 0.90 0.28 0.00 -1.00 0.00 0.00 179.01 179.17 8a3h h ALA 88 N 1.22 0.75 -0.78 3.43 0.00 -0.88 -0.68 119.26 122.32 8a3h h ALA 88 Ca 0.22 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 8a3h h ALA 88 Cb 0.28 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 8a3h h ALA 88 CO -0.01 0.31 0.41 0.00 0.00 0.00 0.00 179.25 179.96 8a3h h ALA 89 N 1.12 1.00 -0.29 0.00 0.00 -0.67 0.96 119.26 121.37 8a3h h ALA 89 Ca 0.20 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 54.99 8a3h h ALA 89 Cb 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 8a3h h ALA 89 CO -0.03 0.52 0.18 0.82 0.00 0.00 0.00 179.25 180.75 8a3h h ILE 90 N 1.08 1.05 -0.01 0.00 2.04 -0.83 0.33 117.51 121.16 8a3h h ILE 90 Ca 0.27 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.93 8a3h h ILE 90 Cb 0.06 0.66 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 8a3h h ILE 90 CO -0.04 0.07 -0.35 0.44 0.00 0.00 0.00 178.15 178.26 8a3h h ASP 91 N 0.36 0.03 0.20 1.72 3.32 -0.62 -2.74 116.42 118.69 8a3h h ASP 91 Ca 0.11 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.15 8a3h h ASP 91 Cb -0.02 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.52 8a3h h ASP 91 CO -0.04 0.38 -0.31 0.18 -1.72 0.00 0.00 179.24 177.73 8a3h n LEU 92 N -4.11 1.19 -3.31 1.55 4.77 0.29 -4.97 117.00 112.40 8a3h n LEU 92 Ca -0.02 -0.35 -0.19 0.00 -0.03 0.00 0.00 56.01 55.43 8a3h n LEU 92 Cb 0.40 -0.10 0.08 0.00 -2.33 0.00 0.00 43.42 41.46 8a3h n LEU 92 CO 0.39 0.22 0.17 -0.67 -1.33 0.00 0.00 177.39 176.17 8a3h n ASP 93 N -0.56 -4.03 -4.47 -1.43 2.03 0.00 -4.59 116.55 103.50 8a3h n ASP 93 Ca 0.11 -0.54 -0.23 0.00 0.52 0.00 0.00 54.79 54.66 8a3h n ASP 93 Cb 0.37 -4.75 -0.10 0.00 -0.72 0.00 0.00 41.12 35.91 8a3h n ASP 93 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 8a3h s ILE 94 N -3.32 1.70 0.58 5.18 -4.36 -0.59 -1.99 121.20 118.41 8a3h s ILE 94 Ca 0.27 -2.10 -0.09 0.00 -0.26 0.00 0.00 60.65 58.47 8a3h s ILE 94 Cb -0.12 -2.60 -0.03 0.00 1.25 0.00 0.00 42.46 40.96 8a3h s ILE 94 CO 0.68 -0.20 0.95 -0.31 0.24 0.00 0.00 174.94 176.29 8a3h s TYR 95 N -2.96 3.58 -0.06 1.37 2.02 -0.74 -4.40 117.35 116.15 8a3h s TYR 95 Ca 0.32 1.10 -0.04 0.00 -0.37 0.00 0.00 57.07 58.07 8a3h s TYR 95 Cb 0.05 -2.61 0.03 0.00 -0.40 0.00 0.00 41.96 39.03 8a3h s TYR 95 CO 0.14 -0.59 0.15 0.54 -1.57 0.00 0.00 175.55 174.21 8a3h s VAL 96 N -3.04 -0.03 -0.23 0.71 0.11 -0.15 -1.64 120.40 116.13 8a3h s VAL 96 Ca 0.53 0.09 -0.08 0.00 -2.93 0.00 0.00 61.98 59.59 8a3h s VAL 96 Cb -0.11 -0.23 -0.04 0.00 -1.53 0.00 0.00 36.38 34.47 8a3h s VAL 96 CO 0.51 0.04 0.09 -0.63 -3.33 0.00 0.00 175.10 171.78 8a3h s ILE 97 N 0.66 4.72 -0.52 7.04 1.01 -0.06 -0.87 121.20 133.18 8a3h s ILE 97 Ca -0.05 -0.04 -0.20 0.00 0.00 0.00 0.00 60.65 60.36 8a3h s ILE 97 Cb -0.06 -3.19 0.06 0.00 0.01 0.00 0.00 42.46 39.28 8a3h s ILE 97 CO -0.03 0.36 0.67 -0.63 0.00 0.00 0.00 174.94 175.31 8a3h s ILE 98 N 1.19 4.81 -0.33 2.92 1.01 -0.16 -1.02 121.20 129.61 8a3h s ILE 98 Ca 0.05 -0.42 -0.09 0.00 0.00 0.00 0.00 60.65 60.20 8a3h s ILE 98 Cb -0.14 -4.34 0.01 0.00 0.01 0.00 0.00 42.46 38.01 8a3h s ILE 98 CO 0.04 -0.86 0.14 -0.62 0.00 0.00 0.00 174.94 173.65 8a3h s ASP 99 N 2.74 5.47 -0.87 3.58 2.15 -0.75 -0.54 116.67 128.45 8a3h s ASP 99 Ca 0.17 -0.79 -0.25 0.00 0.43 0.00 0.00 52.55 52.11 8a3h s ASP 99 Cb -0.19 -1.96 0.03 0.00 -0.30 0.00 0.00 42.92 40.50 8a3h s ASP 99 CO 0.13 -0.27 1.47 0.86 -0.17 0.00 0.00 175.17 177.19 8a3h s TRP 100 N 1.54 2.30 -1.20 -5.34 -0.11 -0.40 -1.39 118.94 114.34 8a3h s TRP 100 Ca 0.03 -0.27 -0.10 0.00 1.22 0.00 0.00 56.10 56.97 8a3h s TRP 100 Cb -0.18 -4.56 0.21 0.00 -1.50 0.00 0.00 33.47 27.44 8a3h s TRP 100 CO 0.05 -2.00 1.51 1.58 -4.62 0.00 0.00 176.95 173.47 8a3h n HIS 101 N 9.89 4.08 -2.23 5.86 -0.00 -0.12 -1.41 115.22 131.30 8a3h n HIS 101 Ca 0.22 -3.19 -0.34 0.00 0.46 0.00 0.00 57.72 54.86 8a3h n HIS 101 Cb 0.50 -1.90 -0.00 0.00 -0.12 0.00 0.00 29.99 28.46 8a3h n HIS 101 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 8a3h s ILE 102 N 0.10 3.47 0.00 3.57 -4.36 -1.26 -2.95 121.20 119.77 8a3h s ILE 102 Ca 0.38 0.84 0.00 0.00 -0.26 0.00 0.00 60.65 61.61 8a3h s ILE 102 Cb 0.00 -3.32 0.00 0.00 1.25 0.00 0.00 42.46 40.39 8a3h s ILE 102 CO 0.00 -0.27 0.00 -0.11 0.24 0.00 0.00 174.94 174.80 8a3h n LEU 103 N -1.49 0.00 0.01 0.37 7.94 -1.26 -3.30 117.00 119.27 8a3h n LEU 103 Ca 0.10 0.00 -0.01 0.00 -1.11 0.00 0.00 56.01 54.99 8a3h n LEU 103 Cb 0.52 0.05 0.28 0.00 0.53 0.00 0.00 43.42 44.80 8a3h n LEU 103 CO 0.43 -0.05 0.88 0.77 -1.11 0.00 0.00 177.39 178.31 8a3h h SER 104 N 0.00 0.47 -0.80 1.96 4.64 -1.92 -3.14 113.55 114.75 8a3h h SER 104 Ca 0.00 -0.11 -0.64 0.00 -0.47 0.00 0.00 61.79 60.57 8a3h h SER 104 Cb 0.00 -0.12 -0.07 0.00 -0.31 0.00 0.00 62.40 61.89 8a3h h SER 104 CO 0.00 0.59 2.11 -0.90 -0.87 0.00 0.00 176.83 177.76 8a3h n ASP 105 N -4.24 4.72 0.20 4.97 5.75 -1.26 -4.82 116.55 121.86 8a3h n ASP 105 Ca 0.01 -2.89 0.12 0.00 -0.01 0.00 0.00 54.79 52.02 8a3h n ASP 105 Cb 0.29 -1.75 0.24 0.00 -1.03 0.00 0.00 41.12 38.87 8a3h n ASP 105 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 8a3h h ASN 106 N 7.77 0.00 -3.72 -1.12 -1.07 -1.85 -3.41 115.58 112.19 8a3h h ASN 106 Ca 0.43 0.00 -0.63 0.00 0.07 0.00 0.00 56.30 56.17 8a3h h ASN 106 Cb 0.87 0.00 -0.16 0.00 -2.07 0.00 0.00 38.32 36.96 8a3h h ASN 106 CO 1.44 0.00 -0.52 -0.62 0.07 0.00 0.00 177.43 177.81 8a3h s ASP 107 N -5.79 6.03 0.57 6.14 -1.08 -1.26 -1.55 116.67 119.73 8a3h s ASP 107 Ca 0.08 0.05 0.38 0.00 -0.52 0.00 0.00 52.55 52.53 8a3h s ASP 107 Cb 0.07 -2.10 1.95 0.00 -1.46 0.00 0.00 42.92 41.37 8a3h s ASP 107 CO 0.65 0.01 2.15 1.55 0.52 0.00 0.00 175.17 180.05 8a3h h PRO 108 N 7.89 0.00 0.00 4.34 0.13 -1.91 -1.69 132.00 140.76 8a3h h PRO 108 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 8a3h h PRO 108 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 8a3h h PRO 108 CO 0.61 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 177.47 8a3h h ASN 109 N 0.00 0.00 -0.58 1.44 2.35 -1.94 -3.21 115.58 113.65 8a3h h ASN 109 Ca 0.00 0.00 0.03 0.00 -0.55 0.00 0.00 56.30 55.78 8a3h h ASN 109 Cb 0.12 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 8a3h h ASN 109 CO 0.00 0.00 0.34 0.40 -1.65 0.00 0.00 177.43 176.52 8a3h h ILE 110 N 0.00 1.05 -0.46 2.81 2.04 -1.67 -2.79 117.51 118.49 8a3h h ILE 110 Ca 0.00 -0.23 -0.29 0.00 1.00 0.00 0.00 64.86 65.34 8a3h h ILE 110 Cb 0.40 0.32 -0.19 0.00 -0.74 0.00 0.00 36.82 36.61 8a3h h ILE 110 CO 0.00 0.12 -0.22 -1.22 0.00 0.00 0.00 178.15 176.84 8a3h n TYR 111 N -4.76 1.53 -0.18 1.37 4.01 -1.23 -4.80 117.16 113.10 8a3h n TYR 111 Ca 0.05 -1.87 -0.02 0.00 -0.16 0.00 0.00 57.90 55.90 8a3h n TYR 111 Cb 0.09 -0.52 0.20 0.00 -0.31 0.00 0.00 39.34 38.79 8a3h n TYR 111 CO 0.00 0.00 0.00 -0.22 -0.46 0.00 0.00 176.86 176.18 8a3h h LYS 112 N 1.36 0.92 -0.35 -0.72 3.64 -1.49 0.42 116.57 120.34 8a3h h LYS 112 Ca 0.27 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.49 8a3h h LYS 112 Cb 1.48 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 33.11 8a3h h LYS 112 CO 0.54 0.74 0.16 0.93 -2.27 0.00 0.00 179.45 179.55 8a3h h GLU 113 N 0.91 0.51 -0.71 1.90 4.39 -1.87 -0.40 114.58 119.32 8a3h h GLU 113 Ca 0.22 -0.08 -0.05 0.00 0.34 0.00 0.00 59.36 59.79 8a3h h GLU 113 Cb 0.15 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.68 8a3h h GLU 113 CO -0.02 0.47 0.26 0.93 -1.16 0.00 0.00 179.01 179.49 8a3h h GLU 114 N 0.43 1.07 -0.46 2.33 3.07 -1.84 -2.03 114.58 117.15 8a3h h GLU 114 Ca 0.12 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.36 58.77 8a3h h GLU 114 Cb 0.14 -0.17 -0.02 0.00 -0.84 0.00 0.00 28.75 27.85 8a3h h GLU 114 CO -0.01 0.88 0.26 0.00 -1.40 0.00 0.00 179.01 178.74 8a3h h ALA 115 N 1.24 0.59 -0.42 3.43 0.00 -0.58 -0.19 119.26 123.33 8a3h h ALA 115 Ca 0.24 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.07 8a3h h ALA 115 Cb 0.23 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 8a3h h ALA 115 CO -0.02 0.11 0.27 0.87 0.00 0.00 0.00 179.25 180.49 8a3h h LYS 116 N 0.61 0.54 -0.70 0.00 1.57 -0.88 0.58 116.57 118.29 8a3h h LYS 116 Ca 0.16 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 8a3h h LYS 116 Cb 0.05 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 8a3h h LYS 116 CO -0.03 0.36 0.15 -0.44 -0.57 0.00 0.00 179.45 178.92 8a3h h ASP 117 N 0.56 1.07 -0.17 0.86 3.32 -1.17 0.08 116.42 120.97 8a3h h ASP 117 Ca 0.16 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.96 8a3h h ASP 117 Cb -0.05 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 8a3h h ASP 117 CO -0.04 1.04 0.06 0.15 -1.72 0.00 0.00 179.24 178.73 8a3h h PHE 118 N 1.06 0.27 0.00 4.55 3.57 -0.76 -1.75 116.94 123.88 8a3h h PHE 118 Ca 0.22 -0.02 -0.10 0.00 3.53 0.00 0.00 57.97 61.59 8a3h h PHE 118 Cb 0.40 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 8a3h h PHE 118 CO 0.03 0.35 -0.50 0.74 -2.23 0.00 0.00 178.31 176.70 8a3h h PHE 119 N 0.11 0.00 -0.13 0.41 0.04 -0.80 -0.40 116.94 116.17 8a3h h PHE 119 Ca 0.06 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.84 8a3h h PHE 119 Cb 0.20 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.33 8a3h h PHE 119 CO -0.01 0.50 0.01 0.22 -0.60 0.00 0.00 178.31 178.43 8a3h h ASP 120 N 0.00 -0.03 -0.11 2.17 3.58 -0.84 -1.16 116.42 120.04 8a3h h ASP 120 Ca -0.00 0.02 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 8a3h h ASP 120 Cb 1.00 0.04 -0.01 0.00 1.72 0.00 0.00 39.33 42.08 8a3h h ASP 120 CO 0.06 0.01 0.06 -0.08 -2.88 0.00 0.00 179.24 176.42 8a3h h GLU 121 N 0.06 0.16 -0.56 0.28 4.81 -0.83 -0.38 114.58 118.11 8a3h h GLU 121 Ca 0.06 -0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 8a3h h GLU 121 Cb 0.06 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 8a3h h GLU 121 CO -0.09 0.17 0.02 0.52 -0.73 0.00 0.00 179.01 178.90 8a3h h MET 122 N 0.10 0.98 -0.03 1.92 2.86 -1.05 -1.34 114.93 118.37 8a3h h MET 122 Ca 0.04 -0.30 -0.13 0.00 -2.06 0.00 0.00 59.70 57.25 8a3h h MET 122 Cb 0.06 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.61 8a3h h MET 122 CO -0.01 0.97 -0.58 0.66 1.06 0.00 0.00 176.91 179.01 8a3h h SER 123 N 0.86 0.12 -0.49 1.22 4.64 -1.15 -0.64 113.55 118.12 8a3h h SER 123 Ca 0.16 -0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.34 8a3h h SER 123 Cb 0.51 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.55 8a3h h SER 123 CO 0.02 0.68 0.01 -0.08 -0.87 0.00 0.00 176.83 176.59 8a3h h GLU 124 N 0.08 0.86 -0.17 4.77 4.22 -0.83 0.12 114.58 123.62 8a3h h GLU 124 Ca -0.00 -0.27 -0.08 0.00 0.08 0.00 0.00 59.36 59.09 8a3h h GLU 124 Cb 1.05 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 30.22 8a3h h GLU 124 CO 0.08 0.89 -0.20 1.25 -2.18 0.00 0.00 179.01 178.85 8a3h h LEU 125 N 0.72 0.46 -1.96 1.64 5.85 -1.08 -3.38 115.31 117.56 8a3h h LEU 125 Ca 0.14 -0.50 0.00 0.00 0.84 0.00 0.00 57.88 58.37 8a3h h LEU 125 Cb 0.49 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.39 8a3h h LEU 125 CO 0.02 0.87 0.00 -1.22 -0.34 0.00 0.00 178.44 177.77 8a3h n TYR 126 N -4.48 0.06 0.35 1.25 4.01 -0.26 -4.73 117.16 113.36 8a3h n TYR 126 Ca -0.06 -0.23 0.10 0.00 -0.16 0.00 0.00 57.90 57.55 8a3h n TYR 126 Cb 0.40 -0.02 0.43 0.00 -0.31 0.00 0.00 39.34 39.84 8a3h n TYR 126 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 8a3h n GLY 127 N 0.00 -1.09 1.82 2.72 0.00 0.03 -1.79 105.19 106.89 8a3h n GLY 127 Ca 0.03 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 46.02 8a3h n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 8a3h n ASP 128 N -2.02 4.04 -4.50 1.61 2.03 -1.26 -4.75 116.55 111.69 8a3h n ASP 128 Ca 0.02 -3.42 -0.32 0.00 0.52 0.00 0.00 54.79 51.60 8a3h n ASP 128 Cb 0.17 -0.74 -0.12 0.00 -0.72 0.00 0.00 41.12 39.71 8a3h n ASP 128 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 8a3h s TYR 129 N -3.12 2.69 -1.51 -0.67 2.02 -0.74 -5.03 117.35 110.99 8a3h s TYR 129 Ca 0.53 -0.17 0.30 0.00 -0.37 0.00 0.00 57.07 57.35 8a3h s TYR 129 Cb 0.44 -1.54 1.38 0.00 -0.40 0.00 0.00 41.96 41.84 8a3h s TYR 129 CO 0.10 0.27 1.96 -0.35 -1.57 0.00 0.00 175.55 175.97 8a3h n PRO 130 N 1.70 0.53 0.18 -1.71 -0.04 -1.26 -3.89 135.00 130.51 8a3h n PRO 130 Ca -0.16 -0.09 0.05 0.00 -0.04 0.00 0.00 63.50 63.25 8a3h n PRO 130 Cb 0.52 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.82 8a3h n PRO 130 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 8a3h h ASN 131 N 0.23 0.00 -3.46 3.54 4.21 -1.89 -3.43 115.58 114.78 8a3h h ASN 131 Ca 0.00 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.97 8a3h h ASN 131 Cb 0.32 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.48 8a3h h ASN 131 CO 0.00 0.40 0.16 0.68 -1.29 0.00 0.00 177.43 177.38 8a3h s VAL 132 N -3.69 4.57 -0.08 2.81 -7.23 -1.25 -0.97 120.40 114.56 8a3h s VAL 132 Ca -0.01 1.65 0.02 0.00 -1.81 0.00 0.00 61.98 61.83 8a3h s VAL 132 Cb 0.12 -4.12 0.01 0.00 0.56 0.00 0.00 36.38 32.95 8a3h s VAL 132 CO 0.70 0.44 -0.13 -0.63 -0.31 0.00 0.00 175.10 175.17 8a3h s ILE 133 N -0.57 1.23 -0.23 -0.62 1.01 -0.05 -4.21 121.20 117.76 8a3h s ILE 133 Ca 0.37 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.40 8a3h s ILE 133 Cb -0.22 -1.13 -0.05 0.00 0.01 0.00 0.00 42.46 41.08 8a3h s ILE 133 CO 0.24 0.38 0.18 -0.31 0.00 0.00 0.00 174.94 175.43 8a3h s TYR 134 N 0.79 3.34 -0.40 3.97 2.02 -0.54 -0.99 117.35 125.54 8a3h s TYR 134 Ca -0.12 0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.86 8a3h s TYR 134 Cb -0.15 -2.27 0.11 0.00 -0.40 0.00 0.00 41.96 39.24 8a3h s TYR 134 CO 0.02 0.11 0.18 -2.00 -1.57 0.00 0.00 175.55 172.29 8a3h s GLU 135 N 0.92 1.89 0.12 -0.62 2.12 0.30 -0.20 118.70 123.24 8a3h s GLU 135 Ca 0.09 -1.87 0.27 0.00 0.36 0.00 0.00 54.97 53.81 8a3h s GLU 135 Cb -0.13 -3.49 0.89 0.00 0.26 0.00 0.00 34.13 31.65 8a3h s GLU 135 CO 0.03 -1.05 1.77 0.44 -0.54 0.00 0.00 175.26 175.91 8a3h n ILE 136 N 4.45 0.35 -3.11 -3.70 -5.35 -0.89 -1.27 119.36 109.83 8a3h n ILE 136 Ca -0.00 -0.18 0.03 0.00 -0.27 0.00 0.00 62.75 62.33 8a3h n ILE 136 Cb 0.41 -0.47 -0.00 0.00 -1.74 0.00 0.00 39.64 37.84 8a3h n ILE 136 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 8a3h s ALA 137 N -3.07 -3.08 0.00 -1.28 0.00 -1.25 -4.71 121.76 108.37 8a3h s ALA 137 Ca 0.11 0.96 -0.01 0.00 0.00 0.00 0.00 51.96 53.02 8a3h s ALA 137 Cb 0.15 -2.73 -0.00 0.00 0.00 0.00 0.00 23.12 20.54 8a3h s ALA 137 CO 0.59 -2.08 0.95 -1.71 0.00 0.00 0.00 175.76 173.51 8a3h n ASN 138 N 4.86 -0.03 -3.37 0.00 5.15 -0.50 -3.17 115.26 118.20 8a3h n ASN 138 Ca 0.08 0.96 -0.25 0.00 -0.60 0.00 0.00 54.58 54.76 8a3h n ASN 138 Cb 0.57 -0.46 -0.10 0.00 -0.53 0.00 0.00 39.78 39.26 8a3h n ASN 138 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 8a3h s GLU 139 N -3.08 0.77 0.38 1.20 2.02 -1.21 -4.60 118.70 114.19 8a3h s GLU 139 Ca -0.00 -1.67 -0.25 0.00 0.02 0.00 0.00 54.97 53.07 8a3h s GLU 139 Cb 0.00 -1.21 -0.12 0.00 0.10 0.00 0.00 34.13 32.91 8a3h s GLU 139 CO 0.02 -1.31 0.99 -2.30 0.02 0.00 0.00 175.26 172.68 8a3h n PRO 140 N 3.37 1.35 -3.66 0.39 -0.02 -1.26 -4.51 135.00 130.65 8a3h n PRO 140 Ca 0.22 0.48 -0.10 0.00 -2.02 0.00 0.00 63.50 62.08 8a3h n PRO 140 Cb 0.45 -1.97 -0.03 0.00 -0.02 0.00 0.00 33.50 31.94 8a3h n PRO 140 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 8a3h s ASN 141 N -0.68 -0.37 0.00 2.55 2.20 -0.59 -0.66 114.94 117.39 8a3h s ASN 141 Ca 0.61 -0.34 0.00 0.00 -0.94 0.00 0.00 52.86 52.19 8a3h s ASN 141 Cb -0.60 0.64 0.00 0.00 -2.00 0.00 0.00 41.25 39.28 8a3h s ASN 141 CO 0.58 -1.12 0.00 0.61 -2.94 0.00 0.00 177.10 174.23 8a3h n GLY 142 N -0.39 2.43 0.23 0.45 0.00 -1.26 -4.50 105.19 102.15 8a3h n GLY 142 Ca -0.11 -1.64 0.16 0.00 0.00 0.00 0.00 46.02 44.44 8a3h n GLY 142 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 8a3h h SER 143 N 0.00 0.00 -0.29 1.61 4.64 -2.01 -2.09 113.55 115.41 8a3h h SER 143 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 8a3h h SER 143 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 8a3h h SER 143 CO 0.00 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.06 8a3h n ASP 144 N -2.78 1.94 -4.04 4.97 5.75 -1.26 -4.71 116.55 116.42 8a3h n ASP 144 Ca 0.00 -1.87 -0.31 0.00 -0.01 0.00 0.00 54.79 52.59 8a3h n ASP 144 Cb 0.23 -0.19 -0.15 0.00 -1.03 0.00 0.00 41.12 39.98 8a3h n ASP 144 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 8a3h s VAL 145 N -1.62 2.21 0.25 2.12 1.01 -0.79 -4.95 120.40 118.64 8a3h s VAL 145 Ca 0.29 -2.00 0.10 0.00 0.00 0.00 0.00 61.98 60.36 8a3h s VAL 145 Cb 0.15 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 8a3h s VAL 145 CO 0.22 -0.33 -0.04 0.42 0.00 0.00 0.00 175.10 175.37 8a3h s THR 146 N 1.00 3.31 0.12 3.92 -4.23 -1.26 -4.68 115.64 113.81 8a3h s THR 146 Ca 0.02 -1.92 -0.27 0.00 -1.18 0.00 0.00 61.69 58.33 8a3h s THR 146 Cb -0.19 -2.75 -0.07 0.00 1.34 0.00 0.00 72.50 70.83 8a3h s THR 146 CO -0.07 -0.33 1.63 -0.25 -0.54 0.00 0.00 174.62 175.06 8a3h h TRP 147 N 2.09 -0.78 -0.15 3.99 2.91 -1.96 -0.53 115.95 121.52 8a3h h TRP 147 Ca -0.44 0.02 -0.14 0.00 1.13 0.00 0.00 58.89 59.46 8a3h h TRP 147 Cb 1.24 0.33 -0.01 0.00 -0.51 0.00 0.00 29.16 30.22 8a3h h TRP 147 CO 0.69 -0.39 -0.51 0.78 -1.03 0.00 0.00 178.44 177.98 8a3h h GLY 148 N -0.48 0.46 0.75 2.65 0.00 -1.96 0.11 103.07 104.61 8a3h h GLY 148 Ca 0.04 -0.51 -0.32 0.00 0.00 0.00 0.00 47.33 46.54 8a3h h GLY 148 CO -0.20 0.46 -1.88 0.70 0.00 0.00 0.00 176.54 175.62 8a3h n ASN 149 N -3.96 1.14 -0.01 0.19 3.02 -1.21 -4.55 115.26 109.88 8a3h n ASN 149 Ca -0.02 0.30 -0.04 0.00 -0.03 0.00 0.00 54.58 54.79 8a3h n ASN 149 Cb 0.57 -0.17 -0.01 0.00 -0.61 0.00 0.00 39.78 39.56 8a3h n ASN 149 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 8a3h n GLN 150 N -3.13 0.09 -0.04 3.52 3.00 -0.32 -4.75 117.38 115.74 8a3h n GLN 150 Ca -0.23 0.04 -0.15 0.00 -0.01 0.00 0.00 57.00 56.64 8a3h n GLN 150 Cb 1.06 -0.65 -0.13 0.00 0.00 0.00 0.00 30.24 30.52 8a3h n GLN 150 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 8a3h h ILE 151 N -0.15 1.68 -0.35 5.09 2.04 -1.09 -2.66 117.51 122.07 8a3h h ILE 151 Ca -0.08 -2.28 0.03 0.00 1.00 0.00 0.00 64.86 63.53 8a3h h ILE 151 Cb 0.88 3.21 -0.03 0.00 -0.74 0.00 0.00 36.82 40.14 8a3h h ILE 151 CO -0.05 0.61 0.15 0.50 0.00 0.00 0.00 178.15 179.36 8a3h h LYS 152 N -0.77 0.31 -0.62 2.37 3.64 -1.02 -0.41 116.57 120.07 8a3h h LYS 152 Ca -0.03 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 8a3h h LYS 152 Cb 1.12 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 8a3h h LYS 152 CO 0.04 0.20 0.22 -1.00 -2.27 0.00 0.00 179.45 176.64 8a3h h PRO 153 N 0.32 0.92 -0.22 1.90 0.13 -1.77 -0.42 132.00 132.86 8a3h h PRO 153 Ca 0.15 -0.16 0.03 0.00 -0.87 0.00 0.00 66.00 65.15 8a3h h PRO 153 Cb 0.09 -0.15 -0.03 0.00 0.13 0.00 0.00 31.00 31.04 8a3h h PRO 153 CO -0.13 0.78 0.02 -0.92 -0.23 0.00 0.00 178.00 177.52 8a3h h TYR 154 N 0.90 0.02 -0.62 1.56 3.20 -1.07 -2.32 116.97 118.64 8a3h h TYR 154 Ca 0.21 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 8a3h h TYR 154 Cb 0.22 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.48 8a3h h TYR 154 CO 0.02 -0.01 0.36 0.00 -1.64 0.00 0.00 178.16 176.88 8a3h h ALA 155 N 1.18 1.47 0.00 1.82 0.00 -0.53 -1.15 119.26 122.04 8a3h h ALA 155 Ca 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.93 8a3h h ALA 155 Cb 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.65 8a3h h ALA 155 CO -0.16 0.45 0.00 0.39 0.00 0.00 0.00 179.25 179.94 8a3h n GLU 156 N -4.40 0.36 -0.10 0.00 1.02 -0.22 -0.63 120.64 116.68 8a3h n GLU 156 Ca 0.06 0.07 -0.17 0.00 -0.02 0.00 0.00 57.16 57.10 8a3h n GLU 156 Cb 0.08 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.87 8a3h n GLU 156 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 8a3h n GLU 157 N -1.25 0.67 0.12 3.49 1.02 -0.55 -4.53 120.64 119.62 8a3h n GLU 157 Ca 0.11 0.15 -0.24 0.00 -0.02 0.00 0.00 57.16 57.17 8a3h n GLU 157 Cb 0.16 -1.56 -0.16 0.00 -0.02 0.00 0.00 31.44 29.86 8a3h n GLU 157 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 8a3h h VAL 158 N 0.01 1.34 -0.55 2.62 2.07 -0.97 -3.32 116.25 117.45 8a3h h VAL 158 Ca -0.54 -2.66 0.06 0.00 0.82 0.00 0.00 66.70 64.39 8a3h h VAL 158 Cb 1.98 3.09 -0.05 0.00 -1.52 0.00 0.00 31.29 34.78 8a3h h VAL 158 CO -0.03 0.79 0.25 0.40 0.02 0.00 0.00 177.57 179.00 8a3h h ILE 159 N 0.02 0.90 -0.74 4.57 2.04 -1.13 -1.95 117.51 121.21 8a3h h ILE 159 Ca -0.23 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.49 8a3h h ILE 159 Cb 2.04 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 8a3h h ILE 159 CO 0.25 0.09 0.49 -0.65 0.00 0.00 0.00 178.15 178.33 8a3h h PRO 160 N 0.48 0.90 -0.12 2.37 0.11 -1.79 0.74 132.00 134.70 8a3h h PRO 160 Ca 0.26 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 66.34 8a3h h PRO 160 Cb 0.22 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 31.10 8a3h h PRO 160 CO -0.21 0.60 -0.05 0.82 -0.21 0.00 0.00 178.00 178.95 8a3h h ILE 161 N 0.93 0.82 -0.32 4.15 1.08 -1.47 -1.56 117.51 121.14 8a3h h ILE 161 Ca 0.29 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.75 8a3h h ILE 161 Cb 0.01 0.82 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 8a3h h ILE 161 CO -0.08 0.00 0.18 0.40 -0.69 0.00 0.00 178.15 177.96 8a3h h ILE 162 N -0.04 1.13 0.00 -0.67 2.04 -0.87 -3.11 117.51 115.98 8a3h h ILE 162 Ca 0.06 -0.34 -0.02 0.00 1.00 0.00 0.00 64.86 65.57 8a3h h ILE 162 Cb 0.14 0.78 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 8a3h h ILE 162 CO -0.14 0.13 -0.08 0.03 0.00 0.00 0.00 178.15 178.08 8a3h h ARG 163 N 0.39 0.00 0.00 2.37 2.47 -0.65 0.14 114.38 119.11 8a3h h ARG 163 Ca 0.11 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.80 8a3h h ARG 163 Cb 0.05 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 8a3h h ARG 163 CO -0.02 0.08 -0.14 -0.97 0.56 0.00 0.00 179.97 179.48 8a3h h ASN 164 N 0.00 0.00 0.00 7.04 -1.24 -1.21 -3.24 115.58 116.93 8a3h h ASN 164 Ca -0.00 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.92 8a3h h ASN 164 Cb 0.38 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.41 8a3h h ASN 164 CO 0.01 0.14 -1.62 0.59 -1.29 0.00 0.00 177.43 175.26 8a3h n ASN 165 N -3.62 2.35 -3.37 1.15 3.02 -0.25 -4.95 115.26 109.58 8a3h n ASN 165 Ca -0.01 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.38 8a3h n ASN 165 Cb 0.27 1.20 -0.08 0.00 -0.61 0.00 0.00 39.78 40.56 8a3h n ASN 165 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 8a3h s ASP 166 N -3.76 1.26 0.42 6.41 -1.08 0.33 -4.75 116.67 115.50 8a3h s ASP 166 Ca -0.05 -0.86 0.29 0.00 -0.52 0.00 0.00 52.55 51.42 8a3h s ASP 166 Cb 0.06 0.66 1.18 0.00 -1.46 0.00 0.00 42.92 43.36 8a3h s ASP 166 CO 0.46 -0.35 1.86 -0.65 0.52 0.00 0.00 175.17 177.01 8a3h h PRO 167 N 7.97 0.00 0.00 4.34 0.11 -1.82 -3.33 132.00 139.27 8a3h h PRO 167 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 8a3h h PRO 167 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 8a3h h PRO 167 CO 0.29 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.35 8a3h n ASN 168 N -2.71 0.00 -4.72 -2.05 0.23 -1.26 -4.96 115.26 99.79 8a3h n ASN 168 Ca 0.01 -1.00 -0.33 0.00 -0.53 0.00 0.00 54.58 52.74 8a3h n ASN 168 Cb 0.28 0.00 0.11 0.00 -2.08 0.00 0.00 39.78 38.09 8a3h n ASN 168 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 8a3h s ASN 169 N 0.00 3.93 0.37 0.53 0.01 -1.26 -4.86 114.94 113.65 8a3h s ASN 169 Ca 0.00 2.22 -0.28 0.00 -0.71 0.00 0.00 52.86 54.09 8a3h s ASN 169 Cb 0.00 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 38.99 8a3h s ASN 169 CO 0.00 -2.43 1.38 -0.63 -1.51 0.00 0.00 177.10 173.91 8a3h s ILE 170 N -2.31 2.40 -0.14 0.60 -1.09 -1.26 -4.91 121.20 114.49 8a3h s ILE 170 Ca 0.70 0.39 0.03 0.00 -2.23 0.00 0.00 60.65 59.54 8a3h s ILE 170 Cb -0.25 -3.25 0.01 0.00 -1.58 0.00 0.00 42.46 37.39 8a3h s ILE 170 CO 0.50 0.09 -0.22 -0.63 -1.23 0.00 0.00 174.94 173.45 8a3h s ILE 171 N -1.16 2.03 -0.22 2.92 1.01 -0.84 -1.47 121.20 123.47 8a3h s ILE 171 Ca 0.53 -0.97 -0.11 0.00 0.00 0.00 0.00 60.65 60.10 8a3h s ILE 171 Cb -0.42 -1.79 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 8a3h s ILE 171 CO 0.56 0.55 0.17 -0.63 0.00 0.00 0.00 174.94 175.59 8a3h s ILE 172 N 0.79 5.37 -0.17 2.92 1.01 0.72 -0.82 121.20 131.04 8a3h s ILE 172 Ca -0.08 0.23 -0.01 0.00 0.00 0.00 0.00 60.65 60.80 8a3h s ILE 172 Cb -0.16 -3.51 -0.01 0.00 0.01 0.00 0.00 42.46 38.80 8a3h s ILE 172 CO -0.01 0.38 -0.12 -0.69 0.00 0.00 0.00 174.94 174.50 8a3h s VAL 173 N 0.74 2.95 0.83 2.92 1.01 0.28 -2.10 120.40 127.02 8a3h s VAL 173 Ca 0.09 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.28 8a3h s VAL 173 Cb -0.12 -2.27 0.09 0.00 0.00 0.00 0.00 36.38 34.08 8a3h s VAL 173 CO 0.02 0.50 1.16 -0.83 0.00 0.00 0.00 175.10 175.95 8a3h s GLY 174 N 0.87 1.94 0.40 4.51 0.00 -1.19 -1.01 107.32 112.84 8a3h s GLY 174 Ca -0.03 0.66 0.06 0.00 0.00 0.00 0.00 44.72 45.41 8a3h s GLY 174 CO -0.00 1.07 0.02 -0.51 0.00 0.00 0.00 173.10 173.68 8a3h s THR 175 N -2.43 1.72 0.98 0.90 -4.23 -1.26 -4.79 115.64 106.53 8a3h s THR 175 Ca 0.69 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 59.08 8a3h s THR 175 Cb -0.24 -2.86 0.18 0.00 1.34 0.00 0.00 72.50 70.92 8a3h s THR 175 CO 0.53 0.00 1.08 -0.83 -0.54 0.00 0.00 174.62 174.86 8a3h s GLY 176 N -3.68 1.59 -1.20 3.99 0.00 -1.26 -1.19 107.32 105.57 8a3h s GLY 176 Ca 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 44.72 44.85 8a3h s GLY 176 CO 0.16 0.41 0.89 2.41 0.00 0.00 0.00 173.10 176.97 8a3h n THR 177 N -4.18 -6.18 -3.30 0.90 -1.04 -1.21 -1.16 114.28 98.11 8a3h n THR 177 Ca 0.06 -0.69 -0.17 0.00 -2.04 0.00 0.00 64.05 61.21 8a3h n THR 177 Cb 0.56 -4.92 0.07 0.00 -1.82 0.00 0.00 70.33 64.22 8a3h n THR 177 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 8a3h n TRP 178 N -4.00 -2.10 -3.82 -1.42 8.01 0.17 -2.77 117.44 111.49 8a3h n TRP 178 Ca -0.24 0.81 -0.26 0.00 -1.31 0.00 0.00 57.50 56.50 8a3h n TRP 178 Cb 0.66 -4.44 0.03 0.00 -2.01 0.00 0.00 31.31 25.54 8a3h n TRP 178 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.69 177.11 8a3h n SER 179 N -2.49 -3.03 -0.01 -0.99 7.64 -0.33 -4.59 113.62 109.82 8a3h n SER 179 Ca -0.11 -0.81 0.02 0.00 1.01 0.00 0.00 58.87 58.98 8a3h n SER 179 Cb 0.59 -3.92 -0.05 0.00 -1.01 0.00 0.00 64.21 59.82 8a3h n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 8a3h n GLN 180 N -4.50 0.91 -2.16 1.43 6.02 -0.59 -0.92 117.38 117.57 8a3h n GLN 180 Ca -0.12 -0.05 -0.42 0.00 -0.01 0.00 0.00 57.00 56.40 8a3h n GLN 180 Cb 0.60 -1.17 0.00 0.00 1.02 0.00 0.00 30.24 30.69 8a3h n GLN 180 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 8a3h n ASP 181 N -1.88 5.69 0.24 1.08 2.03 -0.31 -4.62 116.55 118.79 8a3h n ASP 181 Ca -0.04 -3.07 0.13 0.00 0.52 0.00 0.00 54.79 52.33 8a3h n ASP 181 Cb 0.32 -1.48 0.46 0.00 -0.72 0.00 0.00 41.12 39.70 8a3h n ASP 181 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 8a3h h VAL 182 N 3.51 0.25 -0.21 5.18 -1.51 -1.87 -3.25 116.25 118.34 8a3h h VAL 182 Ca 0.49 -0.94 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 8a3h h VAL 182 Cb 0.55 1.76 -0.01 0.00 -2.13 0.00 0.00 31.29 31.46 8a3h h VAL 182 CO 1.64 0.11 0.13 -0.74 -1.23 0.00 0.00 177.57 177.48 8a3h h HIS 183 N 0.00 0.28 -0.60 5.19 -0.00 -1.83 0.00 115.15 118.19 8a3h h HIS 183 Ca -0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.27 8a3h h HIS 183 Cb 0.75 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 28.05 8a3h h HIS 183 CO 0.00 0.20 -0.02 0.45 -0.00 0.00 0.00 177.93 178.56 8a3h h HIS 184 N 0.27 1.18 -0.62 5.26 3.86 -1.97 -2.33 115.15 120.80 8a3h h HIS 184 Ca 0.08 -0.21 -0.02 0.00 -1.16 0.00 0.00 60.37 59.05 8a3h h HIS 184 Cb -0.00 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.14 8a3h h HIS 184 CO -0.05 1.04 0.30 0.00 0.86 0.00 0.00 177.93 180.07 8a3h h ALA 185 N 0.99 0.80 0.00 2.45 0.00 -1.57 -2.79 119.26 119.14 8a3h h ALA 185 Ca 0.17 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 8a3h h ALA 185 Cb 0.58 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 8a3h h ALA 185 CO 0.03 0.36 -0.18 0.00 0.00 0.00 0.00 179.25 179.47 8a3h h ALA 186 N 1.13 1.33 -0.00 0.00 0.00 -0.77 -1.42 119.26 119.53 8a3h h ALA 186 Ca 0.21 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.96 8a3h h ALA 186 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 8a3h h ALA 186 CO -0.03 0.23 -0.10 -0.25 0.00 0.00 0.00 179.25 179.10 8a3h n ASP 187 N -3.78 0.53 -2.96 0.00 8.00 -0.90 -4.34 116.55 113.10 8a3h n ASP 187 Ca -0.02 -0.68 -0.14 0.00 0.71 0.00 0.00 54.79 54.66 8a3h n ASP 187 Cb 0.28 -0.05 0.03 0.00 -0.02 0.00 0.00 41.12 41.36 8a3h n ASP 187 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 8a3h n ASN 188 N -0.86 -0.78 -4.79 -2.24 5.15 -0.56 -5.10 115.26 106.08 8a3h n ASN 188 Ca 0.15 -3.34 -0.33 0.00 -0.60 0.00 0.00 54.58 50.47 8a3h n ASN 188 Cb 0.27 0.64 0.03 0.00 -0.53 0.00 0.00 39.78 40.20 8a3h n ASN 188 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 8a3h s GLN 189 N -1.04 3.03 0.74 1.20 -0.21 -1.06 -4.86 119.66 117.45 8a3h s GLN 189 Ca 0.31 1.29 -0.11 0.00 0.02 0.00 0.00 55.36 56.87 8a3h s GLN 189 Cb 0.31 -1.99 0.04 0.00 1.00 0.00 0.00 33.01 32.37 8a3h s GLN 189 CO -0.07 -1.06 1.09 -0.51 -2.12 0.00 0.00 175.29 172.62 8a3h s LEU 190 N -4.74 3.12 0.15 2.90 1.43 -1.26 -5.00 118.68 115.28 8a3h s LEU 190 Ca 0.65 1.83 0.05 0.00 -1.03 0.00 0.00 54.13 55.64 8a3h s LEU 190 Cb -0.18 -4.52 -0.08 0.00 0.03 0.00 0.00 46.19 41.44 8a3h s LEU 190 CO 0.40 -1.88 1.34 0.00 0.23 0.00 0.00 176.35 176.45 8a3h h ALA 191 N -0.84 0.47 -2.76 4.21 0.00 -2.02 -3.46 119.26 114.86 8a3h h ALA 191 Ca -0.44 -0.81 -0.53 0.00 0.00 0.00 0.00 54.91 53.13 8a3h h ALA 191 Cb 1.23 -0.11 0.07 0.00 0.00 0.00 0.00 17.79 18.98 8a3h h ALA 191 CO 0.53 1.06 0.84 0.34 0.00 0.00 0.00 179.25 182.02 8a3h s ASP 192 N -6.83 6.50 0.02 0.00 -1.08 -1.26 -4.88 116.67 109.14 8a3h s ASP 192 Ca -0.01 2.81 0.26 0.00 -0.52 0.00 0.00 52.55 55.09 8a3h s ASP 192 Cb 0.10 -2.63 1.10 0.00 -1.46 0.00 0.00 42.92 40.03 8a3h s ASP 192 CO 0.82 -0.83 1.83 -0.81 0.52 0.00 0.00 175.17 176.71 8a3h n PRO 193 N 2.46 0.02 -1.57 4.34 -0.04 -1.26 -3.40 135.00 135.55 8a3h n PRO 193 Ca 0.08 0.06 -0.20 0.00 -0.04 0.00 0.00 63.50 63.41 8a3h n PRO 193 Cb 0.38 -1.53 0.08 0.00 -0.04 0.00 0.00 33.50 32.40 8a3h n PRO 193 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 8a3h n ASN 194 N -1.56 4.69 -4.91 3.54 3.02 -1.26 -4.36 115.26 114.42 8a3h n ASN 194 Ca 0.06 -3.78 -0.33 0.00 -0.03 0.00 0.00 54.58 50.50 8a3h n ASN 194 Cb 0.31 -0.52 -0.05 0.00 -0.61 0.00 0.00 39.78 38.92 8a3h n ASN 194 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 8a3h s VAL 195 N -4.29 5.40 0.15 2.41 0.11 -1.22 -1.99 120.40 120.98 8a3h s VAL 195 Ca 0.51 -0.17 0.07 0.00 -2.93 0.00 0.00 61.98 59.46 8a3h s VAL 195 Cb 0.42 -3.57 -0.04 0.00 -1.53 0.00 0.00 36.38 31.66 8a3h s VAL 195 CO 0.01 0.27 -0.14 -0.04 -3.33 0.00 0.00 175.10 171.87 8a3h s MET 196 N -2.08 1.14 -0.11 1.54 -1.94 0.00 -4.58 119.30 113.28 8a3h s MET 196 Ca 0.30 -1.38 -0.03 0.00 -1.71 0.00 0.00 55.69 52.87 8a3h s MET 196 Cb -0.13 -1.00 -0.03 0.00 2.01 0.00 0.00 34.83 35.68 8a3h s MET 196 CO 0.21 0.18 0.02 0.71 -0.01 0.00 0.00 175.02 176.13 8a3h s TYR 197 N -2.45 3.22 0.26 -0.03 2.02 0.10 -0.56 117.35 119.92 8a3h s TYR 197 Ca 0.14 0.19 -0.30 0.00 -0.37 0.00 0.00 57.07 56.73 8a3h s TYR 197 Cb -0.03 -1.86 -0.09 0.00 -0.40 0.00 0.00 41.96 39.58 8a3h s TYR 197 CO 0.04 0.43 1.06 0.00 -1.57 0.00 0.00 175.55 175.51 8a3h s ALA 198 N -0.66 3.39 -0.06 3.71 0.00 -0.18 -1.60 121.76 126.34 8a3h s ALA 198 Ca 0.11 0.82 0.02 0.00 0.00 0.00 0.00 51.96 52.90 8a3h s ALA 198 Cb -0.12 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.72 8a3h s ALA 198 CO 0.02 -0.06 -0.09 0.12 0.00 0.00 0.00 175.76 175.75 8a3h s PHE 199 N -1.09 1.23 0.06 0.00 5.36 -0.95 -4.26 117.98 118.33 8a3h s PHE 199 Ca 0.44 -0.44 0.09 0.00 -0.96 0.00 0.00 56.93 56.05 8a3h s PHE 199 Cb -0.30 -0.95 -0.03 0.00 -0.34 0.00 0.00 43.02 41.40 8a3h s PHE 199 CO 0.38 -0.27 -0.24 -1.01 -1.46 0.00 0.00 175.22 172.62 8a3h s HIS 200 N 0.83 2.13 0.05 10.12 3.76 -0.10 -3.69 115.29 128.39 8a3h s HIS 200 Ca -0.12 -0.40 -0.04 0.00 -0.15 0.00 0.00 55.06 54.35 8a3h s HIS 200 Cb -0.15 -1.25 -0.02 0.00 1.11 0.00 0.00 32.58 32.27 8a3h s HIS 200 CO 0.02 0.15 0.07 -0.59 -0.85 0.00 0.00 174.74 173.53 8a3h s PHE 201 N -0.86 0.31 -0.07 1.40 -0.12 -1.18 -4.70 117.98 112.76 8a3h s PHE 201 Ca 0.10 -0.73 0.01 0.00 -0.05 0.00 0.00 56.93 56.27 8a3h s PHE 201 Cb -0.10 -0.21 0.02 0.00 -0.63 0.00 0.00 43.02 42.10 8a3h s PHE 201 CO 0.03 -0.41 -0.09 0.71 -0.05 0.00 0.00 175.22 175.41 8a3h s TYR 202 N -3.33 1.26 -0.59 3.49 1.51 -1.26 -1.62 117.35 116.81 8a3h s TYR 202 Ca 0.01 -0.48 0.20 0.00 -1.01 0.00 0.00 57.07 55.79 8a3h s TYR 202 Cb 0.03 -0.99 0.87 0.00 -0.11 0.00 0.00 41.96 41.77 8a3h s TYR 202 CO -0.08 -0.30 1.61 0.00 -1.11 0.00 0.00 175.55 175.67 8a3h n ALA 203 N 4.10 1.54 0.42 3.71 0.00 -0.30 -1.58 120.51 128.41 8a3h n ALA 203 Ca -0.21 0.07 0.10 0.00 0.00 0.00 0.00 53.44 53.39 8a3h n ALA 203 Cb 0.51 -1.32 0.42 0.00 0.00 0.00 0.00 19.45 19.06 8a3h n ALA 203 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 8a3h n GLY 204 N -0.25 -1.16 3.73 0.00 0.00 -0.34 -4.62 105.19 102.55 8a3h n GLY 204 Ca 0.02 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 8a3h n GLY 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 8a3h s THR 205 N -3.20 5.21 0.11 2.61 2.01 -0.61 -4.92 115.64 116.85 8a3h s THR 205 Ca 0.05 0.82 -0.31 0.00 0.31 0.00 0.00 61.69 62.56 8a3h s THR 205 Cb 0.09 -3.75 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 8a3h s THR 205 CO 0.34 0.36 1.65 -1.00 -0.69 0.00 0.00 174.62 175.28 8a3h s HIS 206 N 0.46 2.59 -1.68 4.92 3.76 -1.26 -4.90 115.29 119.19 8a3h s HIS 206 Ca 0.23 0.37 0.17 0.00 -0.15 0.00 0.00 55.06 55.67 8a3h s HIS 206 Cb -0.15 -3.99 0.35 0.00 1.11 0.00 0.00 32.58 29.90 8a3h s HIS 206 CO 0.09 -3.88 1.26 0.41 -0.85 0.00 0.00 174.74 171.77 8a3h n GLY 207 N 3.95 1.79 0.26 -2.22 0.00 -1.26 -4.72 105.19 102.99 8a3h n GLY 207 Ca 0.15 -0.54 -0.09 0.00 0.00 0.00 0.00 46.02 45.54 8a3h n GLY 207 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 8a3h h GLN 208 N 3.19 0.87 -0.15 1.61 4.15 -2.00 -0.99 115.11 121.79 8a3h h GLN 208 Ca 0.00 -0.26 -0.13 0.00 0.77 0.00 0.00 58.65 59.03 8a3h h GLN 208 Cb 0.80 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.39 8a3h h GLN 208 CO 0.00 0.88 -0.48 -0.97 -1.93 0.00 0.00 178.83 176.33 8a3h h ASN 209 N 0.74 0.41 -0.75 -0.69 -0.00 -2.00 -2.41 115.58 110.89 8a3h h ASN 209 Ca 0.15 -0.20 -0.04 0.00 -0.00 0.00 0.00 56.30 56.21 8a3h h ASN 209 Cb 0.46 -0.12 -0.03 0.00 -0.00 0.00 0.00 38.32 38.63 8a3h h ASN 209 CO 0.02 0.83 0.33 -0.07 -0.00 0.00 0.00 177.43 178.54 8a3h h LEU 210 N 0.31 1.02 -0.56 0.34 3.38 -1.76 0.11 115.31 118.14 8a3h h LEU 210 Ca 0.02 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 8a3h h LEU 210 Cb 0.97 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.43 8a3h h LEU 210 CO 0.08 0.88 0.32 0.03 0.09 0.00 0.00 178.44 179.84 8a3h h ARG 211 N 1.09 0.77 -0.70 1.13 3.08 -1.10 -1.33 114.38 117.32 8a3h h ARG 211 Ca 0.26 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 60.22 8a3h h ARG 211 Cb 0.16 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 8a3h h ARG 211 CO -0.03 0.57 0.42 0.22 -1.07 0.00 0.00 179.97 180.09 8a3h h ASP 212 N 0.75 0.84 -0.09 7.04 3.58 -0.87 -1.22 116.42 126.45 8a3h h ASP 212 Ca 0.20 -0.05 -0.13 0.00 0.42 0.00 0.00 57.03 57.47 8a3h h ASP 212 Cb 0.02 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 40.85 8a3h h ASP 212 CO -0.03 0.65 -0.37 1.56 -2.88 0.00 0.00 179.24 178.17 8a3h h GLN 213 N 0.97 0.59 -0.42 0.28 1.08 -0.63 -0.69 115.11 116.29 8a3h h GLN 213 Ca 0.25 -0.29 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 8a3h h GLN 213 Cb -0.03 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.37 8a3h h GLN 213 CO -0.05 0.87 0.26 0.28 -0.95 0.00 0.00 178.83 179.24 8a3h h VAL 214 N 0.50 1.13 -0.95 -0.54 2.07 -0.80 -1.42 116.25 116.23 8a3h h VAL 214 Ca 0.05 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.29 8a3h h VAL 214 Cb 0.86 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 31.15 8a3h h VAL 214 CO 0.07 0.13 0.62 0.44 0.02 0.00 0.00 177.57 178.86 8a3h h ASP 215 N 0.56 1.10 -0.33 0.57 3.32 -0.94 -0.38 116.42 120.32 8a3h h ASP 215 Ca 0.15 -0.03 0.02 0.00 0.02 0.00 0.00 57.03 57.19 8a3h h ASP 215 Cb -0.02 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.23 8a3h h ASP 215 CO -0.03 0.80 0.15 0.22 -1.72 0.00 0.00 179.24 178.66 8a3h h TYR 216 N 1.29 0.28 -0.49 4.55 3.20 -0.72 -0.40 116.97 124.69 8a3h h TYR 216 Ca 0.35 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.22 8a3h h TYR 216 Cb -0.14 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.03 8a3h h TYR 216 CO 0.00 0.15 0.25 0.00 -1.64 0.00 0.00 178.16 176.92 8a3h h ALA 217 N 1.17 0.63 -0.83 1.82 0.00 -0.63 -2.06 119.26 119.36 8a3h h ALA 217 Ca 0.14 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.98 8a3h h ALA 217 Cb 0.06 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 8a3h h ALA 217 CO -0.10 0.17 0.55 -0.07 0.00 0.00 0.00 179.25 179.80 8a3h h LEU 218 N 0.64 0.88 -0.85 0.00 3.38 -0.82 -1.50 115.31 117.04 8a3h h LEU 218 Ca 0.17 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.13 8a3h h LEU 218 Cb 0.09 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.64 8a3h h LEU 218 CO -0.02 0.60 0.00 0.47 0.09 0.00 0.00 178.44 179.57 8a3h n ASP 219 N -4.45 0.69 -0.52 -0.43 8.00 -0.18 -1.15 116.55 118.50 8a3h n ASP 219 Ca 0.11 0.69 0.12 0.00 0.71 0.00 0.00 54.79 56.42 8a3h n ASP 219 Cb 0.13 -0.83 0.43 0.00 -0.02 0.00 0.00 41.12 40.83 8a3h n ASP 219 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 8a3h n GLN 220 N -2.28 1.70 -0.82 -1.24 1.13 -0.58 -4.93 117.38 110.35 8a3h n GLN 220 Ca 0.02 -1.04 0.00 0.00 -1.94 0.00 0.00 57.00 54.04 8a3h n GLN 220 Cb 0.20 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.13 8a3h n GLN 220 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 8a3h n GLY 221 N 1.14 0.67 3.74 1.08 0.00 -0.30 -5.03 105.19 106.50 8a3h n GLY 221 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 8a3h n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8a3h s ALA 222 N -2.43 3.34 0.08 4.61 0.00 -1.10 -4.14 121.76 122.12 8a3h s ALA 222 Ca 0.00 0.71 -0.17 0.00 0.00 0.00 0.00 51.96 52.50 8a3h s ALA 222 Cb 0.00 -3.28 -0.07 0.00 0.00 0.00 0.00 23.12 19.77 8a3h s ALA 222 CO 0.00 -0.01 0.55 0.00 0.00 0.00 0.00 175.76 176.29 8a3h s ALA 223 N -0.70 3.60 -0.07 0.00 0.00 -1.26 -4.20 121.76 119.13 8a3h s ALA 223 Ca 0.45 -0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.41 8a3h s ALA 223 Cb -0.27 -2.58 0.00 0.00 0.00 0.00 0.00 23.12 20.27 8a3h s ALA 223 CO 0.34 0.42 -0.18 0.42 0.00 0.00 0.00 175.76 176.76 8a3h s ILE 224 N -1.20 1.56 -0.16 0.00 1.01 -1.26 -0.72 121.20 120.43 8a3h s ILE 224 Ca 0.31 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 60.21 8a3h s ILE 224 Cb -0.18 -1.36 -0.00 0.00 0.01 0.00 0.00 42.46 40.93 8a3h s ILE 224 CO 0.18 0.45 -0.14 0.12 0.00 0.00 0.00 174.94 175.55 8a3h s PHE 225 N 0.33 2.80 -1.28 3.97 2.19 -0.63 -4.53 117.98 120.83 8a3h s PHE 225 Ca -0.12 -1.05 -0.13 0.00 0.33 0.00 0.00 56.93 55.96 8a3h s PHE 225 Cb -0.15 -1.91 0.13 0.00 -1.31 0.00 0.00 43.02 39.79 8a3h s PHE 225 CO 0.05 -0.49 1.72 0.28 1.83 0.00 0.00 175.22 178.61 8a3h n VAL 226 N 4.14 4.13 0.87 3.12 0.31 -0.07 -2.24 118.33 128.59 8a3h n VAL 226 Ca -0.19 -4.30 0.11 0.00 -0.01 0.00 0.00 64.34 59.95 8a3h n VAL 226 Cb 0.52 -2.43 0.51 0.00 -0.91 0.00 0.00 33.84 31.52 8a3h n VAL 226 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 8a3h n SER 227 N 5.69 0.00 -3.68 4.52 3.41 -1.24 -1.84 113.62 120.48 8a3h n SER 227 Ca 0.42 0.31 -0.09 0.00 -0.26 0.00 0.00 58.87 59.25 8a3h n SER 227 Cb 0.41 -0.43 -0.10 0.00 -0.26 0.00 0.00 64.21 63.84 8a3h n SER 227 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 8a3h s GLU 228 N -2.85 0.49 0.06 4.33 2.12 -1.23 -4.27 118.70 117.35 8a3h s GLU 228 Ca 0.15 0.94 -0.14 0.00 0.36 0.00 0.00 54.97 56.27 8a3h s GLU 228 Cb 0.15 0.05 0.02 0.00 0.26 0.00 0.00 34.13 34.61 8a3h s GLU 228 CO 0.39 -0.16 0.33 1.67 -0.54 0.00 0.00 175.26 176.95 8a3h s TRP 229 N 1.53 -0.13 0.13 5.30 1.48 -0.86 -3.10 118.94 123.29 8a3h s TRP 229 Ca -0.09 -0.04 0.04 0.00 -1.06 0.00 0.00 56.10 54.95 8a3h s TRP 229 Cb -0.08 0.13 -0.04 0.00 -1.16 0.00 0.00 33.47 32.32 8a3h s TRP 229 CO -0.15 -0.55 -0.10 0.20 -4.06 0.00 0.00 176.95 172.29 8a3h s GLY 230 N -2.22 1.01 0.00 3.67 0.00 -0.64 -0.65 107.32 108.48 8a3h s GLY 230 Ca -0.03 -1.41 0.28 0.00 0.00 0.00 0.00 44.72 43.56 8a3h s GLY 230 CO -0.05 -1.50 1.79 -1.30 0.00 0.00 0.00 173.10 172.04 8a3h n THR 231 N 0.02 0.00 -2.46 0.90 -2.24 -1.26 -1.15 114.28 108.09 8a3h n THR 231 Ca -0.12 -0.01 -0.12 0.00 -2.27 0.00 0.00 64.05 61.54 8a3h n THR 231 Cb 0.60 -0.25 0.06 0.00 -2.10 0.00 0.00 70.33 68.63 8a3h n THR 231 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 8a3h n SER 232 N -1.44 0.72 -4.48 3.42 3.41 -1.26 -0.67 113.62 113.32 8a3h n SER 232 Ca 0.08 -1.60 -0.29 0.00 -0.26 0.00 0.00 58.87 56.80 8a3h n SER 232 Cb 0.33 -0.33 0.20 0.00 -0.26 0.00 0.00 64.21 64.14 8a3h n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 8a3h s ALA 233 N -2.96 0.72 0.15 7.33 0.00 -0.36 -1.20 121.76 125.45 8a3h s ALA 233 Ca 0.34 -0.50 0.33 0.00 0.00 0.00 0.00 51.96 52.14 8a3h s ALA 233 Cb -0.02 -3.07 1.68 0.00 0.00 0.00 0.00 23.12 21.71 8a3h s ALA 233 CO 0.23 -3.11 2.01 0.00 0.00 0.00 0.00 175.76 174.88 8a3h h ALA 234 N -2.13 1.00 0.00 0.00 0.00 -1.86 -0.72 119.26 115.55 8a3h h ALA 234 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.38 8a3h h ALA 234 Cb 1.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.12 8a3h h ALA 234 CO 0.52 0.00 0.00 0.25 0.00 0.00 0.00 179.25 180.02 8a3h n THR 235 N -2.72 0.46 -0.37 0.00 -2.24 -1.26 -4.88 114.28 103.28 8a3h n THR 235 Ca -0.01 0.12 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 8a3h n THR 235 Cb 0.12 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.59 8a3h n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 8a3h n GLY 236 N 0.57 1.29 0.00 3.38 0.00 -0.28 -4.99 105.19 105.17 8a3h n GLY 236 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 8a3h n GLY 236 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 8a3h n ASP 237 N 0.00 0.22 -0.05 1.61 -0.08 -1.25 -1.62 116.55 115.37 8a3h n ASP 237 Ca 0.00 0.00 -0.01 0.00 -1.51 0.00 0.00 54.79 53.27 8a3h n ASP 237 Cb 0.00 0.00 -0.00 0.00 2.34 0.00 0.00 41.12 43.46 8a3h n ASP 237 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 8a3h n GLY 238 N 1.48 0.40 0.00 0.27 0.00 -1.26 -1.23 105.19 104.85 8a3h n GLY 238 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 8a3h n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 8a3h n GLY 239 N -2.27 -0.42 3.59 -0.02 0.00 -1.26 -4.57 105.19 100.24 8a3h n GLY 239 Ca -0.01 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.92 8a3h n GLY 239 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 8a3h s VAL 240 N -1.50 3.56 -0.55 1.61 -7.23 -1.26 -3.96 120.40 111.07 8a3h s VAL 240 Ca 0.00 -0.92 0.07 0.00 -1.81 0.00 0.00 61.98 59.31 8a3h s VAL 240 Cb 0.00 -2.58 0.26 0.00 0.56 0.00 0.00 36.38 34.62 8a3h s VAL 240 CO 0.00 0.31 0.70 0.49 -0.31 0.00 0.00 175.10 176.28 8a3h n PHE 241 N 1.29 2.42 0.17 2.82 3.01 0.15 -4.96 117.46 122.37 8a3h n PHE 241 Ca -0.15 -3.96 0.04 0.00 1.01 0.00 0.00 57.45 54.39 8a3h n PHE 241 Cb 0.52 -0.49 0.29 0.00 -0.01 0.00 0.00 39.48 39.80 8a3h n PHE 241 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 8a3h h LEU 242 N 4.00 0.00 0.12 4.37 3.38 -1.94 -0.89 115.31 124.34 8a3h h LEU 242 Ca 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 8a3h h LEU 242 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 8a3h h LEU 242 CO 0.72 0.44 -0.06 0.44 0.09 0.00 0.00 178.44 180.07 8a3h h ASP 243 N 0.00 -0.13 -0.04 -0.43 3.32 -1.97 -0.66 116.42 116.51 8a3h h ASP 243 Ca -0.00 -0.14 -0.10 0.00 0.02 0.00 0.00 57.03 56.81 8a3h h ASP 243 Cb 0.94 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.51 8a3h h ASP 243 CO 0.06 0.06 -0.29 -0.08 -1.72 0.00 0.00 179.24 177.27 8a3h h GLU 244 N -0.32 0.49 -0.86 3.56 4.57 -1.83 -2.38 114.58 117.81 8a3h h GLU 244 Ca -0.02 -0.20 0.01 0.00 -1.18 0.00 0.00 59.36 57.98 8a3h h GLU 244 Cb 0.26 -0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.79 8a3h h GLU 244 CO 0.03 0.73 0.57 0.00 -1.18 0.00 0.00 179.01 179.15 8a3h h ALA 245 N 1.27 1.09 -0.72 2.92 0.00 -1.02 -1.69 119.26 121.11 8a3h h ALA 245 Ca 0.06 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 8a3h h ALA 245 Cb 0.72 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 8a3h h ALA 245 CO 0.06 0.48 0.20 0.37 0.00 0.00 0.00 179.25 180.35 8a3h h GLN 246 N 1.15 1.13 -0.40 0.00 5.75 -0.77 0.72 115.11 122.70 8a3h h GLN 246 Ca 0.32 -0.26 0.07 0.00 -0.15 0.00 0.00 58.65 58.63 8a3h h GLN 246 Cb -0.12 -0.16 -0.06 0.00 1.07 0.00 0.00 27.48 28.21 8a3h h GLN 246 CO -0.07 0.98 0.02 0.28 -2.65 0.00 0.00 178.83 177.39 8a3h h VAL 247 N 1.08 0.72 -0.60 2.39 2.07 -0.93 -1.00 116.25 119.98 8a3h h VAL 247 Ca 0.23 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.67 8a3h h VAL 247 Cb 0.34 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 8a3h h VAL 247 CO -0.00 0.02 0.26 -0.50 0.02 0.00 0.00 177.57 177.37 8a3h h TRP 248 N 0.13 0.89 -0.50 1.57 4.06 -0.78 -1.04 115.95 120.28 8a3h h TRP 248 Ca 0.20 -0.06 0.06 0.00 2.06 0.00 0.00 58.89 61.15 8a3h h TRP 248 Cb 0.27 -0.27 -0.05 0.00 -1.00 0.00 0.00 29.16 28.11 8a3h h TRP 248 CO -0.25 0.70 0.19 0.82 -3.56 0.00 0.00 178.44 176.34 8a3h h ILE 249 N 0.83 0.86 -0.57 1.49 1.08 -0.44 0.12 117.51 120.88 8a3h h ILE 249 Ca 0.20 -0.13 -0.06 0.00 -0.39 0.00 0.00 64.86 64.48 8a3h h ILE 249 Cb 0.17 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.34 8a3h h ILE 249 CO -0.02 0.07 0.12 0.44 -0.69 0.00 0.00 178.15 178.07 8a3h h ASP 250 N 0.38 0.87 -0.47 1.72 3.32 -1.02 -1.45 116.42 119.77 8a3h h ASP 250 Ca 0.23 -0.24 0.02 0.00 0.02 0.00 0.00 57.03 57.06 8a3h h ASP 250 Cb 0.23 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 8a3h h ASP 250 CO -0.23 0.89 0.29 0.15 -1.72 0.00 0.00 179.24 178.62 8a3h h PHE 251 N 0.81 0.54 -0.53 4.55 3.57 -0.80 -0.91 116.94 124.17 8a3h h PHE 251 Ca 0.18 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.62 8a3h h PHE 251 Cb 0.36 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 8a3h h PHE 251 CO 0.03 0.32 0.05 0.52 -2.23 0.00 0.00 178.31 177.00 8a3h h MET 252 N 0.58 0.87 -0.49 1.11 2.86 -0.75 -1.83 114.93 117.29 8a3h h MET 252 Ca 0.18 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.56 8a3h h MET 252 Cb -0.02 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 8a3h h MET 252 CO -0.07 0.83 0.16 -0.44 1.06 0.00 0.00 176.91 178.46 8a3h h ASP 253 N 0.82 0.70 0.08 1.22 3.32 -0.92 -0.08 116.42 121.56 8a3h h ASP 253 Ca 0.16 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 8a3h h ASP 253 Cb 0.41 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 8a3h h ASP 253 CO 0.01 0.71 -0.14 -0.33 -1.72 0.00 0.00 179.24 177.77 8a3h h GLU 254 N 0.65 0.14 -0.64 3.56 5.08 -0.79 -3.09 114.58 119.50 8a3h h GLU 254 Ca 0.16 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 8a3h h GLU 254 Cb 0.25 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.48 8a3h h GLU 254 CO -0.01 0.29 0.00 0.54 -1.00 0.00 0.00 179.01 178.84 8a3h n ARG 255 N -4.30 4.12 -3.96 2.33 3.00 -0.72 -4.97 116.66 112.16 8a3h n ARG 255 Ca -0.01 -2.97 -0.28 0.00 -0.01 0.00 0.00 57.85 54.58 8a3h n ARG 255 Cb 0.25 -2.02 -0.00 0.00 0.00 0.00 0.00 32.46 30.69 8a3h n ARG 255 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 8a3h n ASN 256 N 0.99 -2.12 -4.59 0.55 4.05 -0.98 -4.95 115.26 108.20 8a3h n ASN 256 Ca 0.27 -0.93 -0.35 0.00 0.45 0.00 0.00 54.58 54.02 8a3h n ASN 256 Cb 0.99 -3.34 -0.10 0.00 1.23 0.00 0.00 39.78 38.56 8a3h n ASN 256 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 8a3h s LEU 257 N -7.06 3.71 0.60 1.20 1.43 -0.08 -4.76 118.68 113.72 8a3h s LEU 257 Ca 0.32 0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 53.28 8a3h s LEU 257 Cb -0.17 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.07 8a3h s LEU 257 CO 0.87 0.12 1.04 -0.44 0.23 0.00 0.00 176.35 178.18 8a3h s SER 258 N 0.66 5.87 0.09 2.29 0.01 -1.26 -4.72 113.70 116.65 8a3h s SER 258 Ca 0.03 1.72 -0.21 0.00 1.31 0.00 0.00 55.95 58.80 8a3h s SER 258 Cb -0.13 -2.52 0.05 0.00 0.21 0.00 0.00 66.02 63.63 8a3h s SER 258 CO 0.02 -1.11 0.52 -1.66 0.41 0.00 0.00 173.24 171.42 8a3h s TRP 259 N -2.62 -0.41 -0.02 2.43 1.48 0.07 -0.89 118.94 118.98 8a3h s TRP 259 Ca 0.61 0.32 0.01 0.00 -1.06 0.00 0.00 56.10 55.98 8a3h s TRP 259 Cb -0.14 0.38 0.01 0.00 -1.16 0.00 0.00 33.47 32.56 8a3h s TRP 259 CO 0.40 -0.71 -0.05 0.00 -4.06 0.00 0.00 176.95 172.53 8a3h s ALA 260 N -3.07 0.59 0.00 2.67 0.00 -0.77 -1.62 121.76 119.57 8a3h s ALA 260 Ca -0.02 -0.14 -0.15 0.00 0.00 0.00 0.00 51.96 51.65 8a3h s ALA 260 Cb -0.00 -0.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.78 8a3h s ALA 260 CO -0.07 0.06 0.41 1.21 0.00 0.00 0.00 175.76 177.37 8a3h s ASN 261 N 0.43 6.82 -0.32 0.00 3.84 -0.57 -2.04 114.94 123.10 8a3h s ASN 261 Ca -0.05 0.98 -0.16 0.00 0.21 0.00 0.00 52.86 53.83 8a3h s ASN 261 Cb -0.09 -2.26 -0.02 0.00 -0.55 0.00 0.00 41.25 38.34 8a3h s ASN 261 CO -0.00 0.32 0.41 0.86 -2.79 0.00 0.00 177.10 175.90 8a3h s TRP 262 N -1.06 3.21 0.20 0.43 -0.11 0.17 -0.66 118.94 121.12 8a3h s TRP 262 Ca 0.24 0.16 -0.23 0.00 1.22 0.00 0.00 56.10 57.49 8a3h s TRP 262 Cb -0.17 -2.71 0.05 0.00 -1.50 0.00 0.00 33.47 29.14 8a3h s TRP 262 CO 0.14 -0.40 0.70 -1.54 -4.62 0.00 0.00 176.95 171.23 8a3h s SER 263 N 1.71 -0.39 -0.92 5.86 1.04 -1.03 -4.59 113.70 115.39 8a3h s SER 263 Ca 0.15 -0.31 -0.20 0.00 0.48 0.00 0.00 55.95 56.08 8a3h s SER 263 Cb -0.16 0.64 0.12 0.00 0.10 0.00 0.00 66.02 66.71 8a3h s SER 263 CO 0.12 -1.11 1.15 -0.22 0.98 0.00 0.00 173.24 174.15 8a3h s LEU 264 N -2.82 4.82 0.22 2.42 2.96 0.09 -1.07 118.68 125.29 8a3h s LEU 264 Ca 0.07 -1.89 -0.21 0.00 -0.22 0.00 0.00 54.13 51.87 8a3h s LEU 264 Cb -0.03 -2.42 0.04 0.00 0.50 0.00 0.00 46.19 44.28 8a3h s LEU 264 CO -0.03 -1.15 0.65 0.28 -1.32 0.00 0.00 176.35 174.79 8a3h s THR 265 N 3.07 0.00 -2.27 3.68 -1.32 -1.26 -3.94 115.64 113.60 8a3h s THR 265 Ca 0.33 -0.59 0.23 0.00 -1.21 0.00 0.00 61.69 60.45 8a3h s THR 265 Cb -0.05 -1.57 0.52 0.00 -1.51 0.00 0.00 72.50 69.89 8a3h s THR 265 CO -0.08 -0.01 1.47 0.00 -2.21 0.00 0.00 174.62 173.78 8a3h n HIS 266 N -0.42 0.70 -1.58 9.09 1.44 -1.26 -1.58 115.22 121.61 8a3h n HIS 266 Ca -0.10 -0.35 -0.41 0.00 -2.01 0.00 0.00 57.72 54.85 8a3h n HIS 266 Cb 0.62 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.74 8a3h n HIS 266 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 8a3h n LYS 267 N 1.53 1.16 -1.58 -1.40 4.81 -1.26 -4.35 118.16 117.07 8a3h n LYS 267 Ca 0.21 0.42 -0.42 0.00 -0.87 0.00 0.00 58.31 57.65 8a3h n LYS 267 Cb 0.60 -1.94 -0.01 0.00 0.02 0.00 0.00 35.03 33.70 8a3h n LYS 267 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 8a3h n ASP 268 N 0.58 3.69 -3.91 3.14 2.03 -1.26 -4.65 116.55 116.17 8a3h n ASP 268 Ca 0.10 -2.79 -0.10 0.00 0.52 0.00 0.00 54.79 52.51 8a3h n ASP 268 Cb 0.40 -1.53 -0.11 0.00 -0.72 0.00 0.00 41.12 39.16 8a3h n ASP 268 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 8a3h s GLU 269 N 3.58 0.37 0.47 -0.67 -1.05 -1.26 -5.07 118.70 115.07 8a3h s GLU 269 Ca 0.50 -0.42 0.16 0.00 -0.15 0.00 0.00 54.97 55.06 8a3h s GLU 269 Cb 0.14 0.15 1.09 0.00 -0.44 0.00 0.00 34.13 35.08 8a3h s GLU 269 CO -0.04 -0.08 2.02 0.77 0.95 0.00 0.00 175.26 178.88 8a3h h SER 270 N 4.61 0.00 1.07 0.83 0.02 -1.85 -1.74 113.55 116.50 8a3h h SER 270 Ca -0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.64 8a3h h SER 270 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 8a3h h SER 270 CO 0.41 0.16 0.00 -1.54 -1.14 0.00 0.00 176.83 174.72 8a3h n SER 271 N -4.26 0.77 -4.74 3.07 3.41 -0.64 -4.47 113.62 106.76 8a3h n SER 271 Ca -0.02 0.63 -0.41 0.00 -0.26 0.00 0.00 58.87 58.81 8a3h n SER 271 Cb 0.23 -0.82 -0.02 0.00 -0.26 0.00 0.00 64.21 63.34 8a3h n SER 271 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 8a3h s ALA 272 N -3.23 3.62 -0.30 7.33 0.00 -0.66 -2.46 121.76 126.05 8a3h s ALA 272 Ca 0.07 1.31 0.23 0.00 0.00 0.00 0.00 51.96 53.57 8a3h s ALA 272 Cb 0.10 -3.55 0.47 0.00 0.00 0.00 0.00 23.12 20.14 8a3h s ALA 272 CO 0.49 -0.72 1.65 0.00 0.00 0.00 0.00 175.76 177.17 8a3h h ALA 273 N 5.04 0.96 -2.96 0.00 0.00 -1.07 -3.39 119.26 117.83 8a3h h ALA 273 Ca -0.46 -0.07 -0.63 0.00 0.00 0.00 0.00 54.91 53.74 8a3h h ALA 273 Cb 1.22 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.83 8a3h h ALA 273 CO 0.77 0.10 -0.77 -0.51 0.00 0.00 0.00 179.25 178.84 8a3h s LEU 274 N -6.27 2.68 0.33 0.00 1.43 -0.62 -1.52 118.68 114.73 8a3h s LEU 274 Ca 0.06 -0.77 0.05 0.00 -1.03 0.00 0.00 54.13 52.43 8a3h s LEU 274 Cb 0.06 -1.36 -0.01 0.00 0.03 0.00 0.00 46.19 44.91 8a3h s LEU 274 CO 0.66 0.10 0.48 -0.04 0.23 0.00 0.00 176.35 177.78 8a3h s MET 275 N -2.88 3.18 0.29 1.70 -1.94 -0.05 -4.13 119.30 115.47 8a3h s MET 275 Ca 0.24 -0.88 -0.30 0.00 -1.71 0.00 0.00 55.69 53.04 8a3h s MET 275 Cb -0.08 -2.80 -0.11 0.00 2.01 0.00 0.00 34.83 33.86 8a3h s MET 275 CO 0.13 0.08 1.54 -2.14 -0.01 0.00 0.00 175.02 174.62 8a3h s PRO 276 N -4.19 4.16 0.00 2.03 0.02 -1.26 -1.61 135.00 134.14 8a3h s PRO 276 Ca 0.43 2.50 0.00 0.00 0.02 0.00 0.00 61.00 63.95 8a3h s PRO 276 Cb -0.09 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.38 8a3h s PRO 276 CO 0.32 -0.56 0.00 0.41 -0.33 0.00 0.00 177.00 176.84 8a3h n GLY 277 N 1.98 2.82 3.67 0.52 0.00 -1.26 -5.01 105.19 107.91 8a3h n GLY 277 Ca 0.07 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.62 8a3h n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 8a3h n ALA 278 N -1.00 1.14 -2.02 4.61 0.00 -0.64 -4.90 120.51 117.70 8a3h n ALA 278 Ca 0.00 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.42 8a3h n ALA 278 Cb 0.00 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.03 8a3h n ALA 278 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 8a3h s ASN 279 N 1.99 6.83 0.08 0.00 3.84 -1.26 -4.87 114.94 121.54 8a3h s ASN 279 Ca 0.84 2.43 0.14 0.00 0.21 0.00 0.00 52.86 56.48 8a3h s ASN 279 Cb -0.69 -2.61 0.62 0.00 -0.55 0.00 0.00 41.25 38.03 8a3h s ASN 279 CO 0.43 -0.60 1.45 -0.81 -2.79 0.00 0.00 177.10 174.78 8a3h n PRO 280 N 2.96 0.05 -0.50 0.43 -0.04 -1.26 -1.95 135.00 134.70 8a3h n PRO 280 Ca 0.08 0.36 0.09 0.00 -0.04 0.00 0.00 63.50 63.99 8a3h n PRO 280 Cb 0.42 -1.61 0.32 0.00 -0.04 0.00 0.00 33.50 32.59 8a3h n PRO 280 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 8a3h n THR 281 N -1.72 1.59 -0.90 0.52 -2.24 -1.26 -4.43 114.28 105.85 8a3h n THR 281 Ca 0.02 -1.18 0.00 0.00 -2.27 0.00 0.00 64.05 60.62 8a3h n THR 281 Cb 0.14 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 68.60 8a3h n THR 281 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 8a3h n GLY 282 N 1.04 -1.77 1.50 3.38 0.00 -0.82 -3.39 105.19 105.12 8a3h n GLY 282 Ca 0.23 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.34 8a3h n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 8a3h n GLY 283 N 0.00 0.60 3.78 -0.02 0.00 -1.26 -4.56 105.19 103.72 8a3h n GLY 283 Ca 0.00 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 8a3h n GLY 283 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 8a3h s TRP 284 N -2.00 2.68 0.74 1.61 0.51 -1.26 -5.02 118.94 116.21 8a3h s TRP 284 Ca 0.00 1.20 -0.08 0.00 -2.12 0.00 0.00 56.10 55.10 8a3h s TRP 284 Cb 0.00 -3.96 0.08 0.00 -0.81 0.00 0.00 33.47 28.78 8a3h s TRP 284 CO 0.00 -2.79 1.07 0.95 -0.51 0.00 0.00 176.95 175.66 8a3h s THR 285 N -1.07 2.20 0.26 2.01 -4.23 -1.26 -4.96 115.64 108.59 8a3h s THR 285 Ca 0.52 -0.22 -0.04 0.00 -1.18 0.00 0.00 61.69 60.77 8a3h s THR 285 Cb -0.45 -2.98 0.26 0.00 1.34 0.00 0.00 72.50 70.68 8a3h s THR 285 CO 0.60 0.00 1.92 -0.08 -0.54 0.00 0.00 174.62 176.52 8a3h h GLU 286 N -0.76 1.24 0.00 3.99 4.22 -1.96 -1.41 114.58 119.91 8a3h h GLU 286 Ca -0.44 -0.07 -0.00 0.00 0.08 0.00 0.00 59.36 58.92 8a3h h GLU 286 Cb 1.31 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 8a3h h GLU 286 CO 0.58 0.82 -0.00 0.00 -2.18 0.00 0.00 179.01 178.23 8a3h h ALA 287 N 1.41 1.00 -0.01 2.92 0.00 -2.01 -2.26 119.26 120.32 8a3h h ALA 287 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 8a3h h ALA 287 Cb -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 8a3h h ALA 287 CO -0.11 0.00 -0.15 0.39 0.00 0.00 0.00 179.25 179.38 8a3h n GLU 288 N -3.09 1.14 -3.77 0.00 1.02 -0.54 -4.82 120.64 110.57 8a3h n GLU 288 Ca -0.01 -0.64 -0.36 0.00 -0.02 0.00 0.00 57.16 56.13 8a3h n GLU 288 Cb 0.21 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.09 8a3h n GLU 288 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 8a3h s LEU 289 N -2.31 4.39 0.93 -4.62 1.43 -0.85 -0.87 118.68 116.78 8a3h s LEU 289 Ca 0.30 0.57 -0.13 0.00 -1.03 0.00 0.00 54.13 53.84 8a3h s LEU 289 Cb 0.20 -2.45 0.15 0.00 0.03 0.00 0.00 46.19 44.12 8a3h s LEU 289 CO 0.45 0.32 1.17 -0.94 0.23 0.00 0.00 176.35 177.58 8a3h s SER 290 N -1.40 3.39 0.26 2.29 1.04 -0.57 -4.72 113.70 113.99 8a3h s SER 290 Ca 0.23 0.78 -0.02 0.00 0.48 0.00 0.00 55.95 57.41 8a3h s SER 290 Cb -0.13 -1.22 0.44 0.00 0.10 0.00 0.00 66.02 65.21 8a3h s SER 290 CO 0.12 -2.61 1.85 -0.65 0.98 0.00 0.00 173.24 172.93 8a3h h PRO 291 N -1.54 0.98 -0.05 4.02 0.11 -1.89 0.16 132.00 133.78 8a3h h PRO 291 Ca -0.48 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 8a3h h PRO 291 Cb 1.31 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 8a3h h PRO 291 CO 0.56 0.65 0.02 1.03 -0.21 0.00 0.00 178.00 180.05 8a3h h SER 292 N 1.01 0.07 -0.77 -2.05 0.87 -1.82 -2.64 113.55 108.21 8a3h h SER 292 Ca 0.44 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.87 8a3h h SER 292 Cb 0.31 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.21 8a3h h SER 292 CO -0.22 0.17 0.45 1.23 -0.53 0.00 0.00 176.83 177.93 8a3h h GLY 293 N -0.04 1.13 0.80 5.77 0.00 -1.48 -0.66 103.07 108.58 8a3h h GLY 293 Ca 0.02 -0.49 0.04 0.00 0.00 0.00 0.00 47.33 46.90 8a3h h GLY 293 CO -0.00 0.47 0.37 0.00 0.00 0.00 0.00 176.54 177.38 8a3h h THR 294 N 1.05 1.03 -0.14 4.70 1.03 -0.96 -0.34 112.91 119.29 8a3h h THR 294 Ca 0.27 -0.25 -0.01 0.00 -0.01 0.00 0.00 66.41 66.42 8a3h h THR 294 Cb -0.01 0.26 -0.01 0.00 -1.07 0.00 0.00 68.15 67.32 8a3h h THR 294 CO -0.05 0.13 0.04 0.15 -0.01 0.00 0.00 175.52 175.78 8a3h h PHE 295 N 0.71 0.22 -0.50 0.00 3.57 -1.07 -1.74 116.94 118.14 8a3h h PHE 295 Ca 0.26 -0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 8a3h h PHE 295 Cb 0.08 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 8a3h h PHE 295 CO -0.06 0.35 0.22 0.28 -2.23 0.00 0.00 178.31 176.87 8a3h h VAL 296 N 0.03 1.20 -0.59 1.41 2.07 -0.93 -0.58 116.25 118.86 8a3h h VAL 296 Ca 0.04 -0.60 0.07 0.00 0.82 0.00 0.00 66.70 67.04 8a3h h VAL 296 Cb 0.23 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.61 8a3h h VAL 296 CO -0.00 0.23 0.28 -0.09 0.02 0.00 0.00 177.57 178.01 8a3h h ARG 297 N 0.66 0.50 -0.76 1.57 2.43 -1.04 -1.10 114.38 116.65 8a3h h ARG 297 Ca 0.17 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 8a3h h ARG 297 Cb 0.15 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.55 8a3h h ARG 297 CO -0.02 0.33 0.47 1.49 -1.51 0.00 0.00 179.97 180.74 8a3h h GLU 298 N 0.52 1.03 -0.54 0.20 4.57 -0.74 0.12 114.58 119.73 8a3h h GLU 298 Ca 0.28 -0.08 -0.00 0.00 -1.18 0.00 0.00 59.36 58.37 8a3h h GLU 298 Cb 0.25 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.59 8a3h h GLU 298 CO -0.22 0.71 0.33 0.87 -1.18 0.00 0.00 179.01 179.52 8a3h h LYS 299 N 1.04 0.74 -0.16 1.92 1.79 -0.40 -0.44 116.57 121.07 8a3h h LYS 299 Ca 0.28 -0.07 -0.20 0.00 -2.18 0.00 0.00 60.65 58.48 8a3h h LYS 299 Cb -0.06 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.44 8a3h h LYS 299 CO -0.05 0.54 -0.70 0.82 -1.08 0.00 0.00 179.45 178.97 8a3h h ILE 300 N 0.73 1.31 -0.58 1.86 2.04 -0.93 -2.88 117.51 119.07 8a3h h ILE 300 Ca 0.19 -1.96 -0.07 0.00 1.00 0.00 0.00 64.86 64.03 8a3h h ILE 300 Cb -0.01 1.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 8a3h h ILE 300 CO -0.04 0.61 0.09 0.03 0.00 0.00 0.00 178.15 178.85 8a3h h ARG 301 N 0.47 0.92 -0.54 2.37 3.08 -0.77 -2.61 114.38 117.31 8a3h h ARG 301 Ca -0.03 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.77 8a3h h ARG 301 Cb 1.30 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 8a3h h ARG 301 CO 0.14 0.86 0.24 0.93 -1.07 0.00 0.00 179.97 181.06 8a3h h GLU 302 N 0.87 0.77 0.00 0.04 5.08 -1.04 -3.50 114.58 116.80 8a3h h GLU 302 Ca 0.18 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 8a3h h GLU 302 Cb 0.39 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.50 8a3h h GLU 302 CO 0.01 0.61 0.00 0.45 -1.00 0.00 0.00 179.01 179.08